A0A5K4F030_SCHMA Loading...

Rap-GAP domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F030, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,638 aa.

						>A0A5K4F030_SCHMA|A0A5K4F030
MSSDEGKSILASSNPSFNSNNFHPTYTTDTFTKYMRADLPSSSEMFITLHYDSRSMSHSLLSNYRNPASVEISTDSPVQKPKENKKSIYNLVAESSKFIVEGNENNDNYASSAHRYTVNFSKVCSSQVGAEHMDYYDFEYRDSGACFYRNSIFSCGDQHQNWFGIIPNDGAIAISLVKTSIYFKSNYGTSPSEDKQSHSNTANISCKESNCDKNLPTFDKQTESKNPGTNLNYLPAWLVIVRREQGSDLRGCVINKSLIENNKSISSLIITEPNINNPTIHTSNNSLSSGIITTNLTNDNSSITEPSLKTSLSTTKSISLSSMNTTITTNTSNISQLMMMKKKLTKKNSVKLNDALFNVTDEQLVLQYLVKNDNIMDYLKPGVPDRTVYEKLLKLDEMELLNNHKFGVLLCRKNQSTEEEMYNNEHSTPEFEEFLKLLGRKVRLRNYSGYIGGLDYRNDSTGLETYVTEFRGTNIVFLVSTLLPYEPNKTEQLARKRHIGNSSVTFIFVEEDAMPFQPDTIISGFQKVFILVKYIRLNNDIDDKNDFKFGYRVAVCRAKDVPQFGPIISSDYLFEHNLSFGNLLLTKAINAAYAVLKYSKFREIMQRSRRDYLHQFCNEHTINTENENLKHGKIHLYRRHSQDKLKQLKNSIKFRIHVTSSIEHESMPIKYHFDRIIPFHNQNLKSFDDLCKINQRVKRNHSDIFKLNKNEYIHLSNTFHNLFDFGQCLYVGLKKWQKLDGWHSVMELLPNSLLMNNYNNSTTTTNNNNNSNIYSTDDSVHRHSSNNHYFETQIGINRNWLVIFAPYTISTALANKILLAIPLNSIFGCLFEHNRKVLRIYFDCGQYVQIQDIYNSYHSNEQNTLEQLINFISYCIYPKVLQKCSQIIMKIKNNSIHHNDYHINDNEKFLIHNMDNIHKTNDNDQLKETKETIHHLNNNHKYSTMNDNYYSISDIGLSLSCLSPIDNYNNINSSYSLSLSSPSSPSSLSLLSNLNLSSFSLNPFPYIINFSKKLQNIIDFQFNQQQQQINKQILLQINTYHLPELIRIIQSKKSIWCLQKLNIISPFYNIYFPIIYDIQFTTHLLTLINQLKFNKNIIKIILCDLPEIEIFNRARIRCRHNQYVKHNHNNGRNEIRFSYPVTLYPINHHHQYHDDRFDETNKDNSSLPIISLPYIINVSNVYSNRKIEIKRNSQDFLNFDEMKQLNRKYHSLDVQQILSNELYTNSQCQQKTDDKLVTKSDNETSIDFTSNGLPTINLIETANCVQSRRRTRKPELIFMKQSNHMDSSTVSPPKNEELCLNKETVIRISNSNHQDKNETNSEISNQSGTYARSVNDQNNSPTLENDKIQVTKISTINQNNLSESSLSTLNPDSNKTNDLSINNSSNSNADTTTHIPVKWRRAKTEKTNSHYNTDARIITIRRRLQSTGTNTWNTKLHENITSSKLEQSRPTHLTVNTNMKFKNSSIDYIPPIKQKSRLKITRETFTQSQNIYELNNDTMDKYNTEIEQNLTKNQLYDLTELNENQLRNHLRRINEELLMEQSRRNHLANMCADLLEENRKLRNGQSDSMNKQIEHQTVTTNTSTSLMNQPNETIYKNYNSKKAKLSFINGKIKQISSNPNIWRKSKVKSHSFNNEIDL
					

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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	27.8	Very low	27.4	Very low	242 Å²	242	129.2 Å²	129.2	100%	1.192	74%	0.743	S	S	*	*				0	132.1	0	-70.1	164.8	157.6	0	0	107.3
2	S	24	Very low	27.2	Very low	103 Å²	103	127.2 Å²	127.2	72%	0.72	74%	0.743	S	S	*	*			cis	-165.8	164.9	-15.8	39.1	0	0	0	0	109.2
3	S	26.6	Very low	27.4	Very low	89 Å²	89	125.4 Å²	125.4	62%	0.622	74%	0.742	S	S	*	*			trans	60	87	152	58.5	0	0	0	0	119.8
4	D	29.2	Very low	27.5	Very low	149 Å²	149	127.5 Å²	127.5	80%	0.797	75%	0.748	S	S	*	*				95.8	132.6	98.8	-65.7	-28.4	0	0	0	123.2
5	E	28	Very low	28.1	Very low	150 Å²	150	126.2 Å²	126.2	70%	0.701	75%	0.745	S	S	*	*			trans	58	126.6	138.1	-68.4	-160.2	163.9	0	0	121.7	K7	E5-K7 IonicContact OE1-NZ 2.91Å; E5-K7 PolarHBondContact OE1-NZ 2.61Å; E5-K7 IonicContact OE2-NZ 2.61Å; E5-K7 PolarHBondContact OE2-NZ 2.91Å
6	G	29.6	Very low	28.2	Very low	60 Å²	60	124.5 Å²	124.5	62%	0.619	74%	0.741	S	S	*	*				161.3	91.8	87.6	0	0	0	0	0	119
7	K	29.2	Very low	28.2	Very low	163 Å²	163	127.9 Å²	127.9	71%	0.709	75%	0.745	S	S	*	*			trans	66.4	149.8	138	-67.3	146.9	-176.3	159.8	0	117.7	E5	E5-K7 IonicContact OE1-NZ 2.91Å; E5-K7 PolarHBondContact OE1-NZ 2.61Å; E5-K7 IonicContact OE2-NZ 2.61Å; E5-K7 PolarHBondContact OE2-NZ 2.91Å
8	S	26.2	Very low	28.3	Very low	89 Å²	89	128.5 Å²	128.5	62%	0.622	75%	0.745	S	S	*	*			cis	-176.7	-175.5	-17.7	54.4	0	0	0	0	110.4
9	I	27	Very low	28.3	Very low	136 Å²	136	125.7 Å²	125.7	70%	0.697	73%	0.733	S	S	*	*			trans	93.4	104.9	141.2	-86.3	168.8	0	0	0	119.4
10	L	26.9	Very low	28.4	Very low	160 Å²	160	126.3 Å²	126.3	84%	0.838	73%	0.733	S	S	*	*			trans	65	144.2	136.5	-54.7	177.5	0	0	0	120.8
11	A	27.4	Very low	28.5	Very low	80 Å²	80	126.7 Å²	126.7	66%	0.661	73%	0.733	S	S	*	*			cis	-163.6	164.8	-15.6	0	0	0	0	0	112.9
12	S	25.2	Very low	28.5	Very low	105 Å²	105	124.2 Å²	124.2	73%	0.734	72%	0.716	S	S	*	*			trans	-15.8	156.1	156.6	61.7	0	0	0	0	118.9
13	S	29	Very low	28.4	Very low	104 Å²	104	127.3 Å²	127.3	73%	0.727	72%	0.718	S	S	*	*			cis	-167.3	123.1	46.8	55	0	0	0	0	118.1
14	N	28.4	Very low	28.8	Very low	155 Å²	155	127.6 Å²	127.6	83%	0.829	72%	0.718	S	S	*	*				63.6	165.4	107.9	-104	18.4	0	0	0	122.5
15	P	36.8	Very low	28.5	Very low	108 Å²	108	127.3 Å²	127.3	70%	0.701	72%	0.722	S	S	*	*				-143.5	-159.9	-122.3	44	-21.3	0	0	0	115.2
16	S	29.6	Very low	28.3	Very low	99 Å²	99	130.6 Å²	130.6	69%	0.692	73%	0.729	S	S	*	*			trans	-157.7	119.5	158.4	54.9	0	0	0	0	114.8
17	F	27.9	Very low	28.1	Very low	183 Å²	183	134.7 Å²	134.7	80%	0.803	74%	0.743	S	S	*	*			trans	37.2	147.2	134.9	-53.6	-66	0	0	0	121.4
18	N	30.7	Very low	27.8	Very low	138 Å²	138	132.8 Å²	132.8	74%	0.738	75%	0.745	S	S	*	*			cis	-167.2	173.3	6	-113.1	-4	0	0	0	108.3
19	S	27.6	Very low	27.7	Very low	76 Å²	76	135.4 Å²	135.4	53%	0.531	75%	0.752	S	S	.	*			cis	-175.5	-180	-33.5	61.1	0	0	0	0	109.7
20	N	31	Very low	27.6	Very low	136 Å²	136	134.5 Å²	134.5	73%	0.727	75%	0.753	S	S	*	*			trans	72	138.4	170.4	-47.1	-3.8	0	0	0	115.5
21	N	30.1	Very low	27.4	Very low	136 Å²	136	135.8 Å²	135.8	73%	0.727	75%	0.752	S	S	*	*			cis	-166.8	156.9	-11.4	-101.2	-15.9	0	0	0	106.5
22	F	27.9	Very low	27.3	Very low	189 Å²	189	137.3 Å²	137.3	83%	0.829	75%	0.753	S	S	*	*			cis	-148.1	-175	0.3	-160.6	-106.3	0	0	0	108.8
23	H	22.7	Very low	27.2	Very low	168 Å²	168	140.1 Å²	140.1	78%	0.778	75%	0.752	S	S	*	*			trans	-140.7	-158.6	-177.7	-145	-11.1	0	0	0	113.5
24	P	34.1	Very low	27.1	Very low	95 Å²	95	145.2 Å²	145.2	62%	0.617	76%	0.757	S	S	*	*			trans	-112.8	-179	-133.4	43	-28.2	0	0	0	116
25	T	23.9	Very low	26.9	Very low	143 Å²	143	144.3 Å²	144.3	88%	0.877	75%	0.749	S	S	*	*			trans	-168.1	171.1	135.5	13.7	0	0	0	0	113.5
26	Y	23	Very low	26.3	Very low	219 Å²	219	149.5 Å²	149.5	86%	0.859	76%	0.755	S	S	*	*			trans	-89.2	150.4	-177	-70.6	-113.1	0	0	0	113.6
27	T	25.5	Very low	26.1	Very low	147 Å²	147	148.6 Å²	148.6	90%	0.902	75%	0.754	S	S	*	*				-171.8	167	123.4	24.5	0	0	0	0	112
28	T	23.1	Very low	26.1	Very low	123 Å²	123	147 Å²	147	76%	0.755	75%	0.754	S	S	*	*			trans	-91.8	142.1	179.4	46	0	0	0	0	112.4
29	D	24.1	Very low	26.3	Very low	144 Å²	144	148.4 Å²	148.4	77%	0.77	76%	0.76	S	S	*	*				179.2	169.3	100.3	-120.9	-46	0	0	0	117
30	T	25.4	Very low	26.1	Very low	117 Å²	117	149.7 Å²	149.7	72%	0.718	77%	0.767	S	S	*	*			trans	65.7	109.2	155.1	47	0	0	0	0	124.2
31	F	22.3	Very low	25.7	Very low	187 Å²	187	147.7 Å²	147.7	82%	0.82	76%	0.763	S	S	*	*				57	112.2	121.3	-101.7	-107.9	0	0	0	123.3
32	T	24.7	Very low	25.4	Very low	112 Å²	112	146 Å²	146	69%	0.687	76%	0.762	S	S	*	*			trans	45.7	136.4	141.6	62.6	0	0	0	0	120.3
33	K	23.9	Very low	25.2	Very low	163 Å²	163	142.1 Å²	142.1	71%	0.709	76%	0.758	S	S	*	*			cis	-173	-179	42.8	-143.4	168.7	-173.6	172.3	0	110.5
34	Y	26.4	Very low	25.1	Very low	211 Å²	211	140.1 Å²	140.1	83%	0.827	75%	0.75	S	S	*	*			trans	79.5	114.9	179.4	-60.5	-84.8	0	0	0	114.7
35	M	25	Very low	24.5	Very low	136 Å²	136	143.9 Å²	143.9	67%	0.67	76%	0.761	S	S	*	*			cis	113.9	115.8	27.3	-81.5	-93.6	-179.4	0	0	108
36	R	24	Very low	24.5	Very low	217 Å²	217	145.9 Å²	145.9	82%	0.819	76%	0.758	S	S	*	*			cis	-149.6	158.3	5.6	-66.4	-178.6	171.9	118.2	-1	111.2
37	A	24.9	Very low	24.4	Very low	81 Å²	81	142 Å²	142	67%	0.669	75%	0.751	S	S	*	*			trans	47.1	124.6	144.5	0	0	0	0	0	119.6
38	D	27.4	Very low	24.3	Very low	149 Å²	149	138 Å²	138	80%	0.797	73%	0.726	S	S	*	*			cis	-146.7	148.2	3.7	-84.3	-42.3	0	0	0	112
39	L	35.2	Very low	24.3	Very low	168 Å²	168	139.2 Å²	139.2	88%	0.88	73%	0.727	S	S	*	*			trans	-154.3	95.9	170	-137.8	163.5	0	0	0	110.5
40	P	24	Very low	24.3	Very low	102 Å²	102	138.7 Å²	138.7	66%	0.662	72%	0.72	S	S	*	*			trans	-127.1	130.7	149.9	26.2	-9.3	0	0	0	110.1
41	S	22.8	Very low	24.3	Very low	94 Å²	94	140.1 Å²	140.1	66%	0.657	71%	0.713	S	S	*	*				66.2	126.7	55.2	85.1	0	0	0	0	114.6
42	S	23	Very low	24.4	Very low	100 Å²	100	134.8 Å²	134.8	70%	0.699	69%	0.693	S	S	*	*			trans	54.9	105	153.7	61.9	0	0	0	0	119.6
43	S	23.5	Very low	24.7	Very low	108 Å²	108	131.7 Å²	131.7	76%	0.755	68%	0.676	S	S	*	*			trans	51.2	101.4	133.1	63.2	0	0	0	0	120
44	E	22	Very low	24.9	Very low	127 Å²	127	129.3 Å²	129.3	59%	0.593	66%	0.663	S	S	*	*			trans	-119.1	138.9	139.8	-74.1	-162.6	145.6	0	0	109.5	F46 H1120	E44-F46 PolarHBondContact O-N 2.72Å; E44-H1120 IonicContact OE1-CE1 2.99Å; E44-H1120 PolarHBondContact OE1-CE1 3.28Å; E44-H1120 IonicContact OE1-CG 2.66Å; E44-H1120 IonicContact OE1-ND1 3.02Å; E44-H1120 PolarHBondContact OE1-ND1 2.65Å
45	M	21.4	Very low	24.8	Very low	174 Å²	174	122.8 Å²	122.8	86%	0.857	65%	0.648	S	S	*	*			trans	-79	109.2	-175.6	-71.6	-179	174.2	0	0	111.5	I47	M45-I47 VanDerWaalsContact C-N 3.31Å; M45-I47 HydrophobicContact CB-CG1 4.28Å; M45-I47 PolarHBondContact O-N 2.8Å
46	F	22.7	Very low	24.8	Very low	185 Å²	185	123.7 Å²	123.7	81%	0.811	65%	0.652	S	S	*	*			trans	-69.1	89.1	162	-75.6	-86	0	0	0	110.2	E44 T48	E44-F46 PolarHBondContact O-N 2.72Å; F46-T48 PolarHBondContact O-N 2.92Å
47	I	21.6	Very low	24.7	Very low	138 Å²	138	116.8 Å²	116.8	71%	0.708	64%	0.637	S	S	*	*			trans	-76.3	62.2	164.4	-49.7	-178.1	0	0	0	108.5	M45 L49	M45-I47 VanDerWaalsContact C-N 3.31Å; M45-I47 HydrophobicContact CB-CG1 4.28Å; M45-I47 PolarHBondContact O-N 2.8Å; I47-L49 HydrophobicContact CG2-CD2 4.46Å; I47-L49 PolarHBondContact O-N 3.12Å
48	T	23.3	Very low	24.7	Very low	63 Å²	63	121.6 Å²	121.6	39%	0.387	65%	0.646	S	S	.	*			trans	-68.3	112	164.7	-55.9	0	0	0	0	106.6	F46 H50 Y135	F46-T48 PolarHBondContact O-N 2.92Å; T48-H50 PolarHBondContact O-N 3.33Å; T48-Y135 PolarHBondContact OG1-OH 3.26Å
49	L	22.5	Very low	24.5	Very low	148 Å²	148	117.3 Å²	117.3	78%	0.775	63%	0.627	S	S	*	*			trans	-72	77	179.5	-76.7	171.4	0	0	0	110.9	I47 Y51	I47-L49 HydrophobicContact CG2-CD2 4.46Å; I47-L49 PolarHBondContact O-N 3.12Å; L49-Y51 PolarHBondContact O-N 2.8Å
50	H	23.7	Very low	24	Very low	133 Å²	133	114.4 Å²	114.4	62%	0.616	61%	0.612	S	S	*	*			trans	-62.5	93.1	173.3	-88.3	-104.5	0	0	0	110.8	T48 D52	T48-H50 PolarHBondContact O-N 3.33Å; H50-D52 PolarHBondContact O-N 2.8Å
51	Y	26.2	Very low	24	Very low	146 Å²	146	118.7 Å²	118.7	57%	0.573	63%	0.628	S	S	*	*			trans	-73.1	76	152.9	-90.9	-85.2	0	0	0	109.2	L49 R141	L49-Y51 PolarHBondContact O-N 2.8Å; Y51-R141 PolarHBondContact O-NH1 3.43Å
52	D	25.4	Very low	24.1	Very low	76 Å²	76	116.3 Å²	116.3	41%	0.406	61%	0.611	S	S	.	*			trans	-77.6	127.6	150.7	-167.3	-24.7	0	0	0	107.7	H50 R54	H50-D52 PolarHBondContact O-N 2.8Å; D52-R54 PolarHBondContact OD1-N 2.62Å
53	S	29.6	Very low	24.2	Very low	47 Å²	47	116.8 Å²	116.8	33%	0.329	61%	0.606	S	S	.	*	S	Bend	trans	-101.7	14.5	-177.7	52.8	0	0	0	0	113.1
54	R	27.9	Very low	24.3	Very low	112 Å²	112	120.2 Å²	120.2	42%	0.423	60%	0.604	S	S	.	*	S	Bend	trans	-116.4	-9.4	179.5	-63.8	-175.9	178.8	174.3	0.1	114.7	D52 N402 G472	D52-R54 PolarHBondContact OD1-N 2.62Å; R54-N402 VanDerWaalsContact NH1-CG 3.25Å; R54-N402 PolarHBondContact NH1-OD1 3Å; R54-N402 PolarHBondContact NH2-OD1 3.36Å; R54-G472 PolarHBondContact NH1-O 2.99Å
55	S	25.1	Very low	24.4	Very low	74 Å²	74	125.9 Å²	125.9	52%	0.517	62%	0.62	S	S	.	*	S	Bend	trans	-103.7	31.8	-177.7	52.3	0	0	0	0	114.5
56	M	24.1	Very low	24.7	Very low	156 Å²	156	123.6 Å²	123.6	77%	0.768	61%	0.611	S	S	*	*			trans	-131.5	48.9	176.7	-88.9	-71.7	108.3	0	0	114
57	S	22.8	Very low	25.1	Very low	71 Å²	71	120.4 Å²	120.4	50%	0.497	61%	0.609	S	S	.	*	S	Bend	trans	-72.6	140	139.1	45.3	0	0	0	0	108.9	S59	S57-S59 PolarHBondContact O-N 3.18Å
58	H	24.7	Very low	25.4	Very low	183 Å²	183	117.9 Å²	117.9	85%	0.847	61%	0.608	S	S	*	*	S	Bend	trans	-61.6	100.6	-173	-75.9	-102.3	0	0	0	113.8
59	S	24.2	Very low	25.4	Very low	58 Å²	58	120.2 Å²	120.2	41%	0.406	63%	0.628	S	S	.	*			trans	-145.9	101.1	165.1	56.4	0	0	0	0	113.1	S57	S57-S59 PolarHBondContact O-N 3.18Å
60	L	24.6	Very low	25.6	Very low	107 Å²	107	118.8 Å²	118.8	56%	0.56	63%	0.625	S	S	*	*			trans	53.6	83.5	134.8	-60.7	167	0	0	0	118.4	S62 E1535	L60-S62 PolarHBondContact O-N 3.09Å; L60-S62 VanDerWaalsContact O-N 3.12Å; L60-E1535 HydrophobicContact CD1-CB 4.13Å; L60-E1535 HydrophobicContact CD1-CG 3.49Å; L60-E1535 VanDerWaalsContact CD1-CG 3.49Å
61	L	22.8	Very low	25.6	Very low	192 Å²	192	120.5 Å²	120.5	100%	1.005	63%	0.633	S	S	*	*			trans	-80.6	76.9	150.5	-143.8	132.7	0	0	0	108.9
62	S	24.6	Very low	25.6	Very low	44 Å²	44	120.9 Å²	120.9	31%	0.308	64%	0.643	S	S	.	*			trans	-132.2	134.2	177.4	62.9	0	0	0	0	112.4	L60 R1531	L60-S62 PolarHBondContact O-N 3.09Å; L60-S62 VanDerWaalsContact O-N 3.12Å; S62-R1531 PolarHBondContact OG-NH2 2.88Å
63	N	26.2	Very low	25.5	Very low	110 Å²	110	122 Å²	122	59%	0.588	66%	0.657	S	S	*	*			trans	70.1	80.5	162.2	-60.1	16.9	0	0	0	117.7	R1531	N63-R1531 PolarHBondContact ND2-NH1 3.19Å; N63-R1531 VanDerWaalsContact ND2-NH1 3.17Å
64	Y	25.3	Very low	25.3	Very low	180 Å²	180	125 Å²	125	71%	0.706	67%	0.674	S	S	*	*			trans	-133.4	80.7	139.1	-108	-84.9	0	0	0	111	N1528	Y64-N1528 WeakPolarHBondContact CE2-ND2 3.38Å; Y64-N1528 VanDerWaalsContact CZ-ND2 3.25Å; Y64-N1528 PolarHBondContact OH-ND2 2.99Å
65	R	23.9	Very low	25.2	Very low	246 Å²	246	126 Å²	126	93%	0.928	69%	0.687	S	S	*	*			trans	-152.2	107.4	155.8	-108.9	-175.9	-179.7	-173.5	-1.1	108.4
66	N	27.7	Very low	25.4	Very low	127 Å²	127	125.5 Å²	125.5	68%	0.679	68%	0.684	S	S	*	*			trans	-89	167.1	175.6	-106.3	17.2	0	0	0	111.4
67	P	31.1	Very low	26.1	Very low	118 Å²	118	121.5 Å²	121.5	77%	0.766	67%	0.669	S	S	*	*			trans	-121.3	166.7	-139.3	42.6	-34.8	0	0	0	117.2
68	A	27.3	Very low	26.4	Very low	84 Å²	84	120.8 Å²	120.8	69%	0.694	66%	0.662	S	S	*	*			trans	-156.3	122.3	148.3	0	0	0	0	0	105.8
69	S	24.9	Very low	26.6	Very low	113 Å²	113	121 Å²	121	79%	0.79	66%	0.663	S	S	*	*				43	126	85.5	60.8	0	0	0	0	112.8
70	V	26	Very low	26.8	Very low	117 Å²	117	127.4 Å²	127.4	71%	0.709	68%	0.684	S	S	*	*			cis	-139.8	136	32	168.2	0	0	0	0	107.5
71	E	23.7	Very low	27.1	Very low	170 Å²	170	127.7 Å²	127.7	79%	0.794	69%	0.692	S	S	*	*				57.6	133.3	89.4	-105.5	171.6	-120.8	0	0	112.7
72	I	25	Very low	27.2	Very low	154 Å²	154	127.4 Å²	127.4	79%	0.79	68%	0.683	S	S	*	*			cis	-143.4	166.7	22.7	-82.4	144.4	0	0	0	110.2
73	S	24	Very low	27.1	Very low	98 Å²	98	133.8 Å²	133.8	69%	0.685	71%	0.708	S	S	*	*			trans	-95.5	-174.9	-173.5	65.6	0	0	0	0	114.3
74	T	25.2	Very low	27.2	Very low	112 Å²	112	136.5 Å²	136.5	69%	0.687	72%	0.722	S	S	*	*			cis	-144.5	-136.3	12	-21.8	0	0	0	0	110.5
75	D	27.1	Very low	27.1	Very low	132 Å²	132	137.3 Å²	137.3	71%	0.706	73%	0.73	S	S	*	*			cis	-145.2	-119.2	-1.6	-134.6	-53.7	0	0	0	115.7
76	S	29.1	Very low	27.3	Very low	63 Å²	63	135.1 Å²	135.1	44%	0.441	73%	0.727	S	S	.	*			trans	-142.9	176	-140.5	-78.9	0	0	0	0	118.3	F1157 D1158	S76-F1157 CarbonylContact C-O 3.15Å; S76-F1157 WeakPolarHBondContact CB-O 3.25Å; S76-D1158 VanDerWaalsContact O-CA 3.28Å; S76-D1158 WeakPolarHBondContact O-CA 3.1Å; S76-D1158 PolarHBondContact O-N 2.79Å
77	P	38.2	Very low	27.1	Very low	72 Å²	72	133.8 Å²	133.8	47%	0.468	73%	0.728	S	S	.	*			trans	-140.3	-176	-151.4	45.7	-29.8	0	0	0	117.8	R1156 F1157 D1158	P77-R1156 CarbonylContact O-C 3.45Å; P77-F1157 WeakPolarHBondContact O-CA 3.02Å; P77-F1157 PolarHBondContact O-N 2.83Å; P77-D1158 WeakPolarHBondContact CA-OD1 3.48Å
78	V	29.4	Very low	26.8	Very low	57 Å²	57	134.7 Å²	134.7	35%	0.345	73%	0.725	S	S	.	*				174.5	139.9	130	144.6	0	0	0	0	116.4	R1156 D1158	V78-R1156 HydrophobicContact CB-CG 4.07Å; V78-R1156 HydrophobicContact CG1-CG 4.02Å; V78-R1156 HydrophobicContact CG2-CG 4.18Å; V78-D1158 PolarHBondContact N-OD1 3.37Å; V78-D1158 PolarHBondContact N-OD2 3.02Å; V78-D1158 VanDerWaalsContact N-OD2 3.14Å
79	Q	28.7	Very low	26.5	Very low	186 Å²	186	140 Å²	140	87%	0.869	73%	0.728	S	S	*	*				176	158.8	128	-92.2	-163.9	40	0	0	114.2
80	K	28.5	Very low	26.5	Very low	193 Å²	193	142.7 Å²	142.7	84%	0.839	73%	0.733	S	S	*	*			trans	-139.5	152.5	-175.9	-91.2	175.9	-177.9	163.2	0	108.3
81	P	29.8	Very low	26.3	Very low	114 Å²	114	141.9 Å²	141.9	74%	0.74	73%	0.725	S	S	*	*				-162.9	-174.4	82.9	45.3	-24.3	0	0	0	118.9
82	K	24.9	Very low	26.3	Very low	186 Å²	186	139.1 Å²	139.1	81%	0.809	72%	0.719	S	S	*	*			trans	76.9	103.2	157.7	-70.9	178.5	-177	177.9	0	121.1
83	E	24	Very low	26.2	Very low	177 Å²	177	135.7 Å²	135.7	83%	0.827	71%	0.714	S	S	*	*			trans	35.3	116	133.3	-57.6	-172.6	115.4	0	0	121.2
84	N	26.4	Very low	26.2	Very low	167 Å²	167	136.7 Å²	136.7	89%	0.893	71%	0.708	S	S	*	*				-156.9	157.7	125.5	-119.7	-63.9	0	0	0	114.1
85	K	24.3	Very low	26.2	Very low	198 Å²	198	133.4 Å²	133.4	86%	0.861	69%	0.689	S	S	*	*			trans	-90.4	110.9	-172.5	-64.9	167.9	-177.5	167.2	0	112
86	K	27.2	Very low	26.1	Very low	199 Å²	199	131.8 Å²	131.8	87%	0.865	69%	0.688	S	S	*	*			trans	-169.3	90.8	156.4	-108.1	160	-174.7	179.7	0	112
87	S	25.3	Very low	26.1	Very low	100 Å²	100	134.5 Å²	134.5	70%	0.699	69%	0.692	S	S	*	*			trans	-84.9	167.9	165.7	53.5	0	0	0	0	111.3
88	I	23.5	Very low	25.7	Very low	137 Å²	137	133.1 Å²	133.1	70%	0.703	68%	0.679	S	S	*	*			trans	71	76.6	169.3	-43.1	161.4	0	0	0	114.4
89	Y	22.3	Very low	25.7	Very low	196 Å²	196	136.4 Å²	136.4	77%	0.769	69%	0.693	S	S	*	*			trans	-139.4	-5.9	161.3	-97.2	-77.4	0	0	0	115.9	V92	Y89-V92 WeakPolarHBondContact O-CG2 3.12Å
90	N	23.2	Very low	25.8	Very low	169 Å²	169	128.9 Å²	128.9	90%	0.904	66%	0.66	S	S	*	*			trans	-100.6	28.8	-176.2	-70.2	7.9	0	0	0	114.3
91	L	22.6	Very low	25.8	Very low	100 Å²	100	126.9 Å²	126.9	52%	0.524	65%	0.654	S	S	.	*			trans	-104.3	24.6	-179.5	-113	165.5	0	0	0	113.2	A93 E94	L91-A93 PolarHBondContact O-N 3.32Å; L91-E94 HydrophobicContact CD2-CG 4.06Å; L91-E94 WeakPolarHBondContact CD2-OE2 3.28Å
92	V	23.9	Very low	25.8	Very low	111 Å²	111	123 Å²	123	67%	0.673	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	9.9	-167.9	-164.5	0	0	0	0	113.4	Y89	Y89-V92 WeakPolarHBondContact O-CG2 3.12Å
93	A	23.1	Very low	25.9	Very low	83 Å²	83	120.5 Å²	120.5	69%	0.686	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-15.2	-175.4	0	0	0	0	0	115	L91	L91-A93 PolarHBondContact O-N 3.32Å
94	E	24.5	Very low	26.2	Very low	118 Å²	118	118.8 Å²	118.8	55%	0.551	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-90	-3.5	-169.4	-60.7	-159.4	113.6	0	0	115.3	L91	L91-E94 HydrophobicContact CD2-CG 4.06Å; L91-E94 WeakPolarHBondContact CD2-OE2 3.28Å
95	S	24.9	Very low	26.2	Very low	44 Å²	44	117.2 Å²	117.2	31%	0.308	61%	0.613	S	S	.	*	G	3₁₀ helix	trans	-86.4	-4.8	-174.2	52.1	0	0	0	0	115.7	K97 Y233	S95-K97 PolarHBondContact O-N 3.02Å; S95-K97 VanDerWaalsContact O-N 3.13Å; S95-Y233 VanDerWaalsContact CB-OH 3.31Å; S95-Y233 WeakPolarHBondContact CB-OH 3.27Å; S95-Y233 PolarHBondContact OG-OH 3.29Å
96	S	24.2	Very low	26.4	Very low	98 Å²	98	111.6 Å²	111.6	69%	0.685	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-71.9	0.8	-177.3	53	0	0	0	0	115.3	F98	S96-F98 VanDerWaalsContact C-N 3.35Å; S96-F98 PolarHBondContact O-N 2.95Å
97	K	30.3	Very low	26.3	Very low	120 Å²	120	108.8 Å²	108.8	52%	0.522	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-76.9	-9	-171.9	-72.7	176.9	177.8	168.7	0	115.9	S95	S95-K97 PolarHBondContact O-N 3.02Å; S95-K97 VanDerWaalsContact O-N 3.13Å
98	F	29.8	Very low	26.4	Very low	42 Å²	42	106.3 Å²	106.3	18%	0.184	57%	0.566	C	S	.	*			trans	-137.9	107.2	176	-53.6	-77.2	0	0	0	111.3	S96 F147 S151 I181 L238	S96-F98 VanDerWaalsContact C-N 3.35Å; S96-F98 PolarHBondContact O-N 2.95Å; F98-F147 HydrophobicContact CE1-CD2 4.49Å; F98-F147 AromaticContact CE1-CE2 3.91Å; F98-F147 HydrophobicContact CE1-CE2 3.91Å; F98-S151 WeakPolarHBondContact CE1-OG 3.06Å; F98-S151 WeakPolarHBondContact CZ-OG 3.45Å; F98-I181 HydrophobicContact CB-CG2 4.45Å; F98-L238 HydrophobicContact CE2-CD1 4.37Å; F98-L238 HydrophobicContact CZ-CD1 3.97Å; F98-L238 HydrophobicContact CZ-CD2 4.36Å
99	I	27.7	Very low	26.5	Very low	126 Å²	126	110.3 Å²	110.3	65%	0.646	57%	0.574	S	S	*	*			trans	-96	108.3	156.5	-54.9	179.4	0	0	0	105.8	E101	I99-E101 HydrophobicContact CG2-CG 3.75Å
100	V	32.4	Very low	26.6	Very low	29 Å²	29	106.5 Å²	106.5	18%	0.176	58%	0.584	C	S	.	*			trans	-94.1	93.5	171.2	-179.5	0	0	0	0	107	G102 Y116	V100-G102 PolarHBondContact O-N 3.24Å; V100-G102 VanDerWaalsContact O-N 3.14Å; V100-Y116 HydrophobicContact CG1-CD1 3.56Å; V100-Y116 HydrophobicContact CG1-CE1 4.31Å; V100-Y116 HydrophobicContact CG1-CG 3.9Å
101	E	28.2	Very low	26.8	Very low	150 Å²	150	102.6 Å²	102.6	70%	0.701	57%	0.569	S	S	*	*			trans	-72.8	103.6	173.3	-61.7	-168.1	149.6	0	0	109.2	I99	I99-E101 HydrophobicContact CG2-CG 3.75Å
102	G	28.6	Very low	27	Very low	33 Å²	33	101 Å²	101	34%	0.34	57%	0.567	S	S	.	*			trans	-81.7	121.2	168.2	0	0	0	0	0	109.9	V100 E104	V100-G102 PolarHBondContact O-N 3.24Å; V100-G102 VanDerWaalsContact O-N 3.14Å; G102-E104 PolarHBondContact O-N 3.1Å
103	N	28.6	Very low	27.2	Very low	134 Å²	134	97.7 Å²	97.7	72%	0.717	55%	0.551	S	S	*	*			trans	-72.1	77.6	162.4	-88	46	0	0	0	108.9	N105	N103-N105 PolarHBondContact O-N 3.04Å
104	E	28.4	Very low	27.8	Very low	140 Å²	140	98.7 Å²	98.7	65%	0.654	54%	0.541	S	S	*	.			trans	-78.3	41.8	166.2	-69.1	-179.3	-179.5	0	0	110.8	G102 N106	G102-E104 PolarHBondContact O-N 3.1Å; E104-N106 PolarHBondContact O-N 2.8Å
105	N	26.6	Very low	28.2	Very low	134 Å²	134	96.2 Å²	96.2	72%	0.717	53%	0.527	S	S	*	.			trans	-99.9	75.4	172.8	-73.2	38.6	0	0	0	108.3	N103	N103-N105 PolarHBondContact O-N 3.04Å
106	N	28.5	Very low	28.8	Very low	81 Å²	81	96.3 Å²	96.3	43%	0.433	52%	0.521	S	S	.	.			trans	174.8	112	145.2	-94.2	7.4	0	0	0	109.3	E104 N284	E104-N106 PolarHBondContact O-N 2.8Å; N106-N284 PolarHBondContact ND2-OD1 3.03Å; N106-N284 PolarHBondContact OD1-ND2 3.27Å; N106-N284 PolarHBondContact OD1-OD1 3.26Å
107	D	26.3	Very low	29.3	Very low	140 Å²	140	95.7 Å²	95.7	75%	0.749	51%	0.513	S	S	*	.			trans	-62.1	154.2	161.7	-74.4	-60.9	0	0	0	110.6
108	N	26.1	Very low	29.6	Very low	48 Å²	48	91.9 Å²	91.9	26%	0.257	50%	0.5	S	S	.	.	S	Bend	trans	92.4	129.7	179.3	-41.2	-39	0	0	0	115.2	L287	N108-L287 WeakPolarHBondContact OD1-CD1 3.26Å; N108-L287 WeakPolarHBondContact OD1-CG 3.03Å
109	Y	26.9	Very low	29.7	Very low	220 Å²	220	94.2 Å²	94.2	86%	0.863	51%	0.514	S	S	*	.			trans	69	87.5	-177.1	-61.9	-76	0	0	0	117.9	S111	Y109-S111 VanDerWaalsContact C-N 3.31Å; Y109-S111 PolarHBondContact O-N 3.05Å
110	A	24.8	Very low	29.8	Very low	117 Å²	117	93.6 Å²	93.6	97%	0.967	51%	0.507	S	S	*	.			trans	-70.3	75.8	169.3	0	0	0	0	0	112.9	S112	A110-S112 PolarHBondContact O-N 2.68Å
111	S	27.3	Very low	29.7	Very low	86 Å²	86	97.2 Å²	97.2	60%	0.601	53%	0.534	S	S	*	.			trans	-88.9	90.3	179.2	-171.1	0	0	0	0	112.8	Y109 A113	Y109-S111 VanDerWaalsContact C-N 3.31Å; Y109-S111 PolarHBondContact O-N 3.05Å; S111-A113 VanDerWaalsContact O-CB 3.28Å; S111-A113 WeakPolarHBondContact O-CB 3.2Å; S111-A113 PolarHBondContact O-N 2.75Å
112	S	26.7	Very low	29.7	Very low	67 Å²	67	97.5 Å²	97.5	47%	0.469	53%	0.533	S	S	.	.	S	Bend	trans	31.5	4.2	149.3	66	0	0	0	0	124.2	A110	A110-S112 PolarHBondContact O-N 2.68Å
113	A	27.8	Very low	29.6	Very low	42 Å²	42	102.3 Å²	102.3	35%	0.347	56%	0.555	S	S	.	*			trans	-135.7	44	-149.4	0	0	0	0	0	116.1	S111 R115 I270	S111-A113 VanDerWaalsContact O-CB 3.28Å; S111-A113 WeakPolarHBondContact O-CB 3.2Å; S111-A113 PolarHBondContact O-N 2.75Å; A113-R115 PolarHBondContact O-N 3.27Å; A113-I270 HydrophobicContact CB-CD1 3.41Å; A113-I270 VanDerWaalsContact CB-CD1 3.41Å
114	H	36	Very low	29.5	Very low	104 Å²	104	99.4 Å²	99.4	48%	0.481	55%	0.545	S	S	.	.			trans	-75.3	66.1	-179	-64.5	4.9	0	0	0	114	Y116 L258	H114-Y116 HydrophobicContact CB-CE2 3.91Å; H114-Y116 PolarHBondContact O-N 2.7Å; H114-L258 HydrophobicContact CB-CD1 4.11Å; H114-L258 HydrophobicContact CB-CD2 4.16Å; H114-L258 VanDerWaalsContact O-CD1 3.26Å; H114-L258 WeakPolarHBondContact O-CD1 3.4Å
115	R	32.5	Very low	29.3	Very low	65 Å²	65	98.3 Å²	98.3	25%	0.245	55%	0.552	C	S	.	*			trans	-88.2	89.1	171.7	-169.5	-171.9	-140.1	-171.4	10.5	109.3	A113 T117 E272	A113-R115 PolarHBondContact O-N 3.27Å; R115-T117 PolarHBondContact O-N 3.03Å; R115-E272 IonicContact NH1-OE1 2.84Å; R115-E272 PolarHBondContact NH1-OE1 2.92Å
116	Y	38	Very low	29.4	Very low	46 Å²	46	96.5 Å²	96.5	18%	0.18	55%	0.55	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	91.1	179	-59.3	-81.7	0	0	0	110.8	V100 H114 F183 V253	V100-Y116 HydrophobicContact CG1-CD1 3.56Å; V100-Y116 HydrophobicContact CG1-CE1 4.31Å; V100-Y116 HydrophobicContact CG1-CG 3.9Å; H114-Y116 HydrophobicContact CB-CE2 3.91Å; H114-Y116 PolarHBondContact O-N 2.7Å; Y116-F183 HydrophobicContact CD2-CE1 4.09Å; Y116-F183 HydrophobicContact CD2-CZ 4.33Å; Y116-F183 HydrophobicContact CE1-CE1 4.46Å; Y116-F183 AromaticContact CE2-CE1 3.77Å; Y116-F183 HydrophobicContact CE2-CE1 3.77Å; Y116-F183 HydrophobicContact CE2-CZ 4.17Å; Y116-F183 AromaticContact CZ-CE1 3.97Å; Y116-V253 PolarHBondContact N-O 3.12Å; Y116-V253 PolarHBondContact O-N 2.78Å
117	T	33.9	Very low	29.5	Very low	86 Å²	86	102.4 Å²	102.4	53%	0.528	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76	121.5	166.5	50.3	0	0	0	0	109.6	R115 N119	R115-T117 PolarHBondContact O-N 3.03Å; T117-N119 PolarHBondContact O-N 3.03Å
118	V	36.3	Very low	29.7	Very low	39 Å²	39	98.2 Å²	98.2	24%	0.236	55%	0.554	C	S	.	*			trans	-77.6	98.2	179.7	-170.2	0	0	0	0	108.8	F120 G251	V118-F120 VanDerWaalsContact C-N 3.34Å; V118-F120 HydrophobicContact CB-CD2 4.24Å; V118-F120 HydrophobicContact CB-CE2 3.75Å; V118-F120 HydrophobicContact CB-CZ 4.06Å; V118-F120 HydrophobicContact CG1-CD1 4.19Å; V118-F120 HydrophobicContact CG1-CD2 4Å; V118-F120 HydrophobicContact CG1-CE1 3.73Å; V118-F120 HydrophobicContact CG1-CE2 3.53Å; V118-F120 HydrophobicContact CG1-CG 4.33Å; V118-F120 HydrophobicContact CG1-CZ 3.39Å; V118-F120 VanDerWaalsContact O-CD2 3.25Å; V118-F120 WeakPolarHBondContact O-CD2 3.44Å; V118-F120 PolarHBondContact O-N 3.06Å; V118-G251 PolarHBondContact N-O 2.88Å
119	N	31.6	Very low	29.8	Very low	91 Å²	91	98.4 Å²	98.4	49%	0.487	57%	0.567	S	S	.	*			trans	-81.8	77.9	-174.2	-170.2	-8.4	0	0	0	112.1	T117 S121	T117-N119 PolarHBondContact O-N 3.03Å; N119-S121 PolarHBondContact O-N 2.73Å; N119-S121 VanDerWaalsContact O-N 3.12Å; N119-S121 PolarHBondContact OD1-N 2.77Å; N119-S121 VanDerWaalsContact OD1-N 3.15Å; N119-S121 PolarHBondContact OD1-OG 3.34Å; N119-S121 VanDerWaalsContact OD1-OG 3.04Å
120	F	31.4	Very low	30.1	Very low	113 Å²	113	90 Å²	90	50%	0.496	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-7.5	175.6	-63.6	-74	0	0	0	114.9	V118 F147	V118-F120 VanDerWaalsContact C-N 3.34Å; V118-F120 HydrophobicContact CB-CD2 4.24Å; V118-F120 HydrophobicContact CB-CE2 3.75Å; V118-F120 HydrophobicContact CB-CZ 4.06Å; V118-F120 HydrophobicContact CG1-CD1 4.19Å; V118-F120 HydrophobicContact CG1-CD2 4Å; V118-F120 HydrophobicContact CG1-CE1 3.73Å; V118-F120 HydrophobicContact CG1-CE2 3.53Å; V118-F120 HydrophobicContact CG1-CG 4.33Å; V118-F120 HydrophobicContact CG1-CZ 3.39Å; V118-F120 VanDerWaalsContact O-CD2 3.25Å; V118-F120 WeakPolarHBondContact O-CD2 3.44Å; V118-F120 PolarHBondContact O-N 3.06Å; F120-F147 HydrophobicContact CE2-CB 4.34Å; F120-F147 HydrophobicContact CE2-CD2 4.2Å; F120-F147 HydrophobicContact CZ-CD2 4.21Å
121	S	28.8	Very low	30.4	Very low	106 Å²	106	93 Å²	93	74%	0.741	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	13.1	-177.7	78.5	0	0	0	0	114.4	N119	N119-S121 PolarHBondContact O-N 2.73Å; N119-S121 VanDerWaalsContact O-N 3.12Å; N119-S121 PolarHBondContact OD1-N 2.77Å; N119-S121 VanDerWaalsContact OD1-N 3.15Å; N119-S121 PolarHBondContact OD1-OG 3.34Å; N119-S121 VanDerWaalsContact OD1-OG 3.04Å
122	K	28.2	Very low	30.9	Very low	156 Å²	156	95.4 Å²	95.4	68%	0.678	54%	0.539	S	S	*	.			trans	-91.8	3.2	-178.1	-115	-171.8	175.6	-167.8	0	115.2
123	V	27.7	Very low	31.5	Very low	133 Å²	133	93.6 Å²	93.6	81%	0.806	52%	0.524	S	S	*	.	S	Bend	trans	-116.6	77.3	-179.4	-172.7	0	0	0	0	110.1
124	C	25.6	Very low	32	Very low	74 Å²	74	95.7 Å²	95.7	50%	0.5	53%	0.529	S	S	.	.			trans	178.6	80.7	155.4	-107.9	0	0	0	0	111.2	D137	C124-D137 VanDerWaalsContact SG-CB 3.52Å
125	S	24.3	Very low	32.4	Very low	117 Å²	117	97.7 Å²	97.7	82%	0.818	53%	0.533	S	S	*	.			trans	-156.3	37.3	167.1	70.3	0	0	0	0	112.8
126	S	28	Very low	33.5	Very low	95 Å²	95	96.4 Å²	96.4	66%	0.664	53%	0.528	S	S	*	.			trans	-77.7	131.5	168.6	38.1	0	0	0	0	109.9	V128	S126-V128 PolarHBondContact O-N 3.31Å; S126-V128 WeakPolarHBondContact OG-CG2 3.5Å
127	Q	30.7	Very low	34.6	Very low	206 Å²	206	96.9 Å²	96.9	96%	0.963	53%	0.534	S	S	*	.			trans	-76	71.7	169.8	-70.1	176.1	-67.9	0	0	109.3	G129	Q127-G129 PolarHBondContact O-N 3.4Å
128	V	31.3	Very low	36.4	Very low	51 Å²	51	94.1 Å²	94.1	31%	0.309	52%	0.515	S	S	.	.			trans	-76.9	117.2	176.5	-174	0	0	0	0	108.7	S126 H132 Y136	S126-V128 PolarHBondContact O-N 3.31Å; S126-V128 WeakPolarHBondContact OG-CG2 3.5Å; V128-H132 HydrophobicContact CG1-CB 3.6Å; V128-Y136 HydrophobicContact CB-CE1 4.37Å; V128-Y136 PolarHBondContact O-OH 2.96Å
129	G	27.8	Very low	37.6	Very low	52 Å²	52	96.2 Å²	96.2	54%	0.536	52%	0.522	S	S	.	.			trans	-59.6	168.1	175.3	0	0	0	0	0	113	Q127 E131 H132	Q127-G129 PolarHBondContact O-N 3.4Å; G129-E131 PolarHBondContact O-N 3.38Å; G129-H132 PolarHBondContact O-N 3.22Å
130	A	32.5	Very low	38.6	Very low	43 Å²	43	95.7 Å²	95.7	36%	0.355	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-61.3	-12.4	-170.7	0	0	0	0	0	115.1	H132 M133 Y572	A130-H132 VanDerWaalsContact C-N 3.35Å; A130-H132 PolarHBondContact O-N 2.85Å; A130-M133 HydrophobicContact CB-CE 4.15Å; A130-M133 WeakPolarHBondContact O-CE 3.14Å; A130-M133 WeakPolarHBondContact O-CG 3.28Å; A130-Y572 HydrophobicContact CB-CE2 4.27Å
131	E	33.1	Very low	39.7	Very low	182 Å²	182	96.4 Å²	96.4	85%	0.85	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-81.2	-6.1	-173.9	-62.9	172.5	-162.8	0	0	114.2	G129	G129-E131 PolarHBondContact O-N 3.38Å
132	H	36.1	Very low	40.9	Very low	135 Å²	135	92.4 Å²	92.4	63%	0.625	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-126.6	53	178.4	-71.8	-10.7	0	0	0	112.6	V128 G129 A130 D134 Y135	V128-H132 HydrophobicContact CG1-CB 3.6Å; G129-H132 PolarHBondContact O-N 3.22Å; A130-H132 VanDerWaalsContact C-N 3.35Å; A130-H132 PolarHBondContact O-N 2.85Å; H132-D134 VanDerWaalsContact C-N 3.27Å; H132-D134 PolarHBondContact O-N 3.27Å; H132-Y135 PolarHBondContact O-N 3.43Å
133	M	39.8	Very low	42.4	Very low	30 Å²	30	86.9 Å²	86.9	15%	0.148	46%	0.464	C	S	.	.	G	3₁₀ helix	trans	-53.3	-32.8	-177.5	-79.8	-75.2	138.7	0	0	115.7	A130 Y135 Y136 F574 L583	A130-M133 HydrophobicContact CB-CE 4.15Å; A130-M133 WeakPolarHBondContact O-CE 3.14Å; A130-M133 WeakPolarHBondContact O-CG 3.28Å; M133-Y135 VanDerWaalsContact C-N 3.28Å; M133-Y135 PolarHBondContact O-N 3.45Å; M133-Y136 HydrophobicContact CE-CE2 4.1Å; M133-Y136 WeakPolarHBondContact O-CD2 3.4Å; M133-Y136 HydrophobicContact SD-CE2 3.9Å; M133-F574 HydrophobicContact CE-CE1 4.31Å; M133-L583 HydrophobicContact CE-CD1 4.43Å; M133-L583 HydrophobicContact CE-CD2 4.22Å; M133-L583 HydrophobicContact SD-CB 3.87Å; M133-L583 HydrophobicContact SD-CD1 3.83Å; M133-L583 HydrophobicContact SD-CD2 3.77Å; M133-L583 HydrophobicContact SD-CG 4.02Å
134	D	37.6	Very low	44	Very low	85 Å²	85	80.7 Å²	80.7	46%	0.455	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-77.3	-8.2	-170	-64.9	-51.4	0	0	0	114.5	H132 R471 N582	H132-D134 VanDerWaalsContact C-N 3.27Å; H132-D134 PolarHBondContact O-N 3.27Å; D134-R471 PolarHBondContact O-NH2 3.36Å; D134-N582 PolarHBondContact OD1-ND2 3.03Å
135	Y	46.1	Very low	46	Very low	147 Å²	147	77.2 Å²	77.2	58%	0.576	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-101.6	8.6	-171.9	-112.9	-85.4	0	0	0	116.4	T48 H132 M133 D137	T48-Y135 PolarHBondContact OG1-OH 3.26Å; H132-Y135 PolarHBondContact O-N 3.43Å; M133-Y135 VanDerWaalsContact C-N 3.28Å; M133-Y135 PolarHBondContact O-N 3.45Å; Y135-D137 PolarHBondContact O-N 3.1Å
136	Y	54	Low	47.9	Very low	37 Å²	37	72.9 Å²	72.9	15%	0.145	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-73.1	122.7	175.7	-59.6	-56	0	0	0	112.2	V128 M133 R471 P566 L583	V128-Y136 HydrophobicContact CB-CE1 4.37Å; V128-Y136 PolarHBondContact O-OH 2.96Å; M133-Y136 HydrophobicContact CE-CE2 4.1Å; M133-Y136 WeakPolarHBondContact O-CD2 3.4Å; M133-Y136 HydrophobicContact SD-CE2 3.9Å; Y136-R471 PolarHBondContact O-NH1 2.67Å; Y136-P566 HydrophobicContact CD1-CB 3.8Å; Y136-P566 HydrophobicContact CD1-CG 4.4Å; Y136-P566 HydrophobicContact CD2-CB 3.75Å; Y136-P566 HydrophobicContact CD2-CG 3.81Å; Y136-P566 HydrophobicContact CE1-CB 3.81Å; Y136-P566 HydrophobicContact CE2-CB 3.74Å; Y136-P566 HydrophobicContact CE2-CG 4.21Å; Y136-P566 HydrophobicContact CG-CB 3.78Å; Y136-P566 HydrophobicContact CG-CG 3.91Å; Y136-L583 HydrophobicContact CD2-CD1 4.12Å; Y136-L583 HydrophobicContact CE2-CD1 3.97Å
137	D	62.7	Low	49.7	Very low	56 Å²	56	68.5 Å²	68.5	30%	0.299	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-89.9	172.8	-177.2	-136.6	-42.7	0	0	0	113.2	C124 Y135 R141 N590	C124-D137 VanDerWaalsContact SG-CB 3.52Å; Y135-D137 PolarHBondContact O-N 3.1Å; D137-R141 VanDerWaalsContact CG-NH2 3.34Å; D137-R141 IonicContact OD1-CZ 2.98Å; D137-R141 VanDerWaalsContact OD1-CZ 3.32Å; D137-R141 IonicContact OD1-NE 2.75Å; D137-R141 PolarHBondContact OD1-NE 3.24Å; D137-R141 IonicContact OD1-NH2 3.52Å; D137-R141 PolarHBondContact OD1-NH2 3.04Å; D137-R141 IonicContact OD2-CZ 2.71Å; D137-R141 IonicContact OD2-NE 3.43Å; D137-R141 IonicContact OD2-NH2 2.67Å; D137-R141 PolarHBondContact OD2-NH2 2.85Å; D137-R141 VanDerWaalsContact OD2-NH2 3.12Å; D137-N590 PolarHBondContact O-ND2 3.24Å; D137-N590 VanDerWaalsContact O-ND2 3.12Å
138	F	71.7	Confident	51.9	Low	28 Å²	28	58.7 Å²	58.7	12%	0.123	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-86	119.3	172.8	-61.5	-28.5	0	0	0	111	Y140 F470 R471 T473 T586 I589 N590	F138-Y140 PolarHBondContact O-N 2.82Å; F138-F470 HydrophobicContact CE1-CD1 4.32Å; F138-F470 HydrophobicContact CE1-CE1 4.02Å; F138-F470 AromaticContact CZ-CD1 3.95Å; F138-F470 HydrophobicContact CZ-CD1 3.95Å; F138-F470 HydrophobicContact CZ-CE1 4.02Å; F138-R471 HydrophobicContact CE2-CB 3.88Å; F138-R471 HydrophobicContact CZ-CB 3.83Å; F138-R471 HydrophobicContact CZ-CG 4.38Å; F138-T473 HydrophobicContact CE2-CG2 4.04Å; F138-T586 HydrophobicContact CD1-CG2 4.35Å; F138-T586 HydrophobicContact CE1-CG2 4.33Å; F138-I589 HydrophobicContact CD1-CB 4.36Å; F138-I589 HydrophobicContact CD1-CG2 3.77Å; F138-I589 HydrophobicContact CD2-CG2 4.46Å; F138-I589 HydrophobicContact CE1-CB 4.07Å; F138-I589 HydrophobicContact CE1-CD1 3.6Å; F138-I589 HydrophobicContact CE1-CG1 4.46Å; F138-I589 HydrophobicContact CE1-CG2 3.79Å; F138-I589 HydrophobicContact CE2-CD1 4.37Å; F138-I589 HydrophobicContact CE2-CG2 4.47Å; F138-I589 HydrophobicContact CG-CG2 4.13Å; F138-I589 HydrophobicContact CZ-CD1 3.45Å; F138-I589 VanDerWaalsContact CZ-CD1 3.45Å; F138-I589 HydrophobicContact CZ-CG2 4.15Å; F138-N590 WeakPolarHBondContact CA-OD1 3.28Å
139	E	59.8	Low	54	Low	83 Å²	83	58.7 Å²	58.7	39%	0.388	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	5.4	-170.3	-64.5	176	149.6	0	0	115.1	F564 G565 N590	E139-F564 VanDerWaalsContact OE2-CA 3.25Å; E139-F564 WeakPolarHBondContact OE2-CA 3.35Å; E139-F564 WeakPolarHBondContact OE2-CB 3.18Å; E139-G565 WeakPolarHBondContact OE1-CA 3.17Å; E139-G565 PolarHBondContact OE1-N 3.03Å; E139-G565 PolarHBondContact OE2-N 3.28Å; E139-N590 PolarHBondContact N-OD1 3.25Å
140	Y	53.4	Low	55.8	Low	81 Å²	81	58.8 Å²	58.8	32%	0.318	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147	57.2	-177.8	-146.5	-110	0	0	0	112.4	F138 E399 Y593	F138-Y140 PolarHBondContact O-N 2.82Å; Y140-E399 PolarHBondContact OH-OE2 3.09Å; Y140-Y593 AromaticContact CD1-CD1 3.96Å; Y140-Y593 HydrophobicContact CD1-CD1 3.96Å; Y140-Y593 HydrophobicContact CD1-CE1 4.36Å; Y140-Y593 HydrophobicContact CG-CD1 4.26Å
141	R	54	Low	57.4	Low	127 Å²	127	57.4 Å²	57.4	48%	0.479	27%	0.267	S	S	.	.			trans	-66.2	152.5	170.8	-72.1	-167.7	-176.9	-148.8	10.8	112.3	Y51 D137 S143	Y51-R141 PolarHBondContact O-NH1 3.43Å; D137-R141 VanDerWaalsContact CG-NH2 3.34Å; D137-R141 IonicContact OD1-CZ 2.98Å; D137-R141 VanDerWaalsContact OD1-CZ 3.32Å; D137-R141 IonicContact OD1-NE 2.75Å; D137-R141 PolarHBondContact OD1-NE 3.24Å; D137-R141 IonicContact OD1-NH2 3.52Å; D137-R141 PolarHBondContact OD1-NH2 3.04Å; D137-R141 IonicContact OD2-CZ 2.71Å; D137-R141 IonicContact OD2-NE 3.43Å; D137-R141 IonicContact OD2-NH2 2.67Å; D137-R141 PolarHBondContact OD2-NH2 2.85Å; D137-R141 VanDerWaalsContact OD2-NH2 3.12Å; R141-S143 VanDerWaalsContact C-N 3.35Å; R141-S143 PolarHBondContact O-N 3.27Å
142	D	55	Low	59.2	Low	23 Å²	23	48.7 Å²	48.7	12%	0.123	23%	0.227	C	C	.	.			trans	-63	74	-179.3	178.4	20	0	0	0	113.6	A145 C146 R149 L400	D142-A145 WeakPolarHBondContact OD1-CA 3.12Å; D142-A145 WeakPolarHBondContact OD1-CB 3.21Å; D142-A145 PolarHBondContact OD1-N 2.8Å; D142-A145 WeakPolarHBondContact OD2-CB 3.33Å; D142-C146 VanDerWaalsContact CG-N 3.31Å; D142-C146 WeakPolarHBondContact O-CB 3.5Å; D142-C146 PolarHBondContact O-N 3.02Å; D142-C146 PolarHBondContact OD1-N 3.16Å; D142-C146 PolarHBondContact OD2-N 2.88Å; D142-C146 VanDerWaalsContact OD2-N 3.11Å; D142-R149 IonicContact OD2-CZ 3.97Å; D142-R149 IonicContact OD2-NH1 3.55Å; D142-R149 PolarHBondContact OD2-NH1 3.05Å; D142-R149 IonicContact OD2-NH2 2.99Å; D142-R149 PolarHBondContact OD2-NH2 2.84Å; D142-L400 HydrophobicContact CB-CD1 3.76Å; D142-L400 HydrophobicContact CB-CD2 3.74Å; D142-L400 HydrophobicContact CB-CG 4.4Å
143	S	58.8	Low	61	Low	39 Å²	39	45.3 Å²	45.3	27%	0.273	21%	0.21	S	C	.	.	H	α-helix	trans	-66.6	-41.3	178.6	56.6	0	0	0	0	112.9	R141 F147	R141-S143 VanDerWaalsContact C-N 3.35Å; R141-S143 PolarHBondContact O-N 3.27Å; S143-F147 VanDerWaalsContact O-CB 3.3Å; S143-F147 WeakPolarHBondContact O-CB 3.39Å; S143-F147 PolarHBondContact O-N 3.04Å; S143-F147 VanDerWaalsContact O-N 3.14Å
144	G	61.3	Low	62.4	Low	4 Å²	4	47.3 Å²	47.3	4%	0.041	23%	0.227	C	C	.	.	H	α-helix	trans	-77.5	-51.9	-173.2	0	0	0	0	0	114.7	F147 Y148	G144-F147 PolarHBondContact O-N 3.05Å; G144-Y148 PolarHBondContact O-N 3.13Å
145	A	68.2	Low	63.6	Low	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-77.5	-25	-179.4	0	0	0	0	0	111.1	D142 Y148 R149 L393 D396 E397	D142-A145 WeakPolarHBondContact OD1-CA 3.12Å; D142-A145 WeakPolarHBondContact OD1-CB 3.21Å; D142-A145 PolarHBondContact OD1-N 2.8Å; D142-A145 WeakPolarHBondContact OD2-CB 3.33Å; A145-Y148 PolarHBondContact O-N 2.75Å; A145-R149 WeakPolarHBondContact O-CB 3.48Å; A145-R149 PolarHBondContact O-N 2.87Å; A145-L393 HydrophobicContact CB-CD1 3.92Å; A145-D396 HydrophobicContact CB-CB 3.58Å; A145-E397 HydrophobicContact CB-CG 3.8Å
146	C	64.3	Low	64.5	Low	26 Å²	26	39.5 Å²	39.5	18%	0.176	20%	0.204	C	C	.	.	H	α-helix	trans	-67	-44.9	168.1	-168.6	0	0	0	0	111.9	D142 Y148 R149 N150	D142-C146 VanDerWaalsContact CG-N 3.31Å; D142-C146 WeakPolarHBondContact O-CB 3.5Å; D142-C146 PolarHBondContact O-N 3.02Å; D142-C146 PolarHBondContact OD1-N 3.16Å; D142-C146 PolarHBondContact OD2-N 2.88Å; D142-C146 VanDerWaalsContact OD2-N 3.11Å; C146-Y148 VanDerWaalsContact C-N 3.34Å; C146-Y148 PolarHBondContact O-N 3.04Å; C146-R149 PolarHBondContact O-N 3.05Å; C146-N150 VanDerWaalsContact O-CB 3.24Å; C146-N150 WeakPolarHBondContact O-CB 3.36Å; C146-N150 PolarHBondContact O-N 2.82Å; C146-N150 PolarHBondContact SG-ND2 3.06Å
147	F	66.4	Low	64.9	Low	4 Å²	4	43.6 Å²	43.6	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-62.3	-41	172.4	-174.5	-97.2	0	0	0	111.1	F98 F120 S143 G144 S151 I152 L238 I240 G251	F98-F147 HydrophobicContact CE1-CD2 4.49Å; F98-F147 AromaticContact CE1-CE2 3.91Å; F98-F147 HydrophobicContact CE1-CE2 3.91Å; F120-F147 HydrophobicContact CE2-CB 4.34Å; F120-F147 HydrophobicContact CE2-CD2 4.2Å; F120-F147 HydrophobicContact CZ-CD2 4.21Å; S143-F147 VanDerWaalsContact O-CB 3.3Å; S143-F147 WeakPolarHBondContact O-CB 3.39Å; S143-F147 PolarHBondContact O-N 3.04Å; S143-F147 VanDerWaalsContact O-N 3.14Å; G144-F147 PolarHBondContact O-N 3.05Å; F147-S151 WeakPolarHBondContact O-CA 3.34Å; F147-S151 WeakPolarHBondContact O-CB 3.48Å; F147-S151 PolarHBondContact O-N 3.25Å; F147-S151 PolarHBondContact O-OG 3.18Å; F147-I152 HydrophobicContact CE1-CD1 4.18Å; F147-L238 HydrophobicContact CZ-CB 4.15Å; F147-L238 HydrophobicContact CZ-CD2 4.22Å; F147-I240 HydrophobicContact CD1-CD1 3.83Å; F147-I240 HydrophobicContact CD1-CG1 3.67Å; F147-I240 HydrophobicContact CE1-CG1 3.97Å; F147-G251 VanDerWaalsContact CD1-CA 3.49Å; F147-G251 VanDerWaalsContact CE1-CA 3.49Å
148	Y	77	Confident	65.1	Low	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-51.8	173.4	-170.1	-120	0	0	0	111.9	G144 A145 C146 I152 F153 H159 I240 Y389 L392 L393	G144-Y148 PolarHBondContact O-N 3.13Å; A145-Y148 PolarHBondContact O-N 2.75Å; C146-Y148 VanDerWaalsContact C-N 3.34Å; C146-Y148 PolarHBondContact O-N 3.04Å; Y148-I152 HydrophobicContact CD2-CB 3.76Å; Y148-I152 HydrophobicContact CD2-CD1 4.39Å; Y148-I152 HydrophobicContact CD2-CG2 3.7Å; Y148-I152 HydrophobicContact CE2-CB 4.06Å; Y148-I152 HydrophobicContact CE2-CG2 3.47Å; Y148-I152 VanDerWaalsContact CE2-CG2 3.47Å; Y148-I152 CarbonylContact O-C 3.56Å; Y148-I152 PolarHBondContact O-N 3Å; Y148-F153 HydrophobicContact CE1-CB 4.38Å; Y148-F153 WeakPolarHBondContact O-CB 3.49Å; Y148-F153 PolarHBondContact O-N 3.31Å; Y148-H159 AromaticContact CE2-NE2 3.9Å; Y148-H159 AromaticContact CZ-NE2 3.85Å; Y148-H159 PolarHBondContact OH-NE2 3.14Å; Y148-I240 HydrophobicContact CD2-CD1 3.81Å; Y148-I240 HydrophobicContact CG-CD1 4.1Å; Y148-Y389 WeakPolarHBondContact OH-CB 3.24Å; Y148-L392 HydrophobicContact CE1-CB 4Å; Y148-L393 HydrophobicContact CD1-CB 4.23Å; Y148-L393 HydrophobicContact CD1-CD1 3.92Å; Y148-L393 HydrophobicContact CE1-CB 4.34Å
149	R	74.4	Confident	65.5	Low	51 Å²	51	47.2 Å²	47.2	19%	0.192	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-46.6	-177.5	-165.2	-175.8	-56.1	107.5	2.3	112.2	D142 A145 C146 S154 L393 E397	D142-R149 IonicContact OD2-CZ 3.97Å; D142-R149 IonicContact OD2-NH1 3.55Å; D142-R149 PolarHBondContact OD2-NH1 3.05Å; D142-R149 IonicContact OD2-NH2 2.99Å; D142-R149 PolarHBondContact OD2-NH2 2.84Å; A145-R149 WeakPolarHBondContact O-CB 3.48Å; A145-R149 PolarHBondContact O-N 2.87Å; C146-R149 PolarHBondContact O-N 3.05Å; R149-S154 PolarHBondContact O-N 2.77Å; R149-L393 HydrophobicContact CB-CD1 4.09Å; R149-E397 IonicContact CZ-OE1 3.72Å; R149-E397 IonicContact NE-OE1 3.04Å; R149-E397 IonicContact NH2-OE1 3.47Å; R149-E397 PolarHBondContact NH2-OE1 3.33Å
150	N	66.5	Low	66.7	Low	54 Å²	54	46.3 Å²	46.3	29%	0.289	24%	0.24	S	C	.	.	H	α-helix	trans	-87.8	-26.9	-172.6	-64.7	2	0	0	0	113.6	C146 S154	C146-N150 VanDerWaalsContact O-CB 3.24Å; C146-N150 WeakPolarHBondContact O-CB 3.36Å; C146-N150 PolarHBondContact O-N 2.82Å; C146-N150 PolarHBondContact SG-ND2 3.06Å; N150-S154 PolarHBondContact O-OG 2.85Å
151	S	66.5	Low	68.4	Low	13 Å²	13	42.6 Å²	42.6	9%	0.091	23%	0.226	C	C	.	.	H	α-helix	trans	-121.3	-12	-167.5	-49.2	0	0	0	0	115.2	F98 F147 S154 L238	F98-S151 WeakPolarHBondContact CE1-OG 3.06Å; F98-S151 WeakPolarHBondContact CZ-OG 3.45Å; F147-S151 WeakPolarHBondContact O-CA 3.34Å; F147-S151 WeakPolarHBondContact O-CB 3.48Å; F147-S151 PolarHBondContact O-N 3.25Å; F147-S151 PolarHBondContact O-OG 3.18Å; S151-S154 PolarHBondContact N-OG 3.16Å; S151-L238 VanDerWaalsContact O-CD1 3.25Å; S151-L238 WeakPolarHBondContact O-CD1 3.4Å
152	I	70.7	Confident	70.2	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.5	-54	-179	-64.4	-172	0	0	0	111.9	F147 Y148 S154 C155 H159 V177 I240	F147-I152 HydrophobicContact CE1-CD1 4.18Å; Y148-I152 HydrophobicContact CD2-CB 3.76Å; Y148-I152 HydrophobicContact CD2-CD1 4.39Å; Y148-I152 HydrophobicContact CD2-CG2 3.7Å; Y148-I152 HydrophobicContact CE2-CB 4.06Å; Y148-I152 HydrophobicContact CE2-CG2 3.47Å; Y148-I152 VanDerWaalsContact CE2-CG2 3.47Å; Y148-I152 CarbonylContact O-C 3.56Å; Y148-I152 PolarHBondContact O-N 3Å; I152-S154 VanDerWaalsContact C-N 3.28Å; I152-S154 PolarHBondContact O-N 3.44Å; I152-C155 WeakPolarHBondContact O-CB 3.44Å; I152-C155 PolarHBondContact O-N 2.88Å; I152-H159 HydrophobicContact CG2-CB 3.71Å; I152-H159 WeakPolarHBondContact CG2-CD2 3.49Å; I152-V177 HydrophobicContact CB-CG2 4.14Å; I152-V177 HydrophobicContact CG1-CG2 3.95Å; I152-V177 HydrophobicContact CG2-CG2 3.87Å; I152-I240 HydrophobicContact CD1-CB 4.49Å; I152-I240 HydrophobicContact CD1-CD1 3.93Å; I152-I240 HydrophobicContact CD1-CG1 3.81Å
153	F	72.4	Confident	72	Confident	64 Å²	64	36.5 Å²	36.5	28%	0.281	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-61.7	-37.8	176.9	-178.1	-105.6	0	0	0	111.9	Y148 C155 G156 Y389	Y148-F153 HydrophobicContact CE1-CB 4.38Å; Y148-F153 WeakPolarHBondContact O-CB 3.49Å; Y148-F153 PolarHBondContact O-N 3.31Å; F153-C155 PolarHBondContact O-N 3.47Å; F153-G156 PolarHBondContact O-N 2.85Å; F153-Y389 HydrophobicContact CD2-CD2 4.27Å; F153-Y389 HydrophobicContact CD2-CG 4.4Å; F153-Y389 HydrophobicContact CE2-CD2 4.19Å; F153-Y389 HydrophobicContact CE2-CG 4.47Å
154	S	69.5	Low	73.5	Confident	71 Å²	71	34.9 Å²	34.9	50%	0.497	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-60.4	-19.5	172.5	56.9	0	0	0	0	114.4	R149 N150 S151 I152 G156	R149-S154 PolarHBondContact O-N 2.77Å; N150-S154 PolarHBondContact O-OG 2.85Å; S151-S154 PolarHBondContact N-OG 3.16Å; I152-S154 VanDerWaalsContact C-N 3.28Å; I152-S154 PolarHBondContact O-N 3.44Å; S154-G156 VanDerWaalsContact C-N 3.32Å
155	C	63.6	Low	74.9	Confident	39 Å²	39	37.7 Å²	37.7	26%	0.264	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-84.8	-4.1	174.5	-57.4	0	0	0	0	113.3	I152 F153 D157 Q158 V177	I152-C155 WeakPolarHBondContact O-CB 3.44Å; I152-C155 PolarHBondContact O-N 2.88Å; F153-C155 PolarHBondContact O-N 3.47Å; C155-D157 PolarHBondContact O-N 3.15Å; C155-Q158 HydrophobicContact CB-CB 4.26Å; C155-Q158 WeakPolarHBondContact O-CB 3.42Å; C155-Q158 WeakPolarHBondContact O-CG 3.45Å; C155-Q158 PolarHBondContact O-N 3.32Å; C155-Q158 VanDerWaalsContact O-N 3.15Å; C155-V177 HydrophobicContact CB-CG1 4.39Å; C155-V177 HydrophobicContact CB-CG2 4.41Å
156	G	65.1	Low	75.7	Confident	29 Å²	29	38 Å²	38	30%	0.299	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	55.3	-130.8	178.3	0	0	0	0	0	112.6	F153 S154 Q158 H159	F153-G156 PolarHBondContact O-N 2.85Å; S154-G156 VanDerWaalsContact C-N 3.32Å; G156-Q158 PolarHBondContact O-N 2.85Å; G156-H159 PolarHBondContact O-N 2.6Å; G156-H159 PolarHBondContact O-ND1 3.17Å
157	D	61.4	Low	76.6	Confident	124 Å²	124	40.1 Å²	40.1	66%	0.663	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-63.6	-3.9	-179.5	-61.5	2.6	0	0	0	114.6	C155 H159	C155-D157 PolarHBondContact O-N 3.15Å; D157-H159 VanDerWaalsContact C-N 3.32Å
158	Q	68	Low	77.2	Confident	153 Å²	153	47 Å²	47	72%	0.715	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-84.5	-3.1	178.4	-55.2	-174.9	14	0	0	113.7	C155 G156	C155-Q158 HydrophobicContact CB-CB 4.26Å; C155-Q158 WeakPolarHBondContact O-CB 3.42Å; C155-Q158 WeakPolarHBondContact O-CG 3.45Å; C155-Q158 PolarHBondContact O-N 3.32Å; C155-Q158 VanDerWaalsContact O-N 3.15Å; G156-Q158 PolarHBondContact O-N 2.85Å
159	H	79.7	Confident	77.1	Confident	7 Å²	7	50 Å²	50	3%	0.032	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	136.6	174.2	88.8	-81.8	0	0	0	112.3	Y148 I152 G156 D157 N161 L176 V177 Y389	Y148-H159 AromaticContact CE2-NE2 3.9Å; Y148-H159 AromaticContact CZ-NE2 3.85Å; Y148-H159 PolarHBondContact OH-NE2 3.14Å; I152-H159 HydrophobicContact CG2-CB 3.71Å; I152-H159 WeakPolarHBondContact CG2-CD2 3.49Å; G156-H159 PolarHBondContact O-N 2.6Å; G156-H159 PolarHBondContact O-ND1 3.17Å; D157-H159 VanDerWaalsContact C-N 3.32Å; H159-N161 PolarHBondContact CD2-ND2 3.38Å; H159-N161 VanDerWaalsContact CD2-ND2 3.31Å; H159-N161 PolarHBondContact CD2-OD1 3Å; H159-N161 PolarHBondContact NE2-ND2 3.25Å; H159-L176 WeakPolarHBondContact CA-O 3.21Å; H159-V177 HydrophobicContact CB-CG2 3.38Å; H159-Y389 AromaticContact CE1-CD1 3.56Å; H159-Y389 AromaticContact CE1-CD2 3.71Å; H159-Y389 AromaticContact CE1-CE1 3.46Å; H159-Y389 VanDerWaalsContact CE1-CE1 3.46Å; H159-Y389 WeakPolarHBondContact CE1-CE1 3.44Å; H159-Y389 AromaticContact CE1-CE2 3.6Å; H159-Y389 AromaticContact CE1-CG 3.71Å; H159-Y389 AromaticContact CE1-CZ 3.48Å; H159-Y389 VanDerWaalsContact CE1-CZ 3.48Å; H159-Y389 AromaticContact NE2-CD1 3.57Å; H159-Y389 AromaticContact NE2-CE1 3.63Å
160	Q	85.1	Confident	77.7	Confident	63 Å²	63	48 Å²	48	29%	0.294	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	133	172.6	-174.9	58.7	65.2	0	0	109.6	W162 L176 E362	Q160-W162 HydrophobicContact CG-CZ2 4.44Å; Q160-W162 VanDerWaalsContact CG-NE1 3.35Å; Q160-L176 PolarHBondContact N-O 3.48Å; Q160-L176 PolarHBondContact O-N 2.88Å; Q160-E362 WeakPolarHBondContact CG-OE1 3.44Å
161	N	89.8	Confident	78.9	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.016	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	144.8	172	-62.5	-62.3	0	0	0	110.4	H159 F163 I174 S175 G382 Y389	H159-N161 PolarHBondContact CD2-ND2 3.38Å; H159-N161 VanDerWaalsContact CD2-ND2 3.31Å; H159-N161 PolarHBondContact CD2-OD1 3Å; H159-N161 PolarHBondContact NE2-ND2 3.25Å; N161-F163 HydrophobicContact CB-CE1 3.59Å; N161-F163 HydrophobicContact CB-CE2 4.43Å; N161-F163 HydrophobicContact CB-CZ 3.53Å; N161-I174 CarbonylContact C-O 3.58Å; N161-I174 VanDerWaalsContact CA-O 3.29Å; N161-I174 WeakPolarHBondContact CA-O 3.29Å; N161-S175 VanDerWaalsContact OD1-CB 3.28Å; N161-S175 WeakPolarHBondContact OD1-CB 3.36Å; N161-S175 PolarHBondContact OD1-OG 3.36Å; N161-G382 PolarHBondContact O-N 3.29Å; N161-Y389 VanDerWaalsContact ND2-CE1 3.3Å; N161-Y389 WeakPolarHBondContact ND2-CE1 3.5Å
162	W	91.1	Very high	80	Confident	22 Å²	22	45 Å²	45	8%	0.083	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	124.6	179.1	-69	86.6	0	0	0	109.4	Q160 A173 I174 E362 L366 M376 L379 P381	Q160-W162 HydrophobicContact CG-CZ2 4.44Å; Q160-W162 VanDerWaalsContact CG-NE1 3.35Å; W162-A173 WeakPolarHBondContact O-CA 3.28Å; W162-I174 HydrophobicContact CB-CB 4.37Å; W162-I174 PolarHBondContact N-O 3.38Å; W162-I174 PolarHBondContact O-N 2.79Å; W162-E362 HydrophobicContact CZ2-CG 4.42Å; W162-E362 PolarHBondContact NE1-OE1 2.76Å; W162-L366 HydrophobicContact CB-CD2 4.19Å; W162-L366 HydrophobicContact CD2-CD1 3.68Å; W162-L366 HydrophobicContact CD2-CD2 4.48Å; W162-L366 HydrophobicContact CE3-CD1 4.13Å; W162-L366 HydrophobicContact CG-CD1 4.01Å; W162-L366 HydrophobicContact CG-CD2 3.95Å; W162-L366 HydrophobicContact CH2-CD1 4.4Å; W162-L366 HydrophobicContact CZ2-CD1 3.98Å; W162-L366 HydrophobicContact CZ3-CD1 4.46Å; W162-M376 HydrophobicContact CE3-CE 4.43Å; W162-M376 HydrophobicContact CH2-CE 3.7Å; W162-M376 HydrophobicContact CZ3-CE 3.5Å; W162-M376 VanDerWaalsContact CZ3-CE 3.5Å; W162-L379 HydrophobicContact CB-CD1 4.29Å; W162-L379 HydrophobicContact CE3-CB 4.23Å; W162-P381 HydrophobicContact CE3-CG 4.17Å; W162-P381 HydrophobicContact CH2-CG 3.77Å; W162-P381 HydrophobicContact CZ2-CG 4.36Å; W162-P381 HydrophobicContact CZ3-CG 3.66Å
163	F	92.9	Very high	81	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	144.6	-174.5	-50.6	-36.8	0	0	0	110.2	N161 I172 A173 K380 G382 V388 L392 F616 C617 H620 T621	N161-F163 HydrophobicContact CB-CE1 3.59Å; N161-F163 HydrophobicContact CB-CE2 4.43Å; N161-F163 HydrophobicContact CB-CZ 3.53Å; F163-I172 WeakPolarHBondContact CA-O 3.39Å; F163-A173 HydrophobicContact CD1-CB 3.6Å; F163-A173 HydrophobicContact CE1-CB 3.96Å; F163-K380 PolarHBondContact N-O 2.92Å; F163-K380 PolarHBondContact O-N 2.98Å; F163-G382 VanDerWaalsContact CD2-CA 3.46Å; F163-V388 HydrophobicContact CE2-CG1 3.68Å; F163-V388 HydrophobicContact CZ-CG1 3.69Å; F163-L392 HydrophobicContact CE1-CD1 4.12Å; F163-L392 HydrophobicContact CE1-CD2 4.22Å; F163-L392 HydrophobicContact CZ-CD1 4.09Å; F163-F616 AromaticContact CD1-CE1 3.85Å; F163-F616 HydrophobicContact CD1-CE1 3.85Å; F163-F616 HydrophobicContact CD2-CE1 4.06Å; F163-F616 AromaticContact CE1-CE1 3.52Å; F163-F616 HydrophobicContact CE1-CE1 3.52Å; F163-F616 AromaticContact CE1-CZ 3.99Å; F163-F616 HydrophobicContact CE1-CZ 3.99Å; F163-F616 AromaticContact CE2-CE1 3.74Å; F163-F616 HydrophobicContact CE2-CE1 3.74Å; F163-F616 AromaticContact CE2-CZ 3.79Å; F163-F616 HydrophobicContact CE2-CZ 3.79Å; F163-F616 HydrophobicContact CG-CE1 4.13Å; F163-F616 AromaticContact CZ-CE1 3.48Å; F163-F616 HydrophobicContact CZ-CE1 3.48Å; F163-F616 VanDerWaalsContact CZ-CE1 3.48Å; F163-F616 AromaticContact CZ-CZ 3.5Å; F163-F616 HydrophobicContact CZ-CZ 3.5Å; F163-F616 VanDerWaalsContact CZ-CZ 3.5Å; F163-C617 HydrophobicContact CB-CB 4.32Å; F163-H620 HydrophobicContact CD2-CB 4.08Å; F163-H620 WeakPolarHBondContact CD2-O 3.31Å; F163-H620 HydrophobicContact CE2-CB 3.85Å; F163-T621 HydrophobicContact CB-CG2 3.69Å; F163-T621 WeakPolarHBondContact O-CG2 3.31Å
164	G	89.9	Confident	81.9	Confident	6 Å²	6	42 Å²	42	6%	0.062	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	-179.8	177.8	0	0	0	0	0	113.2	A171 I172 Y378	G164-A171 WeakPolarHBondContact O-CA 3.35Å; G164-I172 PolarHBondContact N-O 3.29Å; G164-I172 VanDerWaalsContact N-O 3.08Å; G164-I172 PolarHBondContact O-N 2.86Å; G164-Y378 WeakPolarHBondContact CA-O 3.41Å
165	I	89.6	Confident	82.8	Confident	63 Å²	63	38.6 Å²	38.6	32%	0.323	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	116.9	169.9	-61	167.6	0	0	0	106.2	A171 N618	I165-A171 HydrophobicContact CG1-CB 4.25Å; I165-N618 WeakPolarHBondContact CD1-ND2 3.3Å
166	I	86.5	Confident	84	Confident	6 Å²	6	36.8 Å²	36.8	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	135.2	-179.7	-59.9	160.5	0	0	0	107.8	N168 D169 G170 I172 V370	I166-N168 PolarHBondContact O-N 3.01Å; I166-D169 HydrophobicContact CB-CB 3.89Å; I166-D169 HydrophobicContact CG2-CB 3.93Å; I166-D169 PolarHBondContact O-N 3.37Å; I166-G170 PolarHBondContact N-O 3.05Å; I166-G170 PolarHBondContact O-N 2.98Å; I166-I172 HydrophobicContact CD1-CB 4.27Å; I166-I172 HydrophobicContact CD1-CD1 3.95Å; I166-I172 HydrophobicContact CD1-CG2 3.54Å; I166-I172 HydrophobicContact CG1-CG2 3.91Å; I166-V370 HydrophobicContact CD1-CG1 3.5Å; I166-V370 HydrophobicContact CD1-CG2 4.23Å
167	P	81.8	Confident	84.9	Confident	71 Å²	71	35.5 Å²	35.5	46%	0.461	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	134.8	171.7	-27.6	35.1	0	0	0	111.7	D169 Y378	P167-D169 PolarHBondContact O-N 3.28Å; P167-Y378 VanDerWaalsContact CD-CD1 3.47Å; P167-Y378 HydrophobicContact CG-CD1 4.19Å; P167-Y378 HydrophobicContact CG-CE1 3.51Å
168	N	78.9	Confident	85.9	Confident	149 Å²	149	34.5 Å²	34.5	80%	0.797	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.9	-42.8	-174.2	-47.2	-45	0	0	0	116	I166 Q245	I166-N168 PolarHBondContact O-N 3.01Å; N168-Q245 PolarHBondContact O-NE2 3.24Å
169	D	75.6	Confident	86.2	Confident	63 Å²	63	29.6 Å²	29.6	34%	0.337	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-26.2	-179.7	-93.6	27.6	0	0	0	113.5	I166 P167 R243 Q245	I166-D169 HydrophobicContact CB-CB 3.89Å; I166-D169 HydrophobicContact CG2-CB 3.93Å; I166-D169 PolarHBondContact O-N 3.37Å; P167-D169 PolarHBondContact O-N 3.28Å; D169-R243 IonicContact OD2-NH1 3.59Å; D169-R243 PolarHBondContact OD2-NH1 3.26Å; D169-Q245 WeakPolarHBondContact O-CB 3.48Å
170	G	86.9	Confident	85.6	Confident	9 Å²	9	32.6 Å²	32.6	9%	0.093	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	84	-158.8	-179.4	0	0	0	0	0	113.9	I166 E244	I166-G170 PolarHBondContact N-O 3.05Å; I166-G170 PolarHBondContact O-N 2.98Å; G170-E244 WeakPolarHBondContact CA-OE2 3.36Å
171	A	91.4	Very high	84.4	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.008	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	140.8	178.9	0	0	0	0	0	112.5	G164 I165 E244 L613 H614	G164-A171 WeakPolarHBondContact O-CA 3.35Å; I165-A171 HydrophobicContact CG1-CB 4.25Å; A171-E244 HydrophobicContact CB-CB 4.23Å; A171-E244 PolarHBondContact N-OE2 2.83Å; A171-E244 WeakPolarHBondContact O-CB 3.19Å; A171-E244 PolarHBondContact O-N 2.89Å; A171-L613 HydrophobicContact CB-CD2 4.4Å; A171-L613 HydrophobicContact CB-CG 4.05Å; A171-L613 WeakPolarHBondContact O-CD2 3.49Å; A171-H614 HydrophobicContact CB-CB 4Å
172	I	90.7	Very high	82.6	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	141.4	-177.8	-175.8	162.9	0	0	0	110.9	F163 G164 I166 I174 V241 R242 R243 V370 L379 C617	F163-I172 WeakPolarHBondContact CA-O 3.39Å; G164-I172 PolarHBondContact N-O 3.29Å; G164-I172 VanDerWaalsContact N-O 3.08Å; G164-I172 PolarHBondContact O-N 2.86Å; I166-I172 HydrophobicContact CD1-CB 4.27Å; I166-I172 HydrophobicContact CD1-CD1 3.95Å; I166-I172 HydrophobicContact CD1-CG2 3.54Å; I166-I172 HydrophobicContact CG1-CG2 3.91Å; I172-I174 HydrophobicContact CD1-CD1 4.16Å; I172-I174 HydrophobicContact CD1-CG1 4.25Å; I172-I174 HydrophobicContact CG1-CD1 4.47Å; I172-I174 HydrophobicContact CG1-CG1 4.06Å; I172-V241 HydrophobicContact CD1-CG1 3.95Å; I172-V241 HydrophobicContact CG1-CG1 4.19Å; I172-R242 WeakPolarHBondContact CA-O 3.32Å; I172-R243 HydrophobicContact CD1-CG 4.39Å; I172-V370 HydrophobicContact CD1-CG2 3.66Å; I172-L379 HydrophobicContact CG2-CD2 3.57Å; I172-C617 PolarHBondContact O-SG 2.73Å
173	A	91.2	Very high	80.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	116.5	173.7	0	0	0	0	0	111.2	W162 F163 R242 L392 L613	W162-A173 WeakPolarHBondContact O-CA 3.28Å; F163-A173 HydrophobicContact CD1-CB 3.6Å; F163-A173 HydrophobicContact CE1-CB 3.96Å; A173-R242 HydrophobicContact CB-CB 4.32Å; A173-R242 PolarHBondContact N-O 2.73Å; A173-R242 PolarHBondContact O-N 3.26Å; A173-L392 HydrophobicContact CB-CD2 4.33Å; A173-L613 HydrophobicContact CB-CD1 3.79Å
174	I	90.6	Very high	77.7	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	135.6	-178.8	-51.9	-174	0	0	0	109.2	N161 W162 I172 L176 V239 I240 V241 L366 L369 V370 L379	N161-I174 CarbonylContact C-O 3.58Å; N161-I174 VanDerWaalsContact CA-O 3.29Å; N161-I174 WeakPolarHBondContact CA-O 3.29Å; W162-I174 HydrophobicContact CB-CB 4.37Å; W162-I174 PolarHBondContact N-O 3.38Å; W162-I174 PolarHBondContact O-N 2.79Å; I172-I174 HydrophobicContact CD1-CD1 4.16Å; I172-I174 HydrophobicContact CD1-CG1 4.25Å; I172-I174 HydrophobicContact CG1-CD1 4.47Å; I172-I174 HydrophobicContact CG1-CG1 4.06Å; I174-L176 HydrophobicContact CG2-CD2 3.77Å; I174-L176 HydrophobicContact CG2-CG 3.96Å; I174-V239 HydrophobicContact CG2-CG1 4.45Å; I174-I240 CarbonylContact C-O 3.51Å; I174-I240 WeakPolarHBondContact CA-O 3.32Å; I174-V241 HydrophobicContact CD1-CG2 4.27Å; I174-V241 HydrophobicContact CG1-CG1 4.18Å; I174-V241 HydrophobicContact CG1-CG2 4.09Å; I174-V241 HydrophobicContact CG2-CG2 4.12Å; I174-L366 HydrophobicContact CB-CD2 4.4Å; I174-L366 HydrophobicContact CD1-CD2 3.89Å; I174-L366 HydrophobicContact CG2-CD2 4.17Å; I174-L369 HydrophobicContact CD1-CB 4.47Å; I174-L369 HydrophobicContact CD1-CD1 4.49Å; I174-L369 HydrophobicContact CG2-CD1 4.06Å; I174-V370 HydrophobicContact CD1-CG2 4.02Å; I174-L379 HydrophobicContact CD1-CD1 3.86Å
175	S	89.3	Confident	74.8	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	128.8	168.4	-61	0	0	0	0	109.6	N161 V239 I240 R242	N161-S175 VanDerWaalsContact OD1-CB 3.28Å; N161-S175 WeakPolarHBondContact OD1-CB 3.36Å; N161-S175 PolarHBondContact OD1-OG 3.36Å; S175-V239 WeakPolarHBondContact O-CA 3.44Å; S175-I240 PolarHBondContact N-O 2.92Å; S175-I240 PolarHBondContact O-N 3.43Å; S175-R242 PolarHBondContact OG-NH1 2.99Å
176	L	88.3	Confident	71.9	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135	-179.6	-60.7	-178.5	0	0	0	111.4	H159 Q160 I174 W237 L238 V239 E362 V365 L366 L369	H159-L176 WeakPolarHBondContact CA-O 3.21Å; Q160-L176 PolarHBondContact N-O 3.48Å; Q160-L176 PolarHBondContact O-N 2.88Å; I174-L176 HydrophobicContact CG2-CD2 3.77Å; I174-L176 HydrophobicContact CG2-CG 3.96Å; L176-W237 HydrophobicContact CB-CE3 4.05Å; L176-W237 HydrophobicContact CB-CZ3 4.06Å; L176-L238 WeakPolarHBondContact CA-O 3.21Å; L176-V239 HydrophobicContact CD2-CB 4.28Å; L176-V239 HydrophobicContact CD2-CG1 4Å; L176-V239 HydrophobicContact CD2-CG2 3.74Å; L176-E362 HydrophobicContact CD1-CG 3.82Å; L176-V365 HydrophobicContact CD1-CG1 4.25Å; L176-V365 HydrophobicContact CD2-CG1 3.85Å; L176-L366 HydrophobicContact CD1-CD2 3.78Å; L176-L366 HydrophobicContact CD1-CG 3.96Å; L176-L369 HydrophobicContact CD2-CD1 4.08Å
177	V	84.6	Confident	69	Low	2 Å²	2	55.7 Å²	55.7	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135.7	166.1	177.2	0	0	0	0	109	I152 C155 H159 W237 L238	I152-V177 HydrophobicContact CB-CG2 4.14Å; I152-V177 HydrophobicContact CG1-CG2 3.95Å; I152-V177 HydrophobicContact CG2-CG2 3.87Å; C155-V177 HydrophobicContact CB-CG1 4.39Å; C155-V177 HydrophobicContact CB-CG2 4.41Å; H159-V177 HydrophobicContact CB-CG2 3.38Å; V177-W237 CarbonylContact O-C 3.58Å; V177-W237 VanDerWaalsContact O-CA 3.26Å; V177-W237 WeakPolarHBondContact O-CA 3.4Å; V177-L238 HydrophobicContact CB-CB 4.22Å; V177-L238 PolarHBondContact N-O 3.04Å; V177-L238 PolarHBondContact O-N 2.94Å
178	K	83	Confident	66.3	Low	103 Å²	103	55.5 Å²	55.5	45%	0.448	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.2	170	-170.1	168.4	179.2	173.1	0	109.6	W237 D361	K178-W237 HydrophobicContact CB-CD2 4.22Å; K178-W237 HydrophobicContact CB-CE3 3.91Å; K178-W237 HydrophobicContact CB-CH2 4.09Å; K178-W237 HydrophobicContact CB-CZ2 4.37Å; K178-W237 HydrophobicContact CB-CZ3 3.85Å; K178-W237 HydrophobicContact CD-CH2 4.14Å; K178-W237 HydrophobicContact CD-CZ2 3.84Å; K178-W237 HydrophobicContact CG-CD2 4.44Å; K178-W237 HydrophobicContact CG-CZ2 4.37Å; K178-D361 IonicContact NZ-OD2 3.74Å; K178-D361 PolarHBondContact NZ-OD2 2.8Å
179	T	73.6	Confident	63.8	Low	50 Å²	50	55 Å²	55	31%	0.307	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	-179.7	-173	-169.4	0	0	0	0	111.6	I181 A236 L238	T179-I181 HydrophobicContact CG2-CD1 4.19Å; T179-I181 HydrophobicContact CG2-CG1 3.88Å; T179-A236 PolarHBondContact N-O 3.1Å; T179-A236 PolarHBondContact O-N 3.11Å; T179-A236 VanDerWaalsContact O-O 3.08Å; T179-L238 HydrophobicContact CG2-CD1 4.03Å; T179-L238 HydrophobicContact CG2-CD2 4.1Å; T179-L238 HydrophobicContact CG2-CG 3.7Å
180	S	67.5	Low	61.4	Low	70 Å²	70	55.6 Å²	55.6	49%	0.49	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	119.8	173.4	56.8	0	0	0	0	109.9	L234	S180-L234 WeakPolarHBondContact CA-O 3.42Å
181	I	59.9	Low	58.5	Low	4 Å²	4	61.2 Å²	61.2	2%	0.021	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	137.4	-173.5	-60.5	175.9	0	0	0	109.7	F98 T179 F183 L234 A236 L238 V253	F98-I181 HydrophobicContact CB-CG2 4.45Å; T179-I181 HydrophobicContact CG2-CD1 4.19Å; T179-I181 HydrophobicContact CG2-CG1 3.88Å; I181-F183 HydrophobicContact CB-CD2 4.45Å; I181-F183 HydrophobicContact CB-CE2 4.02Å; I181-F183 HydrophobicContact CG2-CD2 4.23Å; I181-F183 HydrophobicContact CG2-CE2 3.96Å; I181-F183 HydrophobicContact CG2-CZ 4.42Å; I181-L234 PolarHBondContact N-O 3.43Å; I181-L234 PolarHBondContact O-N 2.81Å; I181-A236 HydrophobicContact CD1-CB 3.69Å; I181-A236 HydrophobicContact CG1-CB 4.13Å; I181-L238 HydrophobicContact CD1-CD2 3.76Å; I181-V253 HydrophobicContact CD1-CB 4.24Å; I181-V253 HydrophobicContact CD1-CG1 3.44Å; I181-V253 VanDerWaalsContact CD1-CG1 3.44Å; I181-V253 HydrophobicContact CD1-CG2 3.74Å
182	Y	51.8	Low	55.5	Low	84 Å²	84	66.8 Å²	66.8	33%	0.329	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	115.3	169.9	174.7	-110.3	0	0	0	109.4	K184 L231	Y182-K184 HydrophobicContact CD1-CB 4.46Å; Y182-K184 HydrophobicContact CE1-CB 3.71Å; Y182-K184 HydrophobicContact CE1-CG 4.24Å; Y182-L231 HydrophobicContact CE2-CD2 4.32Å
183	F	43.5	Very low	52.4	Low	41 Å²	41	75.9 Å²	75.9	18%	0.18	43%	0.425	C	S	.	.			trans	-96.2	116.5	169.1	-74.9	-94.5	0	0	0	108.6	Y116 I181 S185 L234 V253	Y116-F183 HydrophobicContact CD2-CE1 4.09Å; Y116-F183 HydrophobicContact CD2-CZ 4.33Å; Y116-F183 HydrophobicContact CE1-CE1 4.46Å; Y116-F183 AromaticContact CE2-CE1 3.77Å; Y116-F183 HydrophobicContact CE2-CE1 3.77Å; Y116-F183 HydrophobicContact CE2-CZ 4.17Å; Y116-F183 AromaticContact CZ-CE1 3.97Å; I181-F183 HydrophobicContact CB-CD2 4.45Å; I181-F183 HydrophobicContact CB-CE2 4.02Å; I181-F183 HydrophobicContact CG2-CD2 4.23Å; I181-F183 HydrophobicContact CG2-CE2 3.96Å; I181-F183 HydrophobicContact CG2-CZ 4.42Å; F183-S185 PolarHBondContact O-N 2.87Å; F183-L234 HydrophobicContact CD2-CB 4.03Å; F183-L234 HydrophobicContact CD2-CD1 3.87Å; F183-L234 HydrophobicContact CD2-CG 4.24Å; F183-L234 HydrophobicContact CE2-CB 4.16Å; F183-L234 HydrophobicContact CE2-CD1 4.34Å; F183-L234 HydrophobicContact CG-CD1 4.43Å; F183-V253 HydrophobicContact CZ-CG1 4.18Å
184	K	36.3	Very low	49.4	Very low	116 Å²	116	81.9 Å²	81.9	50%	0.504	46%	0.457	S	S	.	.			trans	-85.6	98.7	173.3	-170.7	-172.6	174.8	-159.5	0	108.8	Y182	Y182-K184 HydrophobicContact CD1-CB 4.46Å; Y182-K184 HydrophobicContact CE1-CB 3.71Å; Y182-K184 HydrophobicContact CE1-CG 4.24Å
185	S	30.8	Very low	46.3	Very low	88 Å²	88	89.5 Å²	89.5	62%	0.615	49%	0.49	S	S	*	.			trans	-67.4	136.4	166.7	54.6	0	0	0	0	109.9	F183 Y187	F183-S185 PolarHBondContact O-N 2.87Å; S185-Y187 PolarHBondContact O-N 3.22Å
186	N	28	Very low	43.2	Very low	108 Å²	108	97.6 Å²	97.6	58%	0.578	53%	0.528	S	S	*	.			trans	-77.1	2.4	-178.4	-77.7	-20.2	0	0	0	114.5	G188	N186-G188 VanDerWaalsContact C-N 3.35Å; N186-G188 PolarHBondContact O-N 3.39Å
187	Y	25.3	Very low	40.1	Very low	207 Å²	207	102.2 Å²	102.2	81%	0.812	56%	0.56	S	S	*	*			trans	-73.5	81.7	177.3	-69	-72	0	0	0	113	S185	S185-Y187 PolarHBondContact O-N 3.22Å
188	G	26.2	Very low	37.3	Very low	67 Å²	67	110.8 Å²	110.8	69%	0.691	60%	0.6	S	S	*	*			trans	-120	81.5	168.7	0	0	0	0	0	111.2	N186 S190	N186-G188 VanDerWaalsContact C-N 3.35Å; N186-G188 PolarHBondContact O-N 3.39Å; G188-S190 PolarHBondContact O-N 3.39Å
189	T	26.5	Very low	34.5	Very low	138 Å²	138	110 Å²	110	85%	0.847	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-56.7	118.2	179.5	47	0	0	0	0	112
190	S	25.1	Very low	32.2	Very low	77 Å²	77	114.4 Å²	114.4	54%	0.538	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-72	135	167.8	52.6	0	0	0	0	110.2	G188 S192	G188-S190 PolarHBondContact O-N 3.39Å; S190-S192 PolarHBondContact O-N 3.38Å
191	P	26.2	Very low	30.2	Very low	126 Å²	126	117 Å²	117	82%	0.818	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-73.5	126.1	178.5	29.2	-33.3	0	0	0	110.5
192	S	28.3	Very low	28.5	Very low	119 Å²	119	120.4 Å²	120.4	83%	0.832	67%	0.671	S	S	*	*			trans	-86	111.6	174.5	56.6	0	0	0	0	111.1	S190	S190-S192 PolarHBondContact O-N 3.38Å
193	E	25.2	Very low	27.4	Very low	192 Å²	192	123.3 Å²	123.3	90%	0.897	69%	0.693	S	S	*	*			trans	-76.8	118.6	164.7	-65	-174	149.2	0	0	110.1
194	D	27.8	Very low	26.6	Very low	127 Å²	127	128.9 Å²	128.9	68%	0.679	72%	0.722	S	S	*	*			trans	-150.4	99	155.2	-127.4	-19	0	0	0	113.7
195	K	26.3	Very low	26	Very low	160 Å²	160	127.7 Å²	127.7	70%	0.696	73%	0.729	S	S	*	*			trans	49.2	116.1	142.4	-62.9	-179	-165.4	79.2	0	121.9
196	Q	23.6	Very low	25.8	Very low	170 Å²	170	128.7 Å²	128.7	79%	0.794	74%	0.735	S	S	*	*				80.6	118.1	123	-68.2	175.6	-40.8	0	0	121.7
197	S	23.1	Very low	25.7	Very low	97 Å²	97	130.4 Å²	130.4	68%	0.678	74%	0.737	S	S	*	*				110.9	115.9	125.6	75.3	0	0	0	0	119.9
198	H	25.7	Very low	25.7	Very low	182 Å²	182	125.2 Å²	125.2	84%	0.843	72%	0.72	S	S	*	*			trans	55.9	145.6	148.7	-55	-52.2	0	0	0	121.5
199	S	24.2	Very low	25.8	Very low	88 Å²	88	125.7 Å²	125.7	62%	0.615	71%	0.713	S	S	*	*			cis	-170	163.3	-17.4	52.7	0	0	0	0	111.5
200	N	24.7	Very low	25.9	Very low	141 Å²	141	124.5 Å²	124.5	75%	0.754	70%	0.701	S	S	*	*			trans	64.8	143.7	147.6	-67.6	6	0	0	0	121.6
201	T	25.3	Very low	26	Very low	124 Å²	124	126.2 Å²	126.2	76%	0.761	71%	0.712	S	S	*	*			cis	-169.4	159	-29.5	7.7	0	0	0	0	112.3
202	A	25.8	Very low	26	Very low	77 Å²	77	126 Å²	126	64%	0.636	70%	0.704	S	S	*	*			trans	87	102	144.3	0	0	0	0	0	125.5
203	N	26.8	Very low	25.9	Very low	145 Å²	145	128.2 Å²	128.2	78%	0.775	70%	0.699	S	S	*	*				92.7	120.5	112.1	-63.3	-7.5	0	0	0	126.9
204	I	26.8	Very low	25.9	Very low	157 Å²	157	126.6 Å²	126.6	81%	0.805	70%	0.696	S	S	*	*			trans	80.4	152.7	135.8	-70	170.2	0	0	0	121
205	S	25	Very low	25.7	Very low	91 Å²	91	128.4 Å²	128.4	64%	0.636	71%	0.705	S	S	*	*			cis	-172	174.5	-43.7	84.3	0	0	0	0	113.3
206	C	25.4	Very low	25.8	Very low	110 Å²	110	125.7 Å²	125.7	74%	0.743	70%	0.704	S	S	*	*			trans	73.1	156	155.6	-79.1	0	0	0	0	121.6
207	K	26.8	Very low	25.8	Very low	143 Å²	143	123.1 Å²	123.1	62%	0.622	70%	0.7	S	S	*	*			cis	-156.5	-141.6	-19.2	-145.8	-179.4	-172.2	-75.7	0	113.6	I1187	K207-I1187 VanDerWaalsContact C-CD1 3.42Å; K207-I1187 WeakPolarHBondContact O-CD1 3.17Å
208	E	25.9	Very low	25.8	Very low	99 Å²	99	128 Å²	128	46%	0.463	71%	0.709	S	S	.	*			trans	-124.6	173.7	-146.7	-88.8	-170.6	-76.7	0	0	116.6	R1185 I1187	E208-R1185 WeakPolarHBondContact OE2-CD 3.27Å; E208-R1185 IonicContact OE2-CZ 2.72Å; E208-R1185 IonicContact OE2-NE 3Å; E208-R1185 IonicContact OE2-NH1 3.16Å; E208-R1185 PolarHBondContact OE2-NH1 3.2Å; E208-I1187 HydrophobicContact CB-CD1 4.45Å; E208-I1187 HydrophobicContact CG-CD1 3.63Å
209	S	28.1	Very low	25.6	Very low	76 Å²	76	124.3 Å²	124.3	53%	0.531	70%	0.696	S	S	.	*			cis	-177.7	-165.2	-15	63.2	0	0	0	0	112.8	R1185	S209-R1185 VanDerWaalsContact CB-NH1 3.28Å; S209-R1185 PolarHBondContact OG-NH1 3.23Å
210	N	27.6	Very low	25.6	Very low	114 Å²	114	128.2 Å²	128.2	61%	0.61	70%	0.701	S	S	*	*			trans	98.2	128.4	155.5	-89.7	4.3	0	0	0	123.5	R1185	N210-R1185 PolarHBondContact OD1-NH1 3.31Å; N210-R1185 PolarHBondContact OD1-NH2 3.27Å
211	C	26.6	Very low	25.6	Very low	112 Å²	112	129.8 Å²	129.8	76%	0.757	70%	0.704	S	S	*	*			trans	80.7	122.9	141.6	-63.9	0	0	0	0	126.3
212	D	26.6	Very low	25.6	Very low	122 Å²	122	129.6 Å²	129.6	65%	0.652	70%	0.703	S	S	*	*			trans	73.4	121.1	134.8	-93	19.1	0	0	0	128
213	K	26.3	Very low	25.5	Very low	166 Å²	166	134.1 Å²	134.1	72%	0.722	71%	0.711	S	S	*	*			trans	81.7	133.6	135.4	-73.4	168.3	179.7	135.2	0	124.1
214	N	24.6	Very low	25.4	Very low	157 Å²	157	132 Å²	132	84%	0.84	71%	0.707	S	S	*	*			trans	88.2	156.1	153	-63.2	-16.3	0	0	0	121.9
215	L	24.5	Very low	25.3	Very low	166 Å²	166	134.2 Å²	134.2	87%	0.869	71%	0.711	S	S	*	*			trans	-73.7	172.9	-173.5	-110.6	66.3	0	0	0	113.6
216	P	28.1	Very low	25.4	Very low	103 Å²	103	137.1 Å²	137.1	67%	0.669	72%	0.72	S	S	*	*			cis	-134.9	-175.7	1.9	40.3	-21.4	0	0	0	116.4
217	T	24	Very low	25.4	Very low	116 Å²	116	138.2 Å²	138.2	71%	0.712	73%	0.725	S	S	*	*			trans	4.3	125.6	157.6	53.8	0	0	0	0	120.8
218	F	22.8	Very low	25.3	Very low	199 Å²	199	134 Å²	134	87%	0.873	72%	0.722	S	S	*	*				-166	-180	113.5	-115.1	-78.4	0	0	0	113
219	D	22.6	Very low	25.4	Very low	105 Å²	105	135.8 Å²	135.8	56%	0.561	74%	0.74	S	S	*	*			trans	-47.9	144.7	-166.1	-102.9	-33	0	0	0	121.9
220	K	24.2	Very low	25.5	Very low	169 Å²	169	138.6 Å²	138.6	74%	0.735	75%	0.749	S	S	*	*			trans	69.9	162.7	134.3	-70.9	163.1	-171.6	135.8	0	122.8
221	Q	23.7	Very low	25.8	Very low	175 Å²	175	138.7 Å²	138.7	82%	0.818	75%	0.749	S	S	*	*			trans	70.1	113.3	175.2	-68.8	177.7	-5	0	0	114
222	T	24.7	Very low	26.8	Very low	120 Å²	120	138.5 Å²	138.5	74%	0.736	74%	0.741	S	S	*	*				54.6	128.4	84.1	59.3	0	0	0	0	112.2
223	E	23.6	Very low	28.3	Very low	172 Å²	172	137 Å²	137	80%	0.804	73%	0.726	S	S	*	*			cis	-157	172.4	40	-147.9	159.9	-119.9	0	0	115.5
224	S	24.8	Very low	29.8	Very low	100 Å²	100	132 Å²	132	70%	0.699	71%	0.707	S	S	*	*			trans	22.2	127.5	157.2	60.5	0	0	0	0	122.6
225	K	25.7	Very low	31.9	Very low	204 Å²	204	127.4 Å²	127.4	89%	0.887	69%	0.686	S	S	*	*			trans	-136.7	118.8	141.1	-80.6	-165.1	174.6	-175.8	0	111.1
226	N	25.8	Very low	34.1	Very low	152 Å²	152	119.5 Å²	119.5	81%	0.813	65%	0.645	S	S	*	*			trans	31.5	114.1	162.5	-60.1	7.3	0	0	0	119.3	G228	N226-G228 PolarHBondContact O-N 3.12Å
227	P	26.3	Very low	36.5	Very low	133 Å²	133	115.5 Å²	115.5	86%	0.864	62%	0.616	S	S	*	*			trans	-75	90.5	167.9	32.5	-33.1	0	0	0	110.8
228	G	24.8	Very low	39.1	Very low	54 Å²	54	110.1 Å²	110.1	56%	0.557	58%	0.583	S	S	*	*			trans	-58.6	147.1	159.6	0	0	0	0	0	110.3	N226 N230	N226-G228 PolarHBondContact O-N 3.12Å; G228-N230 PolarHBondContact O-N 3.3Å
229	T	28.1	Very low	41.7	Very low	137 Å²	137	100.6 Å²	100.6	84%	0.84	54%	0.542	S	S	*	.			trans	-57.9	93.6	-172.1	42.4	0	0	0	0	113.1	L231	T229-L231 PolarHBondContact O-N 3.27Å
230	N	29.6	Very low	44.6	Very low	135 Å²	135	95.7 Å²	95.7	72%	0.722	52%	0.515	S	S	*	.			trans	-72.1	110	-180	-86.7	-31.2	0	0	0	111.4	G228 N232	G228-N230 PolarHBondContact O-N 3.3Å; N230-N232 PolarHBondContact O-N 2.82Å
231	L	34.7	Very low	47.4	Very low	115 Å²	115	87.7 Å²	87.7	60%	0.602	48%	0.48	S	S	*	.			trans	-72.9	93.9	168.6	-70.5	93.5	0	0	0	109.7	Y182 T229 Y233	Y182-L231 HydrophobicContact CE2-CD2 4.32Å; T229-L231 PolarHBondContact O-N 3.27Å; L231-Y233 PolarHBondContact O-N 2.91Å
232	N	47	Very low	50.5	Low	109 Å²	109	79.3 Å²	79.3	58%	0.583	44%	0.442	S	S	*	.			trans	-76	89.3	-176.5	-71.1	-22.1	0	0	0	112.3	N230 L234	N230-N232 PolarHBondContact O-N 2.82Å; N232-L234 PolarHBondContact O-N 2.67Å
233	Y	58.5	Low	53.4	Low	89 Å²	89	75.2 Å²	75.2	35%	0.349	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	124.9	160.7	-74.4	-94.7	0	0	0	109.8	S95 L231	S95-Y233 VanDerWaalsContact CB-OH 3.31Å; S95-Y233 WeakPolarHBondContact CB-OH 3.27Å; S95-Y233 PolarHBondContact OG-OH 3.29Å; L231-Y233 PolarHBondContact O-N 2.91Å
234	L	58.6	Low	56.2	Low	62 Å²	62	69.1 Å²	69.1	33%	0.325	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.5	-179.4	-63.4	179.7	0	0	0	111.4	S180 I181 F183 N232	S180-L234 WeakPolarHBondContact CA-O 3.42Å; I181-L234 PolarHBondContact N-O 3.43Å; I181-L234 PolarHBondContact O-N 2.81Å; F183-L234 HydrophobicContact CD2-CB 4.03Å; F183-L234 HydrophobicContact CD2-CD1 3.87Å; F183-L234 HydrophobicContact CD2-CG 4.24Å; F183-L234 HydrophobicContact CE2-CB 4.16Å; F183-L234 HydrophobicContact CE2-CD1 4.34Å; F183-L234 HydrophobicContact CG-CD1 4.43Å; N232-L234 PolarHBondContact O-N 2.67Å
235	P	68	Low	58.4	Low	60 Å²	60	68.5 Å²	68.5	39%	0.39	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	131.9	176	28.8	-33.6	0	0	0	110.5	K256	P235-K256 HydrophobicContact CB-CB 4.25Å; P235-K256 HydrophobicContact CG-CB 4.01Å; P235-K256 HydrophobicContact CG-CD 4.37Å; P235-K256 WeakPolarHBondContact O-CB 3.32Å; P235-K256 PolarHBondContact O-N 3.35Å
236	A	70.8	Confident	60.3	Low	1 Å²	1	62.4 Å²	62.4	1%	0.008	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	164.3	-175.6	0	0	0	0	0	112.2	T179 I181 V253 I254	T179-A236 PolarHBondContact N-O 3.1Å; T179-A236 PolarHBondContact O-N 3.11Å; T179-A236 VanDerWaalsContact O-O 3.08Å; I181-A236 HydrophobicContact CD1-CB 3.69Å; I181-A236 HydrophobicContact CG1-CB 4.13Å; A236-V253 HydrophobicContact CB-CG1 4.05Å; A236-I254 CarbonylContact C-O 3.57Å; A236-I254 VanDerWaalsContact CA-O 3.23Å; A236-I254 WeakPolarHBondContact CA-O 3.05Å; A236-I254 WeakPolarHBondContact CB-O 3.41Å
237	W	77.4	Confident	62.1	Low	18 Å²	18	58.1 Å²	58.1	7%	0.068	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.3	169.1	-66.9	91.7	0	0	0	110.3	L176 V177 K178 V239 V253 I254 D361 E362 V365	L176-W237 HydrophobicContact CB-CE3 4.05Å; L176-W237 HydrophobicContact CB-CZ3 4.06Å; V177-W237 CarbonylContact O-C 3.58Å; V177-W237 VanDerWaalsContact O-CA 3.26Å; V177-W237 WeakPolarHBondContact O-CA 3.4Å; K178-W237 HydrophobicContact CB-CD2 4.22Å; K178-W237 HydrophobicContact CB-CE3 3.91Å; K178-W237 HydrophobicContact CB-CH2 4.09Å; K178-W237 HydrophobicContact CB-CZ2 4.37Å; K178-W237 HydrophobicContact CB-CZ3 3.85Å; K178-W237 HydrophobicContact CD-CH2 4.14Å; K178-W237 HydrophobicContact CD-CZ2 3.84Å; K178-W237 HydrophobicContact CG-CD2 4.44Å; K178-W237 HydrophobicContact CG-CZ2 4.37Å; W237-V239 HydrophobicContact CB-CG2 4.28Å; W237-V253 WeakPolarHBondContact O-CA 3.47Å; W237-I254 HydrophobicContact CB-CB 4.4Å; W237-I254 PolarHBondContact N-O 3.08Å; W237-I254 PolarHBondContact O-N 3.31Å; W237-D361 HydrophobicContact CZ2-CB 3.8Å; W237-E362 HydrophobicContact CH2-CB 3.81Å; W237-E362 HydrophobicContact CH2-CG 4.13Å; W237-E362 HydrophobicContact CZ2-CB 4.17Å; W237-V365 HydrophobicContact CD2-CG2 4.26Å; W237-V365 HydrophobicContact CG-CG2 3.98Å
238	L	78.8	Confident	64.3	Low	3 Å²	3	53.3 Å²	53.3	2%	0.016	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	135.1	162.4	-53.1	178.7	0	0	0	108.4	F98 F147 S151 L176 V177 T179 I181 V253	F98-L238 HydrophobicContact CE2-CD1 4.37Å; F98-L238 HydrophobicContact CZ-CD1 3.97Å; F98-L238 HydrophobicContact CZ-CD2 4.36Å; F147-L238 HydrophobicContact CZ-CB 4.15Å; F147-L238 HydrophobicContact CZ-CD2 4.22Å; S151-L238 VanDerWaalsContact O-CD1 3.25Å; S151-L238 WeakPolarHBondContact O-CD1 3.4Å; L176-L238 WeakPolarHBondContact CA-O 3.21Å; V177-L238 HydrophobicContact CB-CB 4.22Å; V177-L238 PolarHBondContact N-O 3.04Å; V177-L238 PolarHBondContact O-N 2.94Å; T179-L238 HydrophobicContact CG2-CD1 4.03Å; T179-L238 HydrophobicContact CG2-CD2 4.1Å; T179-L238 HydrophobicContact CG2-CG 3.7Å; I181-L238 HydrophobicContact CD1-CD2 3.76Å; L238-V253 HydrophobicContact CD2-CG2 3.9Å
239	V	77.7	Confident	66.4	Low	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	134.9	-172.4	-176.5	0	0	0	0	111.3	I174 S175 L176 W237 V241 G251 C252 I254 V365 L369	I174-V239 HydrophobicContact CG2-CG1 4.45Å; S175-V239 WeakPolarHBondContact O-CA 3.44Å; L176-V239 HydrophobicContact CD2-CB 4.28Å; L176-V239 HydrophobicContact CD2-CG1 4Å; L176-V239 HydrophobicContact CD2-CG2 3.74Å; W237-V239 HydrophobicContact CB-CG2 4.28Å; V239-V241 HydrophobicContact CG1-CG2 3.88Å; V239-G251 WeakPolarHBondContact O-CA 3.48Å; V239-C252 HydrophobicContact CB-CB 4.33Å; V239-C252 PolarHBondContact N-O 3.02Å; V239-C252 PolarHBondContact O-N 3.41Å; V239-I254 HydrophobicContact CG2-CD1 3.81Å; V239-I254 HydrophobicContact CG2-CG1 4.19Å; V239-V365 HydrophobicContact CG2-CG1 4.49Å; V239-L369 HydrophobicContact CG1-CD1 3.51Å; V239-L369 HydrophobicContact CG1-CD2 3.89Å; V239-L369 HydrophobicContact CG1-CG 4.36Å; V239-L369 HydrophobicContact CG2-CD1 4.38Å
240	I	83.1	Confident	68.2	Low	2 Å²	2	48.3 Å²	48.3	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137.5	155.7	-61.2	177.1	0	0	0	108.4	F147 Y148 I152 I174 S175 R242 L249	F147-I240 HydrophobicContact CD1-CD1 3.83Å; F147-I240 HydrophobicContact CD1-CG1 3.67Å; F147-I240 HydrophobicContact CE1-CG1 3.97Å; Y148-I240 HydrophobicContact CD2-CD1 3.81Å; Y148-I240 HydrophobicContact CG-CD1 4.1Å; I152-I240 HydrophobicContact CD1-CB 4.49Å; I152-I240 HydrophobicContact CD1-CD1 3.93Å; I152-I240 HydrophobicContact CD1-CG1 3.81Å; I174-I240 CarbonylContact C-O 3.51Å; I174-I240 WeakPolarHBondContact CA-O 3.32Å; S175-I240 PolarHBondContact N-O 2.92Å; S175-I240 PolarHBondContact O-N 3.43Å; I240-R242 HydrophobicContact CG2-CG 4.12Å; I240-L249 WeakPolarHBondContact CA-O 3.31Å; I240-L249 WeakPolarHBondContact CG2-O 3.36Å
241	V	84.8	Confident	70	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	120.3	169.4	179.8	0	0	0	0	108.9	I172 I174 V239 R243 D248 L249 L369	I172-V241 HydrophobicContact CD1-CG1 3.95Å; I172-V241 HydrophobicContact CG1-CG1 4.19Å; I174-V241 HydrophobicContact CD1-CG2 4.27Å; I174-V241 HydrophobicContact CG1-CG1 4.18Å; I174-V241 HydrophobicContact CG1-CG2 4.09Å; I174-V241 HydrophobicContact CG2-CG2 4.12Å; V239-V241 HydrophobicContact CG1-CG2 3.88Å; V241-R243 HydrophobicContact CG1-CG 3.85Å; V241-D248 CarbonylContact O-C 3.52Å; V241-D248 VanDerWaalsContact O-CA 3.28Å; V241-D248 WeakPolarHBondContact O-CA 3.49Å; V241-L249 HydrophobicContact CB-CB 4.01Å; V241-L249 HydrophobicContact CB-CD1 4.08Å; V241-L249 HydrophobicContact CB-CG 4.2Å; V241-L249 HydrophobicContact CG2-CB 4.42Å; V241-L249 HydrophobicContact CG2-CD1 3.89Å; V241-L249 PolarHBondContact N-O 3.49Å; V241-L249 VanDerWaalsContact N-O 3.09Å; V241-L249 PolarHBondContact O-N 3.43Å; V241-L369 HydrophobicContact CG2-CB 4.4Å; V241-L369 HydrophobicContact CG2-CD1 4.12Å; V241-L369 HydrophobicContact CG2-CD2 4.08Å; V241-L369 HydrophobicContact CG2-CG 4.44Å
242	R	87.9	Confident	71.5	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130.4	174	-59.6	152.5	-175.5	111.4	-6.2	108.2	I172 A173 S175 I240 D248 L395 D396 L613	I172-R242 WeakPolarHBondContact CA-O 3.32Å; A173-R242 HydrophobicContact CB-CB 4.32Å; A173-R242 PolarHBondContact N-O 2.73Å; A173-R242 PolarHBondContact O-N 3.26Å; S175-R242 PolarHBondContact OG-NH1 2.99Å; I240-R242 HydrophobicContact CG2-CG 4.12Å; R242-D248 WeakPolarHBondContact CA-OD1 3.38Å; R242-L395 HydrophobicContact CG-CD2 4.39Å; R242-D396 IonicContact CZ-OD2 2.66Å; R242-D396 VanDerWaalsContact NE-CG 3.34Å; R242-D396 IonicContact NE-OD1 2.98Å; R242-D396 PolarHBondContact NE-OD1 3Å; R242-D396 VanDerWaalsContact NE-OD1 3.12Å; R242-D396 IonicContact NE-OD2 2.83Å; R242-D396 PolarHBondContact NE-OD2 3.3Å; R242-D396 IonicContact NH2-OD2 3.36Å; R242-D396 PolarHBondContact NH2-OD2 3.26Å; R242-L613 HydrophobicContact CB-CD1 4.43Å
243	R	84.6	Confident	72.4	Confident	34 Å²	34	31.6 Å²	31.6	13%	0.128	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	149.7	-176.4	-58.1	-172.7	175.6	-110.4	1.3	112.6	D169 I172 V241 Q245 D248 L369 L613	D169-R243 IonicContact OD2-NH1 3.59Å; D169-R243 PolarHBondContact OD2-NH1 3.26Å; I172-R243 HydrophobicContact CD1-CG 4.39Å; V241-R243 HydrophobicContact CG1-CG 3.85Å; R243-Q245 WeakPolarHBondContact CB-O 3.46Å; R243-Q245 VanDerWaalsContact CD-O 3.28Å; R243-Q245 WeakPolarHBondContact CD-O 3.39Å; R243-D248 PolarHBondContact N-OD1 3.16Å; R243-L369 PolarHBondContact NH2-O 2.98Å; R243-L613 VanDerWaalsContact C-CD2 3.42Å
244	E	83.6	Confident	72.9	Confident	43 Å²	43	27.5 Å²	27.5	20%	0.201	16%	0.161	C	C	.	.	S	Bend	trans	-71.2	-40.8	166.9	-163.6	-171.4	145.6	0	0	111.1	G170 A171 R610 L613 H614	G170-E244 WeakPolarHBondContact CA-OE2 3.36Å; A171-E244 HydrophobicContact CB-CB 4.23Å; A171-E244 PolarHBondContact N-OE2 2.83Å; A171-E244 WeakPolarHBondContact O-CB 3.19Å; A171-E244 PolarHBondContact O-N 2.89Å; E244-R610 HydrophobicContact CB-CG 4.43Å; E244-R610 HydrophobicContact CG-CB 3.71Å; E244-R610 HydrophobicContact CG-CG 3.43Å; E244-R610 VanDerWaalsContact CG-CG 3.43Å; E244-R610 PolarHBondContact O-NE 2.87Å; E244-R610 PolarHBondContact O-NH2 2.72Å; E244-L613 HydrophobicContact CB-CD2 4.47Å; E244-H614 IonicContact OE2-CD2 2.69Å
245	Q	70.5	Confident	73.3	Confident	88 Å²	88	25.6 Å²	25.6	41%	0.411	15%	0.151	S	C	.	.	S	Bend	trans	-123	148	178.9	-55	-171.2	51.5	0	0	111.8	N168 D169 R243	N168-Q245 PolarHBondContact O-NE2 3.24Å; D169-Q245 WeakPolarHBondContact O-CB 3.48Å; R243-Q245 WeakPolarHBondContact CB-O 3.46Å; R243-Q245 VanDerWaalsContact CD-O 3.28Å; R243-Q245 WeakPolarHBondContact CD-O 3.39Å
246	G	65.4	Low	73.3	Confident	75 Å²	75	24.7 Å²	24.7	77%	0.773	14%	0.141	S	C	*	.	S	Bend	trans	81.7	-160.7	-168.8	0	0	0	0	0	113
247	S	65	Low	72.8	Confident	62 Å²	62	26.8 Å²	26.8	43%	0.434	16%	0.156	S	C	.	.			trans	-99.4	146.2	177.3	37.4	0	0	0	0	112.2
248	D	72.1	Confident	71.9	Confident	32 Å²	32	27.3 Å²	27.3	17%	0.171	16%	0.16	C	C	.	.			trans	-68.1	143.6	167.1	-53.5	-64	0	0	0	110.5	V241 R242 R243 R250 R609	V241-D248 CarbonylContact O-C 3.52Å; V241-D248 VanDerWaalsContact O-CA 3.28Å; V241-D248 WeakPolarHBondContact O-CA 3.49Å; R242-D248 WeakPolarHBondContact CA-OD1 3.38Å; R243-D248 PolarHBondContact N-OD1 3.16Å; D248-R250 HydrophobicContact CB-CG 3.89Å; D248-R250 PolarHBondContact O-N 3.34Å; D248-R250 IonicContact OD2-CZ 2.73Å; D248-R250 IonicContact OD2-NE 3.22Å; D248-R250 PolarHBondContact OD2-NE 3.43Å; D248-R250 IonicContact OD2-NH2 2.66Å; D248-R250 PolarHBondContact OD2-NH2 3.37Å; D248-R609 IonicContact OD1-CZ 3.54Å; D248-R609 IonicContact OD1-NE 2.8Å; D248-R609 IonicContact OD1-NH2 2.83Å; D248-R609 PolarHBondContact OD1-NH2 2.82Å; D248-R609 IonicContact OD2-CZ 3.44Å; D248-R609 IonicContact OD2-NE 2.72Å; D248-R609 PolarHBondContact OD2-NE 3.46Å; D248-R609 IonicContact OD2-NH2 2.6Å; D248-R609 PolarHBondContact OD2-NH2 3.23Å; D248-R609 VanDerWaalsContact OD2-NH2 3.08Å
249	L	68.5	Low	71	Confident	21 Å²	21	28.2 Å²	28.2	11%	0.11	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	93.7	161.8	-60	175.6	0	0	0	108.1	I240 V241 G251 L369	I240-L249 WeakPolarHBondContact CA-O 3.31Å; I240-L249 WeakPolarHBondContact CG2-O 3.36Å; V241-L249 HydrophobicContact CB-CB 4.01Å; V241-L249 HydrophobicContact CB-CD1 4.08Å; V241-L249 HydrophobicContact CB-CG 4.2Å; V241-L249 HydrophobicContact CG2-CB 4.42Å; V241-L249 HydrophobicContact CG2-CD1 3.89Å; V241-L249 PolarHBondContact N-O 3.49Å; V241-L249 VanDerWaalsContact N-O 3.09Å; V241-L249 PolarHBondContact O-N 3.43Å; L249-G251 PolarHBondContact O-N 3.44Å; L249-L369 HydrophobicContact CD1-CD2 4.05Å
250	R	66.1	Low	69.8	Low	66 Å²	66	32.9 Å²	32.9	25%	0.249	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	18.6	-175.5	-65.4	-168.3	179.6	-172.6	-0	115	D248 E399	D248-R250 HydrophobicContact CB-CG 3.89Å; D248-R250 PolarHBondContact O-N 3.34Å; D248-R250 IonicContact OD2-CZ 2.73Å; D248-R250 IonicContact OD2-NE 3.22Å; D248-R250 PolarHBondContact OD2-NE 3.43Å; D248-R250 IonicContact OD2-NH2 2.66Å; D248-R250 PolarHBondContact OD2-NH2 3.37Å; R250-E399 IonicContact CZ-OE2 2.67Å; R250-E399 VanDerWaalsContact CZ-OE2 3.23Å; R250-E399 IonicContact NH1-OE2 3.94Å; R250-E399 PolarHBondContact NH1-OE2 3.38Å; R250-E399 VanDerWaalsContact NH2-CD 3.26Å; R250-E399 IonicContact NH2-OE1 2.69Å; R250-E399 PolarHBondContact NH2-OE1 3.29Å; R250-E399 IonicContact NH2-OE2 2.72Å; R250-E399 PolarHBondContact NH2-OE2 2.93Å
251	G	66.3	Low	68.1	Low	7 Å²	7	39 Å²	39	7%	0.072	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	141.8	115.2	178.8	0	0	0	0	0	112.3	V118 F147 V239 L249	V118-G251 PolarHBondContact N-O 2.88Å; F147-G251 VanDerWaalsContact CD1-CA 3.49Å; F147-G251 VanDerWaalsContact CE1-CA 3.49Å; V239-G251 WeakPolarHBondContact O-CA 3.48Å; L249-G251 PolarHBondContact O-N 3.44Å
252	C	66.9	Low	66.4	Low	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	145	179.4	-173.2	0	0	0	0	110.8	V239	V239-C252 HydrophobicContact CB-CB 4.33Å; V239-C252 PolarHBondContact N-O 3.02Å; V239-C252 PolarHBondContact O-N 3.41Å
253	V	65.4	Low	64.1	Low	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130	169.7	172.3	0	0	0	0	109.2	Y116 I181 F183 A236 W237 L238	Y116-V253 PolarHBondContact N-O 3.12Å; Y116-V253 PolarHBondContact O-N 2.78Å; I181-V253 HydrophobicContact CD1-CB 4.24Å; I181-V253 HydrophobicContact CD1-CG1 3.44Å; I181-V253 VanDerWaalsContact CD1-CG1 3.44Å; I181-V253 HydrophobicContact CD1-CG2 3.74Å; F183-V253 HydrophobicContact CZ-CG1 4.18Å; A236-V253 HydrophobicContact CB-CG1 4.05Å; W237-V253 WeakPolarHBondContact O-CA 3.47Å; L238-V253 HydrophobicContact CD2-CG2 3.9Å
254	I	69.4	Low	61.7	Low	4 Å²	4	51 Å²	51	2%	0.021	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	113.1	173.4	-56	178	0	0	0	108.8	A236 W237 V239 I259 V365 Y368 L369	A236-I254 CarbonylContact C-O 3.57Å; A236-I254 VanDerWaalsContact CA-O 3.23Å; A236-I254 WeakPolarHBondContact CA-O 3.05Å; A236-I254 WeakPolarHBondContact CB-O 3.41Å; W237-I254 HydrophobicContact CB-CB 4.4Å; W237-I254 PolarHBondContact N-O 3.08Å; W237-I254 PolarHBondContact O-N 3.31Å; V239-I254 HydrophobicContact CG2-CD1 3.81Å; V239-I254 HydrophobicContact CG2-CG1 4.19Å; I254-I259 HydrophobicContact CG2-CD1 4.48Å; I254-I259 HydrophobicContact CG2-CG1 4.45Å; I254-V365 HydrophobicContact CD1-CG1 4.2Å; I254-Y368 HydrophobicContact CD1-CD1 3.94Å; I254-Y368 HydrophobicContact CD1-CE1 3.91Å; I254-L369 HydrophobicContact CD1-CD2 4.12Å; I254-L369 HydrophobicContact CD1-CG 4.49Å
255	N	67.9	Low	59.5	Low	21 Å²	21	52 Å²	52	11%	0.112	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	135.9	175.1	-173.2	-21.7	0	0	0	110.4	S257 L258	N255-S257 VanDerWaalsContact CG-OG 3.3Å; N255-S257 PolarHBondContact O-N 2.97Å; N255-S257 PolarHBondContact OD1-N 3.1Å; N255-S257 VanDerWaalsContact OD1-N 3.16Å; N255-S257 PolarHBondContact OD1-OG 3.25Å; N255-L258 HydrophobicContact CB-CD1 4.08Å; N255-L258 HydrophobicContact CB-CG 4.37Å; N255-L258 WeakPolarHBondContact O-CB 3.38Å; N255-L258 PolarHBondContact O-N 3.45Å
256	K	67.6	Low	57.4	Low	42 Å²	42	52.7 Å²	52.7	18%	0.183	30%	0.303	C	S	.	.	H	α-helix	trans	-59	-33	-179	-158	-155.8	-177.6	-155.5	0	112.9	P235 L258 I259 E260 D361	P235-K256 HydrophobicContact CB-CB 4.25Å; P235-K256 HydrophobicContact CG-CB 4.01Å; P235-K256 HydrophobicContact CG-CD 4.37Å; P235-K256 WeakPolarHBondContact O-CB 3.32Å; P235-K256 PolarHBondContact O-N 3.35Å; K256-L258 PolarHBondContact O-N 2.78Å; K256-I259 WeakPolarHBondContact O-CB 3.39Å; K256-I259 PolarHBondContact O-N 2.83Å; K256-E260 HydrophobicContact CD-CG 4.48Å; K256-E260 VanDerWaalsContact CE-OE1 3.31Å; K256-E260 WeakPolarHBondContact CE-OE1 3.34Å; K256-E260 IonicContact NZ-OE1 2.75Å; K256-E260 PolarHBondContact NZ-OE1 2.94Å; K256-E260 PolarHBondContact O-N 3.46Å; K256-D361 WeakPolarHBondContact CE-OD2 3.43Å; K256-D361 IonicContact NZ-OD2 2.64Å
257	S	60.5	Low	55.6	Low	44 Å²	44	51.8 Å²	51.8	31%	0.308	28%	0.284	S	S	.	.	H	α-helix	trans	-60.2	-29.5	-179.1	61.5	0	0	0	0	113.4	N255 I259 E260 N261	N255-S257 VanDerWaalsContact CG-OG 3.3Å; N255-S257 PolarHBondContact O-N 2.97Å; N255-S257 PolarHBondContact OD1-N 3.1Å; N255-S257 VanDerWaalsContact OD1-N 3.16Å; N255-S257 PolarHBondContact OD1-OG 3.25Å; S257-I259 PolarHBondContact O-N 3.04Å; S257-E260 PolarHBondContact O-N 3.39Å; S257-N261 VanDerWaalsContact O-CB 3.3Å; S257-N261 WeakPolarHBondContact O-CB 3.36Å; S257-N261 VanDerWaalsContact O-CG 3.24Å; S257-N261 PolarHBondContact O-N 2.97Å; S257-N261 PolarHBondContact O-ND2 2.9Å
258	L	58	Low	53.8	Low	30 Å²	30	50.2 Å²	50.2	16%	0.157	27%	0.271	C	S	.	.	H	α-helix	trans	-65.3	-30.2	176.8	-63.7	165.2	0	0	0	112.4	H114 N255 K256 N262	H114-L258 HydrophobicContact CB-CD1 4.11Å; H114-L258 HydrophobicContact CB-CD2 4.16Å; H114-L258 VanDerWaalsContact O-CD1 3.26Å; H114-L258 WeakPolarHBondContact O-CD1 3.4Å; N255-L258 HydrophobicContact CB-CD1 4.08Å; N255-L258 HydrophobicContact CB-CG 4.37Å; N255-L258 WeakPolarHBondContact O-CB 3.38Å; N255-L258 PolarHBondContact O-N 3.45Å; K256-L258 PolarHBondContact O-N 2.78Å; L258-N262 WeakPolarHBondContact O-CB 3.33Å; L258-N262 PolarHBondContact O-ND2 2.64Å
259	I	59.8	Low	51.6	Low	21 Å²	21	52.3 Å²	52.3	11%	0.108	28%	0.281	C	S	.	.	H	α-helix	trans	-81.4	-41.5	178.5	-50	164.8	0	0	0	109.9	I254 K256 S257 L364 V365	I254-I259 HydrophobicContact CG2-CD1 4.48Å; I254-I259 HydrophobicContact CG2-CG1 4.45Å; K256-I259 WeakPolarHBondContact O-CB 3.39Å; K256-I259 PolarHBondContact O-N 2.83Å; S257-I259 PolarHBondContact O-N 3.04Å; I259-L364 HydrophobicContact CG2-CB 3.65Å; I259-L364 HydrophobicContact CG2-CD1 3.61Å; I259-L364 HydrophobicContact CG2-CG 4.28Å; I259-V365 HydrophobicContact CD1-CG2 3.44Å; I259-V365 VanDerWaalsContact CD1-CG2 3.44Å; I259-V365 HydrophobicContact CG1-CG2 4.35Å
260	E	53.5	Low	49.5	Very low	98 Å²	98	54.8 Å²	54.8	46%	0.458	29%	0.294	S	S	.	.	H	α-helix	trans	-73.6	-31.5	-176.7	-67.2	-177	141	0	0	113.3	K256 S257 K263	K256-E260 HydrophobicContact CD-CG 4.48Å; K256-E260 VanDerWaalsContact CE-OE1 3.31Å; K256-E260 WeakPolarHBondContact CE-OE1 3.34Å; K256-E260 IonicContact NZ-OE1 2.75Å; K256-E260 PolarHBondContact NZ-OE1 2.94Å; K256-E260 PolarHBondContact O-N 3.46Å; S257-E260 PolarHBondContact O-N 3.39Å; E260-K263 WeakPolarHBondContact O-CE 3.39Å
261	N	46.4	Very low	47.5	Very low	130 Å²	130	55.6 Å²	55.6	70%	0.695	31%	0.306	S	S	*	.	H	α-helix	trans	-84.1	-37.9	-178.5	-68.5	-16.3	0	0	0	112.9	S257 K263	S257-N261 VanDerWaalsContact O-CB 3.3Å; S257-N261 WeakPolarHBondContact O-CB 3.36Å; S257-N261 VanDerWaalsContact O-CG 3.24Å; S257-N261 PolarHBondContact O-N 2.97Å; S257-N261 PolarHBondContact O-ND2 2.9Å; N261-K263 PolarHBondContact O-N 2.72Å
262	N	48.4	Very low	45.5	Very low	38 Å²	38	59.5 Å²	59.5	20%	0.203	32%	0.322	C	S	.	.			trans	-91.4	65.7	-178.3	-71.5	-56.7	0	0	0	112.5	L258 S264 L268	L258-N262 WeakPolarHBondContact O-CB 3.33Å; L258-N262 PolarHBondContact O-ND2 2.64Å; N262-S264 PolarHBondContact O-N 3.18Å; N262-S264 VanDerWaalsContact O-N 3.17Å; N262-L268 HydrophobicContact CB-CD1 3.75Å; N262-L268 HydrophobicContact CB-CD2 3.85Å; N262-L268 HydrophobicContact CB-CG 3.64Å
263	K	40.6	Very low	43.5	Very low	185 Å²	185	64.7 Å²	64.7	80%	0.804	36%	0.356	S	S	*	.			trans	-68.7	-9.1	179	-66	-176.4	-179.8	176.5	0	114.5	E260 N261	E260-K263 WeakPolarHBondContact O-CE 3.39Å; N261-K263 PolarHBondContact O-N 2.72Å
264	S	34.9	Very low	41.6	Very low	64 Å²	64	69.3 Å²	69.3	45%	0.448	38%	0.381	S	S	.	.			trans	-90.4	101.1	166	48.1	0	0	0	0	110.1	N262 S266 S267	N262-S264 PolarHBondContact O-N 3.18Å; N262-S264 VanDerWaalsContact O-N 3.17Å; S264-S266 PolarHBondContact O-N 3.05Å; S264-S267 PolarHBondContact O-N 2.7Å; S264-S267 PolarHBondContact O-OG 2.92Å; S264-S267 PolarHBondContact OG-OG 2.92Å
265	I	36.3	Very low	39.5	Very low	63 Å²	63	76.2 Å²	76.2	32%	0.323	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-49.9	-36	178.2	-63.2	172.2	0	0	0	111.3	S267 L268 I269	I265-S267 VanDerWaalsContact C-N 3.28Å; I265-S267 PolarHBondContact O-N 3.45Å; I265-L268 PolarHBondContact O-N 3.36Å; I265-L268 VanDerWaalsContact O-N 3.12Å; I265-I269 HydrophobicContact CG2-CD1 4.49Å
266	S	27	Very low	37.4	Very low	104 Å²	104	80.6 Å²	80.6	73%	0.727	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-54.2	-32.9	178	-32.3	0	0	0	0	115.3	S264	S264-S266 PolarHBondContact O-N 3.05Å
267	S	26.2	Very low	35.4	Very low	55 Å²	55	81.9 Å²	81.9	39%	0.385	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-84.1	-11.7	-178.3	59.9	0	0	0	0	113.7	S264 I265	S264-S267 PolarHBondContact O-N 2.7Å; S264-S267 PolarHBondContact O-OG 2.92Å; S264-S267 PolarHBondContact OG-OG 2.92Å; I265-S267 VanDerWaalsContact C-N 3.28Å; I265-S267 PolarHBondContact O-N 3.45Å
268	L	27.3	Very low	33.6	Very low	29 Å²	29	85.9 Å²	85.9	15%	0.152	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-12.8	179.1	-77.2	163.5	0	0	0	113.3	N262 I265 I270 Y368	N262-L268 HydrophobicContact CB-CD1 3.75Å; N262-L268 HydrophobicContact CB-CD2 3.85Å; N262-L268 HydrophobicContact CB-CG 3.64Å; I265-L268 PolarHBondContact O-N 3.36Å; I265-L268 VanDerWaalsContact O-N 3.12Å; L268-I270 PolarHBondContact O-N 3.22Å; L268-Y368 HydrophobicContact CB-CD2 3.84Å; L268-Y368 HydrophobicContact CB-CE2 4.17Å; L268-Y368 HydrophobicContact CD2-CD2 4.11Å; L268-Y368 HydrophobicContact CD2-CE2 4.02Å; L268-Y368 HydrophobicContact CG-CD2 4.44Å; L268-Y368 WeakPolarHBondContact O-CE2 3.46Å
269	I	25.6	Very low	31.9	Very low	76 Å²	76	89.4 Å²	89.4	39%	0.39	50%	0.496	S	S	.	.			trans	-82.7	66.7	-173.1	-55.8	177.1	0	0	0	110.8	I265 T271 K371	I265-I269 HydrophobicContact CG2-CD1 4.49Å; I269-T271 PolarHBondContact O-N 2.94Å; I269-K371 HydrophobicContact CG2-CB 3.96Å; I269-K371 HydrophobicContact CG2-CD 4.05Å; I269-K371 HydrophobicContact CG2-CG 4.02Å
270	I	26.2	Very low	30.3	Very low	74 Å²	74	94.6 Å²	94.6	38%	0.379	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-74.8	120.7	175.6	-58.4	177.7	0	0	0	109	A113 L268 K371	A113-I270 HydrophobicContact CB-CD1 3.41Å; A113-I270 VanDerWaalsContact CB-CD1 3.41Å; L268-I270 PolarHBondContact O-N 3.22Å; I270-K371 VanDerWaalsContact O-CE 3.31Å; I270-K371 WeakPolarHBondContact O-CE 3.31Å; I270-K371 PolarHBondContact O-NZ 2.68Å
271	T	23.8	Very low	28.9	Very low	82 Å²	82	98.4 Å²	98.4	50%	0.503	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-63.2	140.2	173.5	41.5	0	0	0	0	111.2	I269	I269-T271 PolarHBondContact O-N 2.94Å
272	E	24.6	Very low	27.9	Very low	89 Å²	89	97.8 Å²	97.8	42%	0.416	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-74	135.2	-179.4	-57.2	-165.5	141.2	0	0	110.8	R115	R115-E272 IonicContact NH1-OE1 2.84Å; R115-E272 PolarHBondContact NH1-OE1 2.92Å
273	P	24	Very low	26.8	Very low	110 Å²	110	100.3 Å²	100.3	71%	0.714	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-69.9	142.4	172.6	30.3	-34.1	0	0	0	109.9	I275	P273-I275 PolarHBondContact O-N 2.86Å
274	N	24.8	Very low	26	Very low	96 Å²	96	95.5 Å²	95.5	51%	0.513	55%	0.546	S	S	.	.			trans	-73.1	110.7	-179.7	-109.7	-66.5	0	0	0	110.8	N276 Y847	N274-N276 PolarHBondContact O-N 3.39Å; N274-Y847 WeakPolarHBondContact ND2-CE1 3.47Å; N274-Y847 PolarHBondContact ND2-OH 3.07Å
275	I	25.5	Very low	25.6	Very low	149 Å²	149	98.7 Å²	98.7	76%	0.764	56%	0.557	S	S	*	*	S	Bend	trans	-79.4	51	-176.7	-39.9	-178.6	0	0	0	111.3	P273	P273-I275 PolarHBondContact O-N 2.86Å
276	N	24.7	Very low	25.2	Very low	113 Å²	113	101 Å²	101	60%	0.604	58%	0.579	S	S	*	*			trans	-129.4	30.1	-179.6	-81.8	-19.6	0	0	0	111.7	N274 Q846	N274-N276 PolarHBondContact O-N 3.39Å; N276-Q846 PolarHBondContact O-NE2 3.02Å
277	N	24.8	Very low	25.1	Very low	69 Å²	69	101.9 Å²	101.9	37%	0.369	58%	0.575	S	S	.	*			trans	-151.9	122.2	171.9	-106.7	-34.4	0	0	0	111.8	Q846 F871	N277-Q846 PolarHBondContact ND2-NE2 3.07Å; N277-Q846 PolarHBondContact OD1-NE2 3.27Å; N277-F871 WeakPolarHBondContact ND2-CE2 3.4Å; N277-F871 WeakPolarHBondContact ND2-CZ 3.48Å
278	P	23	Very low	25	Very low	128 Å²	128	105 Å²	105	83%	0.831	60%	0.597	S	S	*	*			trans	-107.3	54.3	176.8	39.7	-32.6	0	0	0	112.5
279	T	23	Very low	24.8	Very low	104 Å²	104	108.8 Å²	108.8	64%	0.638	63%	0.626	S	S	*	*			trans	-145.2	124.5	173.1	44.3	0	0	0	0	111.6
280	I	25.7	Very low	24.8	Very low	130 Å²	130	109 Å²	109	67%	0.667	65%	0.647	S	S	*	*			trans	-179.9	135.1	146.7	-96.7	156.3	0	0	0	107.4
281	H	24	Very low	24.6	Very low	178 Å²	178	112.8 Å²	112.8	82%	0.824	67%	0.666	S	S	*	*			trans	-95	147.7	172.1	-81.9	-104.8	0	0	0	110.4
282	T	24.9	Very low	24.5	Very low	118 Å²	118	116.7 Å²	116.7	72%	0.724	68%	0.682	S	S	*	*			trans	-89.1	136.2	173.5	47.5	0	0	0	0	112
283	S	25.4	Very low	24.3	Very low	91 Å²	91	117.7 Å²	117.7	64%	0.636	70%	0.695	S	S	*	*			trans	-138.5	150.3	161	57.1	0	0	0	0	109.1
284	N	25.1	Very low	24.3	Very low	84 Å²	84	118 Å²	118	45%	0.449	70%	0.695	S	S	.	*			trans	-121.3	163.4	-154.7	-67.6	-2.4	0	0	0	114.4	N106	N106-N284 PolarHBondContact ND2-OD1 3.03Å; N106-N284 PolarHBondContact OD1-ND2 3.27Å; N106-N284 PolarHBondContact OD1-OD1 3.26Å
285	N	26.2	Very low	24.1	Very low	130 Å²	130	121.3 Å²	121.3	70%	0.695	71%	0.712	S	S	*	*			trans	76.9	144.6	167.9	-52.8	-37.7	0	0	0	115.2
286	S	27.9	Very low	24	Very low	111 Å²	111	122.2 Å²	122.2	78%	0.776	72%	0.718	S	S	*	*			cis	-140.1	166.6	23.4	54.1	0	0	0	0	115.8
287	L	24.9	Very low	24	Very low	124 Å²	124	123.5 Å²	123.5	65%	0.649	73%	0.73	S	S	*	*			trans	-89.2	154.5	-179.6	-122	170.3	0	0	0	112.4	N108	N108-L287 WeakPolarHBondContact OD1-CD1 3.26Å; N108-L287 WeakPolarHBondContact OD1-CG 3.03Å
288	S	24.1	Very low	23.9	Very low	119 Å²	119	126.4 Å²	126.4	83%	0.832	75%	0.746	S	S	*	*			trans	-151.9	150.6	132.5	57.3	0	0	0	0	112.2
289	S	23.2	Very low	24.1	Very low	109 Å²	109	125.1 Å²	125.1	76%	0.762	73%	0.732	S	S	*	*			trans	-90.9	146.1	-163.8	47.5	0	0	0	0	114.4
290	G	24.4	Very low	24.2	Very low	81 Å²	81	122.8 Å²	122.8	84%	0.835	72%	0.715	S	S	*	*			trans	-143.6	93	172.1	0	0	0	0	0	111.9
291	I	22.1	Very low	24.2	Very low	154 Å²	154	120.2 Å²	120.2	79%	0.79	71%	0.709	S	S	*	*			trans	-87.3	136.3	174.6	-59.9	164.3	0	0	0	108.6
292	I	21.7	Very low	24.2	Very low	163 Å²	163	116.1 Å²	116.1	84%	0.836	70%	0.7	S	S	*	*			trans	-169.9	150	135.2	-101.2	153.9	0	0	0	112.7
293	T	21.2	Very low	24.1	Very low	111 Å²	111	116.6 Å²	116.6	68%	0.681	70%	0.697	S	S	*	*			trans	-70.8	148	-175.7	49.1	0	0	0	0	114.7
294	T	22.9	Very low	24.1	Very low	117 Å²	117	118.7 Å²	118.7	72%	0.718	71%	0.706	S	S	*	*			trans	25.8	122.8	145.4	59.8	0	0	0	0	119.4
295	N	22.2	Very low	24.2	Very low	164 Å²	164	122.3 Å²	122.3	88%	0.877	72%	0.72	S	S	*	*				-159.4	152.2	119.8	-101.5	-34.7	0	0	0	113.1
296	L	23.5	Very low	24.4	Very low	169 Å²	169	120.2 Å²	120.2	89%	0.885	71%	0.714	S	S	*	*			trans	-98.5	129.8	164.4	-68.4	124	0	0	0	108.8
297	T	23.2	Very low	24.2	Very low	139 Å²	139	120.3 Å²	120.3	85%	0.853	72%	0.715	S	S	*	*			trans	-151.1	143.6	148.4	21.6	0	0	0	0	109.2
298	N	24.3	Very low	24.2	Very low	131 Å²	131	119.8 Å²	119.8	70%	0.701	71%	0.712	S	S	*	*			trans	-72.7	165.9	169.7	-49.5	-36.6	0	0	0	109.6
299	D	25.9	Very low	24.2	Very low	100 Å²	100	122.6 Å²	122.6	54%	0.535	71%	0.709	S	S	.	*				-151.6	153.7	118.7	-114.2	-27.7	0	0	0	111.9	T326	D299-T326 HydrophobicContact CB-CG2 3.74Å; D299-T326 WeakPolarHBondContact OD1-CG2 3.22Å
300	N	24.5	Very low	24.4	Very low	56 Å²	56	123.1 Å²	123.1	30%	0.299	71%	0.708	S	S	.	*			trans	-154	87.6	-149.8	-98.3	-27.7	0	0	0	115.2	N324 T325 T326	N300-N324 HydrophobicContact CB-CB 3.88Å; N300-N324 VanDerWaalsContact CG-CG 3.49Å; N300-N324 VanDerWaalsContact CG-ND2 3.32Å; N300-N324 CarbonylContact O-C 3.33Å; N300-N324 PolarHBondContact OD1-ND2 3.49Å; N300-T325 CarbonylContact O-C 3.57Å; N300-T325 WeakPolarHBondContact O-CA 3.46Å; N300-T325 PolarHBondContact O-N 2.88Å; N300-T326 PolarHBondContact O-N 3.39Å; N300-T326 VanDerWaalsContact O-N 3.13Å; N300-T326 PolarHBondContact O-OG1 2.68Å
301	S	26	Very low	24.4	Very low	75 Å²	75	123.7 Å²	123.7	52%	0.524	70%	0.699	S	S	.	*			trans	-167.4	166.9	158.4	81.9	0	0	0	0	110.4	T326	S301-T326 WeakPolarHBondContact CB-OG1 3.06Å; S301-T326 PolarHBondContact N-OG1 2.92Å; S301-T326 PolarHBondContact OG-OG1 2.9Å
302	S	23.9	Very low	24.7	Very low	93 Å²	93	123.9 Å²	123.9	65%	0.65	70%	0.701	S	S	*	*			cis	-148.9	126.8	-6.4	3.6	0	0	0	0	107.3
303	I	24	Very low	24.9	Very low	128 Å²	128	120.2 Å²	120.2	66%	0.656	69%	0.689	S	S	*	*				61.2	96.2	95	-56.7	166.8	0	0	0	114.1
304	T	25.1	Very low	25.1	Very low	134 Å²	134	120.7 Å²	120.7	82%	0.822	69%	0.693	S	S	*	*				-171.3	117.1	122.2	20.5	0	0	0	0	105.9
305	E	27	Very low	25.3	Very low	161 Å²	161	120 Å²	120	75%	0.752	69%	0.688	S	S	*	*				58.7	147.7	55.2	-79.4	-133	142.6	0	0	115
306	P	29.7	Very low	25.5	Very low	85 Å²	85	122.2 Å²	122.2	55%	0.552	69%	0.69	S	S	*	*			cis	-138.4	164.7	-18.5	35.7	-18.1	0	0	0	115.2	L308	P306-L308 HydrophobicContact CB-CD1 4.11Å; P306-L308 HydrophobicContact CB-CG 4.45Å
307	S	24.9	Very low	25.5	Very low	114 Å²	114	119 Å²	119	80%	0.797	68%	0.681	S	S	*	*				166.3	98.1	124.7	44.6	0	0	0	0	110.3
308	L	24.4	Very low	25.5	Very low	112 Å²	112	120.2 Å²	120.2	59%	0.586	68%	0.681	S	S	*	*				85.7	100.4	65.7	-69.9	163.9	0	0	0	114.2	P306	P306-L308 HydrophobicContact CB-CD1 4.11Å; P306-L308 HydrophobicContact CB-CG 4.45Å
309	K	25	Very low	25.5	Very low	178 Å²	178	118.5 Å²	118.5	77%	0.774	68%	0.68	S	S	*	*				66.3	165.9	125.3	-65.8	176.5	-171.6	155.1	0	117.2
310	T	25.7	Very low	25.4	Very low	121 Å²	121	121.6 Å²	121.6	74%	0.742	70%	0.695	S	S	*	*			cis	-153.2	169.3	8.4	-14.8	0	0	0	0	106.6
311	S	25.7	Very low	25.3	Very low	93 Å²	93	124 Å²	124	65%	0.65	72%	0.717	S	S	*	*			cis	-157.3	146.6	0.9	-0.1	0	0	0	0	106
312	L	26.8	Very low	25.3	Very low	157 Å²	157	125.9 Å²	125.9	82%	0.822	73%	0.729	S	S	*	*				56.3	143.9	71.9	-89	77.7	0	0	0	113.5
313	S	26.4	Very low	25.3	Very low	86 Å²	86	130 Å²	130	60%	0.601	74%	0.74	S	S	*	*			cis	-164.2	177.2	2.1	39	0	0	0	0	107.9
314	T	26.6	Very low	25.3	Very low	122 Å²	122	127.9 Å²	127.9	75%	0.748	73%	0.731	S	S	*	*			cis	-168	161	46.7	39.8	0	0	0	0	110.6
315	T	26.5	Very low	25.3	Very low	102 Å²	102	127.3 Å²	127.3	63%	0.626	73%	0.727	S	S	*	*			cis	166.8	144.5	-40.8	34.2	0	0	0	0	107.7
316	K	25.8	Very low	25.2	Very low	211 Å²	211	121.7 Å²	121.7	92%	0.917	70%	0.704	S	S	*	*				-169.6	108.4	122.8	-107.3	166	-175.6	177.2	0	112.4
317	S	23.7	Very low	25	Very low	100 Å²	100	125.3 Å²	125.3	70%	0.699	72%	0.717	S	S	*	*			trans	-110.4	168	163.7	51.5	0	0	0	0	109.2
318	I	24.4	Very low	24.9	Very low	165 Å²	165	124.8 Å²	124.8	85%	0.846	71%	0.709	S	S	*	*			trans	-131	125.4	157.8	-62.4	-179.4	0	0	0	107.3	L320	I318-L320 HydrophobicContact CG2-CD1 4.37Å
319	S	22.6	Very low	24.9	Very low	96 Å²	96	125 Å²	125	67%	0.671	72%	0.715	S	S	*	*			trans	-135.3	153.3	170.9	52.9	0	0	0	0	108.7
320	L	24.1	Very low	24.9	Very low	165 Å²	165	123.8 Å²	123.8	86%	0.864	72%	0.717	S	S	*	*			trans	-129.4	124.6	165.7	-84.7	94.6	0	0	0	109	I318	I318-L320 HydrophobicContact CG2-CD1 4.37Å
321	S	23	Very low	24.8	Very low	107 Å²	107	124.4 Å²	124.4	75%	0.748	72%	0.721	S	S	*	*			trans	-155.3	87.3	-177.4	57	0	0	0	0	110.6
322	S	24.9	Very low	24.9	Very low	113 Å²	113	124 Å²	124	79%	0.79	72%	0.718	S	S	*	*			trans	-176.7	112.6	163.5	53.7	0	0	0	0	111.6
323	M	24.9	Very low	25	Very low	179 Å²	179	121 Å²	121	88%	0.882	70%	0.703	S	S	*	*			trans	-176.9	108.3	132.6	-105.5	178.4	172.9	0	0	109.9
324	N	23.3	Very low	25.1	Very low	84 Å²	84	122.5 Å²	122.5	45%	0.449	70%	0.703	S	S	.	*			trans	-118.6	105.3	176.9	-81.6	34	0	0	0	109.1	N300	N300-N324 HydrophobicContact CB-CB 3.88Å; N300-N324 VanDerWaalsContact CG-CG 3.49Å; N300-N324 VanDerWaalsContact CG-ND2 3.32Å; N300-N324 CarbonylContact O-C 3.33Å; N300-N324 PolarHBondContact OD1-ND2 3.49Å
325	T	26.3	Very low	25.3	Very low	122 Å²	122	121.2 Å²	121.2	75%	0.748	70%	0.699	S	S	*	*			trans	-147.5	119.6	165	35.9	0	0	0	0	110.5	N300	N300-T325 CarbonylContact O-C 3.57Å; N300-T325 WeakPolarHBondContact O-CA 3.46Å; N300-T325 PolarHBondContact O-N 2.88Å
326	T	23.6	Very low	25.7	Very low	44 Å²	44	122.4 Å²	122.4	27%	0.27	70%	0.697	S	S	.	*			trans	-77.2	133.4	173.8	-25.5	0	0	0	0	111.1	D299 N300 S301	D299-T326 HydrophobicContact CB-CG2 3.74Å; D299-T326 WeakPolarHBondContact OD1-CG2 3.22Å; N300-T326 PolarHBondContact O-N 3.39Å; N300-T326 VanDerWaalsContact O-N 3.13Å; N300-T326 PolarHBondContact O-OG1 2.68Å; S301-T326 WeakPolarHBondContact CB-OG1 3.06Å; S301-T326 PolarHBondContact N-OG1 2.92Å; S301-T326 PolarHBondContact OG-OG1 2.9Å
327	I	25.7	Very low	25.7	Very low	160 Å²	160	116.9 Å²	116.9	82%	0.821	68%	0.678	S	S	*	*			trans	-139.4	131.1	149.7	-63.3	-172.7	0	0	0	107.7
328	T	24.5	Very low	26	Very low	104 Å²	104	118.7 Å²	118.7	64%	0.638	68%	0.677	S	S	*	*			trans	-74.4	142.5	-163.7	48.2	0	0	0	0	115.1
329	T	24.3	Very low	26.4	Very low	115 Å²	115	118.1 Å²	118.1	71%	0.706	67%	0.672	S	S	*	*			trans	23.4	120.8	144.6	59	0	0	0	0	119.4
330	N	24.2	Very low	26.8	Very low	154 Å²	154	120.1 Å²	120.1	82%	0.824	67%	0.672	S	S	*	*				-154.7	139.5	113.7	-117.4	-31.2	0	0	0	112.8	S332	N330-S332 PolarHBondContact O-N 3.01Å
331	T	24.4	Very low	27.2	Very low	134 Å²	134	118.7 Å²	118.7	82%	0.822	66%	0.659	S	S	*	*			trans	-91.6	76	-170.8	44.5	0	0	0	0	112.9
332	S	26.5	Very low	27.6	Very low	84 Å²	84	122.4 Å²	122.4	59%	0.587	66%	0.662	S	S	*	*			trans	-135.7	167.8	161	66.7	0	0	0	0	110.4	N330 I334	N330-S332 PolarHBondContact O-N 3.01Å; S332-I334 PolarHBondContact O-N 2.86Å
333	N	28.7	Very low	27.9	Very low	94 Å²	94	125.9 Å²	125.9	50%	0.503	66%	0.663	S	S	.	*			trans	65.7	22.4	176.5	-57.2	-39.5	0	0	0	118.2	S335 Q336 L337	N333-S335 PolarHBondContact O-N 3.35Å; N333-S335 VanDerWaalsContact O-N 3.13Å; N333-Q336 HydrophobicContact CB-CB 4.35Å; N333-Q336 HydrophobicContact CB-CG 4.27Å; N333-Q336 PolarHBondContact O-N 2.86Å; N333-L337 PolarHBondContact O-N 2.69Å
334	I	29.4	Very low	28.1	Very low	118 Å²	118	124.3 Å²	124.3	61%	0.605	66%	0.657	S	S	*	*	H	α-helix	trans	-50.8	-35.9	164.8	-68.1	177.7	0	0	0	111.1	S332 Q336 L337 M338	S332-I334 PolarHBondContact O-N 2.86Å; I334-Q336 VanDerWaalsContact C-N 3.3Å; I334-Q336 PolarHBondContact O-N 2.99Å; I334-L337 PolarHBondContact O-N 3.44Å; I334-M338 HydrophobicContact CG2-CE 4.41Å; I334-M338 PolarHBondContact O-N 2.72Å
335	S	30.9	Very low	28.4	Very low	95 Å²	95	124.9 Å²	124.9	66%	0.664	66%	0.664	S	S	*	*	H	α-helix	trans	-58.3	-32.9	175.1	-39.9	0	0	0	0	114.4	N333	N333-S335 PolarHBondContact O-N 3.35Å; N333-S335 VanDerWaalsContact O-N 3.13Å
336	Q	33.5	Very low	28.6	Very low	126 Å²	126	128.1 Å²	128.1	59%	0.589	67%	0.668	S	S	*	*	H	α-helix	trans	-84.7	-38.4	-179	-63.5	-176.3	-5.9	0	0	111.6	N333 I334 M338 M339 M340	N333-Q336 HydrophobicContact CB-CB 4.35Å; N333-Q336 HydrophobicContact CB-CG 4.27Å; N333-Q336 PolarHBondContact O-N 2.86Å; I334-Q336 VanDerWaalsContact C-N 3.3Å; I334-Q336 PolarHBondContact O-N 2.99Å; Q336-M338 VanDerWaalsContact C-N 3.27Å; Q336-M338 PolarHBondContact O-N 3.17Å; Q336-M339 PolarHBondContact O-N 3.19Å; Q336-M340 PolarHBondContact O-N 2.87Å
337	L	27.5	Very low	28.9	Very low	96 Å²	96	135.1 Å²	135.1	50%	0.503	69%	0.694	S	S	.	*	H	α-helix	trans	-65.7	-29.5	-178.6	-161.3	70.7	0	0	0	112.6	N333 I334 M339 M340 K341	N333-L337 PolarHBondContact O-N 2.69Å; I334-L337 PolarHBondContact O-N 3.44Å; L337-M339 VanDerWaalsContact C-N 3.3Å; L337-M339 PolarHBondContact O-N 3.02Å; L337-M340 PolarHBondContact O-N 3.32Å; L337-K341 HydrophobicContact CG-CD 4.45Å; L337-K341 PolarHBondContact O-N 3.24Å
338	M	30.2	Very low	29	Very low	138 Å²	138	134.6 Å²	134.6	68%	0.68	69%	0.693	S	S	*	*	H	α-helix	trans	-66.1	-27.7	172.2	-71.2	-157.4	-178.9	0	0	113.6	I334 Q336	I334-M338 HydrophobicContact CG2-CE 4.41Å; I334-M338 PolarHBondContact O-N 2.72Å; Q336-M338 VanDerWaalsContact C-N 3.27Å; Q336-M338 PolarHBondContact O-N 3.17Å
339	M	31.6	Very low	29.2	Very low	153 Å²	153	132.5 Å²	132.5	75%	0.754	68%	0.683	S	S	*	*	H	α-helix	trans	-75.7	-39.2	174.6	-62.3	-157	-170.6	0	0	111.9	Q336 L337	Q336-M339 PolarHBondContact O-N 3.19Å; L337-M339 VanDerWaalsContact C-N 3.3Å; L337-M339 PolarHBondContact O-N 3.02Å
340	M	32	Very low	29.5	Very low	137 Å²	137	131.5 Å²	131.5	68%	0.675	68%	0.676	S	S	*	*	H	α-helix	trans	-73.2	-36.3	178.7	-72.4	-166.4	171.7	0	0	113.6	Q336 L337 K342 K343	Q336-M340 PolarHBondContact O-N 2.87Å; L337-M340 PolarHBondContact O-N 3.32Å; M340-K342 PolarHBondContact O-N 2.94Å; M340-K342 VanDerWaalsContact O-N 3.13Å; M340-K343 PolarHBondContact O-N 3.47Å
341	K	31.4	Very low	29.7	Very low	136 Å²	136	133.4 Å²	133.4	59%	0.591	68%	0.677	S	S	*	*	H	α-helix	trans	-63.2	-18.6	177.9	-77.3	-178.2	175.5	178.4	0	114	L337 K343 T345	L337-K341 HydrophobicContact CG-CD 4.45Å; L337-K341 PolarHBondContact O-N 3.24Å; K341-K343 VanDerWaalsContact C-N 3.33Å; K341-T345 WeakPolarHBondContact O-CG2 3.43Å; K341-T345 PolarHBondContact O-OG1 3.24Å
342	K	32.4	Very low	30	Very low	184 Å²	184	133.5 Å²	133.5	80%	0.8	67%	0.672	S	S	*	*	H	α-helix	trans	-75	-11	170	-90.2	-178.2	175	175.4	0	114.9	M340	M340-K342 PolarHBondContact O-N 2.94Å; M340-K342 VanDerWaalsContact O-N 3.13Å
343	K	30.2	Very low	30.1	Very low	186 Å²	186	133.6 Å²	133.6	81%	0.809	67%	0.666	S	S	*	*	H	α-helix	trans	-103.5	-29.1	179.2	-77	-173.9	173.9	-179.7	0	115.1	M340 K341	M340-K343 PolarHBondContact O-N 3.47Å; K341-K343 VanDerWaalsContact C-N 3.33Å
344	L	29.1	Very low	30.2	Very low	147 Å²	147	134.1 Å²	134.1	77%	0.77	67%	0.669	S	S	*	*	H	α-helix	trans	-88.1	-12.7	-177.9	-84.2	82.9	0	0	0	115.4	K346	L344-K346 PolarHBondContact O-N 2.81Å; L344-K346 VanDerWaalsContact O-N 3.13Å
345	T	29.3	Very low	30.5	Very low	96 Å²	96	131.9 Å²	131.9	59%	0.589	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	6	-168.8	33.7	0	0	0	0	115.8	K341 S349	K341-T345 WeakPolarHBondContact O-CG2 3.43Å; K341-T345 PolarHBondContact O-OG1 3.24Å; T345-S349 PolarHBondContact O-OG 3.49Å; T345-S349 VanDerWaalsContact O-OG 3.08Å
346	K	30.8	Very low	30.8	Very low	190 Å²	190	133.7 Å²	133.7	83%	0.826	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	0.1	-165.6	-113.2	-174.4	-180	-174.2	0	118.1	L344	L344-K346 PolarHBondContact O-N 2.81Å; L344-K346 VanDerWaalsContact O-N 3.13Å
347	K	29.2	Very low	31.2	Very low	190 Å²	190	135.6 Å²	135.6	83%	0.826	68%	0.676	S	S	*	*	S	Bend	trans	-122.1	-30.5	180	-86.9	-170.5	171.7	-175.4	0	117.3
348	N	29	Very low	32.4	Very low	150 Å²	150	137.2 Å²	137.2	80%	0.802	69%	0.685	S	S	*	*	S	Bend	trans	-103.6	-6.3	-175.6	-70.7	2.9	0	0	0	115.1	V350	N348-V350 VanDerWaalsContact C-N 3.27Å; N348-V350 PolarHBondContact O-N 2.82Å
349	S	28.7	Very low	34	Very low	59 Å²	59	134 Å²	134	41%	0.413	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.1	-3.8	-175.8	39.4	0	0	0	0	115.2	T345 N353	T345-S349 PolarHBondContact O-OG 3.49Å; T345-S349 VanDerWaalsContact O-OG 3.08Å; S349-N353 PolarHBondContact O-ND2 3.47Å
350	V	30.4	Very low	36.2	Very low	94 Å²	94	129.8 Å²	129.8	57%	0.57	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-19.1	-166.2	-175.9	0	0	0	0	113.9	N348	N348-V350 VanDerWaalsContact C-N 3.27Å; N348-V350 PolarHBondContact O-N 2.82Å
351	K	29	Very low	38.4	Very low	195 Å²	195	125.5 Å²	125.5	85%	0.848	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-14.5	-176	-71.9	-170.3	177.7	-178.2	0	116.4
352	L	29.8	Very low	40.8	Very low	136 Å²	136	121.2 Å²	121.2	71%	0.712	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-27.2	-177.9	-120.7	165.3	0	0	0	113
353	N	29.1	Very low	43.2	Very low	85 Å²	85	114.9 Å²	114.9	46%	0.455	59%	0.591	S	S	.	*	H	α-helix	trans	-71.6	-41.6	177.7	-72.5	-58.6	0	0	0	112.2	S349 A355 L356 F357	S349-N353 PolarHBondContact O-ND2 3.47Å; N353-A355 PolarHBondContact O-N 3.45Å; N353-L356 PolarHBondContact O-N 3.44Å; N353-F357 HydrophobicContact CB-CD2 4.23Å; N353-F357 HydrophobicContact CB-CE2 4.43Å; N353-F357 WeakPolarHBondContact O-CD2 3.28Å; N353-F357 PolarHBondContact O-N 3.04Å; N353-F357 VanDerWaalsContact O-N 3.08Å
354	D	30.2	Very low	45.5	Very low	105 Å²	105	108.7 Å²	108.7	56%	0.561	57%	0.567	S	S	*	*	H	α-helix	trans	-59.1	-21.7	-176.8	-70.4	2.5	0	0	0	114	N358	D354-N358 PolarHBondContact O-ND2 2.83Å
355	A	35.1	Very low	47.9	Very low	71 Å²	71	101.8 Å²	101.8	59%	0.587	53%	0.531	S	S	*	.	H	α-helix	trans	-76.7	-42.9	173.8	0	0	0	0	0	112.8	N353	N353-A355 PolarHBondContact O-N 3.45Å
356	L	38	Very low	50.6	Low	134 Å²	134	97.2 Å²	97.2	70%	0.702	50%	0.502	S	S	*	.	H	α-helix	trans	-74.5	-29	179	-93.8	72.6	0	0	0	112.7	N353 N358	N353-L356 PolarHBondContact O-N 3.44Å; L356-N358 PolarHBondContact O-N 3.23Å
357	F	42.1	Very low	52.9	Low	165 Å²	165	89.5 Å²	89.5	72%	0.724	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	3.4	-175.3	-93.4	-89.2	0	0	0	115.5	N353	N353-F357 HydrophobicContact CB-CD2 4.23Å; N353-F357 HydrophobicContact CB-CE2 4.43Å; N353-F357 WeakPolarHBondContact O-CD2 3.28Å; N353-F357 PolarHBondContact O-N 3.04Å; N353-F357 VanDerWaalsContact O-N 3.08Å
358	N	53.5	Low	55.1	Low	130 Å²	130	82.4 Å²	82.4	70%	0.695	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-3.1	-178.1	-82.8	-56.1	0	0	0	115.2	D354 L356	D354-N358 PolarHBondContact O-ND2 2.83Å; L356-N358 PolarHBondContact O-N 3.23Å
359	V	62.1	Low	57.3	Low	71 Å²	71	75.3 Å²	75.3	43%	0.43	40%	0.4	S	S	.	.			trans	-81.6	131.2	175.3	-169.1	0	0	0	0	109.9	Q363 L364	V359-Q363 HydrophobicContact CG1-CB 3.75Å; V359-L364 HydrophobicContact CG1-CD2 3.81Å; V359-L364 HydrophobicContact CG1-CG 3.93Å
360	T	78.9	Confident	59.6	Low	64 Å²	64	73 Å²	73	39%	0.393	38%	0.383	S	S	.	.			trans	-86.3	156.3	-179.9	69.4	0	0	0	0	112.8	E362 Q363 L364	T360-E362 PolarHBondContact O-N 2.71Å; T360-E362 PolarHBondContact OG1-N 2.9Å; T360-Q363 PolarHBondContact O-N 2.8Å; T360-Q363 WeakPolarHBondContact OG1-CG 3.22Å; T360-Q363 PolarHBondContact OG1-N 3.37Å; T360-Q363 VanDerWaalsContact OG1-N 3.15Å; T360-Q363 PolarHBondContact OG1-OE1 2.94Å; T360-L364 PolarHBondContact O-N 3.3Å; T360-L364 VanDerWaalsContact O-N 3.14Å
361	D	77.8	Confident	61.7	Low	48 Å²	48	71.7 Å²	71.7	26%	0.257	37%	0.37	S	S	.	.	H	α-helix	trans	-43.9	-40.4	168.1	-68.9	8.3	0	0	0	112.2	K178 W237 K256 V365	K178-D361 IonicContact NZ-OD2 3.74Å; K178-D361 PolarHBondContact NZ-OD2 2.8Å; W237-D361 HydrophobicContact CZ2-CB 3.8Å; K256-D361 WeakPolarHBondContact CE-OD2 3.43Å; K256-D361 IonicContact NZ-OD2 2.64Å; D361-V365 WeakPolarHBondContact O-CG2 3.35Å; D361-V365 PolarHBondContact O-N 3.22Å; D361-V365 VanDerWaalsContact O-N 3.15Å
362	E	81.5	Confident	63.7	Low	45 Å²	45	64.8 Å²	64.8	21%	0.21	34%	0.342	C	S	.	.	H	α-helix	trans	-70.3	-44	-177.6	-174	177.5	-157.5	0	0	112	Q160 W162 L176 W237 T360 L364 V365 L366	Q160-E362 WeakPolarHBondContact CG-OE1 3.44Å; W162-E362 HydrophobicContact CZ2-CG 4.42Å; W162-E362 PolarHBondContact NE1-OE1 2.76Å; L176-E362 HydrophobicContact CD1-CG 3.82Å; W237-E362 HydrophobicContact CH2-CB 3.81Å; W237-E362 HydrophobicContact CH2-CG 4.13Å; W237-E362 HydrophobicContact CZ2-CB 4.17Å; T360-E362 PolarHBondContact O-N 2.71Å; T360-E362 PolarHBondContact OG1-N 2.9Å; E362-L364 VanDerWaalsContact C-N 3.3Å; E362-L364 PolarHBondContact O-N 3.37Å; E362-V365 PolarHBondContact O-N 3Å; E362-L366 HydrophobicContact CG-CD1 4.16Å; E362-L366 WeakPolarHBondContact O-CB 3.4Å; E362-L366 VanDerWaalsContact O-CG 3.26Å; E362-L366 WeakPolarHBondContact O-CG 3.17Å; E362-L366 PolarHBondContact O-N 2.8Å
363	Q	82.5	Confident	65.6	Low	51 Å²	51	62.8 Å²	62.8	24%	0.238	33%	0.332	C	S	.	.	H	α-helix	trans	-62.8	-38.1	176.3	-71.9	173.1	-57	0	0	111.7	V359 T360 L366 Q367 M376	V359-Q363 HydrophobicContact CG1-CB 3.75Å; T360-Q363 PolarHBondContact O-N 2.8Å; T360-Q363 WeakPolarHBondContact OG1-CG 3.22Å; T360-Q363 PolarHBondContact OG1-N 3.37Å; T360-Q363 VanDerWaalsContact OG1-N 3.15Å; T360-Q363 PolarHBondContact OG1-OE1 2.94Å; Q363-L366 PolarHBondContact O-N 3.04Å; Q363-Q367 WeakPolarHBondContact O-CB 3.47Å; Q363-Q367 WeakPolarHBondContact O-CG 3.38Å; Q363-Q367 PolarHBondContact O-N 2.93Å; Q363-M376 HydrophobicContact CB-SD 4.48Å; Q363-M376 HydrophobicContact CG-CE 4.15Å; Q363-M376 HydrophobicContact CG-SD 3.9Å
364	L	78.4	Confident	67.8	Low	57 Å²	57	63.4 Å²	63.4	30%	0.298	34%	0.336	S	S	.	.	H	α-helix	trans	-65.3	-40.7	174.6	-63.3	173.3	0	0	0	111.9	I259 V359 T360 E362 Y368	I259-L364 HydrophobicContact CG2-CB 3.65Å; I259-L364 HydrophobicContact CG2-CD1 3.61Å; I259-L364 HydrophobicContact CG2-CG 4.28Å; V359-L364 HydrophobicContact CG1-CD2 3.81Å; V359-L364 HydrophobicContact CG1-CG 3.93Å; T360-L364 PolarHBondContact O-N 3.3Å; T360-L364 VanDerWaalsContact O-N 3.14Å; E362-L364 VanDerWaalsContact C-N 3.3Å; E362-L364 PolarHBondContact O-N 3.37Å; L364-Y368 VanDerWaalsContact O-CB 3.29Å; L364-Y368 WeakPolarHBondContact O-CB 3.5Å; L364-Y368 PolarHBondContact O-N 2.93Å
365	V	80.7	Confident	70.1	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-44.2	172.6	169.8	0	0	0	0	111.3	L176 W237 V239 I254 I259 D361 E362 Y368 L369	L176-V365 HydrophobicContact CD1-CG1 4.25Å; L176-V365 HydrophobicContact CD2-CG1 3.85Å; W237-V365 HydrophobicContact CD2-CG2 4.26Å; W237-V365 HydrophobicContact CG-CG2 3.98Å; V239-V365 HydrophobicContact CG2-CG1 4.49Å; I254-V365 HydrophobicContact CD1-CG1 4.2Å; I259-V365 HydrophobicContact CD1-CG2 3.44Å; I259-V365 VanDerWaalsContact CD1-CG2 3.44Å; I259-V365 HydrophobicContact CG1-CG2 4.35Å; D361-V365 WeakPolarHBondContact O-CG2 3.35Å; D361-V365 PolarHBondContact O-N 3.22Å; D361-V365 VanDerWaalsContact O-N 3.15Å; E362-V365 PolarHBondContact O-N 3Å; V365-Y368 PolarHBondContact O-N 2.9Å; V365-L369 HydrophobicContact CG1-CD1 3.69Å; V365-L369 HydrophobicContact CG1-CG 4.3Å; V365-L369 WeakPolarHBondContact O-CB 3.13Å; V365-L369 WeakPolarHBondContact O-CG 3.31Å; V365-L369 PolarHBondContact O-N 2.91Å
366	L	85	Confident	72.3	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.1	-50.1	179.1	-70.5	168.8	0	0	0	111.3	W162 I174 L176 E362 Q363 Y368 L369 V370 I375 M376 L379	W162-L366 HydrophobicContact CB-CD2 4.19Å; W162-L366 HydrophobicContact CD2-CD1 3.68Å; W162-L366 HydrophobicContact CD2-CD2 4.48Å; W162-L366 HydrophobicContact CE3-CD1 4.13Å; W162-L366 HydrophobicContact CG-CD1 4.01Å; W162-L366 HydrophobicContact CG-CD2 3.95Å; W162-L366 HydrophobicContact CH2-CD1 4.4Å; W162-L366 HydrophobicContact CZ2-CD1 3.98Å; W162-L366 HydrophobicContact CZ3-CD1 4.46Å; I174-L366 HydrophobicContact CB-CD2 4.4Å; I174-L366 HydrophobicContact CD1-CD2 3.89Å; I174-L366 HydrophobicContact CG2-CD2 4.17Å; L176-L366 HydrophobicContact CD1-CD2 3.78Å; L176-L366 HydrophobicContact CD1-CG 3.96Å; E362-L366 HydrophobicContact CG-CD1 4.16Å; E362-L366 WeakPolarHBondContact O-CB 3.4Å; E362-L366 VanDerWaalsContact O-CG 3.26Å; E362-L366 WeakPolarHBondContact O-CG 3.17Å; E362-L366 PolarHBondContact O-N 2.8Å; Q363-L366 PolarHBondContact O-N 3.04Å; L366-Y368 VanDerWaalsContact C-N 3.33Å; L366-Y368 PolarHBondContact O-N 3.1Å; L366-L369 PolarHBondContact O-N 2.87Å; L366-V370 PolarHBondContact O-N 2.93Å; L366-I375 HydrophobicContact CB-CD1 3.94Å; L366-I375 WeakPolarHBondContact O-CD1 3.46Å; L366-M376 HydrophobicContact CD1-SD 4.36Å; L366-L379 HydrophobicContact CD2-CD1 3.99Å
367	Q	80.1	Confident	74.4	Confident	29 Å²	29	57 Å²	57	14%	0.136	29%	0.291	C	S	.	.	H	α-helix	trans	-55.3	-46	174.6	-76.2	175.8	-36.8	0	0	111.8	Q363 L369 V370 K371 D373 I375	Q363-Q367 WeakPolarHBondContact O-CB 3.47Å; Q363-Q367 WeakPolarHBondContact O-CG 3.38Å; Q363-Q367 PolarHBondContact O-N 2.93Å; Q367-L369 PolarHBondContact O-N 2.81Å; Q367-V370 PolarHBondContact O-N 2.88Å; Q367-K371 WeakPolarHBondContact O-CA 3.43Å; Q367-K371 PolarHBondContact O-N 2.8Å; Q367-D373 PolarHBondContact NE2-O 2.9Å; Q367-I375 HydrophobicContact CB-CG2 4.44Å; Q367-I375 HydrophobicContact CG-CG2 3.51Å
368	Y	74.8	Confident	76.5	Confident	41 Å²	41	53.1 Å²	53.1	16%	0.161	27%	0.272	C	S	.	.	H	α-helix	trans	-59.9	-42.2	176.1	172	-118.7	0	0	0	113.5	I254 L268 L364 V365 L366 V370	I254-Y368 HydrophobicContact CD1-CD1 3.94Å; I254-Y368 HydrophobicContact CD1-CE1 3.91Å; L268-Y368 HydrophobicContact CB-CD2 3.84Å; L268-Y368 HydrophobicContact CB-CE2 4.17Å; L268-Y368 HydrophobicContact CD2-CD2 4.11Å; L268-Y368 HydrophobicContact CD2-CE2 4.02Å; L268-Y368 HydrophobicContact CG-CD2 4.44Å; L268-Y368 WeakPolarHBondContact O-CE2 3.46Å; L364-Y368 VanDerWaalsContact O-CB 3.29Å; L364-Y368 WeakPolarHBondContact O-CB 3.5Å; L364-Y368 PolarHBondContact O-N 2.93Å; V365-Y368 PolarHBondContact O-N 2.9Å; L366-Y368 VanDerWaalsContact C-N 3.33Å; L366-Y368 PolarHBondContact O-N 3.1Å; Y368-V370 PolarHBondContact O-N 3.24Å
369	L	76.6	Confident	78.1	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-69.6	-32.5	-176.8	-74.1	168.5	0	0	0	113.5	I174 L176 V239 V241 R243 L249 I254 V365 L366 Q367	I174-L369 HydrophobicContact CD1-CB 4.47Å; I174-L369 HydrophobicContact CD1-CD1 4.49Å; I174-L369 HydrophobicContact CG2-CD1 4.06Å; L176-L369 HydrophobicContact CD2-CD1 4.08Å; V239-L369 HydrophobicContact CG1-CD1 3.51Å; V239-L369 HydrophobicContact CG1-CD2 3.89Å; V239-L369 HydrophobicContact CG1-CG 4.36Å; V239-L369 HydrophobicContact CG2-CD1 4.38Å; V241-L369 HydrophobicContact CG2-CB 4.4Å; V241-L369 HydrophobicContact CG2-CD1 4.12Å; V241-L369 HydrophobicContact CG2-CD2 4.08Å; V241-L369 HydrophobicContact CG2-CG 4.44Å; R243-L369 PolarHBondContact NH2-O 2.98Å; L249-L369 HydrophobicContact CD1-CD2 4.05Å; I254-L369 HydrophobicContact CD1-CD2 4.12Å; I254-L369 HydrophobicContact CD1-CG 4.49Å; V365-L369 HydrophobicContact CG1-CD1 3.69Å; V365-L369 HydrophobicContact CG1-CG 4.3Å; V365-L369 WeakPolarHBondContact O-CB 3.13Å; V365-L369 WeakPolarHBondContact O-CG 3.31Å; V365-L369 PolarHBondContact O-N 2.91Å; L366-L369 PolarHBondContact O-N 2.87Å; Q367-L369 PolarHBondContact O-N 2.81Å
370	V	76.1	Confident	79.4	Confident	11 Å²	11	46.5 Å²	46.5	7%	0.067	23%	0.231	C	C	.	.	H	α-helix	trans	-102	-22.5	-176.9	174.1	0	0	0	0	113.4	I166 I172 I174 L366 Q367 Y368 N372 I375	I166-V370 HydrophobicContact CD1-CG1 3.5Å; I166-V370 HydrophobicContact CD1-CG2 4.23Å; I172-V370 HydrophobicContact CD1-CG2 3.66Å; I174-V370 HydrophobicContact CD1-CG2 4.02Å; L366-V370 PolarHBondContact O-N 2.93Å; Q367-V370 PolarHBondContact O-N 2.88Å; Y368-V370 PolarHBondContact O-N 3.24Å; V370-N372 HydrophobicContact CG1-CB 3.99Å; V370-I375 HydrophobicContact CB-CD1 3.53Å; V370-I375 HydrophobicContact CB-CG1 4.15Å; V370-I375 HydrophobicContact CG1-CD1 4.16Å; V370-I375 HydrophobicContact CG1-CG1 4.24Å; V370-I375 HydrophobicContact CG2-CD1 3.51Å; V370-I375 HydrophobicContact CG2-CG1 4.28Å
371	K	73.9	Confident	79.9	Confident	67 Å²	67	45.5 Å²	45.5	29%	0.291	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	42	-178	-51.8	167.4	-171.3	174.8	0	112.6	I269 I270 Q367	I269-K371 HydrophobicContact CG2-CB 3.96Å; I269-K371 HydrophobicContact CG2-CD 4.05Å; I269-K371 HydrophobicContact CG2-CG 4.02Å; I270-K371 VanDerWaalsContact O-CE 3.31Å; I270-K371 WeakPolarHBondContact O-CE 3.31Å; I270-K371 PolarHBondContact O-NZ 2.68Å; Q367-K371 WeakPolarHBondContact O-CA 3.43Å; Q367-K371 PolarHBondContact O-N 2.8Å
372	N	72.6	Confident	80.3	Confident	50 Å²	50	43.2 Å²	43.2	27%	0.267	21%	0.214	S	C	.	.			trans	-140	124.2	178.2	-174.7	-23.8	0	0	0	109	V370 N374 I375	V370-N372 HydrophobicContact CG1-CB 3.99Å; N372-N374 VanDerWaalsContact C-N 3.35Å; N372-N374 PolarHBondContact OD1-N 2.76Å; N372-I375 WeakPolarHBondContact O-CB 3.25Å; N372-I375 PolarHBondContact O-N 3.25Å
373	D	68.6	Low	80.5	Confident	93 Å²	93	43.8 Å²	43.8	50%	0.497	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-37.4	-176.7	-57.4	-44.2	0	0	0	111.8	Q367 I375	Q367-D373 PolarHBondContact NE2-O 2.9Å; D373-I375 PolarHBondContact O-N 3.15Å
374	N	74.3	Confident	80.4	Confident	99 Å²	99	45.5 Å²	45.5	53%	0.529	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	21.1	-178.2	-66.6	6.5	0	0	0	112.8	N372 M376 D377 Y378	N372-N374 VanDerWaalsContact C-N 3.35Å; N372-N374 PolarHBondContact OD1-N 2.76Å; N374-M376 PolarHBondContact O-N 2.91Å; N374-D377 WeakPolarHBondContact O-CB 3.43Å; N374-D377 PolarHBondContact O-N 3.08Å; N374-D377 VanDerWaalsContact O-N 3.08Å; N374-Y378 HydrophobicContact CB-CE2 4.49Å; N374-Y378 WeakPolarHBondContact O-CD2 3.41Å
375	I	80.2	Confident	80.5	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-51.7	-32.6	-177.1	-166.8	-176	0	0	0	114.3	L366 Q367 V370 N372 D373 D377 Y378 L379	L366-I375 HydrophobicContact CB-CD1 3.94Å; L366-I375 WeakPolarHBondContact O-CD1 3.46Å; Q367-I375 HydrophobicContact CB-CG2 4.44Å; Q367-I375 HydrophobicContact CG-CG2 3.51Å; V370-I375 HydrophobicContact CB-CD1 3.53Å; V370-I375 HydrophobicContact CB-CG1 4.15Å; V370-I375 HydrophobicContact CG1-CD1 4.16Å; V370-I375 HydrophobicContact CG1-CG1 4.24Å; V370-I375 HydrophobicContact CG2-CD1 3.51Å; V370-I375 HydrophobicContact CG2-CG1 4.28Å; N372-I375 WeakPolarHBondContact O-CB 3.25Å; N372-I375 PolarHBondContact O-N 3.25Å; D373-I375 PolarHBondContact O-N 3.15Å; I375-D377 PolarHBondContact O-N 3.04Å; I375-Y378 PolarHBondContact O-N 3.06Å; I375-L379 HydrophobicContact CD1-CD1 3.48Å; I375-L379 VanDerWaalsContact CD1-CD1 3.48Å; I375-L379 HydrophobicContact CD1-CG 4.28Å; I375-L379 HydrophobicContact CG1-CB 4.47Å; I375-L379 HydrophobicContact CG1-CD1 3.69Å; I375-L379 HydrophobicContact CG1-CG 3.92Å; I375-L379 PolarHBondContact O-N 3.32Å
376	M	81.4	Confident	80.5	Confident	60 Å²	60	52.4 Å²	52.4	30%	0.296	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-69.5	-15.8	-176.3	-58	-54.4	-54.3	0	0	113.6	W162 Q363 L366 N374 Y378	W162-M376 HydrophobicContact CE3-CE 4.43Å; W162-M376 HydrophobicContact CH2-CE 3.7Å; W162-M376 HydrophobicContact CZ3-CE 3.5Å; W162-M376 VanDerWaalsContact CZ3-CE 3.5Å; Q363-M376 HydrophobicContact CB-SD 4.48Å; Q363-M376 HydrophobicContact CG-CE 4.15Å; Q363-M376 HydrophobicContact CG-SD 3.9Å; L366-M376 HydrophobicContact CD1-SD 4.36Å; N374-M376 PolarHBondContact O-N 2.91Å; M376-Y378 VanDerWaalsContact C-N 3.29Å
377	D	82	Confident	80.4	Confident	115 Å²	115	55.8 Å²	55.8	62%	0.615	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-75.3	-24	172.8	-59.3	-24.6	0	0	0	111.3	N374 I375	N374-D377 WeakPolarHBondContact O-CB 3.43Å; N374-D377 PolarHBondContact O-N 3.08Å; N374-D377 VanDerWaalsContact O-N 3.08Å; I375-D377 PolarHBondContact O-N 3.04Å
378	Y	84.8	Confident	80.7	Confident	83 Å²	83	54.5 Å²	54.5	33%	0.325	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-38.2	-174.2	-53.6	-74.8	0	0	0	113.3	G164 P167 N374 I375 M376	G164-Y378 WeakPolarHBondContact CA-O 3.41Å; P167-Y378 VanDerWaalsContact CD-CD1 3.47Å; P167-Y378 HydrophobicContact CG-CD1 4.19Å; P167-Y378 HydrophobicContact CG-CE1 3.51Å; N374-Y378 HydrophobicContact CB-CE2 4.49Å; N374-Y378 WeakPolarHBondContact O-CD2 3.41Å; I375-Y378 PolarHBondContact O-N 3.06Å; M376-Y378 VanDerWaalsContact C-N 3.29Å
379	L	88.2	Confident	81.2	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	116.5	176.7	-74.4	-172.1	0	0	0	111.5	W162 I172 I174 L366 I375	W162-L379 HydrophobicContact CB-CD1 4.29Å; W162-L379 HydrophobicContact CE3-CB 4.23Å; I172-L379 HydrophobicContact CG2-CD2 3.57Å; I174-L379 HydrophobicContact CD1-CD1 3.86Å; L366-L379 HydrophobicContact CD2-CD1 3.99Å; I375-L379 HydrophobicContact CD1-CD1 3.48Å; I375-L379 VanDerWaalsContact CD1-CD1 3.48Å; I375-L379 HydrophobicContact CD1-CG 4.28Å; I375-L379 HydrophobicContact CG1-CB 4.47Å; I375-L379 HydrophobicContact CG1-CD1 3.69Å; I375-L379 HydrophobicContact CG1-CG 3.92Å; I375-L379 PolarHBondContact O-N 3.32Å
380	K	89.3	Confident	81.6	Confident	59 Å²	59	55.5 Å²	55.5	26%	0.257	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	152	168.7	-55.1	-172.2	-171.2	-174.9	0	110	F163 G382 T621 N623	F163-K380 PolarHBondContact N-O 2.92Å; F163-K380 PolarHBondContact O-N 2.98Å; K380-G382 PolarHBondContact O-N 3.37Å; K380-T621 HydrophobicContact CB-CG2 4.03Å; K380-N623 PolarHBondContact NZ-OD1 3.4Å
381	P	88.3	Confident	82.1	Confident	43 Å²	43	58 Å²	58	28%	0.279	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	136.8	168.7	-22.6	33.3	0	0	0	110.8	W162 I622	W162-P381 HydrophobicContact CE3-CG 4.17Å; W162-P381 HydrophobicContact CH2-CG 3.77Å; W162-P381 HydrophobicContact CZ2-CG 4.36Å; W162-P381 HydrophobicContact CZ3-CG 3.66Å; P381-I622 HydrophobicContact CB-CD1 4.31Å; P381-I622 WeakPolarHBondContact O-CG1 3.39Å; P381-I622 PolarHBondContact O-N 3.29Å
382	G	86.4	Confident	82.7	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.01	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-72.8	151.5	168.6	0	0	0	0	0	111.5	N161 F163 K380 P384 H620	N161-G382 PolarHBondContact O-N 3.29Å; F163-G382 VanDerWaalsContact CD2-CA 3.46Å; K380-G382 PolarHBondContact O-N 3.37Å; G382-P384 WeakPolarHBondContact O-CD 3.2Å; G382-H620 WeakPolarHBondContact CA-O 3.4Å
383	V	85.6	Confident	83.3	Confident	57 Å²	57	53.6 Å²	53.6	35%	0.345	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-60.7	125.7	172.5	178.6	0	0	0	0	109.4	D385 V388 H620 I622	V383-D385 HydrophobicContact CG1-CB 3.9Å; V383-D385 PolarHBondContact O-N 2.92Å; V383-V388 HydrophobicContact CB-CG2 4.25Å; V383-H620 PolarHBondContact N-O 3.11Å; V383-I622 HydrophobicContact CG2-CG1 3.88Å
384	P	80.7	Confident	84	Confident	86 Å²	86	54 Å²	54	56%	0.558	27%	0.27	S	S	*	.			trans	-80	68.7	178.5	33.9	-35.9	0	0	0	110.4	G382 Y389	G382-P384 WeakPolarHBondContact O-CD 3.2Å; P384-Y389 WeakPolarHBondContact CA-OH 3.47Å
385	D	80.3	Confident	84.5	Confident	60 Å²	60	49.2 Å²	49.2	32%	0.321	24%	0.244	S	C	.	.			trans	-122.7	141.8	178.6	163.2	46.8	0	0	0	110.7	V383 T387 V388 Y389	V383-D385 HydrophobicContact CG1-CB 3.9Å; V383-D385 PolarHBondContact O-N 2.92Å; D385-T387 PolarHBondContact O-N 3.41Å; D385-T387 PolarHBondContact OD1-N 2.84Å; D385-T387 VanDerWaalsContact OD2-CB 3.23Å; D385-T387 WeakPolarHBondContact OD2-CB 3.43Å; D385-T387 WeakPolarHBondContact OD2-CG2 3.5Å; D385-T387 PolarHBondContact OD2-N 2.91Å; D385-T387 PolarHBondContact OD2-OG1 3.21Å; D385-V388 HydrophobicContact CB-CG2 4.04Å; D385-V388 VanDerWaalsContact O-CB 3.25Å; D385-V388 WeakPolarHBondContact O-CB 3.21Å; D385-V388 PolarHBondContact O-N 2.94Å; D385-Y389 PolarHBondContact O-N 3.05Å
386	R	80.7	Confident	84.6	Confident	144 Å²	144	49.7 Å²	49.7	54%	0.543	25%	0.247	S	C	.	.	H	α-helix	trans	-57.7	-34.2	178.2	179.3	175.5	164.4	161.6	-1.5	112.4	V388 Y389 E390	R386-V388 VanDerWaalsContact C-N 3.25Å; R386-V388 PolarHBondContact O-N 3.39Å; R386-Y389 PolarHBondContact O-N 3.05Å; R386-E390 HydrophobicContact CG-CG 4.41Å; R386-E390 IonicContact CZ-OE1 3.86Å; R386-E390 IonicContact NE-OE1 2.72Å; R386-E390 PolarHBondContact NE-OE1 3.05Å; R386-E390 IonicContact NH2-OE1 3.03Å; R386-E390 PolarHBondContact NH2-OE1 2.94Å; R386-E390 WeakPolarHBondContact O-CG 3.35Å; R386-E390 PolarHBondContact O-N 3.17Å
387	T	84	Confident	84.5	Confident	70 Å²	70	49.9 Å²	49.9	43%	0.429	25%	0.247	S	C	.	.	H	α-helix	trans	-67.6	-28.5	178	86.5	0	0	0	0	112.3	D385 K391	D385-T387 PolarHBondContact O-N 3.41Å; D385-T387 PolarHBondContact OD1-N 2.84Å; D385-T387 VanDerWaalsContact OD2-CB 3.23Å; D385-T387 WeakPolarHBondContact OD2-CB 3.43Å; D385-T387 WeakPolarHBondContact OD2-CG2 3.5Å; D385-T387 PolarHBondContact OD2-N 2.91Å; D385-T387 PolarHBondContact OD2-OG1 3.21Å; T387-K391 WeakPolarHBondContact O-CB 3.47Å; T387-K391 WeakPolarHBondContact O-CG 3.27Å; T387-K391 PolarHBondContact O-N 3.14Å
388	V	86.6	Confident	84.2	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.012	23%	0.229	C	C	.	.	H	α-helix	trans	-67.9	-44.3	173.1	-176	0	0	0	0	110.1	F163 V383 D385 R386 K391 L392 F616 H620	F163-V388 HydrophobicContact CE2-CG1 3.68Å; F163-V388 HydrophobicContact CZ-CG1 3.69Å; V383-V388 HydrophobicContact CB-CG2 4.25Å; D385-V388 HydrophobicContact CB-CG2 4.04Å; D385-V388 VanDerWaalsContact O-CB 3.25Å; D385-V388 WeakPolarHBondContact O-CB 3.21Å; D385-V388 PolarHBondContact O-N 2.94Å; R386-V388 VanDerWaalsContact C-N 3.25Å; R386-V388 PolarHBondContact O-N 3.39Å; V388-K391 PolarHBondContact O-N 3.45Å; V388-L392 PolarHBondContact O-N 3.43Å; V388-F616 HydrophobicContact CG1-CE2 3.97Å; V388-F616 HydrophobicContact CG1-CZ 3.6Å; V388-H620 HydrophobicContact CG1-CB 4.11Å; V388-H620 HydrophobicContact CG2-CB 4.24Å
389	Y	85	Confident	83.5	Confident	12 Å²	12	44.5 Å²	44.5	5%	0.047	22%	0.222	C	C	.	.	H	α-helix	trans	-64.9	-42.3	177.7	-50	-21.9	0	0	0	111.7	Y148 F153 H159 N161 P384 D385 R386 K391 L392 L393	Y148-Y389 WeakPolarHBondContact OH-CB 3.24Å; F153-Y389 HydrophobicContact CD2-CD2 4.27Å; F153-Y389 HydrophobicContact CD2-CG 4.4Å; F153-Y389 HydrophobicContact CE2-CD2 4.19Å; F153-Y389 HydrophobicContact CE2-CG 4.47Å; H159-Y389 AromaticContact CE1-CD1 3.56Å; H159-Y389 AromaticContact CE1-CD2 3.71Å; H159-Y389 AromaticContact CE1-CE1 3.46Å; H159-Y389 VanDerWaalsContact CE1-CE1 3.46Å; H159-Y389 WeakPolarHBondContact CE1-CE1 3.44Å; H159-Y389 AromaticContact CE1-CE2 3.6Å; H159-Y389 AromaticContact CE1-CG 3.71Å; H159-Y389 AromaticContact CE1-CZ 3.48Å; H159-Y389 VanDerWaalsContact CE1-CZ 3.48Å; H159-Y389 AromaticContact NE2-CD1 3.57Å; H159-Y389 AromaticContact NE2-CE1 3.63Å; N161-Y389 VanDerWaalsContact ND2-CE1 3.3Å; N161-Y389 WeakPolarHBondContact ND2-CE1 3.5Å; P384-Y389 WeakPolarHBondContact CA-OH 3.47Å; D385-Y389 PolarHBondContact O-N 3.05Å; R386-Y389 PolarHBondContact O-N 3.05Å; Y389-K391 VanDerWaalsContact C-N 3.31Å; Y389-K391 PolarHBondContact O-N 3.22Å; Y389-L392 PolarHBondContact O-N 3.39Å; Y389-L393 PolarHBondContact O-N 2.96Å
390	E	84.1	Confident	82.8	Confident	50 Å²	50	45.6 Å²	45.6	23%	0.234	23%	0.228	C	C	.	.	H	α-helix	trans	-67.2	-29.4	175.2	-70.8	-179	-169.3	0	0	112.7	R386 K394	R386-E390 HydrophobicContact CG-CG 4.41Å; R386-E390 IonicContact CZ-OE1 3.86Å; R386-E390 IonicContact NE-OE1 2.72Å; R386-E390 PolarHBondContact NE-OE1 3.05Å; R386-E390 IonicContact NH2-OE1 3.03Å; R386-E390 PolarHBondContact NH2-OE1 2.94Å; R386-E390 WeakPolarHBondContact O-CG 3.35Å; R386-E390 PolarHBondContact O-N 3.17Å; E390-K394 WeakPolarHBondContact O-CB 3.3Å; E390-K394 WeakPolarHBondContact O-CD 3.42Å; E390-K394 VanDerWaalsContact O-CG 3.23Å; E390-K394 WeakPolarHBondContact O-CG 3.43Å; E390-K394 PolarHBondContact O-N 2.93Å; E390-K394 VanDerWaalsContact O-N 3.11Å
391	K	87.6	Confident	82.2	Confident	63 Å²	63	45.1 Å²	45.1	27%	0.274	23%	0.227	S	C	.	.	H	α-helix	trans	-72.6	-36.8	170.8	-77.1	170.3	-175.7	177.8	0	112.4	T387 V388 Y389 K394 L395 F616 H620	T387-K391 WeakPolarHBondContact O-CB 3.47Å; T387-K391 WeakPolarHBondContact O-CG 3.27Å; T387-K391 PolarHBondContact O-N 3.14Å; V388-K391 PolarHBondContact O-N 3.45Å; Y389-K391 VanDerWaalsContact C-N 3.31Å; Y389-K391 PolarHBondContact O-N 3.22Å; K391-K394 PolarHBondContact O-N 3.23Å; K391-L395 PolarHBondContact O-N 2.9Å; K391-F616 HydrophobicContact CB-CD2 3.94Å; K391-F616 HydrophobicContact CB-CE2 3.68Å; K391-F616 HydrophobicContact CD-CD2 4.45Å; K391-F616 HydrophobicContact CD-CE2 4.45Å; K391-H620 WeakPolarHBondContact CD-NE2 3.35Å; K391-H620 PolarHBondContact NZ-NE2 2.9Å
392	L	87	Confident	82	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.1	-44.6	171.7	-76.3	176.4	0	0	0	111.8	Y148 F163 A173 V388 Y389 K394 L395 D396 F616	Y148-L392 HydrophobicContact CE1-CB 4Å; F163-L392 HydrophobicContact CE1-CD1 4.12Å; F163-L392 HydrophobicContact CE1-CD2 4.22Å; F163-L392 HydrophobicContact CZ-CD1 4.09Å; A173-L392 HydrophobicContact CB-CD2 4.33Å; V388-L392 PolarHBondContact O-N 3.43Å; Y389-L392 PolarHBondContact O-N 3.39Å; L392-K394 VanDerWaalsContact C-N 3.33Å; L392-K394 PolarHBondContact O-N 3.28Å; L392-L395 WeakPolarHBondContact O-CA 3.4Å; L392-L395 VanDerWaalsContact O-CB 3.26Å; L392-L395 WeakPolarHBondContact O-CB 3.42Å; L392-L395 PolarHBondContact O-N 3.11Å; L392-D396 PolarHBondContact O-N 3.08Å; L392-D396 VanDerWaalsContact O-N 3.11Å; L392-F616 HydrophobicContact CD1-CZ 4.33Å; L392-F616 HydrophobicContact CD2-CD1 4.28Å; L392-F616 HydrophobicContact CD2-CE1 3.46Å; L392-F616 VanDerWaalsContact CD2-CE1 3.46Å; L392-F616 HydrophobicContact CD2-CE2 4.27Å; L392-F616 HydrophobicContact CD2-CZ 3.46Å; L392-F616 VanDerWaalsContact CD2-CZ 3.46Å; L392-F616 HydrophobicContact CG-CE1 4.09Å; L392-F616 HydrophobicContact CG-CE2 4.21Å; L392-F616 HydrophobicContact CG-CZ 3.55Å
393	L	83.9	Confident	82.3	Confident	26 Å²	26	49 Å²	49	14%	0.136	25%	0.246	C	C	.	.	H	α-helix	trans	-58.4	-47.5	175.7	-171.1	73.9	0	0	0	110.3	A145 Y148 R149 Y389 L395 D396 E397	A145-L393 HydrophobicContact CB-CD1 3.92Å; Y148-L393 HydrophobicContact CD1-CB 4.23Å; Y148-L393 HydrophobicContact CD1-CD1 3.92Å; Y148-L393 HydrophobicContact CE1-CB 4.34Å; R149-L393 HydrophobicContact CB-CD1 4.09Å; Y389-L393 PolarHBondContact O-N 2.96Å; L393-L395 PolarHBondContact O-N 2.99Å; L393-D396 PolarHBondContact O-N 2.99Å; L393-D396 VanDerWaalsContact O-N 3.15Å; L393-E397 HydrophobicContact CG-CG 4.34Å; L393-E397 WeakPolarHBondContact CG-OE1 3.42Å; L393-E397 WeakPolarHBondContact O-CB 3.38Å; L393-E397 VanDerWaalsContact O-CG 3.27Å; L393-E397 WeakPolarHBondContact O-CG 3.15Å; L393-E397 PolarHBondContact O-N 2.99Å
394	K	83.9	Confident	82.7	Confident	100 Å²	100	46.6 Å²	46.6	44%	0.435	23%	0.231	S	C	.	.	H	α-helix	trans	-60.2	-28.2	173.9	-75.1	163.8	-174.1	154.2	0	114	E390 K391 L392 M398	E390-K394 WeakPolarHBondContact O-CB 3.3Å; E390-K394 WeakPolarHBondContact O-CD 3.42Å; E390-K394 VanDerWaalsContact O-CG 3.23Å; E390-K394 WeakPolarHBondContact O-CG 3.43Å; E390-K394 PolarHBondContact O-N 2.93Å; E390-K394 VanDerWaalsContact O-N 3.11Å; K391-K394 PolarHBondContact O-N 3.23Å; L392-K394 VanDerWaalsContact C-N 3.33Å; L392-K394 PolarHBondContact O-N 3.28Å; K394-M398 WeakPolarHBondContact O-CG 3.31Å; K394-M398 PolarHBondContact O-N 3.38Å
395	L	85.4	Confident	83.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-70.3	-41.7	175.7	-165.4	148.5	0	0	0	111.4	R242 K391 L392 L393 M398 R609 Y612 L613	R242-L395 HydrophobicContact CG-CD2 4.39Å; K391-L395 PolarHBondContact O-N 2.9Å; L392-L395 WeakPolarHBondContact O-CA 3.4Å; L392-L395 VanDerWaalsContact O-CB 3.26Å; L392-L395 WeakPolarHBondContact O-CB 3.42Å; L392-L395 PolarHBondContact O-N 3.11Å; L393-L395 PolarHBondContact O-N 2.99Å; L395-M398 WeakPolarHBondContact O-CB 3.18Å; L395-M398 WeakPolarHBondContact O-CG 3.43Å; L395-R609 PolarHBondContact O-NH1 2.91Å; L395-Y612 HydrophobicContact CB-CD1 4.11Å; L395-Y612 HydrophobicContact CB-CE1 3.81Å; L395-Y612 HydrophobicContact CD1-CD1 3.7Å; L395-Y612 HydrophobicContact CD1-CE1 3.98Å; L395-Y612 HydrophobicContact CG-CD1 3.82Å; L395-Y612 HydrophobicContact CG-CE1 4.04Å; L395-L613 HydrophobicContact CD1-CB 4.03Å; L395-L613 HydrophobicContact CD1-CD1 3.76Å
396	D	81.4	Confident	84.3	Confident	11 Å²	11	42.7 Å²	42.7	6%	0.059	20%	0.202	C	C	.	.	H	α-helix	trans	-78.5	-31.4	178.8	-62	-33.5	0	0	0	111.7	A145 R242 L392 L393 M398 R609	A145-D396 HydrophobicContact CB-CB 3.58Å; R242-D396 IonicContact CZ-OD2 2.66Å; R242-D396 VanDerWaalsContact NE-CG 3.34Å; R242-D396 IonicContact NE-OD1 2.98Å; R242-D396 PolarHBondContact NE-OD1 3Å; R242-D396 VanDerWaalsContact NE-OD1 3.12Å; R242-D396 IonicContact NE-OD2 2.83Å; R242-D396 PolarHBondContact NE-OD2 3.3Å; R242-D396 IonicContact NH2-OD2 3.36Å; R242-D396 PolarHBondContact NH2-OD2 3.26Å; L392-D396 PolarHBondContact O-N 3.08Å; L392-D396 VanDerWaalsContact O-N 3.11Å; L393-D396 PolarHBondContact O-N 2.99Å; L393-D396 VanDerWaalsContact O-N 3.15Å; D396-M398 PolarHBondContact O-N 3.5Å; D396-R609 IonicContact OD1-NH2 3.52Å; D396-R609 PolarHBondContact OD1-NH2 3.33Å
397	E	79.4	Confident	85.1	Confident	64 Å²	64	35.8 Å²	35.8	30%	0.299	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-71.9	-8.5	173.5	-69.3	176.1	167.9	0	0	114	A145 R149 L393 E399 L400	A145-E397 HydrophobicContact CB-CG 3.8Å; R149-E397 IonicContact CZ-OE1 3.72Å; R149-E397 IonicContact NE-OE1 3.04Å; R149-E397 IonicContact NH2-OE1 3.47Å; R149-E397 PolarHBondContact NH2-OE1 3.33Å; L393-E397 HydrophobicContact CG-CG 4.34Å; L393-E397 WeakPolarHBondContact CG-OE1 3.42Å; L393-E397 WeakPolarHBondContact O-CB 3.38Å; L393-E397 VanDerWaalsContact O-CG 3.27Å; L393-E397 WeakPolarHBondContact O-CG 3.15Å; L393-E397 PolarHBondContact O-N 2.99Å; E397-E399 PolarHBondContact O-N 3.24Å; E397-L400 HydrophobicContact CB-CD1 4.08Å; E397-L400 HydrophobicContact CG-CD1 3.91Å; E397-L400 WeakPolarHBondContact O-CB 3.4Å; E397-L400 PolarHBondContact O-N 3.46Å
398	M	76.2	Confident	85.7	Confident	46 Å²	46	32.5 Å²	32.5	23%	0.227	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-57.9	-20.6	-176.8	-70.8	-171.4	71.7	0	0	115.1	K394 L395 D396 M605 Y612	K394-M398 WeakPolarHBondContact O-CG 3.31Å; K394-M398 PolarHBondContact O-N 3.38Å; L395-M398 WeakPolarHBondContact O-CB 3.18Å; L395-M398 WeakPolarHBondContact O-CG 3.43Å; D396-M398 PolarHBondContact O-N 3.5Å; M398-M605 VanDerWaalsContact O-CE 3.31Å; M398-M605 WeakPolarHBondContact O-CE 3.38Å; M398-Y612 HydrophobicContact SD-CD1 3.75Å; M398-Y612 HydrophobicContact SD-CE1 4.47Å; M398-Y612 HydrophobicContact SD-CG 4.28Å
399	E	69.7	Low	86.2	Confident	38 Å²	38	32.4 Å²	32.4	18%	0.178	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-96.7	-3.9	-179.4	-68	171.9	-170.3	0	0	113.2	Y140 R250 E397	Y140-E399 PolarHBondContact OH-OE2 3.09Å; R250-E399 IonicContact CZ-OE2 2.67Å; R250-E399 VanDerWaalsContact CZ-OE2 3.23Å; R250-E399 IonicContact NH1-OE2 3.94Å; R250-E399 PolarHBondContact NH1-OE2 3.38Å; R250-E399 VanDerWaalsContact NH2-CD 3.26Å; R250-E399 IonicContact NH2-OE1 2.69Å; R250-E399 PolarHBondContact NH2-OE1 3.29Å; R250-E399 IonicContact NH2-OE2 2.72Å; R250-E399 PolarHBondContact NH2-OE2 2.93Å; E397-E399 PolarHBondContact O-N 3.24Å
400	L	73.9	Confident	86.8	Confident	26 Å²	26	31.8 Å²	31.8	14%	0.136	15%	0.153	C	C	.	.			trans	-86.3	127.5	-177.9	-53.6	-179.3	0	0	0	111.1	D142 E397	D142-L400 HydrophobicContact CB-CD1 3.76Å; D142-L400 HydrophobicContact CB-CD2 3.74Å; D142-L400 HydrophobicContact CB-CG 4.4Å; E397-L400 HydrophobicContact CB-CD1 4.08Å; E397-L400 HydrophobicContact CG-CD1 3.91Å; E397-L400 WeakPolarHBondContact O-CB 3.4Å; E397-L400 PolarHBondContact O-N 3.46Å
401	L	76.8	Confident	87.3	Confident	48 Å²	48	29.4 Å²	29.4	25%	0.251	14%	0.142	S	C	.	.			trans	-102.8	102.9	175.8	-59	-179.4	0	0	0	108.7	H404 A592 Y593 L596	L401-H404 VanDerWaalsContact CB-CE1 3.5Å; L401-H404 WeakPolarHBondContact CB-CE1 3.06Å; L401-H404 PolarHBondContact O-NE2 2.94Å; L401-A592 HydrophobicContact CD1-CB 4.09Å; L401-Y593 HydrophobicContact CB-CE1 4.12Å; L401-Y593 HydrophobicContact CG-CE1 4.17Å; L401-Y593 PolarHBondContact N-OH 3.37Å; L401-Y593 PolarHBondContact O-OH 2.97Å; L401-L596 HydrophobicContact CD1-CD1 3.98Å; L401-L596 HydrophobicContact CD1-CD2 4.4Å; L401-L596 HydrophobicContact CD1-CG 4.23Å; L401-L596 HydrophobicContact CG-CD1 4.16Å
402	N	83.3	Confident	87.6	Confident	64 Å²	64	29.7 Å²	29.7	34%	0.342	14%	0.141	S	C	.	.			trans	-93.4	-20.1	177.5	-55.9	-3.1	0	0	0	111.7	R54 T473 N474	R54-N402 VanDerWaalsContact NH1-CG 3.25Å; R54-N402 PolarHBondContact NH1-OD1 3Å; R54-N402 PolarHBondContact NH2-OD1 3.36Å; N402-T473 CarbonylContact O-C 3.52Å; N402-T473 WeakPolarHBondContact O-CA 3.34Å; N402-N474 PolarHBondContact O-N 2.85Å
403	N	92	Very high	87.7	Confident	62 Å²	62	34.5 Å²	34.5	33%	0.332	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	109.4	-172	-65.5	-18.7	0	0	0	108.3	Y450 N474	N403-Y450 HydrophobicContact CB-CD1 3.86Å; N403-Y450 HydrophobicContact CB-CD2 3.84Å; N403-Y450 HydrophobicContact CB-CE1 3.74Å; N403-Y450 HydrophobicContact CB-CE2 3.75Å; N403-Y450 HydrophobicContact CB-CG 3.89Å; N403-N474 CarbonylContact C-O 3.56Å; N403-N474 WeakPolarHBondContact CA-O 3.48Å; N403-N474 PolarHBondContact OD1-ND2 2.81Å
404	H	94.2	Very high	87.8	Confident	6 Å²	6	39.4 Å²	39.4	3%	0.028	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	143.1	-178.7	-64.6	-90.4	0	0	0	111.1	L401 F406 Y450 N474 I475 V476	L401-H404 VanDerWaalsContact CB-CE1 3.5Å; L401-H404 WeakPolarHBondContact CB-CE1 3.06Å; L401-H404 PolarHBondContact O-NE2 2.94Å; H404-F406 HydrophobicContact CB-CE1 3.99Å; H404-F406 HydrophobicContact CB-CE2 3.92Å; H404-F406 HydrophobicContact CB-CZ 3.57Å; H404-F406 AromaticContact CG-CZ 3.89Å; H404-F406 AromaticContact ND1-CZ 3.96Å; H404-Y450 WeakPolarHBondContact O-CE1 3.34Å; H404-N474 PolarHBondContact N-O 3.42Å; H404-I475 HydrophobicContact CB-CG1 4.42Å; H404-I475 WeakPolarHBondContact O-CA 3.38Å; H404-V476 PolarHBondContact O-N 2.75Å
405	K	96.2	Very high	88.2	Confident	62 Å²	62	35.9 Å²	35.9	27%	0.27	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119.6	170.6	65.7	-179.5	-170.2	137.2	0	109.4	Y450 G452 V476 L478 N501 S502	K405-Y450 HydrophobicContact CB-CE1 4.43Å; K405-G452 VanDerWaalsContact CD-O 3.23Å; K405-G452 WeakPolarHBondContact CD-O 3.47Å; K405-V476 VanDerWaalsContact CA-O 3.28Å; K405-V476 WeakPolarHBondContact CA-O 3.34Å; K405-V476 HydrophobicContact CB-CG1 3.9Å; K405-L478 HydrophobicContact CB-CD1 4.29Å; K405-L478 HydrophobicContact CD-CD1 4.29Å; K405-L478 HydrophobicContact CG-CD1 4.38Å; K405-N501 VanDerWaalsContact CE-O 3.29Å; K405-N501 WeakPolarHBondContact CE-O 3.43Å; K405-N501 PolarHBondContact NZ-O 3.44Å; K405-S502 PolarHBondContact O-OG 3.49Å
406	F	98.1	Very high	88.2	Confident	2 Å²	2	38 Å²	38	1%	0.009	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.1	-175.9	-61.1	-45	0	0	0	110.6	H404 I475 V476 F477 L478 V504 F506 A588 I589 A592	H404-F406 HydrophobicContact CB-CE1 3.99Å; H404-F406 HydrophobicContact CB-CE2 3.92Å; H404-F406 HydrophobicContact CB-CZ 3.57Å; H404-F406 AromaticContact CG-CZ 3.89Å; H404-F406 AromaticContact ND1-CZ 3.96Å; F406-I475 HydrophobicContact CD2-CG2 3.54Å; F406-I475 HydrophobicContact CE2-CD1 4.31Å; F406-I475 HydrophobicContact CE2-CG2 3.72Å; F406-V476 PolarHBondContact N-O 3.4Å; F406-F477 HydrophobicContact CB-CD1 4.05Å; F406-F477 HydrophobicContact CB-CE1 4.16Å; F406-F477 HydrophobicContact CD2-CE1 4.03Å; F406-F477 CarbonylContact O-C 3.6Å; F406-F477 WeakPolarHBondContact O-CA 3.19Å; F406-L478 PolarHBondContact O-N 2.93Å; F406-V504 HydrophobicContact CD1-CB 3.84Å; F406-V504 HydrophobicContact CD1-CG1 4.38Å; F406-V504 HydrophobicContact CE1-CB 4.05Å; F406-V504 HydrophobicContact CE1-CG2 4.27Å; F406-F506 HydrophobicContact CB-CD2 4.15Å; F406-F506 HydrophobicContact CB-CE2 4.1Å; F406-F506 HydrophobicContact CD2-CE2 4.12Å; F406-F506 HydrophobicContact CG-CE2 4.24Å; F406-A588 HydrophobicContact CD1-CB 4.48Å; F406-A588 HydrophobicContact CD2-CB 4.11Å; F406-A588 HydrophobicContact CE1-CB 4.04Å; F406-A588 WeakPolarHBondContact CE1-O 3.33Å; F406-A588 HydrophobicContact CE2-CB 3.62Å; F406-A588 HydrophobicContact CZ-CB 3.58Å; F406-A588 WeakPolarHBondContact CZ-O 3.16Å; F406-I589 HydrophobicContact CZ-CG1 4.34Å; F406-A592 HydrophobicContact CE1-CB 4.37Å
407	G	98	Very high	88.5	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	144.4	170.9	0	0	0	0	0	110.4	V504 T505 F506	G407-V504 PolarHBondContact N-O 3.41Å; G407-V504 VanDerWaalsContact N-O 3.08Å; G407-T505 CarbonylContact O-C 3.54Å; G407-T505 WeakPolarHBondContact O-CA 3.39Å; G407-F506 PolarHBondContact O-N 3.26Å
408	V	98.1	Very high	89.1	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	117	167.3	-165.8	0	0	0	0	109.1	F431 L435 F477 L478 V479 S480 F506	V408-F431 HydrophobicContact CG1-CE2 3.62Å; V408-F431 HydrophobicContact CG1-CZ 3.73Å; V408-L435 HydrophobicContact CG1-CD2 4.2Å; V408-L435 HydrophobicContact CG2-CD2 4.47Å; V408-F477 HydrophobicContact CG2-CB 3.97Å; V408-F477 HydrophobicContact CG2-CD1 3.7Å; V408-F477 HydrophobicContact CG2-CG 4.22Å; V408-L478 PolarHBondContact N-O 2.9Å; V408-V479 HydrophobicContact CB-CG2 4.35Å; V408-V479 HydrophobicContact CG2-CG2 4.32Å; V408-S480 PolarHBondContact O-N 2.82Å; V408-F506 WeakPolarHBondContact CA-O 3.39Å; V408-F506 HydrophobicContact CG1-CB 4.16Å; V408-F506 HydrophobicContact CG2-CB 4.36Å
409	L	96.6	Very high	89.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	143.4	171.3	-65.2	177.1	0	0	0	109.8	M421 Y422 I499 T505 F506 I507 F508 I521	L409-M421 HydrophobicContact CB-SD 4.43Å; L409-M421 HydrophobicContact CD1-SD 4.36Å; L409-Y422 HydrophobicContact CD2-CD1 4.05Å; L409-Y422 HydrophobicContact CD2-CD2 4.48Å; L409-Y422 HydrophobicContact CD2-CE1 3.91Å; L409-Y422 HydrophobicContact CD2-CE2 4.33Å; L409-Y422 HydrophobicContact CD2-CG 4.35Å; L409-I499 HydrophobicContact CD2-CD1 3.82Å; L409-I499 HydrophobicContact CD2-CG2 4.1Å; L409-I499 HydrophobicContact CG-CG2 4.24Å; L409-T505 HydrophobicContact CD1-CG2 4.26Å; L409-T505 HydrophobicContact CG-CG2 4.15Å; L409-F506 PolarHBondContact N-O 2.71Å; L409-I507 HydrophobicContact CB-CG1 4.45Å; L409-I507 WeakPolarHBondContact O-CA 3.44Å; L409-F508 PolarHBondContact O-N 2.95Å; L409-I521 HydrophobicContact CD1-CD1 3.94Å
410	L	96.3	Very high	90.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	127.6	164.8	174	58.6	0	0	0	108	R412 M421 N424 F431 T481 F508 E510	L410-R412 HydrophobicContact CD1-CG 4.39Å; L410-R412 HydrophobicContact CD2-CG 3.95Å; L410-R412 HydrophobicContact CG-CG 3.86Å; L410-M421 WeakPolarHBondContact O-CG 3.43Å; L410-N424 PolarHBondContact O-ND2 3.14Å; L410-F431 HydrophobicContact CB-CD1 4.28Å; L410-F431 HydrophobicContact CB-CE1 4.05Å; L410-F431 HydrophobicContact CB-CE2 4.42Å; L410-F431 HydrophobicContact CB-CZ 4.11Å; L410-F431 HydrophobicContact CD1-CB 4.19Å; L410-F431 HydrophobicContact CD1-CD1 4.44Å; L410-F431 HydrophobicContact CD1-CD2 4.27Å; L410-F431 HydrophobicContact CD1-CG 4.07Å; L410-F431 HydrophobicContact CD2-CD1 4.1Å; L410-F431 HydrophobicContact CD2-CG 4.48Å; L410-T481 HydrophobicContact CD2-CG2 4.29Å; L410-F508 HydrophobicContact CD1-CD1 3.63Å; L410-F508 HydrophobicContact CD1-CE1 4.38Å; L410-E510 HydrophobicContact CD1-CG 4.35Å
411	C	95.1	Very high	91.8	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	105.7	169.3	-168.6	0	0	0	0	108.5	M421 I507 F508 V509 E510	C411-M421 HydrophobicContact CB-CG 3.97Å; C411-M421 HydrophobicContact CB-SD 3.68Å; C411-I507 HydrophobicContact CB-CG2 4.03Å; C411-F508 WeakPolarHBondContact CB-O 3.32Å; C411-F508 PolarHBondContact N-O 2.98Å; C411-V509 HydrophobicContact CB-CG2 4.48Å; C411-E510 PolarHBondContact O-N 2.98Å
412	R	93.9	Very high	92.7	Very high	68 Å²	68	38.3 Å²	38.3	26%	0.257	19%	0.19	S	C	.	.			trans	-82	170.9	-177.2	-61	-179.7	174.9	160.3	-21.1	112.2	L410 N414 Q415 N424 H426 E510 A513	L410-R412 HydrophobicContact CD1-CG 4.39Å; L410-R412 HydrophobicContact CD2-CG 3.95Å; L410-R412 HydrophobicContact CG-CG 3.86Å; R412-N414 PolarHBondContact O-N 3.45Å; R412-Q415 HydrophobicContact CB-CG 4.17Å; R412-Q415 WeakPolarHBondContact O-CB 3.23Å; R412-Q415 PolarHBondContact O-N 3.48Å; R412-Q415 VanDerWaalsContact O-N 3.08Å; R412-N424 VanDerWaalsContact CD-OD1 3.27Å; R412-N424 WeakPolarHBondContact CD-OD1 3.25Å; R412-N424 VanDerWaalsContact CZ-OD1 3.31Å; R412-N424 PolarHBondContact NE-OD1 3.25Å; R412-N424 PolarHBondContact NH1-OD1 3.02Å; R412-H426 PolarHBondContact NH2-O 3.27Å; R412-E510 WeakPolarHBondContact CA-OE2 3.2Å; R412-E510 WeakPolarHBondContact CB-OE2 3.43Å; R412-A513 WeakPolarHBondContact O-CB 3.28Å
413	K	89.3	Confident	93.3	Very high	101 Å²	101	36.9 Å²	36.9	44%	0.439	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-43	137.5	165.4	-51.6	-166.4	179.9	-152.7	0	111.2	Q415 E510 D512	K413-Q415 PolarHBondContact O-N 3.25Å; K413-Q415 VanDerWaalsContact O-N 3.12Å; K413-E510 HydrophobicContact CG-CB 4.37Å; K413-E510 PolarHBondContact N-OE2 3.49Å; K413-D512 HydrophobicContact CB-CB 4.25Å; K413-D512 HydrophobicContact CD-CB 4Å; K413-D512 VanDerWaalsContact CD-OD2 3.31Å; K413-D512 WeakPolarHBondContact CD-OD2 3.5Å; K413-D512 WeakPolarHBondContact CE-OD2 3.33Å; K413-D512 HydrophobicContact CG-CB 3.98Å; K413-D512 IonicContact NZ-OD2 3.8Å; K413-D512 PolarHBondContact NZ-OD2 3.39Å
414	N	86.2	Confident	93.5	Very high	130 Å²	130	34 Å²	34	70%	0.695	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.7	-3.3	-177.2	-52.6	-32.7	0	0	0	117.6	R412 D512	R412-N414 PolarHBondContact O-N 3.45Å; N414-D512 PolarHBondContact N-O 2.94Å
415	Q	91.5	Very high	93.4	Very high	26 Å²	26	38.1 Å²	38.1	12%	0.121	19%	0.187	C	C	.	.			trans	-86.5	151	178.1	-60.6	-174.2	-32.2	0	0	112.2	R412 K413 E420 N424 M514	R412-Q415 HydrophobicContact CB-CG 4.17Å; R412-Q415 WeakPolarHBondContact O-CB 3.23Å; R412-Q415 PolarHBondContact O-N 3.48Å; R412-Q415 VanDerWaalsContact O-N 3.08Å; K413-Q415 PolarHBondContact O-N 3.25Å; K413-Q415 VanDerWaalsContact O-N 3.12Å; Q415-E420 HydrophobicContact CB-CB 4.02Å; Q415-E420 HydrophobicContact CG-CB 3.9Å; Q415-E420 PolarHBondContact NE2-O 3.19Å; Q415-N424 PolarHBondContact NE2-OD1 3.32Å; Q415-N424 PolarHBondContact OE1-ND2 3.14Å; Q415-N424 PolarHBondContact OE1-OD1 3.12Å; Q415-M514 PolarHBondContact O-N 3.01Å
416	S	85.8	Confident	93.3	Very high	43 Å²	43	41.2 Å²	41.2	30%	0.301	20%	0.202	S	C	.	.			trans	-148.3	-24.6	176.7	63.7	0	0	0	0	115	E420	S416-E420 PolarHBondContact N-OE2 3.01Å
417	T	87.9	Confident	93.1	Very high	53 Å²	53	42.6 Å²	42.6	33%	0.325	21%	0.211	S	C	.	.	S	Bend	trans	-94.1	162.4	-171.4	67.7	0	0	0	0	113.1	E419 E420 M421	T417-E419 VanDerWaalsContact C-N 3.29Å; T417-E419 PolarHBondContact O-N 3.21Å; T417-E420 WeakPolarHBondContact CB-OE2 3.38Å; T417-E420 WeakPolarHBondContact CG2-OE2 3.47Å; T417-E420 PolarHBondContact N-OE2 3.34Å; T417-E420 VanDerWaalsContact OG1-CG 3.22Å; T417-E420 WeakPolarHBondContact OG1-CG 3.39Å; T417-E420 PolarHBondContact OG1-N 2.94Å; T417-E420 PolarHBondContact OG1-OE2 3.44Å; T417-M421 WeakPolarHBondContact O-CE 3.47Å; T417-M421 PolarHBondContact O-N 2.95Å
418	E	91.6	Very high	93	Very high	17 Å²	17	44 Å²	44	8%	0.079	22%	0.22	C	C	.	.	H	α-helix	trans	-57.4	-43.4	171.3	-177.8	170	-162.2	0	0	111.8	Y422 K496 T520 I521 I522	E418-Y422 HydrophobicContact CG-CD2 3.55Å; E418-Y422 HydrophobicContact CG-CE2 3.59Å; E418-Y422 VanDerWaalsContact O-CD2 3.28Å; E418-Y422 WeakPolarHBondContact O-CD2 3.48Å; E418-Y422 PolarHBondContact O-N 2.92Å; E418-Y422 VanDerWaalsContact O-N 3.16Å; E418-Y422 WeakPolarHBondContact OE1-CE2 3.34Å; E418-K496 WeakPolarHBondContact OE1-CD 3.23Å; E418-K496 WeakPolarHBondContact OE1-CE 3.44Å; E418-K496 IonicContact OE1-NZ 2.88Å; E418-K496 PolarHBondContact OE1-NZ 3.29Å; E418-K496 IonicContact OE2-NZ 3.58Å; E418-K496 PolarHBondContact OE2-NZ 3.01Å; E418-T520 WeakPolarHBondContact CB-O 3.45Å; E418-I521 HydrophobicContact CB-CD1 3.87Å; E418-I521 HydrophobicContact CG-CD1 3.81Å; E418-I522 PolarHBondContact OE2-N 2.95Å
419	E	91.4	Very high	92.7	Very high	98 Å²	98	48.8 Å²	48.8	46%	0.458	25%	0.251	S	S	.	.	H	α-helix	trans	-63	-51	-175.1	-170	167.2	131.3	0	0	111.8	T417 M421 Y422 N423 T490	T417-E419 VanDerWaalsContact C-N 3.29Å; T417-E419 PolarHBondContact O-N 3.21Å; E419-M421 PolarHBondContact O-N 3.47Å; E419-Y422 PolarHBondContact O-N 3.22Å; E419-N423 PolarHBondContact O-N 3.2Å; E419-N423 PolarHBondContact O-ND2 3.47Å; E419-T490 VanDerWaalsContact OE1-CB 3.28Å; E419-T490 WeakPolarHBondContact OE1-CB 3.4Å; E419-T490 WeakPolarHBondContact OE1-CG2 3.46Å
420	E	92.8	Very high	92.6	Very high	71 Å²	71	50.5 Å²	50.5	33%	0.332	26%	0.259	S	S	.	.	H	α-helix	trans	-56.6	-47.4	179.6	-68	159.6	143.3	0	0	112.1	Q415 S416 T417 Y422 N423	Q415-E420 HydrophobicContact CB-CB 4.02Å; Q415-E420 HydrophobicContact CG-CB 3.9Å; Q415-E420 PolarHBondContact NE2-O 3.19Å; S416-E420 PolarHBondContact N-OE2 3.01Å; T417-E420 WeakPolarHBondContact CB-OE2 3.38Å; T417-E420 WeakPolarHBondContact CG2-OE2 3.47Å; T417-E420 PolarHBondContact N-OE2 3.34Å; T417-E420 VanDerWaalsContact OG1-CG 3.22Å; T417-E420 WeakPolarHBondContact OG1-CG 3.39Å; T417-E420 PolarHBondContact OG1-N 2.94Å; T417-E420 PolarHBondContact OG1-OE2 3.44Å; E420-Y422 PolarHBondContact O-N 2.98Å; E420-N423 PolarHBondContact O-N 3.08Å
421	M	93.9	Very high	92.6	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.2	-37.1	-179.4	-71.8	-171.8	-80.9	0	0	113.2	L409 L410 C411 T417 E419 N424 I507 F516 I521	L409-M421 HydrophobicContact CB-SD 4.43Å; L409-M421 HydrophobicContact CD1-SD 4.36Å; L410-M421 WeakPolarHBondContact O-CG 3.43Å; C411-M421 HydrophobicContact CB-CG 3.97Å; C411-M421 HydrophobicContact CB-SD 3.68Å; T417-M421 WeakPolarHBondContact O-CE 3.47Å; T417-M421 PolarHBondContact O-N 2.95Å; E419-M421 PolarHBondContact O-N 3.47Å; M421-N424 PolarHBondContact O-ND2 3.46Å; M421-I507 HydrophobicContact SD-CG2 4.1Å; M421-F516 HydrophobicContact CE-CD2 3.77Å; M421-F516 HydrophobicContact CE-CE2 3.67Å; M421-F516 HydrophobicContact SD-CD2 4.44Å; M421-I521 HydrophobicContact CE-CD1 3.88Å
422	Y	95.3	Very high	92.6	Very high	1 Å²	1	53.3 Å²	53.3	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-74.1	-27.9	177.2	-89.1	-69.9	0	0	0	113.2	L409 E418 E419 E420 N424 R495 K496 I499 G500	L409-Y422 HydrophobicContact CD2-CD1 4.05Å; L409-Y422 HydrophobicContact CD2-CD2 4.48Å; L409-Y422 HydrophobicContact CD2-CE1 3.91Å; L409-Y422 HydrophobicContact CD2-CE2 4.33Å; L409-Y422 HydrophobicContact CD2-CG 4.35Å; E418-Y422 HydrophobicContact CG-CD2 3.55Å; E418-Y422 HydrophobicContact CG-CE2 3.59Å; E418-Y422 VanDerWaalsContact O-CD2 3.28Å; E418-Y422 WeakPolarHBondContact O-CD2 3.48Å; E418-Y422 PolarHBondContact O-N 2.92Å; E418-Y422 VanDerWaalsContact O-N 3.16Å; E418-Y422 WeakPolarHBondContact OE1-CE2 3.34Å; E419-Y422 PolarHBondContact O-N 3.22Å; E420-Y422 PolarHBondContact O-N 2.98Å; Y422-N424 VanDerWaalsContact C-N 3.28Å; Y422-N424 PolarHBondContact O-N 3.41Å; Y422-R495 HydrophobicContact CD1-CB 3.69Å; Y422-R495 HydrophobicContact CE1-CB 4.07Å; Y422-R495 WeakPolarHBondContact O-CD 3.34Å; Y422-R495 PolarHBondContact O-NH1 3.35Å; Y422-K496 HydrophobicContact CD1-CB 4.41Å; Y422-K496 HydrophobicContact CE1-CB 3.93Å; Y422-K496 HydrophobicContact CE2-CB 4.25Å; Y422-K496 HydrophobicContact CE2-CD 4.24Å; Y422-K496 HydrophobicContact CE2-CG 4.22Å; Y422-I499 HydrophobicContact CE1-CB 3.87Å; Y422-I499 HydrophobicContact CE1-CD1 3.95Å; Y422-I499 HydrophobicContact CE1-CG1 4.28Å; Y422-I499 HydrophobicContact CE1-CG2 4.26Å; Y422-I499 WeakPolarHBondContact OH-CB 3.17Å; Y422-I499 WeakPolarHBondContact OH-CG2 3.48Å; Y422-G500 PolarHBondContact OH-N 3.35Å
423	N	95.3	Very high	92.7	Very high	35 Å²	35	53.2 Å²	53.2	19%	0.187	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-1	178.3	-75.5	-79	0	0	0	114.1	E419 E420 E425 Y485 T490 Q492	E419-N423 PolarHBondContact O-N 3.2Å; E419-N423 PolarHBondContact O-ND2 3.47Å; E420-N423 PolarHBondContact O-N 3.08Å; N423-E425 PolarHBondContact O-N 2.84Å; N423-Y485 HydrophobicContact CB-CE2 4.21Å; N423-Y485 WeakPolarHBondContact O-CE2 3.3Å; N423-T490 PolarHBondContact ND2-O 2.67Å; N423-Q492 VanDerWaalsContact OD1-CG 3.29Å; N423-Q492 WeakPolarHBondContact OD1-CG 3.26Å; N423-Q492 PolarHBondContact OD1-NE2 3.17Å
424	N	95.4	Very high	93	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.011	25%	0.254	C	S	.	.			trans	-64.2	104.3	176.6	-76.1	-34.5	0	0	0	112.8	L410 R412 Q415 M421 Y422 R495	L410-N424 PolarHBondContact O-ND2 3.14Å; R412-N424 VanDerWaalsContact CD-OD1 3.27Å; R412-N424 WeakPolarHBondContact CD-OD1 3.25Å; R412-N424 VanDerWaalsContact CZ-OD1 3.31Å; R412-N424 PolarHBondContact NE-OD1 3.25Å; R412-N424 PolarHBondContact NH1-OD1 3.02Å; Q415-N424 PolarHBondContact NE2-OD1 3.32Å; Q415-N424 PolarHBondContact OE1-ND2 3.14Å; Q415-N424 PolarHBondContact OE1-OD1 3.12Å; M421-N424 PolarHBondContact O-ND2 3.46Å; Y422-N424 VanDerWaalsContact C-N 3.28Å; Y422-N424 PolarHBondContact O-N 3.41Å; N424-R495 PolarHBondContact O-NH1 3.48Å
425	E	93.5	Very high	93.6	Very high	92 Å²	92	42.2 Å²	42.2	43%	0.43	22%	0.221	S	C	.	.			trans	-70.9	-33.3	-176.5	-63.4	-163.5	-126.6	0	0	114.5	N423 Y485	N423-E425 PolarHBondContact O-N 2.84Å; E425-Y485 HydrophobicContact CG-CD1 3.58Å; E425-Y485 HydrophobicContact CG-CD2 3.94Å; E425-Y485 HydrophobicContact CG-CE1 3.53Å; E425-Y485 HydrophobicContact CG-CE2 3.9Å; E425-Y485 HydrophobicContact CG-CG 3.79Å; E425-Y485 WeakPolarHBondContact OE1-CE1 3.29Å; E425-Y485 WeakPolarHBondContact OE2-CD1 3.25Å; E425-Y485 WeakPolarHBondContact OE2-CE1 3.29Å
426	H	93.6	Very high	93.8	Very high	127 Å²	127	47.4 Å²	47.4	59%	0.588	24%	0.243	S	C	*	.	S	Bend	trans	-128.3	145.9	-168.2	-53.5	-25.8	0	0	0	111.7	R412 T481	R412-H426 PolarHBondContact NH2-O 3.27Å; H426-T481 WeakPolarHBondContact O-CG2 3.22Å
427	S	94.4	Very high	94.3	Very high	30 Å²	30	46.3 Å²	46.3	21%	0.21	23%	0.234	C	C	.	.			trans	-69.9	149.7	169.1	-51.9	0	0	0	0	111.2	E432 T481	S427-E432 WeakPolarHBondContact CB-OE1 3.38Å; S427-E432 PolarHBondContact OG-OE1 2.81Å; S427-T481 PolarHBondContact OG-OG1 3.04Å
428	T	94.2	Very high	94.7	Very high	30 Å²	30	43.9 Å²	43.9	18%	0.184	22%	0.218	C	C	.	.			trans	-92.5	153.5	162.3	37.3	0	0	0	0	110.1	E430 F431 E432 E510	T428-E430 VanDerWaalsContact C-N 3.28Å; T428-E430 PolarHBondContact O-N 3.05Å; T428-F431 WeakPolarHBondContact O-CA 3.46Å; T428-F431 WeakPolarHBondContact O-CB 3.28Å; T428-F431 PolarHBondContact O-N 3.06Å; T428-E432 PolarHBondContact O-N 2.96Å; T428-E510 WeakPolarHBondContact CG2-OE1 3.28Å; T428-E510 PolarHBondContact OG1-OE1 3.35Å
429	P	93.8	Very high	94.9	Very high	100 Å²	100	43.7 Å²	43.7	65%	0.649	22%	0.221	S	C	*	.	H	α-helix	trans	-53.1	-43.8	-177.8	-28.3	35.5	0	0	0	113.6	F431 E432 E433	P429-F431 VanDerWaalsContact C-N 3.27Å; P429-F431 PolarHBondContact O-N 2.96Å; P429-E432 PolarHBondContact O-N 3.27Å; P429-E433 WeakPolarHBondContact O-CB 3.27Å; P429-E433 PolarHBondContact O-N 2.66Å
430	E	93.2	Very high	95.2	Very high	36 Å²	36	46.2 Å²	46.2	17%	0.168	23%	0.226	C	C	.	.	H	α-helix	trans	-62.4	-33.7	178	-57.7	88.8	157	0	0	112.1	T428 F434 F508 Y534 R536	T428-E430 VanDerWaalsContact C-N 3.28Å; T428-E430 PolarHBondContact O-N 3.05Å; E430-F434 WeakPolarHBondContact O-CB 3.36Å; E430-F434 PolarHBondContact O-N 3.09Å; E430-F508 HydrophobicContact CB-CE1 4.36Å; E430-F508 HydrophobicContact CB-CZ 3.96Å; E430-Y534 HydrophobicContact CB-CD2 4.09Å; E430-Y534 HydrophobicContact CB-CE1 4.44Å; E430-Y534 HydrophobicContact CB-CE2 3.96Å; E430-Y534 HydrophobicContact CB-CG 4.38Å; E430-Y534 HydrophobicContact CG-CD1 4.29Å; E430-Y534 HydrophobicContact CG-CD2 4.29Å; E430-Y534 HydrophobicContact CG-CE1 3.75Å; E430-Y534 HydrophobicContact CG-CE2 3.74Å; E430-Y534 VanDerWaalsContact CG-CZ 3.45Å; E430-R536 IonicContact OE1-CZ 2.8Å; E430-R536 IonicContact OE1-NH2 3.9Å; E430-R536 PolarHBondContact OE1-NH2 3.35Å
431	F	96.3	Very high	95.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-75.5	-38.3	175.4	-178.5	-125.4	0	0	0	111.9	V408 L410 T428 P429 E433 F434 L435 V479 T481 F508	V408-F431 HydrophobicContact CG1-CE2 3.62Å; V408-F431 HydrophobicContact CG1-CZ 3.73Å; L410-F431 HydrophobicContact CB-CD1 4.28Å; L410-F431 HydrophobicContact CB-CE1 4.05Å; L410-F431 HydrophobicContact CB-CE2 4.42Å; L410-F431 HydrophobicContact CB-CZ 4.11Å; L410-F431 HydrophobicContact CD1-CB 4.19Å; L410-F431 HydrophobicContact CD1-CD1 4.44Å; L410-F431 HydrophobicContact CD1-CD2 4.27Å; L410-F431 HydrophobicContact CD1-CG 4.07Å; L410-F431 HydrophobicContact CD2-CD1 4.1Å; L410-F431 HydrophobicContact CD2-CG 4.48Å; T428-F431 WeakPolarHBondContact O-CA 3.46Å; T428-F431 WeakPolarHBondContact O-CB 3.28Å; T428-F431 PolarHBondContact O-N 3.06Å; P429-F431 VanDerWaalsContact C-N 3.27Å; P429-F431 PolarHBondContact O-N 2.96Å; F431-E433 VanDerWaalsContact C-N 3.34Å; F431-F434 HydrophobicContact CD2-CD1 4.2Å; F431-F434 HydrophobicContact CE2-CD1 4.37Å; F431-F434 PolarHBondContact O-N 2.92Å; F431-L435 HydrophobicContact CD1-CD1 4.01Å; F431-L435 HydrophobicContact CD2-CG 4.47Å; F431-L435 HydrophobicContact CE1-CD1 3.75Å; F431-L435 HydrophobicContact CE2-CD1 4.31Å; F431-L435 HydrophobicContact CE2-CD2 4.48Å; F431-L435 HydrophobicContact CE2-CG 4.26Å; F431-L435 HydrophobicContact CG-CD1 4.41Å; F431-L435 HydrophobicContact CZ-CD1 3.92Å; F431-L435 HydrophobicContact CZ-CD2 4.45Å; F431-L435 HydrophobicContact CZ-CG 4.32Å; F431-L435 WeakPolarHBondContact O-CB 3.45Å; F431-L435 VanDerWaalsContact O-CG 3.25Å; F431-L435 WeakPolarHBondContact O-CG 3.31Å; F431-L435 PolarHBondContact O-N 3.42Å; F431-V479 HydrophobicContact CE1-CG1 3.88Å; F431-V479 HydrophobicContact CZ-CG1 3.89Å; F431-T481 HydrophobicContact CE1-CG2 4.08Å; F431-F508 HydrophobicContact CB-CD1 4.06Å; F431-F508 HydrophobicContact CB-CE1 4.03Å; F431-F508 HydrophobicContact CB-CZ 4.49Å; F431-F508 HydrophobicContact CD2-CB 3.52Å; F431-F508 AromaticContact CD2-CD1 3.81Å; F431-F508 HydrophobicContact CD2-CD1 3.81Å; F431-F508 HydrophobicContact CD2-CD2 4.09Å; F431-F508 HydrophobicContact CD2-CE1 4.5Å; F431-F508 AromaticContact CD2-CG 3.54Å; F431-F508 HydrophobicContact CD2-CG 3.54Å; F431-F508 HydrophobicContact CE2-CB 3.66Å; F431-F508 HydrophobicContact CE2-CG 4.21Å; F431-F508 HydrophobicContact CG-CD1 4.32Å; F431-F508 HydrophobicContact CG-CG 4.46Å
432	E	96.2	Very high	95.6	Very high	59 Å²	59	47.3 Å²	47.3	28%	0.276	23%	0.231	S	C	.	.	H	α-helix	trans	-67.6	-35.2	173.7	-64.5	-142.6	148.8	0	0	112.6	S427 T428 P429 L435 K436	S427-E432 WeakPolarHBondContact CB-OE1 3.38Å; S427-E432 PolarHBondContact OG-OE1 2.81Å; T428-E432 PolarHBondContact O-N 2.96Å; P429-E432 PolarHBondContact O-N 3.27Å; E432-L435 PolarHBondContact O-N 3.45Å; E432-K436 WeakPolarHBondContact O-CD 3.3Å; E432-K436 WeakPolarHBondContact O-CG 3.49Å; E432-K436 PolarHBondContact O-N 3.47Å
433	E	94.1	Very high	95.6	Very high	66 Å²	66	51.6 Å²	51.6	31%	0.308	25%	0.247	S	C	.	.	H	α-helix	trans	-63.6	-47.8	172.1	179	164.7	-126.1	0	0	111.9	P429 F431 L435 K436 L437 F549 H576	P429-E433 WeakPolarHBondContact O-CB 3.27Å; P429-E433 PolarHBondContact O-N 2.66Å; F431-E433 VanDerWaalsContact C-N 3.34Å; E433-L435 VanDerWaalsContact C-N 3.32Å; E433-L435 PolarHBondContact O-N 3.33Å; E433-K436 WeakPolarHBondContact O-CB 3.42Å; E433-K436 PolarHBondContact O-N 3.47Å; E433-L437 PolarHBondContact O-N 2.73Å; E433-L437 VanDerWaalsContact O-N 3.08Å; E433-F549 VanDerWaalsContact CD-CZ 3.43Å; E433-F549 HydrophobicContact CG-CZ 4.33Å; E433-F549 VanDerWaalsContact OE2-CZ 3.24Å; E433-F549 WeakPolarHBondContact OE2-CZ 3.45Å; E433-H576 VanDerWaalsContact CG-CE1 3.44Å; E433-H576 WeakPolarHBondContact CG-CE1 3.27Å
434	F	96.6	Very high	95.6	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.6	-39.9	171.2	170.5	-106.5	0	0	0	113.1	E430 F431 L437 L438 F506 F508 V532 Y551 L584	E430-F434 WeakPolarHBondContact O-CB 3.36Å; E430-F434 PolarHBondContact O-N 3.09Å; F431-F434 HydrophobicContact CD2-CD1 4.2Å; F431-F434 HydrophobicContact CE2-CD1 4.37Å; F431-F434 PolarHBondContact O-N 2.92Å; F434-L437 WeakPolarHBondContact O-CB 3.47Å; F434-L437 PolarHBondContact O-N 2.89Å; F434-L438 HydrophobicContact CD1-CD1 4.42Å; F434-L438 HydrophobicContact CE1-CD1 3.69Å; F434-L438 HydrophobicContact CE2-CD1 4.14Å; F434-L438 HydrophobicContact CE2-CG 4.29Å; F434-L438 HydrophobicContact CZ-CD1 3.54Å; F434-L438 HydrophobicContact CZ-CG 4.19Å; F434-L438 PolarHBondContact O-N 3.01Å; F434-F506 HydrophobicContact CZ-CD1 4.25Å; F434-F508 HydrophobicContact CB-CD2 3.83Å; F434-F508 HydrophobicContact CB-CE2 3.52Å; F434-F508 HydrophobicContact CB-CZ 4.46Å; F434-F508 HydrophobicContact CD1-CB 4.4Å; F434-F508 AromaticContact CD1-CD2 3.49Å; F434-F508 HydrophobicContact CD1-CD2 3.49Å; F434-F508 VanDerWaalsContact CD1-CD2 3.49Å; F434-F508 HydrophobicContact CD1-CE2 4.12Å; F434-F508 HydrophobicContact CD1-CG 4.29Å; F434-F508 HydrophobicContact CD2-CD2 4.2Å; F434-F508 HydrophobicContact CD2-CE2 4.34Å; F434-F508 HydrophobicContact CE1-CB 4.44Å; F434-F508 HydrophobicContact CE1-CD2 4.05Å; F434-F508 AromaticContact CG-CD2 3.56Å; F434-F508 HydrophobicContact CG-CD2 3.56Å; F434-F508 AromaticContact CG-CE2 3.74Å; F434-F508 HydrophobicContact CG-CE2 3.74Å; F434-V532 HydrophobicContact CD2-CG1 4.18Å; F434-V532 HydrophobicContact CE2-CB 4.05Å; F434-V532 HydrophobicContact CE2-CG1 3.75Å; F434-V532 HydrophobicContact CE2-CG2 3.9Å; F434-V532 HydrophobicContact CZ-CB 4.13Å; F434-V532 HydrophobicContact CZ-CG1 4.33Å; F434-V532 HydrophobicContact CZ-CG2 3.84Å; F434-Y551 HydrophobicContact CD2-CE1 4.48Å; F434-L584 HydrophobicContact CE2-CD1 3.74Å; F434-L584 HydrophobicContact CZ-CD1 4.36Å
435	L	97.8	Very high	95.5	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.9	-38.5	176.3	-73.5	169.5	0	0	0	112.5	V408 F431 E432 E433 L437 L438 G439 Y466 V479	V408-L435 HydrophobicContact CG1-CD2 4.2Å; V408-L435 HydrophobicContact CG2-CD2 4.47Å; F431-L435 HydrophobicContact CD1-CD1 4.01Å; F431-L435 HydrophobicContact CD2-CG 4.47Å; F431-L435 HydrophobicContact CE1-CD1 3.75Å; F431-L435 HydrophobicContact CE2-CD1 4.31Å; F431-L435 HydrophobicContact CE2-CD2 4.48Å; F431-L435 HydrophobicContact CE2-CG 4.26Å; F431-L435 HydrophobicContact CG-CD1 4.41Å; F431-L435 HydrophobicContact CZ-CD1 3.92Å; F431-L435 HydrophobicContact CZ-CD2 4.45Å; F431-L435 HydrophobicContact CZ-CG 4.32Å; F431-L435 WeakPolarHBondContact O-CB 3.45Å; F431-L435 VanDerWaalsContact O-CG 3.25Å; F431-L435 WeakPolarHBondContact O-CG 3.31Å; F431-L435 PolarHBondContact O-N 3.42Å; E432-L435 PolarHBondContact O-N 3.45Å; E433-L435 VanDerWaalsContact C-N 3.32Å; E433-L435 PolarHBondContact O-N 3.33Å; L435-L437 VanDerWaalsContact C-N 3.27Å; L435-L437 PolarHBondContact O-N 2.89Å; L435-L438 PolarHBondContact O-N 3.38Å; L435-G439 PolarHBondContact O-N 3.48Å; L435-G439 VanDerWaalsContact O-N 3.14Å; L435-Y466 VanDerWaalsContact C-CE1 3.45Å; L435-Y466 HydrophobicContact CB-CD1 3.93Å; L435-Y466 HydrophobicContact CB-CD2 4.04Å; L435-Y466 HydrophobicContact CB-CE1 3.65Å; L435-Y466 HydrophobicContact CB-CE2 3.76Å; L435-Y466 HydrophobicContact CB-CG 4.12Å; L435-Y466 HydrophobicContact CD1-CD2 4.19Å; L435-Y466 HydrophobicContact CD1-CE2 3.84Å; L435-Y466 HydrophobicContact CD2-CD2 4.36Å; L435-Y466 HydrophobicContact CG-CD2 4.45Å; L435-Y466 HydrophobicContact CG-CE2 4.33Å; L435-Y466 WeakPolarHBondContact O-CD1 3.3Å; L435-Y466 WeakPolarHBondContact O-CE1 3.45Å; L435-V479 HydrophobicContact CD1-CG1 3.8Å; L435-V479 HydrophobicContact CD1-CG2 4.39Å; L435-V479 HydrophobicContact CD2-CG1 4.35Å; L435-V479 HydrophobicContact CD2-CG2 3.78Å
436	K	96.6	Very high	95.5	Very high	135 Å²	135	58.1 Å²	58.1	59%	0.587	28%	0.275	S	S	*	.	H	α-helix	trans	-61	-35.9	172.7	-70.1	161.1	-163.4	164.5	0	111.7	E432 E433 L438 G439 Y466	E432-K436 WeakPolarHBondContact O-CD 3.3Å; E432-K436 WeakPolarHBondContact O-CG 3.49Å; E432-K436 PolarHBondContact O-N 3.47Å; E433-K436 WeakPolarHBondContact O-CB 3.42Å; E433-K436 PolarHBondContact O-N 3.47Å; K436-L438 VanDerWaalsContact C-N 3.35Å; K436-G439 CarbonylContact C-O 3.56Å; K436-G439 WeakPolarHBondContact CA-O 3.49Å; K436-G439 PolarHBondContact O-N 2.86Å; K436-G439 VanDerWaalsContact O-O 3.06Å; K436-Y466 HydrophobicContact CG-CE1 4.3Å
437	L	95.4	Very high	95.5	Very high	21 Å²	21	54.2 Å²	54.2	11%	0.11	26%	0.256	C	S	.	.	H	α-helix	trans	-67.9	-33.4	176.4	-173.4	62.9	0	0	0	112.9	E433 F434 L435 N577 F580	E433-L437 PolarHBondContact O-N 2.73Å; E433-L437 VanDerWaalsContact O-N 3.08Å; F434-L437 WeakPolarHBondContact O-CB 3.47Å; F434-L437 PolarHBondContact O-N 2.89Å; L435-L437 VanDerWaalsContact C-N 3.27Å; L435-L437 PolarHBondContact O-N 2.89Å; L437-N577 WeakPolarHBondContact CD1-O 3.35Å; L437-F580 HydrophobicContact CD2-CD1 3.78Å; L437-F580 HydrophobicContact CD2-CE1 4.45Å
438	L	96.9	Very high	95.3	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-80.5	-19.7	177.5	-69.9	-177.1	0	0	0	114	F434 L435 K436 T468 F477 L584 L585	F434-L438 HydrophobicContact CD1-CD1 4.42Å; F434-L438 HydrophobicContact CE1-CD1 3.69Å; F434-L438 HydrophobicContact CE2-CD1 4.14Å; F434-L438 HydrophobicContact CE2-CG 4.29Å; F434-L438 HydrophobicContact CZ-CD1 3.54Å; F434-L438 HydrophobicContact CZ-CG 4.19Å; F434-L438 PolarHBondContact O-N 3.01Å; L435-L438 PolarHBondContact O-N 3.38Å; K436-L438 VanDerWaalsContact C-N 3.35Å; L438-T468 VanDerWaalsContact O-CG2 3.31Å; L438-T468 WeakPolarHBondContact O-CG2 3.47Å; L438-F477 HydrophobicContact CB-CE1 4.32Å; L438-F477 HydrophobicContact CB-CE2 3.99Å; L438-F477 HydrophobicContact CB-CZ 3.75Å; L438-F477 HydrophobicContact CD1-CE1 3.95Å; L438-F477 HydrophobicContact CD1-CZ 4.22Å; L438-F477 HydrophobicContact CG-CZ 4.46Å; L438-F477 WeakPolarHBondContact O-CE2 3.43Å; L438-L584 HydrophobicContact CD2-CB 4.05Å; L438-L584 HydrophobicContact CD2-CD1 4.05Å; L438-L585 HydrophobicContact CD2-CD2 4.21Å
439	G	96.7	Very high	95.3	Very high	13 Å²	13	58.7 Å²	58.7	13%	0.134	29%	0.292	C	S	.	.			trans	170.1	-175.7	178.6	0	0	0	0	0	114.9	L435 K436 Y466 V467	L435-G439 PolarHBondContact O-N 3.48Å; L435-G439 VanDerWaalsContact O-N 3.14Å; K436-G439 CarbonylContact C-O 3.56Å; K436-G439 WeakPolarHBondContact CA-O 3.49Å; K436-G439 PolarHBondContact O-N 2.86Å; K436-G439 VanDerWaalsContact O-O 3.06Å; G439-Y466 WeakPolarHBondContact O-CD1 3.23Å; G439-V467 CarbonylContact C-O 3.58Å; G439-V467 WeakPolarHBondContact CA-O 3.26Å
440	R	96.5	Very high	95.3	Very high	151 Å²	151	56.8 Å²	56.8	57%	0.57	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	139.8	178.4	63.4	-174.5	-179.7	100.2	0.6	111.5	V442 Y466 V467	R440-V442 HydrophobicContact CG-CG1 4.31Å; R440-Y466 WeakPolarHBondContact O-CA 3.2Å; R440-V467 HydrophobicContact CG-CG2 3.93Å; R440-V467 WeakPolarHBondContact CG-O 3.44Å; R440-V467 PolarHBondContact N-O 3.48Å; R440-V467 PolarHBondContact O-N 3.19Å
441	K	97.6	Very high	95.2	Very high	83 Å²	83	57 Å²	57	36%	0.361	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	138.8	170.9	-150.7	-175.4	-159.5	-159	0	109.7	E464 T465 Y466	K441-E464 WeakPolarHBondContact CD-OE2 3.44Å; K441-E464 WeakPolarHBondContact CE-OE2 3.32Å; K441-E464 HydrophobicContact CG-CB 4.48Å; K441-E464 IonicContact NZ-OE2 3.84Å; K441-E464 PolarHBondContact NZ-OE2 3.02Å; K441-T465 CarbonylContact C-O 3.58Å; K441-T465 WeakPolarHBondContact CA-O 2.97Å; K441-Y466 HydrophobicContact CB-CD1 4.35Å; K441-Y466 HydrophobicContact CB-CE1 3.99Å; K441-Y466 HydrophobicContact CB-CE2 4.29Å; K441-Y466 HydrophobicContact CD-CE2 4.18Å; K441-Y466 HydrophobicContact CG-CD2 4.17Å; K441-Y466 HydrophobicContact CG-CE1 4.36Å; K441-Y466 HydrophobicContact CG-CE2 3.76Å
442	V	97	Very high	94.9	Very high	12 Å²	12	57.3 Å²	57.3	7%	0.073	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	142.6	178.3	-67.2	0	0	0	0	111.7	R440 Y447 E464 T465 V467	R440-V442 HydrophobicContact CG-CG1 4.31Å; V442-Y447 HydrophobicContact CB-CD2 4.25Å; V442-Y447 HydrophobicContact CB-CE2 4.21Å; V442-Y447 HydrophobicContact CG1-CE2 4.03Å; V442-Y447 HydrophobicContact CG2-CD2 4.27Å; V442-Y447 HydrophobicContact CG2-CE2 4.16Å; V442-E464 CarbonylContact O-C 3.59Å; V442-E464 WeakPolarHBondContact O-CA 2.98Å; V442-E464 WeakPolarHBondContact O-CB 3.38Å; V442-T465 HydrophobicContact CG2-CG2 4.3Å; V442-T465 PolarHBondContact N-O 3.02Å; V442-T465 PolarHBondContact O-N 3.16Å; V442-V467 HydrophobicContact CB-CG2 4.24Å; V442-V467 HydrophobicContact CG1-CG2 3.54Å; V442-V467 HydrophobicContact CG2-CB 4.31Å; V442-V467 HydrophobicContact CG2-CG1 3.75Å; V442-V467 HydrophobicContact CG2-CG2 3.6Å
443	R	96.6	Very high	94.8	Very high	90 Å²	90	57 Å²	57	34%	0.34	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	125.7	167.6	-172.5	71.8	-177.8	70.6	9.7	109.3	R445 D459 L463	R443-R445 HydrophobicContact CG-CB 4.49Å; R443-D459 IonicContact CZ-OD1 3.06Å; R443-D459 VanDerWaalsContact CZ-OD1 3.32Å; R443-D459 IonicContact CZ-OD2 2.8Å; R443-D459 IonicContact NH1-OD1 2.9Å; R443-D459 PolarHBondContact NH1-OD1 2.72Å; R443-D459 IonicContact NH1-OD2 3.12Å; R443-D459 IonicContact NH2-OD1 3.48Å; R443-D459 PolarHBondContact NH2-OD1 3.22Å; R443-D459 IonicContact NH2-OD2 2.7Å; R443-D459 PolarHBondContact NH2-OD2 3Å; R443-L463 WeakPolarHBondContact CD-O 3.36Å; R443-L463 PolarHBondContact NH1-O 3.44Å
444	L	95.6	Very high	94.8	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.01	28%	0.278	C	S	.	.			trans	-68.5	-36.7	-178.1	-76.6	169.3	0	0	0	113.1	N446 Y447 L454 Y456 G462 L463 T465	L444-N446 PolarHBondContact O-N 3.47Å; L444-Y447 VanDerWaalsContact O-CB 3.31Å; L444-Y447 WeakPolarHBondContact O-CB 3.49Å; L444-Y447 PolarHBondContact O-N 3Å; L444-L454 HydrophobicContact CD1-CB 4.3Å; L444-L454 HydrophobicContact CD1-CD1 4.25Å; L444-L454 HydrophobicContact CD2-CB 3.97Å; L444-L454 HydrophobicContact CD2-CD1 3.82Å; L444-Y456 WeakPolarHBondContact O-CA 3.43Å; L444-Y456 WeakPolarHBondContact O-CB 3.43Å; L444-G462 WeakPolarHBondContact CD1-O 3.5Å; L444-L463 PolarHBondContact N-O 3.02Å; L444-T465 HydrophobicContact CD2-CG2 3.74Å; L444-T465 HydrophobicContact CG-CG2 4.37Å
445	R	93.5	Very high	94.7	Very high	133 Å²	133	55.4 Å²	55.4	50%	0.502	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	124.8	-177.9	-171.5	162.3	174.4	172.3	-5.4	111.5	R443 Y447 Y456 D459	R443-R445 HydrophobicContact CG-CB 4.49Å; R445-Y447 PolarHBondContact O-N 2.93Å; R445-Y456 WeakPolarHBondContact CA-O 3.41Å; R445-D459 WeakPolarHBondContact CB-OD1 3.47Å; R445-D459 WeakPolarHBondContact CD-OD2 3.44Å; R445-D459 IonicContact NH1-OD2 3.57Å
446	N	91.9	Very high	94.4	Very high	132 Å²	132	59.4 Å²	59.4	71%	0.706	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	15.4	-174.9	-53.7	-27.4	0	0	0	114.9	L444 S448 Y456	L444-N446 PolarHBondContact O-N 3.47Å; N446-S448 PolarHBondContact O-N 2.9Å; N446-Y456 PolarHBondContact N-O 3.08Å
447	Y	93.3	Very high	94.2	Very high	45 Å²	45	59.5 Å²	59.5	18%	0.176	30%	0.297	C	S	.	.			trans	-62.4	130.5	174.4	-173.7	-115.4	0	0	0	110.9	V442 L444 R445 G449 I451 V467	V442-Y447 HydrophobicContact CB-CD2 4.25Å; V442-Y447 HydrophobicContact CB-CE2 4.21Å; V442-Y447 HydrophobicContact CG1-CE2 4.03Å; V442-Y447 HydrophobicContact CG2-CD2 4.27Å; V442-Y447 HydrophobicContact CG2-CE2 4.16Å; L444-Y447 VanDerWaalsContact O-CB 3.31Å; L444-Y447 WeakPolarHBondContact O-CB 3.49Å; L444-Y447 PolarHBondContact O-N 3Å; R445-Y447 PolarHBondContact O-N 2.93Å; Y447-G449 VanDerWaalsContact CE1-C 3.5Å; Y447-G449 VanDerWaalsContact CE1-CA 3.4Å; Y447-I451 HydrophobicContact CD1-CG2 3.94Å; Y447-V467 HydrophobicContact CE1-CG1 4.15Å
448	S	92.2	Very high	94	Very high	124 Å²	124	64.6 Å²	64.6	87%	0.867	32%	0.324	S	S	*	.			trans	-92.8	-15.4	-174	52.7	0	0	0	0	114.5	N446	N446-S448 PolarHBondContact O-N 2.9Å
449	G	92.3	Very high	93.8	Very high	29 Å²	29	66.1 Å²	66.1	30%	0.299	33%	0.332	S	S	.	.	S	Bend	trans	-84.9	-169.3	-179.9	0	0	0	0	0	113.9	Y447 I451	Y447-G449 VanDerWaalsContact CE1-C 3.5Å; Y447-G449 VanDerWaalsContact CE1-CA 3.4Å; G449-I451 PolarHBondContact O-N 3.35Å
450	Y	93.7	Very high	93.6	Very high	60 Å²	60	69.5 Å²	69.5	24%	0.235	35%	0.354	C	S	.	.			trans	-69	124.3	178.8	-180	-115.9	0	0	0	112.5	N403 H404 K405 N474 V476	N403-Y450 HydrophobicContact CB-CD1 3.86Å; N403-Y450 HydrophobicContact CB-CD2 3.84Å; N403-Y450 HydrophobicContact CB-CE1 3.74Å; N403-Y450 HydrophobicContact CB-CE2 3.75Å; N403-Y450 HydrophobicContact CB-CG 3.89Å; H404-Y450 WeakPolarHBondContact O-CE1 3.34Å; K405-Y450 HydrophobicContact CB-CE1 4.43Å; Y450-N474 HydrophobicContact CD1-CB 4.46Å; Y450-N474 HydrophobicContact CG-CB 4.45Å; Y450-V476 HydrophobicContact CD1-CB 4.35Å; Y450-V476 HydrophobicContact CD1-CG1 3.58Å; Y450-V476 HydrophobicContact CE1-CG1 3.55Å
451	I	92.2	Very high	93.5	Very high	40 Å²	40	62.9 Å²	62.9	21%	0.205	33%	0.33	C	S	.	.			trans	-101.9	-6.5	-172.9	50.3	162.5	0	0	0	114.9	Y447 G449 G453 L454 Y456	Y447-I451 HydrophobicContact CD1-CG2 3.94Å; G449-I451 PolarHBondContact O-N 3.35Å; I451-G453 PolarHBondContact O-N 3.49Å; I451-L454 WeakPolarHBondContact CD1-O 3.49Å; I451-L454 VanDerWaalsContact O-CB 3.31Å; I451-L454 WeakPolarHBondContact O-CB 3.42Å; I451-L454 WeakPolarHBondContact O-CG 3.48Å; I451-L454 PolarHBondContact O-N 3.06Å; I451-Y456 HydrophobicContact CD1-CD1 3.78Å; I451-Y456 HydrophobicContact CD1-CE1 4.4Å
452	G	90.7	Very high	93.3	Very high	7 Å²	7	59.5 Å²	59.5	7%	0.072	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	6.7	176	0	0	0	0	0	116.5	K405	K405-G452 VanDerWaalsContact CD-O 3.23Å; K405-G452 WeakPolarHBondContact CD-O 3.47Å
453	G	92.4	Very high	93.2	Very high	53 Å²	53	63.7 Å²	63.7	55%	0.546	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	9.6	-172.2	0	0	0	0	0	115	I451 H498	I451-G453 PolarHBondContact O-N 3.49Å; G453-H498 PolarHBondContact O-CE1 3.16Å; G453-H498 VanDerWaalsContact O-CE1 3.25Å
454	L	96	Very high	93.3	Very high	7 Å²	7	62.5 Å²	62.5	4%	0.037	34%	0.338	C	S	.	.			trans	-69.3	161	164.1	-61.8	171.9	0	0	0	110.8	L444 I451 T461 T465 V476 L478 L483	L444-L454 HydrophobicContact CD1-CB 4.3Å; L444-L454 HydrophobicContact CD1-CD1 4.25Å; L444-L454 HydrophobicContact CD2-CB 3.97Å; L444-L454 HydrophobicContact CD2-CD1 3.82Å; I451-L454 WeakPolarHBondContact CD1-O 3.49Å; I451-L454 VanDerWaalsContact O-CB 3.31Å; I451-L454 WeakPolarHBondContact O-CB 3.42Å; I451-L454 WeakPolarHBondContact O-CG 3.48Å; I451-L454 PolarHBondContact O-N 3.06Å; L454-T461 WeakPolarHBondContact CA-OG1 3.25Å; L454-T461 WeakPolarHBondContact CB-OG1 3.42Å; L454-T461 WeakPolarHBondContact CD2-OG1 3.37Å; L454-T465 HydrophobicContact CD1-CG2 3.78Å; L454-V476 HydrophobicContact CD1-CG2 4.14Å; L454-L478 HydrophobicContact CD1-CD2 4.02Å; L454-L478 HydrophobicContact CD2-CD2 3.88Å; L454-L478 HydrophobicContact CG-CD2 3.87Å; L454-L483 HydrophobicContact CD2-CD2 3.68Å
455	D	94.3	Very high	93.3	Very high	26 Å²	26	62.6 Å²	62.6	14%	0.139	34%	0.339	C	S	.	.			trans	-88.4	120.4	177.9	178.6	18.6	0	0	0	111.6	R457 N458 D459 S460 T461	D455-R457 PolarHBondContact OD1-N 3.28Å; D455-N458 PolarHBondContact OD1-N 2.96Å; D455-N458 VanDerWaalsContact OD1-N 3.16Å; D455-N458 VanDerWaalsContact OD2-C 3.25Å; D455-N458 WeakPolarHBondContact OD2-CA 3.39Å; D455-N458 WeakPolarHBondContact OD2-CB 3.44Å; D455-N458 PolarHBondContact OD2-N 2.77Å; D455-N458 VanDerWaalsContact OD2-N 3.15Å; D455-D459 PolarHBondContact OD2-N 3.22Å; D455-S460 WeakPolarHBondContact CB-OG 3.34Å; D455-S460 WeakPolarHBondContact OD2-CB 3.33Å; D455-S460 PolarHBondContact OD2-N 2.78Å; D455-S460 PolarHBondContact OD2-OG 3.45Å; D455-T461 HydrophobicContact CB-CG2 3.96Å; D455-T461 PolarHBondContact N-OG1 3.4Å
456	Y	91.7	Very high	93.6	Very high	83 Å²	83	56.4 Å²	56.4	33%	0.325	32%	0.316	S	S	.	.	S	Bend	trans	-101.9	3.2	179.8	78.2	-78.4	0	0	0	113.6	L444 R445 N446 I451	L444-Y456 WeakPolarHBondContact O-CA 3.43Å; L444-Y456 WeakPolarHBondContact O-CB 3.43Å; R445-Y456 WeakPolarHBondContact CA-O 3.41Å; N446-Y456 PolarHBondContact N-O 3.08Å; I451-Y456 HydrophobicContact CD1-CD1 3.78Å; I451-Y456 HydrophobicContact CD1-CE1 4.4Å
457	R	91.1	Very high	93.8	Very high	137 Å²	137	50.3 Å²	50.3	52%	0.517	28%	0.283	S	S	.	.	S	Bend	trans	-113	-52.6	-174.4	-58.2	-176.6	-179.8	-161.5	-1	112.6	D455	D455-R457 PolarHBondContact OD1-N 3.28Å
458	N	91.4	Very high	94	Very high	129 Å²	129	49.8 Å²	49.8	69%	0.69	29%	0.285	S	S	*	.	S	Bend	trans	-117.5	12.1	-166.1	-59.4	11.1	0	0	0	112.8	D455 S460	D455-N458 PolarHBondContact OD1-N 2.96Å; D455-N458 VanDerWaalsContact OD1-N 3.16Å; D455-N458 VanDerWaalsContact OD2-C 3.25Å; D455-N458 WeakPolarHBondContact OD2-CA 3.39Å; D455-N458 WeakPolarHBondContact OD2-CB 3.44Å; D455-N458 PolarHBondContact OD2-N 2.77Å; D455-N458 VanDerWaalsContact OD2-N 3.15Å; N458-S460 PolarHBondContact O-N 2.91Å
459	D	92.4	Very high	94.1	Very high	33 Å²	33	50.3 Å²	50.3	18%	0.176	27%	0.274	C	S	.	.			trans	58.3	15.9	178.1	-59.7	-44.5	0	0	0	114.9	R443 R445 D455 T461 G462 L463	R443-D459 IonicContact CZ-OD1 3.06Å; R443-D459 VanDerWaalsContact CZ-OD1 3.32Å; R443-D459 IonicContact CZ-OD2 2.8Å; R443-D459 IonicContact NH1-OD1 2.9Å; R443-D459 PolarHBondContact NH1-OD1 2.72Å; R443-D459 IonicContact NH1-OD2 3.12Å; R443-D459 IonicContact NH2-OD1 3.48Å; R443-D459 PolarHBondContact NH2-OD1 3.22Å; R443-D459 IonicContact NH2-OD2 2.7Å; R443-D459 PolarHBondContact NH2-OD2 3Å; R445-D459 WeakPolarHBondContact CB-OD1 3.47Å; R445-D459 WeakPolarHBondContact CD-OD2 3.44Å; R445-D459 IonicContact NH1-OD2 3.57Å; D455-D459 PolarHBondContact OD2-N 3.22Å; D459-T461 PolarHBondContact O-N 2.9Å; D459-G462 PolarHBondContact O-N 3.27Å; D459-G462 VanDerWaalsContact O-N 3.1Å; D459-L463 HydrophobicContact CB-CD2 4.03Å
460	S	92.3	Very high	94.1	Very high	84 Å²	84	49.8 Å²	49.8	59%	0.587	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	1.6	-172.2	66	0	0	0	0	115.1	D455 N458	D455-S460 WeakPolarHBondContact CB-OG 3.34Å; D455-S460 WeakPolarHBondContact OD2-CB 3.33Å; D455-S460 PolarHBondContact OD2-N 2.78Å; D455-S460 PolarHBondContact OD2-OG 3.45Å; N458-S460 PolarHBondContact O-N 2.91Å
461	T	94.6	Very high	93.7	Very high	12 Å²	12	51.8 Å²	51.8	7%	0.074	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	33.5	171.2	70.7	0	0	0	0	111.4	L454 D455 D459 P484	L454-T461 WeakPolarHBondContact CA-OG1 3.25Å; L454-T461 WeakPolarHBondContact CB-OG1 3.42Å; L454-T461 WeakPolarHBondContact CD2-OG1 3.37Å; D455-T461 HydrophobicContact CB-CG2 3.96Å; D455-T461 PolarHBondContact N-OG1 3.4Å; D459-T461 PolarHBondContact O-N 2.9Å; T461-P484 VanDerWaalsContact C-CD 3.48Å
462	G	93.4	Very high	93.3	Very high	11 Å²	11	51.2 Å²	51.2	11%	0.113	27%	0.274	C	S	.	.			trans	96.3	169.7	-177.3	0	0	0	0	0	112.5	L444 D459	L444-G462 WeakPolarHBondContact CD1-O 3.5Å; D459-G462 PolarHBondContact O-N 3.27Å; D459-G462 VanDerWaalsContact O-N 3.1Å
463	L	96.1	Very high	93.2	Very high	100 Å²	100	51 Å²	51	52%	0.524	27%	0.272	S	S	.	.	S	Bend	trans	-85.9	-33.3	-179	-64.1	170.9	0	0	0	112.3	R443 L444 D459	R443-L463 WeakPolarHBondContact CD-O 3.36Å; R443-L463 PolarHBondContact NH1-O 3.44Å; L444-L463 PolarHBondContact N-O 3.02Å; D459-L463 HydrophobicContact CB-CD2 4.03Å
464	E	97.1	Very high	93.3	Very high	65 Å²	65	51.2 Å²	51.2	30%	0.304	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	158.8	-167.1	-55.3	-169.4	132.2	0	0	111.4	K441 V442	K441-E464 WeakPolarHBondContact CD-OE2 3.44Å; K441-E464 WeakPolarHBondContact CE-OE2 3.32Å; K441-E464 HydrophobicContact CG-CB 4.48Å; K441-E464 IonicContact NZ-OE2 3.84Å; K441-E464 PolarHBondContact NZ-OE2 3.02Å; V442-E464 CarbonylContact O-C 3.59Å; V442-E464 WeakPolarHBondContact O-CA 2.98Å; V442-E464 WeakPolarHBondContact O-CB 3.38Å
465	T	97.5	Very high	93.4	Very high	4 Å²	4	51 Å²	51	3%	0.025	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	177.6	165.1	-162.3	0	0	0	0	111	K441 V442 L444 L454 V467 V476 F477	K441-T465 CarbonylContact C-O 3.58Å; K441-T465 WeakPolarHBondContact CA-O 2.97Å; V442-T465 HydrophobicContact CG2-CG2 4.3Å; V442-T465 PolarHBondContact N-O 3.02Å; V442-T465 PolarHBondContact O-N 3.16Å; L444-T465 HydrophobicContact CD2-CG2 3.74Å; L444-T465 HydrophobicContact CG-CG2 4.37Å; L454-T465 HydrophobicContact CD1-CG2 3.78Å; T465-V467 HydrophobicContact CG2-CG1 4.21Å; T465-V476 HydrophobicContact CG2-CG2 3.8Å; T465-F477 PolarHBondContact OG1-O 2.8Å
466	Y	98.1	Very high	93.5	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.016	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	140.7	170.9	-74.4	-103.8	0	0	0	111.2	L435 K436 G439 R440 K441 F477 V479 L482	L435-Y466 VanDerWaalsContact C-CE1 3.45Å; L435-Y466 HydrophobicContact CB-CD1 3.93Å; L435-Y466 HydrophobicContact CB-CD2 4.04Å; L435-Y466 HydrophobicContact CB-CE1 3.65Å; L435-Y466 HydrophobicContact CB-CE2 3.76Å; L435-Y466 HydrophobicContact CB-CG 4.12Å; L435-Y466 HydrophobicContact CD1-CD2 4.19Å; L435-Y466 HydrophobicContact CD1-CE2 3.84Å; L435-Y466 HydrophobicContact CD2-CD2 4.36Å; L435-Y466 HydrophobicContact CG-CD2 4.45Å; L435-Y466 HydrophobicContact CG-CE2 4.33Å; L435-Y466 WeakPolarHBondContact O-CD1 3.3Å; L435-Y466 WeakPolarHBondContact O-CE1 3.45Å; K436-Y466 HydrophobicContact CG-CE1 4.3Å; G439-Y466 WeakPolarHBondContact O-CD1 3.23Å; R440-Y466 WeakPolarHBondContact O-CA 3.2Å; K441-Y466 HydrophobicContact CB-CD1 4.35Å; K441-Y466 HydrophobicContact CB-CE1 3.99Å; K441-Y466 HydrophobicContact CB-CE2 4.29Å; K441-Y466 HydrophobicContact CD-CE2 4.18Å; K441-Y466 HydrophobicContact CG-CD2 4.17Å; K441-Y466 HydrophobicContact CG-CE1 4.36Å; K441-Y466 HydrophobicContact CG-CE2 3.76Å; Y466-F477 WeakPolarHBondContact O-CD2 3.42Å; Y466-F477 PolarHBondContact O-N 3Å; Y466-V479 HydrophobicContact CD2-CG2 4.34Å; Y466-L482 HydrophobicContact CD2-CD1 3.85Å; Y466-L482 HydrophobicContact CE2-CD1 3.92Å
467	V	97.6	Very high	93.8	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.024	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	153.4	177.3	-65	0	0	0	0	110.7	G439 R440 V442 Y447 T465 I475 V476	G439-V467 CarbonylContact C-O 3.58Å; G439-V467 WeakPolarHBondContact CA-O 3.26Å; R440-V467 HydrophobicContact CG-CG2 3.93Å; R440-V467 WeakPolarHBondContact CG-O 3.44Å; R440-V467 PolarHBondContact N-O 3.48Å; R440-V467 PolarHBondContact O-N 3.19Å; V442-V467 HydrophobicContact CB-CG2 4.24Å; V442-V467 HydrophobicContact CG1-CG2 3.54Å; V442-V467 HydrophobicContact CG2-CB 4.31Å; V442-V467 HydrophobicContact CG2-CG1 3.75Å; V442-V467 HydrophobicContact CG2-CG2 3.6Å; Y447-V467 HydrophobicContact CE1-CG1 4.15Å; T465-V467 HydrophobicContact CG2-CG1 4.21Å; V467-I475 CarbonylContact C-O 3.57Å; V467-I475 VanDerWaalsContact CA-O 3.27Å; V467-I475 WeakPolarHBondContact CA-O 3.2Å; V467-V476 HydrophobicContact CG1-CB 4.12Å; V467-V476 HydrophobicContact CG1-CG2 3.93Å
468	T	96.8	Very high	94.2	Very high	34 Å²	34	39.3 Å²	39.3	21%	0.209	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	158.6	167.3	-168.8	0	0	0	0	110.7	L438 I475 F477 L585	L438-T468 VanDerWaalsContact O-CG2 3.31Å; L438-T468 WeakPolarHBondContact O-CG2 3.47Å; T468-I475 HydrophobicContact CG2-CB 3.79Å; T468-I475 HydrophobicContact CG2-CD1 3.93Å; T468-I475 HydrophobicContact CG2-CG1 4.24Å; T468-I475 HydrophobicContact CG2-CG2 4.37Å; T468-I475 PolarHBondContact N-O 3.15Å; T468-I475 PolarHBondContact O-N 2.86Å; T468-F477 HydrophobicContact CG2-CE2 4.29Å; T468-L585 HydrophobicContact CG2-CD1 4.01Å; T468-L585 HydrophobicContact CG2-CD2 4.11Å
469	E	94.7	Very high	94.5	Very high	135 Å²	135	33.2 Å²	33.2	63%	0.631	18%	0.18	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.9	165	-174.1	178.3	170.9	0	0	107.9	T473	E469-T473 WeakPolarHBondContact CA-O 3.43Å
470	F	92.2	Very high	94.7	Very high	18 Å²	18	31.7 Å²	31.7	8%	0.079	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	114.1	-176.6	-174.4	-106.2	0	0	0	109.6	F138 G472 T473 I475 N582 L585 T586 I589	F138-F470 HydrophobicContact CE1-CD1 4.32Å; F138-F470 HydrophobicContact CE1-CE1 4.02Å; F138-F470 AromaticContact CZ-CD1 3.95Å; F138-F470 HydrophobicContact CZ-CD1 3.95Å; F138-F470 HydrophobicContact CZ-CE1 4.02Å; F470-G472 PolarHBondContact O-N 2.97Å; F470-T473 PolarHBondContact N-O 2.9Å; F470-T473 PolarHBondContact O-N 3.08Å; F470-T473 PolarHBondContact O-OG1 2.88Å; F470-I475 HydrophobicContact CB-CD1 3.97Å; F470-N582 HydrophobicContact CE2-CB 4.06Å; F470-N582 WeakPolarHBondContact CE2-OD1 3.41Å; F470-N582 HydrophobicContact CZ-CB 4.21Å; F470-L585 HydrophobicContact CB-CD1 4.12Å; F470-L585 HydrophobicContact CD1-CB 3.96Å; F470-L585 HydrophobicContact CD2-CB 4.44Å; F470-L585 HydrophobicContact CD2-CD1 3.8Å; F470-L585 HydrophobicContact CE1-CB 4.09Å; F470-L585 HydrophobicContact CE2-CD1 4.37Å; F470-L585 HydrophobicContact CG-CB 4.13Å; F470-L585 HydrophobicContact CG-CD1 3.93Å; F470-L585 HydrophobicContact CZ-CB 4.4Å; F470-T586 VanDerWaalsContact CE1-OG1 3.3Å; F470-T586 WeakPolarHBondContact CE1-OG1 3.31Å; F470-T586 WeakPolarHBondContact CZ-OG1 3.47Å; F470-I589 HydrophobicContact CD1-CD1 3.78Å; F470-I589 HydrophobicContact CE1-CD1 4.43Å
471	R	86.1	Confident	94.9	Very high	102 Å²	102	28.3 Å²	28.3	39%	0.385	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	49.3	176.5	-55.4	-179.1	178	-162.7	-1.4	113.6	D134 Y136 F138 T473	D134-R471 PolarHBondContact O-NH2 3.36Å; Y136-R471 PolarHBondContact O-NH1 2.67Å; F138-R471 HydrophobicContact CE2-CB 3.88Å; F138-R471 HydrophobicContact CZ-CB 3.83Å; F138-R471 HydrophobicContact CZ-CG 4.38Å; R471-T473 VanDerWaalsContact C-N 3.28Å; R471-T473 PolarHBondContact O-N 2.91Å
472	G	83.5	Confident	95	Very high	28 Å²	28	29.3 Å²	29.3	29%	0.289	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	25.5	-179.2	0	0	0	0	0	114.3	R54 F470	R54-G472 PolarHBondContact NH1-O 2.99Å; F470-G472 PolarHBondContact O-N 2.97Å
473	T	87.5	Confident	95.2	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.018	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.2	169	72.3	0	0	0	0	110.8	F138 N402 E469 F470 R471 I589	F138-T473 HydrophobicContact CE2-CG2 4.04Å; N402-T473 CarbonylContact O-C 3.52Å; N402-T473 WeakPolarHBondContact O-CA 3.34Å; E469-T473 WeakPolarHBondContact CA-O 3.43Å; F470-T473 PolarHBondContact N-O 2.9Å; F470-T473 PolarHBondContact O-N 3.08Å; F470-T473 PolarHBondContact O-OG1 2.88Å; R471-T473 VanDerWaalsContact C-N 3.28Å; R471-T473 PolarHBondContact O-N 2.91Å; T473-I589 WeakPolarHBondContact OG1-CD1 3.31Å
474	N	94.6	Very high	95.1	Very high	56 Å²	56	26.4 Å²	26.4	30%	0.299	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	132.4	174.9	-62.8	-86.7	0	0	0	109.6	N402 N403 H404 Y450	N402-N474 PolarHBondContact O-N 2.85Å; N403-N474 CarbonylContact C-O 3.56Å; N403-N474 WeakPolarHBondContact CA-O 3.48Å; N403-N474 PolarHBondContact OD1-ND2 2.81Å; H404-N474 PolarHBondContact N-O 3.42Å; Y450-N474 HydrophobicContact CD1-CB 4.46Å; Y450-N474 HydrophobicContact CG-CB 4.45Å
475	I	97.5	Very high	95	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.015	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	133.2	179.8	-52.2	177	0	0	0	108.9	H404 F406 V467 T468 F470 F477 L585 I589	H404-I475 HydrophobicContact CB-CG1 4.42Å; H404-I475 WeakPolarHBondContact O-CA 3.38Å; F406-I475 HydrophobicContact CD2-CG2 3.54Å; F406-I475 HydrophobicContact CE2-CD1 4.31Å; F406-I475 HydrophobicContact CE2-CG2 3.72Å; V467-I475 CarbonylContact C-O 3.57Å; V467-I475 VanDerWaalsContact CA-O 3.27Å; V467-I475 WeakPolarHBondContact CA-O 3.2Å; T468-I475 HydrophobicContact CG2-CB 3.79Å; T468-I475 HydrophobicContact CG2-CD1 3.93Å; T468-I475 HydrophobicContact CG2-CG1 4.24Å; T468-I475 HydrophobicContact CG2-CG2 4.37Å; T468-I475 PolarHBondContact N-O 3.15Å; T468-I475 PolarHBondContact O-N 2.86Å; F470-I475 HydrophobicContact CB-CD1 3.97Å; I475-F477 HydrophobicContact CG2-CE1 4.2Å; I475-F477 HydrophobicContact CG2-CE2 3.97Å; I475-F477 HydrophobicContact CG2-CZ 3.72Å; I475-L585 HydrophobicContact CD1-CB 4.47Å; I475-L585 HydrophobicContact CD1-CD2 3.9Å; I475-I589 HydrophobicContact CD1-CD1 4.12Å; I475-I589 HydrophobicContact CD1-CG1 4.48Å
476	V	97.7	Very high	94.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	133.2	172.1	59.7	0	0	0	0	110	H404 K405 F406 Y450 L454 T465 V467	H404-V476 PolarHBondContact O-N 2.75Å; K405-V476 VanDerWaalsContact CA-O 3.28Å; K405-V476 WeakPolarHBondContact CA-O 3.34Å; K405-V476 HydrophobicContact CB-CG1 3.9Å; F406-V476 PolarHBondContact N-O 3.4Å; Y450-V476 HydrophobicContact CD1-CB 4.35Å; Y450-V476 HydrophobicContact CD1-CG1 3.58Å; Y450-V476 HydrophobicContact CE1-CG1 3.55Å; L454-V476 HydrophobicContact CD1-CG2 4.14Å; T465-V476 HydrophobicContact CG2-CG2 3.8Å; V467-V476 HydrophobicContact CG1-CB 4.12Å; V467-V476 HydrophobicContact CG1-CG2 3.93Å
477	F	98.4	Very high	94.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	146.8	178.4	-62.3	-79.4	0	0	0	110.3	F406 V408 L438 T465 Y466 T468 I475 V479 F506 L585	F406-F477 HydrophobicContact CB-CD1 4.05Å; F406-F477 HydrophobicContact CB-CE1 4.16Å; F406-F477 HydrophobicContact CD2-CE1 4.03Å; F406-F477 CarbonylContact O-C 3.6Å; F406-F477 WeakPolarHBondContact O-CA 3.19Å; V408-F477 HydrophobicContact CG2-CB 3.97Å; V408-F477 HydrophobicContact CG2-CD1 3.7Å; V408-F477 HydrophobicContact CG2-CG 4.22Å; L438-F477 HydrophobicContact CB-CE1 4.32Å; L438-F477 HydrophobicContact CB-CE2 3.99Å; L438-F477 HydrophobicContact CB-CZ 3.75Å; L438-F477 HydrophobicContact CD1-CE1 3.95Å; L438-F477 HydrophobicContact CD1-CZ 4.22Å; L438-F477 HydrophobicContact CG-CZ 4.46Å; L438-F477 WeakPolarHBondContact O-CE2 3.43Å; T465-F477 PolarHBondContact OG1-O 2.8Å; Y466-F477 WeakPolarHBondContact O-CD2 3.42Å; Y466-F477 PolarHBondContact O-N 3Å; T468-F477 HydrophobicContact CG2-CE2 4.29Å; I475-F477 HydrophobicContact CG2-CE1 4.2Å; I475-F477 HydrophobicContact CG2-CE2 3.97Å; I475-F477 HydrophobicContact CG2-CZ 3.72Å; F477-V479 HydrophobicContact CB-CG2 3.89Å; F477-F506 HydrophobicContact CE1-CD2 4.3Å; F477-F506 AromaticContact CE1-CE2 3.99Å; F477-F506 HydrophobicContact CE1-CE2 3.99Å; F477-L585 HydrophobicContact CZ-CD2 3.88Å
478	L	97.8	Very high	93.9	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	81	175.5	-54.4	175.2	0	0	0	105.8	K405 F406 V408 L454 H498 I499	K405-L478 HydrophobicContact CB-CD1 4.29Å; K405-L478 HydrophobicContact CD-CD1 4.29Å; K405-L478 HydrophobicContact CG-CD1 4.38Å; F406-L478 PolarHBondContact O-N 2.93Å; V408-L478 PolarHBondContact N-O 2.9Å; L454-L478 HydrophobicContact CD1-CD2 4.02Å; L454-L478 HydrophobicContact CD2-CD2 3.88Å; L454-L478 HydrophobicContact CG-CD2 3.87Å; L478-H498 HydrophobicContact CD1-CB 4.41Å; L478-H498 WeakPolarHBondContact CD1-O 3.4Å; L478-I499 HydrophobicContact CB-CG1 4.03Å; L478-I499 VanDerWaalsContact O-CD1 3.22Å; L478-I499 WeakPolarHBondContact O-CD1 3.38Å; L478-I499 VanDerWaalsContact O-CG1 3.28Å; L478-I499 WeakPolarHBondContact O-CG1 3.48Å
479	V	97.8	Very high	93.5	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	124.9	-170.6	-174.7	0	0	0	0	110.1	V408 F431 L435 Y466 F477 T481 L482 L483	V408-V479 HydrophobicContact CB-CG2 4.35Å; V408-V479 HydrophobicContact CG2-CG2 4.32Å; F431-V479 HydrophobicContact CE1-CG1 3.88Å; F431-V479 HydrophobicContact CZ-CG1 3.89Å; L435-V479 HydrophobicContact CD1-CG1 3.8Å; L435-V479 HydrophobicContact CD1-CG2 4.39Å; L435-V479 HydrophobicContact CD2-CG1 4.35Å; L435-V479 HydrophobicContact CD2-CG2 3.78Å; Y466-V479 HydrophobicContact CD2-CG2 4.34Å; F477-V479 HydrophobicContact CB-CG2 3.89Å; V479-T481 PolarHBondContact O-N 3.04Å; V479-L482 HydrophobicContact CB-CB 4.24Å; V479-L482 HydrophobicContact CB-CD1 4.1Å; V479-L482 HydrophobicContact CB-CG 4.11Å; V479-L482 HydrophobicContact CG1-CD1 4.33Å; V479-L482 HydrophobicContact CG1-CG 4.08Å; V479-L482 HydrophobicContact CG2-CD1 4.31Å; V479-L482 PolarHBondContact O-N 2.86Å; V479-L483 WeakPolarHBondContact O-CG 3.4Å; V479-L483 PolarHBondContact O-N 2.83Å; V479-L483 VanDerWaalsContact O-N 3.17Å
480	S	97.1	Very high	93.2	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-57.4	-45.4	-175.7	56	0	0	0	0	113.1	V408 L482 L483 R495	V408-S480 PolarHBondContact O-N 2.82Å; S480-L482 VanDerWaalsContact C-N 3.31Å; S480-L482 PolarHBondContact O-N 2.83Å; S480-L483 PolarHBondContact O-N 2.9Å; S480-R495 PolarHBondContact O-NE 2.93Å; S480-R495 VanDerWaalsContact O-NE 3.14Å; S480-R495 PolarHBondContact O-NH2 2.97Å
481	T	96.9	Very high	93	Very high	14 Å²	14	45.8 Å²	45.8	9%	0.086	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-67.5	-26.7	-177.7	58.8	0	0	0	0	113.6	L410 H426 S427 F431 V479	L410-T481 HydrophobicContact CD2-CG2 4.29Å; H426-T481 WeakPolarHBondContact O-CG2 3.22Å; S427-T481 PolarHBondContact OG-OG1 3.04Å; F431-T481 HydrophobicContact CE1-CG2 4.08Å; V479-T481 PolarHBondContact O-N 3.04Å
482	L	96.8	Very high	93.4	Very high	33 Å²	33	40.9 Å²	40.9	17%	0.173	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-90.1	-16.2	178.6	-57.1	-178.4	0	0	0	113.5	Y466 V479 S480	Y466-L482 HydrophobicContact CD2-CD1 3.85Å; Y466-L482 HydrophobicContact CE2-CD1 3.92Å; V479-L482 HydrophobicContact CB-CB 4.24Å; V479-L482 HydrophobicContact CB-CD1 4.1Å; V479-L482 HydrophobicContact CB-CG 4.11Å; V479-L482 HydrophobicContact CG1-CD1 4.33Å; V479-L482 HydrophobicContact CG1-CG 4.08Å; V479-L482 HydrophobicContact CG2-CD1 4.31Å; V479-L482 PolarHBondContact O-N 2.86Å; S480-L482 VanDerWaalsContact C-N 3.31Å; S480-L482 PolarHBondContact O-N 2.83Å
483	L	97	Very high	93.8	Very high	6 Å²	6	43.8 Å²	43.8	3%	0.031	23%	0.23	C	C	.	.	S	Bend	trans	-78.2	149.4	172.7	-73	166.4	0	0	0	110.5	L454 V479 S480 Y485 R495 H498 I499	L454-L483 HydrophobicContact CD2-CD2 3.68Å; V479-L483 WeakPolarHBondContact O-CG 3.4Å; V479-L483 PolarHBondContact O-N 2.83Å; V479-L483 VanDerWaalsContact O-N 3.17Å; S480-L483 PolarHBondContact O-N 2.9Å; L483-Y485 PolarHBondContact O-N 3.01Å; L483-R495 HydrophobicContact CB-CB 4.39Å; L483-R495 HydrophobicContact CB-CG 3.88Å; L483-R495 HydrophobicContact CD1-CB 4.47Å; L483-R495 PolarHBondContact O-NE 3.41Å; L483-R495 PolarHBondContact O-NH2 3.33Å; L483-H498 HydrophobicContact CD1-CB 4.09Å; L483-H498 HydrophobicContact CD2-CB 4.38Å; L483-I499 HydrophobicContact CD1-CD1 3.96Å; L483-I499 HydrophobicContact CD1-CG1 3.81Å
484	P	94.4	Very high	94	Very high	44 Å²	44	45 Å²	45	29%	0.286	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-55.5	131.8	-176.8	-25.5	34.9	0	0	0	112	T461 R495	T461-P484 VanDerWaalsContact C-CD 3.48Å; P484-R495 WeakPolarHBondContact O-CG 3.37Å; P484-R495 PolarHBondContact O-NE 3.29Å
485	Y	95.1	Very high	94.1	Very high	68 Å²	68	42.5 Å²	42.5	27%	0.267	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-88.1	138.7	170.8	-179.4	-119.9	0	0	0	109.8	N423 E425 L483 P487 Q492	N423-Y485 HydrophobicContact CB-CE2 4.21Å; N423-Y485 WeakPolarHBondContact O-CE2 3.3Å; E425-Y485 HydrophobicContact CG-CD1 3.58Å; E425-Y485 HydrophobicContact CG-CD2 3.94Å; E425-Y485 HydrophobicContact CG-CE1 3.53Å; E425-Y485 HydrophobicContact CG-CE2 3.9Å; E425-Y485 HydrophobicContact CG-CG 3.79Å; E425-Y485 WeakPolarHBondContact OE1-CE1 3.29Å; E425-Y485 WeakPolarHBondContact OE2-CD1 3.25Å; E425-Y485 WeakPolarHBondContact OE2-CE1 3.29Å; L483-Y485 PolarHBondContact O-N 3.01Å; Y485-P487 HydrophobicContact CD1-CB 4.32Å; Y485-P487 HydrophobicContact CE1-CB 3.65Å; Y485-P487 HydrophobicContact CE1-CG 4.3Å; Y485-Q492 VanDerWaalsContact CD2-NE2 3.34Å
486	E	92.9	Very high	94	Very high	59 Å²	59	45 Å²	45	28%	0.276	24%	0.237	S	C	.	.			trans	-121.5	91.8	175.5	-56.6	-163.3	95.2	0	0	109	N488 K489 Q492 A494	E486-N488 PolarHBondContact O-N 2.83Å; E486-N488 VanDerWaalsContact O-N 3.09Å; E486-K489 HydrophobicContact CB-CB 4.13Å; E486-K489 HydrophobicContact CB-CD 3.87Å; E486-K489 HydrophobicContact CB-CG 4.41Å; E486-K489 HydrophobicContact CG-CD 4.34Å; E486-K489 PolarHBondContact O-N 3.49Å; E486-K489 IonicContact OE1-NZ 2.62Å; E486-K489 PolarHBondContact OE1-NZ 3.23Å; E486-K489 WeakPolarHBondContact OE2-CD 3.38Å; E486-K489 IonicContact OE2-NZ 2.8Å; E486-K489 PolarHBondContact OE2-NZ 3Å; E486-Q492 PolarHBondContact O-NE2 2.9Å; E486-A494 HydrophobicContact CG-CB 4.13Å
487	P	88.8	Confident	93.8	Very high	88 Å²	88	51.9 Å²	51.9	57%	0.571	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-32.5	-169.2	17.3	-30.7	0	0	0	114	Y485 K489	Y485-P487 HydrophobicContact CD1-CB 4.32Å; Y485-P487 HydrophobicContact CE1-CB 3.65Å; Y485-P487 HydrophobicContact CE1-CG 4.3Å; P487-K489 PolarHBondContact O-N 3.11Å
488	N	87.9	Confident	93.7	Very high	163 Å²	163	52.7 Å²	52.7	87%	0.872	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	16.3	-179.9	-60.4	-16.1	0	0	0	113.7	E486	E486-N488 PolarHBondContact O-N 2.83Å; E486-N488 VanDerWaalsContact O-N 3.09Å
489	K	89.6	Confident	93.6	Very high	95 Å²	95	52.7 Å²	52.7	41%	0.413	27%	0.267	S	S	.	.			trans	-144.4	88.8	-175.7	-69.2	172.4	178.3	167.7	0	111.9	E486 P487 E491 Q492	E486-K489 HydrophobicContact CB-CB 4.13Å; E486-K489 HydrophobicContact CB-CD 3.87Å; E486-K489 HydrophobicContact CB-CG 4.41Å; E486-K489 HydrophobicContact CG-CD 4.34Å; E486-K489 PolarHBondContact O-N 3.49Å; E486-K489 IonicContact OE1-NZ 2.62Å; E486-K489 PolarHBondContact OE1-NZ 3.23Å; E486-K489 WeakPolarHBondContact OE2-CD 3.38Å; E486-K489 IonicContact OE2-NZ 2.8Å; E486-K489 PolarHBondContact OE2-NZ 3Å; P487-K489 PolarHBondContact O-N 3.11Å; K489-E491 VanDerWaalsContact C-N 3.27Å; K489-E491 PolarHBondContact O-N 3.43Å; K489-E491 VanDerWaalsContact O-N 3.16Å; K489-Q492 WeakPolarHBondContact O-CA 3.41Å; K489-Q492 PolarHBondContact O-N 3.23Å; K489-Q492 PolarHBondContact O-NE2 3.07Å
490	T	87.7	Confident	93.4	Very high	79 Å²	79	52.9 Å²	52.9	49%	0.485	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.9	-46.2	173.1	49	0	0	0	0	114.2	E419 N423 Q492	E419-T490 VanDerWaalsContact OE1-CB 3.28Å; E419-T490 WeakPolarHBondContact OE1-CB 3.4Å; E419-T490 WeakPolarHBondContact OE1-CG2 3.46Å; N423-T490 PolarHBondContact ND2-O 2.67Å; T490-Q492 PolarHBondContact O-N 2.82Å
491	E	87.9	Confident	93.2	Very high	118 Å²	118	55.5 Å²	55.5	55%	0.551	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-12.9	178.5	-64	-172.1	163.8	0	0	115.3	K489 L493	K489-E491 VanDerWaalsContact C-N 3.27Å; K489-E491 PolarHBondContact O-N 3.43Å; K489-E491 VanDerWaalsContact O-N 3.16Å; E491-L493 VanDerWaalsContact C-N 3.27Å; E491-L493 HydrophobicContact CB-CD2 4.1Å; E491-L493 HydrophobicContact CB-CG 3.98Å; E491-L493 PolarHBondContact O-N 3.01Å; E491-L493 VanDerWaalsContact O-N 3.13Å; E491-L493 WeakPolarHBondContact OE2-CD1 3.45Å; E491-L493 WeakPolarHBondContact OE2-CD2 3.32Å; E491-L493 WeakPolarHBondContact OE2-CG 3.37Å
492	Q	94.2	Very high	93.1	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.28	C	S	.	.			trans	41.9	49.8	-177.4	-67	-59.9	-28.2	0	0	113.5	N423 Y485 E486 K489 T490 A494 R495 K496	N423-Q492 VanDerWaalsContact OD1-CG 3.29Å; N423-Q492 WeakPolarHBondContact OD1-CG 3.26Å; N423-Q492 PolarHBondContact OD1-NE2 3.17Å; Y485-Q492 VanDerWaalsContact CD2-NE2 3.34Å; E486-Q492 PolarHBondContact O-NE2 2.9Å; K489-Q492 WeakPolarHBondContact O-CA 3.41Å; K489-Q492 PolarHBondContact O-N 3.23Å; K489-Q492 PolarHBondContact O-NE2 3.07Å; T490-Q492 PolarHBondContact O-N 2.82Å; Q492-A494 PolarHBondContact O-N 3.21Å; Q492-R495 HydrophobicContact CB-CB 4.23Å; Q492-R495 HydrophobicContact CB-CG 4.3Å; Q492-R495 WeakPolarHBondContact O-CA 3.34Å; Q492-R495 WeakPolarHBondContact O-CB 3.44Å; Q492-R495 PolarHBondContact O-N 2.75Å; Q492-K496 PolarHBondContact O-N 3.1Å
493	L	92.7	Very high	93	Very high	89 Å²	89	54.9 Å²	54.9	47%	0.466	28%	0.282	S	S	.	.	H	α-helix	trans	-56.9	-27.5	-172.2	-70.5	179.3	0	0	0	114	E491 R497	E491-L493 VanDerWaalsContact C-N 3.27Å; E491-L493 HydrophobicContact CB-CD2 4.1Å; E491-L493 HydrophobicContact CB-CG 3.98Å; E491-L493 PolarHBondContact O-N 3.01Å; E491-L493 VanDerWaalsContact O-N 3.13Å; E491-L493 WeakPolarHBondContact OE2-CD1 3.45Å; E491-L493 WeakPolarHBondContact OE2-CD2 3.32Å; E491-L493 WeakPolarHBondContact OE2-CG 3.37Å; L493-R497 WeakPolarHBondContact O-CB 3.41Å; L493-R497 PolarHBondContact O-N 3.17Å
494	A	91.6	Very high	93	Very high	29 Å²	29	54.6 Å²	54.6	24%	0.24	28%	0.28	C	S	.	.	H	α-helix	trans	-57.6	-49.9	169.2	0	0	0	0	0	111.8	E486 Q492 H498	E486-A494 HydrophobicContact CG-CB 4.13Å; Q492-A494 PolarHBondContact O-N 3.21Å; A494-H498 PolarHBondContact O-CD2 2.94Å
495	R	96.4	Very high	93.1	Very high	3 Å²	3	52.5 Å²	52.5	1%	0.011	27%	0.267	C	S	.	.	H	α-helix	trans	-72.1	-50.9	179.7	-55.1	-178.2	156.9	-164.9	-15.3	111.6	Y422 N424 S480 L483 P484 Q492 R497 H498 I499	Y422-R495 HydrophobicContact CD1-CB 3.69Å; Y422-R495 HydrophobicContact CE1-CB 4.07Å; Y422-R495 WeakPolarHBondContact O-CD 3.34Å; Y422-R495 PolarHBondContact O-NH1 3.35Å; N424-R495 PolarHBondContact O-NH1 3.48Å; S480-R495 PolarHBondContact O-NE 2.93Å; S480-R495 VanDerWaalsContact O-NE 3.14Å; S480-R495 PolarHBondContact O-NH2 2.97Å; L483-R495 HydrophobicContact CB-CB 4.39Å; L483-R495 HydrophobicContact CB-CG 3.88Å; L483-R495 HydrophobicContact CD1-CB 4.47Å; L483-R495 PolarHBondContact O-NE 3.41Å; L483-R495 PolarHBondContact O-NH2 3.33Å; P484-R495 WeakPolarHBondContact O-CG 3.37Å; P484-R495 PolarHBondContact O-NE 3.29Å; Q492-R495 HydrophobicContact CB-CB 4.23Å; Q492-R495 HydrophobicContact CB-CG 4.3Å; Q492-R495 WeakPolarHBondContact O-CA 3.34Å; Q492-R495 WeakPolarHBondContact O-CB 3.44Å; Q492-R495 PolarHBondContact O-N 2.75Å; R495-R497 VanDerWaalsContact C-N 3.26Å; R495-R497 PolarHBondContact O-N 2.92Å; R495-H498 PolarHBondContact O-N 2.83Å; R495-I499 PolarHBondContact O-N 3.28Å; R495-I499 VanDerWaalsContact O-N 3.1Å
496	K	94.5	Very high	93.3	Very high	54 Å²	54	49.2 Å²	49.2	24%	0.235	25%	0.254	C	S	.	.	H	α-helix	trans	-62.4	-28.6	-178.9	-176.4	162.4	173.8	163.4	0	113.1	E418 Y422 Q492 H498 G500	E418-K496 WeakPolarHBondContact OE1-CD 3.23Å; E418-K496 WeakPolarHBondContact OE1-CE 3.44Å; E418-K496 IonicContact OE1-NZ 2.88Å; E418-K496 PolarHBondContact OE1-NZ 3.29Å; E418-K496 IonicContact OE2-NZ 3.58Å; E418-K496 PolarHBondContact OE2-NZ 3.01Å; Y422-K496 HydrophobicContact CD1-CB 4.41Å; Y422-K496 HydrophobicContact CE1-CB 3.93Å; Y422-K496 HydrophobicContact CE2-CB 4.25Å; Y422-K496 HydrophobicContact CE2-CD 4.24Å; Y422-K496 HydrophobicContact CE2-CG 4.22Å; Q492-K496 PolarHBondContact O-N 3.1Å; K496-H498 VanDerWaalsContact C-N 3.28Å; K496-H498 PolarHBondContact O-N 3.34Å; K496-G500 WeakPolarHBondContact O-CA 3.25Å; K496-G500 PolarHBondContact O-N 2.74Å
497	R	94.6	Very high	93.4	Very high	146 Å²	146	46.4 Å²	46.4	55%	0.551	24%	0.241	S	C	*	.	H	α-helix	trans	-64.1	-28	171.6	174.1	176.2	156.4	-137.2	-21.3	113.5	L493 R495 N501	L493-R497 WeakPolarHBondContact O-CB 3.41Å; L493-R497 PolarHBondContact O-N 3.17Å; R495-R497 VanDerWaalsContact C-N 3.26Å; R495-R497 PolarHBondContact O-N 2.92Å; R497-N501 PolarHBondContact O-ND2 2.95Å
498	H	95.4	Very high	93.8	Very high	17 Å²	17	42.2 Å²	42.2	8%	0.079	21%	0.214	C	C	.	.	H	α-helix	trans	-91.7	-58.9	178.4	-73.2	-102.1	0	0	0	111	G453 L478 L483 A494 R495 K496 N501	G453-H498 PolarHBondContact O-CE1 3.16Å; G453-H498 VanDerWaalsContact O-CE1 3.25Å; L478-H498 HydrophobicContact CD1-CB 4.41Å; L478-H498 WeakPolarHBondContact CD1-O 3.4Å; L483-H498 HydrophobicContact CD1-CB 4.09Å; L483-H498 HydrophobicContact CD2-CB 4.38Å; A494-H498 PolarHBondContact O-CD2 2.94Å; R495-H498 PolarHBondContact O-N 2.83Å; K496-H498 VanDerWaalsContact C-N 3.28Å; K496-H498 PolarHBondContact O-N 3.34Å; H498-N501 PolarHBondContact O-N 3.06Å
499	I	96.2	Very high	94.1	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.1	-47.2	-176.7	-58.8	-174.9	0	0	0	111.1	L409 Y422 L478 L483 R495 N501 S502 T505	L409-I499 HydrophobicContact CD2-CD1 3.82Å; L409-I499 HydrophobicContact CD2-CG2 4.1Å; L409-I499 HydrophobicContact CG-CG2 4.24Å; Y422-I499 HydrophobicContact CE1-CB 3.87Å; Y422-I499 HydrophobicContact CE1-CD1 3.95Å; Y422-I499 HydrophobicContact CE1-CG1 4.28Å; Y422-I499 HydrophobicContact CE1-CG2 4.26Å; Y422-I499 WeakPolarHBondContact OH-CB 3.17Å; Y422-I499 WeakPolarHBondContact OH-CG2 3.48Å; L478-I499 HydrophobicContact CB-CG1 4.03Å; L478-I499 VanDerWaalsContact O-CD1 3.22Å; L478-I499 WeakPolarHBondContact O-CD1 3.38Å; L478-I499 VanDerWaalsContact O-CG1 3.28Å; L478-I499 WeakPolarHBondContact O-CG1 3.48Å; L483-I499 HydrophobicContact CD1-CD1 3.96Å; L483-I499 HydrophobicContact CD1-CG1 3.81Å; R495-I499 PolarHBondContact O-N 3.28Å; R495-I499 VanDerWaalsContact O-N 3.1Å; I499-N501 PolarHBondContact O-N 3.18Å; I499-S502 PolarHBondContact O-N 2.83Å; I499-T505 HydrophobicContact CG2-CG2 4.25Å
500	G	93.8	Very high	94.3	Very high	6 Å²	6	31.5 Å²	31.5	6%	0.062	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-8.5	177.3	0	0	0	0	0	115.2	Y422 K496 S523	Y422-G500 PolarHBondContact OH-N 3.35Å; K496-G500 WeakPolarHBondContact O-CA 3.25Å; K496-G500 PolarHBondContact O-N 2.74Å; G500-S523 PolarHBondContact O-OG 3.38Å
501	N	93.9	Very high	94.2	Very high	55 Å²	55	30.4 Å²	30.4	29%	0.294	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	23.1	172.1	-72.7	-64.6	0	0	0	112.9	K405 R497 H498 I499 F525	K405-N501 VanDerWaalsContact CE-O 3.29Å; K405-N501 WeakPolarHBondContact CE-O 3.43Å; K405-N501 PolarHBondContact NZ-O 3.44Å; R497-N501 PolarHBondContact O-ND2 2.95Å; H498-N501 PolarHBondContact O-N 3.06Å; I499-N501 PolarHBondContact O-N 3.18Å; N501-F525 VanDerWaalsContact OD1-CD2 3.22Å; N501-F525 WeakPolarHBondContact OD1-CD2 3.44Å
502	S	94.1	Very high	94	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.014	15%	0.145	C	C	.	.			trans	-95.4	156.3	158.1	-176.8	0	0	0	0	110.7	K405 I499 V504 F525 Q526	K405-S502 PolarHBondContact O-OG 3.49Å; I499-S502 PolarHBondContact O-N 2.83Å; S502-V504 PolarHBondContact OG-N 3.29Å; S502-V504 PolarHBondContact OG-O 2.92Å; S502-F525 CarbonylContact O-C 3.58Å; S502-Q526 VanDerWaalsContact O-CA 3.29Å; S502-Q526 WeakPolarHBondContact O-CA 3.38Å; S502-Q526 VanDerWaalsContact O-CG 3.25Å; S502-Q526 WeakPolarHBondContact O-CG 3.48Å; S502-Q526 PolarHBondContact O-N 2.98Å
503	S	93.8	Very high	93.5	Very high	31 Å²	31	29.1 Å²	29.1	22%	0.217	15%	0.148	C	C	.	.	S	Bend	trans	-83	-30.4	173.5	42.2	0	0	0	0	113.4	F525 K527 V528	S503-F525 WeakPolarHBondContact CA-O 3.27Å; S503-K527 PolarHBondContact O-N 3.12Å; S503-V528 PolarHBondContact O-N 2.84Å; S503-V528 VanDerWaalsContact O-N 3.17Å
504	V	96.9	Very high	93.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	128.4	-173.9	-173.1	0	0	0	0	108.2	F406 G407 S502 V528 I530 A588 A591 A592	F406-V504 HydrophobicContact CD1-CB 3.84Å; F406-V504 HydrophobicContact CD1-CG1 4.38Å; F406-V504 HydrophobicContact CE1-CB 4.05Å; F406-V504 HydrophobicContact CE1-CG2 4.27Å; G407-V504 PolarHBondContact N-O 3.41Å; G407-V504 VanDerWaalsContact N-O 3.08Å; S502-V504 PolarHBondContact OG-N 3.29Å; S502-V504 PolarHBondContact OG-O 2.92Å; V504-V528 WeakPolarHBondContact CA-O 3.41Å; V504-V528 HydrophobicContact CG1-CB 4.29Å; V504-V528 HydrophobicContact CG1-CG1 4.11Å; V504-V528 HydrophobicContact CG2-CB 4.33Å; V504-I530 HydrophobicContact CG1-CD1 4.02Å; V504-I530 HydrophobicContact CG1-CG1 4.34Å; V504-A588 HydrophobicContact CG1-CB 4.37Å; V504-A591 HydrophobicContact CG1-CB 4.02Å; V504-A591 HydrophobicContact CG2-CB 3.69Å; V504-A592 HydrophobicContact CG2-CB 4.31Å
505	T	97.7	Very high	92.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	124.6	-178.4	-62.5	0	0	0	0	110.3	G407 L409 I499 I507 Q526 V528 F529 I530	G407-T505 CarbonylContact O-C 3.54Å; G407-T505 WeakPolarHBondContact O-CA 3.39Å; L409-T505 HydrophobicContact CD1-CG2 4.26Å; L409-T505 HydrophobicContact CG-CG2 4.15Å; I499-T505 HydrophobicContact CG2-CG2 4.25Å; T505-I507 HydrophobicContact CG2-CG1 4.3Å; T505-Q526 PolarHBondContact OG1-NE2 2.97Å; T505-V528 PolarHBondContact N-O 2.7Å; T505-F529 HydrophobicContact CG2-CD1 4.33Å; T505-F529 CarbonylContact O-C 3.48Å; T505-F529 VanDerWaalsContact O-CA 3.27Å; T505-F529 WeakPolarHBondContact O-CA 3.43Å; T505-I530 PolarHBondContact O-N 2.81Å
506	F	97.8	Very high	92	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	137.4	164.3	-69.7	-85.6	0	0	0	109.3	F406 G407 V408 L409 F434 F477 I530 V532 L584 A588	F406-F506 HydrophobicContact CB-CD2 4.15Å; F406-F506 HydrophobicContact CB-CE2 4.1Å; F406-F506 HydrophobicContact CD2-CE2 4.12Å; F406-F506 HydrophobicContact CG-CE2 4.24Å; G407-F506 PolarHBondContact O-N 3.26Å; V408-F506 WeakPolarHBondContact CA-O 3.39Å; V408-F506 HydrophobicContact CG1-CB 4.16Å; V408-F506 HydrophobicContact CG2-CB 4.36Å; L409-F506 PolarHBondContact N-O 2.71Å; F434-F506 HydrophobicContact CZ-CD1 4.25Å; F477-F506 HydrophobicContact CE1-CD2 4.3Å; F477-F506 AromaticContact CE1-CE2 3.99Å; F477-F506 HydrophobicContact CE1-CE2 3.99Å; F506-I530 CarbonylContact C-O 3.5Å; F506-I530 VanDerWaalsContact CA-O 3.3Å; F506-I530 WeakPolarHBondContact CA-O 3.28Å; F506-I530 HydrophobicContact CD1-CB 3.87Å; F506-I530 HydrophobicContact CD1-CG2 3.9Å; F506-I530 HydrophobicContact CE1-CB 4.05Å; F506-I530 HydrophobicContact CE1-CD1 4.03Å; F506-I530 HydrophobicContact CE1-CG2 3.84Å; F506-I530 HydrophobicContact CZ-CD1 4.18Å; F506-V532 HydrophobicContact CD1-CG2 4.33Å; F506-L584 HydrophobicContact CE1-CB 4.11Å; F506-L584 HydrophobicContact CE1-CD1 4.42Å; F506-L584 HydrophobicContact CE1-CD2 4.32Å; F506-L584 HydrophobicContact CZ-CB 4.39Å; F506-A588 HydrophobicContact CE2-CB 3.96Å; F506-A588 HydrophobicContact CZ-CB 3.71Å
507	I	96	Very high	91.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	109.1	169.9	-56.3	178.9	0	0	0	106	L409 C411 M421 T505 V509 F516 F529 I530 L531 V532	L409-I507 HydrophobicContact CB-CG1 4.45Å; L409-I507 WeakPolarHBondContact O-CA 3.44Å; C411-I507 HydrophobicContact CB-CG2 4.03Å; M421-I507 HydrophobicContact SD-CG2 4.1Å; T505-I507 HydrophobicContact CG2-CG1 4.3Å; I507-V509 HydrophobicContact CG2-CG2 3.89Å; I507-F516 HydrophobicContact CD1-CD1 3.68Å; I507-F516 HydrophobicContact CD1-CD2 4.06Å; I507-F516 HydrophobicContact CD1-CE1 3.29Å; I507-F516 HydrophobicContact CD1-CE2 3.74Å; I507-F516 HydrophobicContact CD1-CG 4.04Å; I507-F516 HydrophobicContact CD1-CZ 3.32Å; I507-F529 HydrophobicContact CD1-CB 4.23Å; I507-F529 HydrophobicContact CD1-CD1 3.78Å; I507-F529 HydrophobicContact CD1-CG 4.24Å; I507-F529 HydrophobicContact CG1-CD1 4.37Å; I507-I530 PolarHBondContact N-O 3.01Å; I507-L531 WeakPolarHBondContact O-CA 3.34Å; I507-V532 PolarHBondContact O-N 2.83Å
508	F	96.8	Very high	90.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	124.4	170.8	-173.1	-93.2	0	0	0	108.2	L409 L410 C411 E430 F431 F434 E510 V532 Y534 Y551	L409-F508 PolarHBondContact O-N 2.95Å; L410-F508 HydrophobicContact CD1-CD1 3.63Å; L410-F508 HydrophobicContact CD1-CE1 4.38Å; C411-F508 WeakPolarHBondContact CB-O 3.32Å; C411-F508 PolarHBondContact N-O 2.98Å; E430-F508 HydrophobicContact CB-CE1 4.36Å; E430-F508 HydrophobicContact CB-CZ 3.96Å; F431-F508 HydrophobicContact CB-CD1 4.06Å; F431-F508 HydrophobicContact CB-CE1 4.03Å; F431-F508 HydrophobicContact CB-CZ 4.49Å; F431-F508 HydrophobicContact CD2-CB 3.52Å; F431-F508 AromaticContact CD2-CD1 3.81Å; F431-F508 HydrophobicContact CD2-CD1 3.81Å; F431-F508 HydrophobicContact CD2-CD2 4.09Å; F431-F508 HydrophobicContact CD2-CE1 4.5Å; F431-F508 AromaticContact CD2-CG 3.54Å; F431-F508 HydrophobicContact CD2-CG 3.54Å; F431-F508 HydrophobicContact CE2-CB 3.66Å; F431-F508 HydrophobicContact CE2-CG 4.21Å; F431-F508 HydrophobicContact CG-CD1 4.32Å; F431-F508 HydrophobicContact CG-CG 4.46Å; F434-F508 HydrophobicContact CB-CD2 3.83Å; F434-F508 HydrophobicContact CB-CE2 3.52Å; F434-F508 HydrophobicContact CB-CZ 4.46Å; F434-F508 HydrophobicContact CD1-CB 4.4Å; F434-F508 AromaticContact CD1-CD2 3.49Å; F434-F508 HydrophobicContact CD1-CD2 3.49Å; F434-F508 VanDerWaalsContact CD1-CD2 3.49Å; F434-F508 HydrophobicContact CD1-CE2 4.12Å; F434-F508 HydrophobicContact CD1-CG 4.29Å; F434-F508 HydrophobicContact CD2-CD2 4.2Å; F434-F508 HydrophobicContact CD2-CE2 4.34Å; F434-F508 HydrophobicContact CE1-CB 4.44Å; F434-F508 HydrophobicContact CE1-CD2 4.05Å; F434-F508 AromaticContact CG-CD2 3.56Å; F434-F508 HydrophobicContact CG-CD2 3.56Å; F434-F508 AromaticContact CG-CE2 3.74Å; F434-F508 HydrophobicContact CG-CE2 3.74Å; F508-E510 HydrophobicContact CE1-CG 4.28Å; F508-V532 WeakPolarHBondContact CA-O 3.44Å; F508-Y534 HydrophobicContact CZ-CD2 4.37Å; F508-Y534 HydrophobicContact CZ-CG 4.2Å; F508-Y551 AromaticContact CE2-CE1 3.95Å; F508-Y551 HydrophobicContact CE2-CE1 3.95Å
509	V	94.8	Very high	90.5	Very high	11 Å²	11	39.6 Å²	39.6	7%	0.067	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	117.2	-172.8	-178.9	0	0	0	0	108	C411 I507 A513 V532 K533 Y534	C411-V509 HydrophobicContact CB-CG2 4.48Å; I507-V509 HydrophobicContact CG2-CG2 3.89Å; V509-A513 HydrophobicContact CG1-CB 3.69Å; V509-V532 PolarHBondContact N-O 3.32Å; V509-K533 HydrophobicContact CB-CB 4.11Å; V509-K533 HydrophobicContact CB-CG 4.35Å; V509-K533 HydrophobicContact CG1-CB 4.4Å; V509-K533 HydrophobicContact CG1-CD 4.33Å; V509-K533 HydrophobicContact CG1-CG 4.24Å; V509-K533 WeakPolarHBondContact O-CA 3.46Å; V509-Y534 PolarHBondContact O-N 2.73Å
510	E	94.2	Very high	89.9	Confident	21 Å²	21	41.3 Å²	41.3	10%	0.098	23%	0.226	C	C	.	.			trans	-69.7	162.3	175.1	-70.6	178.4	179.4	0	0	111.7	L410 C411 R412 K413 T428 F508 D512 A513	L410-E510 HydrophobicContact CD1-CG 4.35Å; C411-E510 PolarHBondContact O-N 2.98Å; R412-E510 WeakPolarHBondContact CA-OE2 3.2Å; R412-E510 WeakPolarHBondContact CB-OE2 3.43Å; K413-E510 HydrophobicContact CG-CB 4.37Å; K413-E510 PolarHBondContact N-OE2 3.49Å; T428-E510 WeakPolarHBondContact CG2-OE1 3.28Å; T428-E510 PolarHBondContact OG1-OE1 3.35Å; F508-E510 HydrophobicContact CE1-CG 4.28Å; E510-D512 VanDerWaalsContact C-N 3.29Å; E510-D512 PolarHBondContact O-N 3.46Å; E510-A513 WeakPolarHBondContact O-CB 3.32Å; E510-A513 PolarHBondContact O-N 3.49Å; E510-A513 VanDerWaalsContact O-N 3.1Å
511	E	85.4	Confident	89.7	Confident	57 Å²	57	41.7 Å²	41.7	27%	0.266	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-36.6	-169.9	-169	150.6	-132.3	0	0	113.6	K533 I535 R536	E511-K533 WeakPolarHBondContact O-CE 3.47Å; E511-K533 PolarHBondContact O-NZ 2.97Å; E511-I535 VanDerWaalsContact OE1-CA 3.28Å; E511-I535 WeakPolarHBondContact OE1-CA 3.32Å; E511-I535 WeakPolarHBondContact OE1-CG2 3.34Å; E511-R536 PolarHBondContact OE1-N 3.13Å; E511-R536 WeakPolarHBondContact OE2-CB 3.22Å; E511-R536 WeakPolarHBondContact OE2-CG 3.46Å; E511-R536 PolarHBondContact OE2-N 3.46Å
512	D	82.6	Confident	89.4	Confident	82 Å²	82	45.4 Å²	45.4	44%	0.439	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	18.8	178.5	-45.2	-62.2	0	0	0	113.3	K413 N414 E510	K413-D512 HydrophobicContact CB-CB 4.25Å; K413-D512 HydrophobicContact CD-CB 4Å; K413-D512 VanDerWaalsContact CD-OD2 3.31Å; K413-D512 WeakPolarHBondContact CD-OD2 3.5Å; K413-D512 WeakPolarHBondContact CE-OD2 3.33Å; K413-D512 HydrophobicContact CG-CB 3.98Å; K413-D512 IonicContact NZ-OD2 3.8Å; K413-D512 PolarHBondContact NZ-OD2 3.39Å; N414-D512 PolarHBondContact N-O 2.94Å; E510-D512 VanDerWaalsContact C-N 3.29Å; E510-D512 PolarHBondContact O-N 3.46Å
513	A	84.5	Confident	89.2	Confident	9 Å²	9	46.4 Å²	46.4	7%	0.074	25%	0.252	C	S	.	.			trans	-71.8	146.2	173	0	0	0	0	0	111	R412 V509 E510	R412-A513 WeakPolarHBondContact O-CB 3.28Å; V509-A513 HydrophobicContact CG1-CB 3.69Å; E510-A513 WeakPolarHBondContact O-CB 3.32Å; E510-A513 PolarHBondContact O-N 3.49Å; E510-A513 VanDerWaalsContact O-N 3.1Å
514	M	83.1	Confident	88.9	Confident	96 Å²	96	47.6 Å²	47.6	47%	0.473	27%	0.269	S	S	.	.			trans	-70	156.8	177.9	-75.8	-67.1	106.7	0	0	111.4	Q415 F516	Q415-M514 PolarHBondContact O-N 3.01Å; M514-F516 PolarHBondContact O-N 2.96Å
515	P	82.8	Confident	88.6	Confident	106 Å²	106	50.9 Å²	50.9	69%	0.688	28%	0.284	S	S	*	.			trans	-58	110.8	179.2	-25.1	35.1	0	0	0	112.2	Q517	P515-Q517 PolarHBondContact O-N 3.14Å
516	F	82.8	Confident	88.3	Confident	19 Å²	19	51 Å²	51	8%	0.083	29%	0.285	C	S	.	.			trans	-62.2	120.5	179.4	169.3	-104.6	0	0	0	111.4	M421 I507 M514 P518 T520 I521 F529 L531	M421-F516 HydrophobicContact CE-CD2 3.77Å; M421-F516 HydrophobicContact CE-CE2 3.67Å; M421-F516 HydrophobicContact SD-CD2 4.44Å; I507-F516 HydrophobicContact CD1-CD1 3.68Å; I507-F516 HydrophobicContact CD1-CD2 4.06Å; I507-F516 HydrophobicContact CD1-CE1 3.29Å; I507-F516 HydrophobicContact CD1-CE2 3.74Å; I507-F516 HydrophobicContact CD1-CG 4.04Å; I507-F516 HydrophobicContact CD1-CZ 3.32Å; M514-F516 PolarHBondContact O-N 2.96Å; F516-P518 HydrophobicContact CD1-CG 4.44Å; F516-P518 HydrophobicContact CE1-CB 4.18Å; F516-P518 HydrophobicContact CE1-CG 3.97Å; F516-T520 WeakPolarHBondContact CE2-OG1 3.39Å; F516-I521 HydrophobicContact CE2-CD1 4.18Å; F516-I521 HydrophobicContact CE2-CG1 3.76Å; F516-I521 HydrophobicContact CZ-CD1 4.45Å; F516-I521 HydrophobicContact CZ-CG1 3.63Å; F516-F529 HydrophobicContact CE1-CB 4.44Å; F516-F529 HydrophobicContact CE1-CD2 4.45Å; F516-F529 HydrophobicContact CE1-CG 4.25Å; F516-L531 HydrophobicContact CB-CD2 4.25Å; F516-L531 HydrophobicContact CD1-CD1 4.25Å; F516-L531 HydrophobicContact CD1-CD2 4.06Å; F516-L531 HydrophobicContact CD1-CG 4.21Å
517	Q	83.3	Confident	88.2	Confident	134 Å²	134	52.4 Å²	52.4	63%	0.626	29%	0.291	S	S	*	.			trans	-95.7	117	173.8	-68.2	-175.9	-5.9	0	0	110.1	P515 D519 T520	P515-Q517 PolarHBondContact O-N 3.14Å; Q517-D519 PolarHBondContact O-N 3.04Å; Q517-D519 VanDerWaalsContact O-N 3.1Å; Q517-T520 HydrophobicContact CB-CG2 4.1Å; Q517-T520 WeakPolarHBondContact O-CB 3.46Å; Q517-T520 WeakPolarHBondContact O-CG2 3.46Å; Q517-T520 PolarHBondContact O-N 2.73Å; Q517-T520 PolarHBondContact O-OG1 3.36Å
518	P	83.4	Confident	88.2	Confident	44 Å²	44	52.4 Å²	52.4	29%	0.286	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-56.2	-29.2	-177.8	-29.1	36.7	0	0	0	115.5	F516 T520 I521 F529 C556	F516-P518 HydrophobicContact CD1-CG 4.44Å; F516-P518 HydrophobicContact CE1-CB 4.18Å; F516-P518 HydrophobicContact CE1-CG 3.97Å; P518-T520 PolarHBondContact O-N 3.33Å; P518-I521 PolarHBondContact O-N 3.39Å; P518-F529 HydrophobicContact CB-CD2 4.19Å; P518-F529 HydrophobicContact CB-CE2 4.23Å; P518-C556 HydrophobicContact CB-CB 4.5Å; P518-C556 HydrophobicContact CG-CB 3.78Å
519	D	85.6	Confident	88.1	Confident	158 Å²	158	53.2 Å²	53.2	85%	0.845	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-71.6	-10.5	-179.4	-63.7	-43.8	0	0	0	113.6	Q517 I521	Q517-D519 PolarHBondContact O-N 3.04Å; Q517-D519 VanDerWaalsContact O-N 3.1Å; D519-I521 VanDerWaalsContact C-N 3.29Å; D519-I521 PolarHBondContact O-N 2.84Å
520	T	84.2	Confident	88.2	Confident	36 Å²	36	52.7 Å²	52.7	22%	0.221	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-67.1	-29.1	170.9	59.5	0	0	0	0	112.6	E418 F516 Q517 P518 I522	E418-T520 WeakPolarHBondContact CB-O 3.45Å; F516-T520 WeakPolarHBondContact CE2-OG1 3.39Å; Q517-T520 HydrophobicContact CB-CG2 4.1Å; Q517-T520 WeakPolarHBondContact O-CB 3.46Å; Q517-T520 WeakPolarHBondContact O-CG2 3.46Å; Q517-T520 PolarHBondContact O-N 2.73Å; Q517-T520 PolarHBondContact O-OG1 3.36Å; P518-T520 PolarHBondContact O-N 3.33Å; T520-I522 PolarHBondContact O-N 3Å
521	I	89	Confident	88.2	Confident	14 Å²	14	52.9 Å²	52.9	7%	0.072	29%	0.292	C	S	.	.	S	Bend	trans	-86.2	102.1	-175.5	-57.8	-67	0	0	0	110.7	L409 E418 M421 F516 P518 D519 S523 F529	L409-I521 HydrophobicContact CD1-CD1 3.94Å; E418-I521 HydrophobicContact CB-CD1 3.87Å; E418-I521 HydrophobicContact CG-CD1 3.81Å; M421-I521 HydrophobicContact CE-CD1 3.88Å; F516-I521 HydrophobicContact CE2-CD1 4.18Å; F516-I521 HydrophobicContact CE2-CG1 3.76Å; F516-I521 HydrophobicContact CZ-CD1 4.45Å; F516-I521 HydrophobicContact CZ-CG1 3.63Å; P518-I521 PolarHBondContact O-N 3.39Å; D519-I521 VanDerWaalsContact C-N 3.29Å; D519-I521 PolarHBondContact O-N 2.84Å; I521-S523 PolarHBondContact O-N 3.32Å; I521-F529 HydrophobicContact CB-CE1 4.14Å; I521-F529 HydrophobicContact CB-CZ 3.74Å; I521-F529 HydrophobicContact CG1-CE1 3.97Å; I521-F529 HydrophobicContact CG1-CZ 3.99Å; I521-F529 HydrophobicContact CG2-CE1 3.96Å; I521-F529 HydrophobicContact CG2-CZ 3.76Å
522	I	88.3	Confident	88.7	Confident	134 Å²	134	50.1 Å²	50.1	69%	0.687	28%	0.28	S	S	*	.			trans	-83.6	83.4	-177.2	-52.5	-178.7	0	0	0	110.3	E418 T520	E418-I522 PolarHBondContact OE2-N 2.95Å; T520-I522 PolarHBondContact O-N 3Å
523	S	90.4	Very high	89.3	Confident	22 Å²	22	49.6 Å²	49.6	15%	0.154	27%	0.274	C	S	.	.			trans	-133.8	134.2	176.4	178.6	0	0	0	0	115.8	G500 I521 F525 Q526 K527	G500-S523 PolarHBondContact O-OG 3.38Å; I521-S523 PolarHBondContact O-N 3.32Å; S523-F525 VanDerWaalsContact C-N 3.3Å; S523-F525 PolarHBondContact OG-N 3.23Å; S523-Q526 PolarHBondContact OG-N 2.93Å; S523-Q526 VanDerWaalsContact OG-N 3.08Å; S523-K527 PolarHBondContact O-NZ 2.93Å
524	G	87	Confident	89.8	Confident	56 Å²	56	50 Å²	50	58%	0.577	27%	0.273	S	S	*	.	S	Bend	trans	-69.8	-22.9	167.8	0	0	0	0	0	114.1	K527	G524-K527 VanDerWaalsContact O-CE 3.32Å; G524-K527 WeakPolarHBondContact O-CE 3.35Å
525	F	89.9	Confident	90.2	Very high	69 Å²	69	46.5 Å²	46.5	30%	0.303	26%	0.256	S	S	.	.	S	Bend	trans	-106.5	-38.5	-171.5	-72.3	-86.2	0	0	0	114.7	N501 S502 S503 S523 K527 F601 T1271	N501-F525 VanDerWaalsContact OD1-CD2 3.22Å; N501-F525 WeakPolarHBondContact OD1-CD2 3.44Å; S502-F525 CarbonylContact O-C 3.58Å; S503-F525 WeakPolarHBondContact CA-O 3.27Å; S523-F525 VanDerWaalsContact C-N 3.3Å; S523-F525 PolarHBondContact OG-N 3.23Å; F525-K527 WeakPolarHBondContact O-CG 3.32Å; F525-K527 PolarHBondContact O-N 3.18Å; F525-F601 HydrophobicContact CB-CZ 4.47Å; F525-F601 HydrophobicContact CD1-CE1 4.04Å; F525-F601 AromaticContact CD1-CZ 3.68Å; F525-F601 HydrophobicContact CD1-CZ 3.68Å; F525-F601 HydrophobicContact CE1-CE1 4.31Å; F525-F601 HydrophobicContact CE1-CZ 4.33Å; F525-F601 HydrophobicContact CG-CZ 4.44Å; F525-T1271 HydrophobicContact CE1-CG2 4.31Å; F525-T1271 HydrophobicContact CE2-CG2 4.15Å; F525-T1271 HydrophobicContact CZ-CG2 3.69Å
526	Q	93.3	Very high	90.4	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.019	25%	0.245	C	C	.	.			trans	-68.5	121.1	177.7	-65.5	166.2	-76.6	0	0	109.2	S502 T505 S523 F529	S502-Q526 VanDerWaalsContact O-CA 3.29Å; S502-Q526 WeakPolarHBondContact O-CA 3.38Å; S502-Q526 VanDerWaalsContact O-CG 3.25Å; S502-Q526 WeakPolarHBondContact O-CG 3.48Å; S502-Q526 PolarHBondContact O-N 2.98Å; T505-Q526 PolarHBondContact OG1-NE2 2.97Å; S523-Q526 PolarHBondContact OG-N 2.93Å; S523-Q526 VanDerWaalsContact OG-N 3.08Å; Q526-F529 HydrophobicContact CB-CE1 4.12Å; Q526-F529 HydrophobicContact CB-CZ 4Å
527	K	94.2	Very high	90.4	Very high	29 Å²	29	48.7 Å²	48.7	13%	0.126	25%	0.254	C	S	.	.			trans	-133	-8.2	-174.8	-65.1	-72.2	151.8	-91.9	0	113.3	S503 S523 G524 F525 R557 A558 V561 V595 Y598	S503-K527 PolarHBondContact O-N 3.12Å; S523-K527 PolarHBondContact O-NZ 2.93Å; G524-K527 VanDerWaalsContact O-CE 3.32Å; G524-K527 WeakPolarHBondContact O-CE 3.35Å; F525-K527 WeakPolarHBondContact O-CG 3.32Å; F525-K527 PolarHBondContact O-N 3.18Å; K527-R557 WeakPolarHBondContact O-CA 3.43Å; K527-A558 HydrophobicContact CB-CB 4.36Å; K527-A558 HydrophobicContact CD-CB 3.87Å; K527-A558 PolarHBondContact O-N 2.96Å; K527-V561 HydrophobicContact CB-CG2 4.13Å; K527-V595 HydrophobicContact CB-CG1 4.12Å; K527-V595 HydrophobicContact CB-CG2 4Å; K527-V595 HydrophobicContact CG-CG1 4.48Å; K527-Y598 HydrophobicContact CD-CD1 4.2Å; K527-Y598 HydrophobicContact CD-CE1 3.83Å; K527-Y598 HydrophobicContact CG-CD1 4.21Å; K527-Y598 HydrophobicContact CG-CE1 4.29Å
528	V	95.8	Very high	89.7	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	136.3	168.1	174.1	0	0	0	0	109.3	S503 V504 T505 I530 V555 C556 R557 V561 F564 A591 V595	S503-V528 PolarHBondContact O-N 2.84Å; S503-V528 VanDerWaalsContact O-N 3.17Å; V504-V528 WeakPolarHBondContact CA-O 3.41Å; V504-V528 HydrophobicContact CG1-CB 4.29Å; V504-V528 HydrophobicContact CG1-CG1 4.11Å; V504-V528 HydrophobicContact CG2-CB 4.33Å; T505-V528 PolarHBondContact N-O 2.7Å; V528-I530 HydrophobicContact CG1-CG1 4.22Å; V528-V555 HydrophobicContact CG1-CG1 4.09Å; V528-C556 CarbonylContact C-O 3.57Å; V528-C556 WeakPolarHBondContact CA-O 3.5Å; V528-R557 HydrophobicContact CG2-CB 4.09Å; V528-V561 HydrophobicContact CG2-CG1 4.19Å; V528-F564 HydrophobicContact CB-CZ 4.42Å; V528-F564 HydrophobicContact CG1-CE1 4.32Å; V528-F564 HydrophobicContact CG1-CE2 4.45Å; V528-F564 HydrophobicContact CG1-CZ 3.62Å; V528-F564 HydrophobicContact CG2-CE1 3.71Å; V528-F564 HydrophobicContact CG2-CZ 3.86Å; V528-A591 HydrophobicContact CB-CB 4.34Å; V528-A591 HydrophobicContact CG1-CB 4Å; V528-A591 HydrophobicContact CG2-CB 4.28Å; V528-V595 HydrophobicContact CG2-CG2 3.69Å
529	F	95.8	Very high	88.3	Confident	16 Å²	16	51.4 Å²	51.4	7%	0.07	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.4	167.8	-56.4	-79.5	0	0	0	109.2	T505 I507 F516 P518 I521 Q526 L531 V555 C556	T505-F529 HydrophobicContact CG2-CD1 4.33Å; T505-F529 CarbonylContact O-C 3.48Å; T505-F529 VanDerWaalsContact O-CA 3.27Å; T505-F529 WeakPolarHBondContact O-CA 3.43Å; I507-F529 HydrophobicContact CD1-CB 4.23Å; I507-F529 HydrophobicContact CD1-CD1 3.78Å; I507-F529 HydrophobicContact CD1-CG 4.24Å; I507-F529 HydrophobicContact CG1-CD1 4.37Å; F516-F529 HydrophobicContact CE1-CB 4.44Å; F516-F529 HydrophobicContact CE1-CD2 4.45Å; F516-F529 HydrophobicContact CE1-CG 4.25Å; P518-F529 HydrophobicContact CB-CD2 4.19Å; P518-F529 HydrophobicContact CB-CE2 4.23Å; I521-F529 HydrophobicContact CB-CE1 4.14Å; I521-F529 HydrophobicContact CB-CZ 3.74Å; I521-F529 HydrophobicContact CG1-CE1 3.97Å; I521-F529 HydrophobicContact CG1-CZ 3.99Å; I521-F529 HydrophobicContact CG2-CE1 3.96Å; I521-F529 HydrophobicContact CG2-CZ 3.76Å; Q526-F529 HydrophobicContact CB-CE1 4.12Å; Q526-F529 HydrophobicContact CB-CZ 4Å; F529-L531 HydrophobicContact CB-CD1 4.14Å; F529-V555 WeakPolarHBondContact O-CA 3.5Å; F529-C556 HydrophobicContact CB-CB 4.32Å; F529-C556 HydrophobicContact CD2-CB 4.46Å; F529-C556 PolarHBondContact N-O 3.27Å; F529-C556 PolarHBondContact O-N 2.98Å
530	I	96.4	Very high	86.5	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	102.3	172.1	-58.1	176.5	0	0	0	106.2	V504 T505 F506 I507 V528 V532 V553 V555 L584 K587 A588	V504-I530 HydrophobicContact CG1-CD1 4.02Å; V504-I530 HydrophobicContact CG1-CG1 4.34Å; T505-I530 PolarHBondContact O-N 2.81Å; F506-I530 CarbonylContact C-O 3.5Å; F506-I530 VanDerWaalsContact CA-O 3.3Å; F506-I530 WeakPolarHBondContact CA-O 3.28Å; F506-I530 HydrophobicContact CD1-CB 3.87Å; F506-I530 HydrophobicContact CD1-CG2 3.9Å; F506-I530 HydrophobicContact CE1-CB 4.05Å; F506-I530 HydrophobicContact CE1-CD1 4.03Å; F506-I530 HydrophobicContact CE1-CG2 3.84Å; F506-I530 HydrophobicContact CZ-CD1 4.18Å; I507-I530 PolarHBondContact N-O 3.01Å; V528-I530 HydrophobicContact CG1-CG1 4.22Å; I530-V532 HydrophobicContact CG2-CG2 4.34Å; I530-V553 HydrophobicContact CG2-CG1 4.05Å; I530-V555 HydrophobicContact CG1-CG2 4.44Å; I530-V555 HydrophobicContact CG2-CG2 4.5Å; I530-L584 HydrophobicContact CG2-CD2 4.16Å; I530-K587 HydrophobicContact CD1-CG 4.3Å; I530-A588 HydrophobicContact CD1-CB 3.92Å
531	L	95.1	Very high	84.7	Confident	25 Å²	25	56.1 Å²	56.1	13%	0.131	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	130.6	176.5	-67.4	72.1	0	0	0	107.7	I507 F516 F529 V553 A554 C556	I507-L531 WeakPolarHBondContact O-CA 3.34Å; F516-L531 HydrophobicContact CB-CD2 4.25Å; F516-L531 HydrophobicContact CD1-CD1 4.25Å; F516-L531 HydrophobicContact CD1-CD2 4.06Å; F516-L531 HydrophobicContact CD1-CG 4.21Å; F529-L531 HydrophobicContact CB-CD1 4.14Å; L531-V553 VanDerWaalsContact O-CA 3.32Å; L531-V553 WeakPolarHBondContact O-CA 3.5Å; L531-A554 HydrophobicContact CB-CB 4.28Å; L531-A554 PolarHBondContact N-O 3.14Å; L531-A554 PolarHBondContact O-N 2.6Å; L531-C556 HydrophobicContact CD1-CB 4.45Å
532	V	95.8	Very high	82.7	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	102.1	172	-175.7	0	0	0	0	106.8	F434 F506 I507 F508 V509 I530 Y551 V553 F580 L584	F434-V532 HydrophobicContact CD2-CG1 4.18Å; F434-V532 HydrophobicContact CE2-CB 4.05Å; F434-V532 HydrophobicContact CE2-CG1 3.75Å; F434-V532 HydrophobicContact CE2-CG2 3.9Å; F434-V532 HydrophobicContact CZ-CB 4.13Å; F434-V532 HydrophobicContact CZ-CG1 4.33Å; F434-V532 HydrophobicContact CZ-CG2 3.84Å; F506-V532 HydrophobicContact CD1-CG2 4.33Å; I507-V532 PolarHBondContact O-N 2.83Å; F508-V532 WeakPolarHBondContact CA-O 3.44Å; V509-V532 PolarHBondContact N-O 3.32Å; I530-V532 HydrophobicContact CG2-CG2 4.34Å; V532-Y551 HydrophobicContact CG1-CD1 3.7Å; V532-Y551 HydrophobicContact CG1-CE1 4.46Å; V532-Y551 HydrophobicContact CG1-CG 3.98Å; V532-V553 HydrophobicContact CG1-CG2 4.39Å; V532-V553 HydrophobicContact CG2-CG2 4.26Å; V532-F580 HydrophobicContact CG1-CZ 4.23Å; V532-L584 HydrophobicContact CG2-CD1 4.18Å; V532-L584 HydrophobicContact CG2-CD2 4.32Å
533	K	94.6	Very high	80.6	Confident	71 Å²	71	63.9 Å²	63.9	31%	0.309	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	121.5	176.4	-178.3	166.8	-174.9	171.6	0	109.9	V509 E511 I535 Y551 R552	V509-K533 HydrophobicContact CB-CB 4.11Å; V509-K533 HydrophobicContact CB-CG 4.35Å; V509-K533 HydrophobicContact CG1-CB 4.4Å; V509-K533 HydrophobicContact CG1-CD 4.33Å; V509-K533 HydrophobicContact CG1-CG 4.24Å; V509-K533 WeakPolarHBondContact O-CA 3.46Å; E511-K533 WeakPolarHBondContact O-CE 3.47Å; E511-K533 PolarHBondContact O-NZ 2.97Å; K533-I535 HydrophobicContact CG-CG1 4.3Å; K533-Y551 CarbonylContact O-C 3.59Å; K533-Y551 VanDerWaalsContact O-CA 3.26Å; K533-Y551 WeakPolarHBondContact O-CA 3.47Å; K533-R552 PolarHBondContact N-O 3.11Å; K533-R552 PolarHBondContact O-N 3.37Å
534	Y	94.1	Very high	78.5	Confident	18 Å²	18	71.6 Å²	71.6	7%	0.071	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	138.4	169.9	174	-90.9	0	0	0	110.2	E430 F508 V509 R536 F549 Y551	E430-Y534 HydrophobicContact CB-CD2 4.09Å; E430-Y534 HydrophobicContact CB-CE1 4.44Å; E430-Y534 HydrophobicContact CB-CE2 3.96Å; E430-Y534 HydrophobicContact CB-CG 4.38Å; E430-Y534 HydrophobicContact CG-CD1 4.29Å; E430-Y534 HydrophobicContact CG-CD2 4.29Å; E430-Y534 HydrophobicContact CG-CE1 3.75Å; E430-Y534 HydrophobicContact CG-CE2 3.74Å; E430-Y534 VanDerWaalsContact CG-CZ 3.45Å; F508-Y534 HydrophobicContact CZ-CD2 4.37Å; F508-Y534 HydrophobicContact CZ-CG 4.2Å; V509-Y534 PolarHBondContact O-N 2.73Å; Y534-R536 HydrophobicContact CD1-CG 4.45Å; Y534-R536 HydrophobicContact CE1-CG 3.44Å; Y534-R536 VanDerWaalsContact CE1-CG 3.44Å; Y534-F549 AromaticContact CD2-CD2 3.96Å; Y534-F549 HydrophobicContact CD2-CD2 3.96Å; Y534-F549 HydrophobicContact CE2-CB 3.72Å; Y534-F549 HydrophobicContact CE2-CD1 4.46Å; Y534-F549 AromaticContact CE2-CD2 3.42Å; Y534-F549 HydrophobicContact CE2-CD2 3.42Å; Y534-F549 VanDerWaalsContact CE2-CD2 3.42Å; Y534-F549 HydrophobicContact CE2-CE2 4.12Å; Y534-F549 AromaticContact CE2-CG 3.63Å; Y534-F549 HydrophobicContact CE2-CG 3.63Å; Y534-Y551 HydrophobicContact CD2-CD1 4.43Å; Y534-Y551 AromaticContact CD2-CE1 3.84Å; Y534-Y551 HydrophobicContact CD2-CE1 3.84Å
535	I	91.7	Very high	76.7	Confident	22 Å²	22	76.5 Å²	76.5	11%	0.113	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	128	-179.5	-60.5	-178.9	0	0	0	108.2	E511 K533 L537 F549 G550 R552 L573	E511-I535 VanDerWaalsContact OE1-CA 3.28Å; E511-I535 WeakPolarHBondContact OE1-CA 3.32Å; E511-I535 WeakPolarHBondContact OE1-CG2 3.34Å; K533-I535 HydrophobicContact CG-CG1 4.3Å; I535-L537 HydrophobicContact CG2-CD2 4.22Å; I535-F549 WeakPolarHBondContact O-CA 3.46Å; I535-F549 WeakPolarHBondContact O-CB 3.45Å; I535-G550 PolarHBondContact N-O 3.46Å; I535-G550 PolarHBondContact O-N 3.47Å; I535-R552 HydrophobicContact CD1-CB 4.27Å; I535-R552 HydrophobicContact CD1-CG 3.75Å; I535-L573 HydrophobicContact CB-CD1 4.39Å; I535-L573 HydrophobicContact CD1-CD1 4.25Å
536	R	87.9	Confident	75	Confident	119 Å²	119	79.9 Å²	79.9	45%	0.449	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	138.7	171.2	-65.1	-178.6	173.8	177.3	1.5	109.1	E430 E511 Y534	E430-R536 IonicContact OE1-CZ 2.8Å; E430-R536 IonicContact OE1-NH2 3.9Å; E430-R536 PolarHBondContact OE1-NH2 3.35Å; E511-R536 PolarHBondContact OE1-N 3.13Å; E511-R536 WeakPolarHBondContact OE2-CB 3.22Å; E511-R536 WeakPolarHBondContact OE2-CG 3.46Å; E511-R536 PolarHBondContact OE2-N 3.46Å; Y534-R536 HydrophobicContact CD1-CG 4.45Å; Y534-R536 HydrophobicContact CE1-CG 3.44Å; Y534-R536 VanDerWaalsContact CE1-CG 3.44Å
537	L	82.3	Confident	73.1	Confident	52 Å²	52	88.3 Å²	88.3	27%	0.272	44%	0.437	S	S	.	.			trans	-102.4	112.3	174.7	-52.3	178.5	0	0	0	107.2	I535 N539 K548 L573	I535-L537 HydrophobicContact CG2-CD2 4.22Å; L537-N539 PolarHBondContact O-N 2.91Å; L537-N539 VanDerWaalsContact O-N 3.11Å; L537-K548 WeakPolarHBondContact CA-O 3.34Å; L537-K548 HydrophobicContact CB-CB 4.36Å; L537-K548 WeakPolarHBondContact CB-O 3.33Å; L537-K548 HydrophobicContact CD1-CB 4.38Å; L537-K548 HydrophobicContact CD1-CD 4.15Å; L537-K548 HydrophobicContact CD1-CG 4.04Å; L537-K548 PolarHBondContact N-O 3.21Å; L537-L573 HydrophobicContact CD1-CD2 4.04Å; L537-L573 HydrophobicContact CD2-CD2 3.77Å
538	N	68.4	Low	72.3	Confident	139 Å²	139	91.7 Å²	91.7	74%	0.743	45%	0.452	S	S	*	.			trans	-67.5	110.8	173.6	-69.7	-3.7	0	0	0	108.2	D540	N538-D540 PolarHBondContact O-N 3.12Å
539	N	54	Low	72	Confident	96 Å²	96	93.3 Å²	93.3	51%	0.513	46%	0.459	S	S	.	.			trans	-74.2	81.1	163.4	-67.2	-11	0	0	0	107.9	L537 I541 D546	L537-N539 PolarHBondContact O-N 2.91Å; L537-N539 VanDerWaalsContact O-N 3.11Å; N539-I541 PolarHBondContact O-N 3.17Å; N539-D546 PolarHBondContact ND2-O 3.13Å
540	D	47.7	Very low	71.7	Confident	140 Å²	140	92.6 Å²	92.6	75%	0.749	46%	0.456	S	S	*	.			trans	-60.7	118.7	154.3	-72.5	-38.5	0	0	0	106.6	N538	N538-D540 PolarHBondContact O-N 3.12Å
541	I	46.9	Very low	71.6	Confident	152 Å²	152	92.6 Å²	92.6	78%	0.779	46%	0.456	S	S	*	.	S	Bend	trans	77.5	79.6	-179.9	-44	155.3	0	0	0	114.7	N539	N539-I541 PolarHBondContact O-N 3.17Å
542	D	48.2	Very low	71.6	Confident	139 Å²	139	97.1 Å²	97.1	74%	0.743	47%	0.472	S	S	*	.				167.6	135.8	119.4	-90.3	-18.3	0	0	0	113.8	K544	D542-K544 PolarHBondContact O-N 2.89Å
543	D	42.4	Very low	71.5	Confident	172 Å²	172	97.2 Å²	97.2	92%	0.92	47%	0.472	S	S	*	.			trans	-76	63.5	-171.3	-76.7	-55.1	0	0	0	115.6
544	K	48.1	Very low	71.5	Confident	184 Å²	184	95.7 Å²	95.7	80%	0.8	47%	0.473	S	S	*	.	S	Bend	trans	-144.4	71.7	170.7	-69.2	-168.8	-179	172.4	0	115.7	D542 D546	D542-K544 PolarHBondContact O-N 2.89Å; K544-D546 PolarHBondContact O-N 3.24Å
545	N	47.8	Very low	71.5	Confident	159 Å²	159	97 Å²	97	85%	0.85	48%	0.483	S	S	*	.			trans	46.3	-18.8	152.9	-72.7	-5.5	0	0	0	123.1	F547	N545-F547 PolarHBondContact O-N 3.47Å
546	D	53.9	Low	71.5	Confident	140 Å²	140	97.7 Å²	97.7	75%	0.749	49%	0.489	S	S	*	.			trans	-88.2	93.2	-177.4	-73.8	-26.7	0	0	0	110.7	N539 K544 K548	N539-D546 PolarHBondContact ND2-O 3.13Å; K544-D546 PolarHBondContact O-N 3.24Å; D546-K548 PolarHBondContact O-N 3.09Å
547	F	55.1	Low	71.8	Confident	181 Å²	181	97.5 Å²	97.5	79%	0.794	49%	0.488	S	S	*	.			trans	-62.4	104.2	170	-70.2	-81.5	0	0	0	110.2	N545	N545-F547 PolarHBondContact O-N 3.47Å
548	K	76.5	Confident	72.2	Confident	100 Å²	100	96.5 Å²	96.5	44%	0.435	49%	0.488	S	S	.	.			trans	-72.8	140.2	173.1	-158.1	178	179.9	176.6	0	109.8	L537 D546 E575	L537-K548 WeakPolarHBondContact CA-O 3.34Å; L537-K548 HydrophobicContact CB-CB 4.36Å; L537-K548 WeakPolarHBondContact CB-O 3.33Å; L537-K548 HydrophobicContact CD1-CB 4.38Å; L537-K548 HydrophobicContact CD1-CD 4.15Å; L537-K548 HydrophobicContact CD1-CG 4.04Å; L537-K548 PolarHBondContact N-O 3.21Å; D546-K548 PolarHBondContact O-N 3.09Å; K548-E575 VanDerWaalsContact CE-OE1 3.25Å; K548-E575 WeakPolarHBondContact CE-OE1 3.38Å; K548-E575 IonicContact NZ-OE1 3.91Å; K548-E575 PolarHBondContact NZ-OE1 3.28Å
549	F	88.4	Confident	73.3	Confident	34 Å²	34	99.1 Å²	99.1	15%	0.149	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	167.2	177.4	65.3	-90.3	0	0	0	110.4	E433 Y534 I535 Y551 H576	E433-F549 VanDerWaalsContact CD-CZ 3.43Å; E433-F549 HydrophobicContact CG-CZ 4.33Å; E433-F549 VanDerWaalsContact OE2-CZ 3.24Å; E433-F549 WeakPolarHBondContact OE2-CZ 3.45Å; Y534-F549 AromaticContact CD2-CD2 3.96Å; Y534-F549 HydrophobicContact CD2-CD2 3.96Å; Y534-F549 HydrophobicContact CE2-CB 3.72Å; Y534-F549 HydrophobicContact CE2-CD1 4.46Å; Y534-F549 AromaticContact CE2-CD2 3.42Å; Y534-F549 HydrophobicContact CE2-CD2 3.42Å; Y534-F549 VanDerWaalsContact CE2-CD2 3.42Å; Y534-F549 HydrophobicContact CE2-CE2 4.12Å; Y534-F549 AromaticContact CE2-CG 3.63Å; Y534-F549 HydrophobicContact CE2-CG 3.63Å; I535-F549 WeakPolarHBondContact O-CA 3.46Å; I535-F549 WeakPolarHBondContact O-CB 3.45Å; F549-Y551 HydrophobicContact CE2-CE2 4.14Å; F549-Y551 AromaticContact CE2-CZ 3.91Å; F549-H576 HydrophobicContact CD2-CB 4.4Å; F549-H576 HydrophobicContact CE2-CB 3.49Å; F549-H576 VanDerWaalsContact CE2-CB 3.49Å; F549-H576 AromaticContact CE2-CG 3.79Å; F549-H576 AromaticContact CE2-ND1 3.66Å; F549-H576 HydrophobicContact CZ-CB 3.69Å; F549-H576 AromaticContact CZ-CG 3.79Å; F549-H576 AromaticContact CZ-ND1 3.85Å
550	G	90.9	Very high	74.9	Confident	1 Å²	1	98.9 Å²	98.9	1%	0.01	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	179.9	176.7	0	0	0	0	0	112.7	I535 F574	I535-G550 PolarHBondContact N-O 3.46Å; I535-G550 PolarHBondContact O-N 3.47Å; G550-F574 CarbonylContact C-O 3.58Å; G550-F574 VanDerWaalsContact CA-O 3.23Å; G550-F574 WeakPolarHBondContact CA-O 3.49Å
551	Y	94.7	Very high	77	Confident	0 Å²	0	92.2 Å²	92.2	0%	0	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.6	-176.5	-55.8	-73.8	0	0	0	111.7	F434 F508 V532 K533 Y534 F549 F574 H576 F580	F434-Y551 HydrophobicContact CD2-CE1 4.48Å; F508-Y551 AromaticContact CE2-CE1 3.95Å; F508-Y551 HydrophobicContact CE2-CE1 3.95Å; V532-Y551 HydrophobicContact CG1-CD1 3.7Å; V532-Y551 HydrophobicContact CG1-CE1 4.46Å; V532-Y551 HydrophobicContact CG1-CG 3.98Å; K533-Y551 CarbonylContact O-C 3.59Å; K533-Y551 VanDerWaalsContact O-CA 3.26Å; K533-Y551 WeakPolarHBondContact O-CA 3.47Å; Y534-Y551 HydrophobicContact CD2-CD1 4.43Å; Y534-Y551 AromaticContact CD2-CE1 3.84Å; Y534-Y551 HydrophobicContact CD2-CE1 3.84Å; F549-Y551 HydrophobicContact CE2-CE2 4.14Å; F549-Y551 AromaticContact CE2-CZ 3.91Å; Y551-F574 PolarHBondContact N-O 2.84Å; Y551-F574 PolarHBondContact O-N 2.86Å; Y551-H576 HydrophobicContact CE2-CB 3.95Å; Y551-H576 AromaticContact CE2-ND1 3.54Å; Y551-H576 AromaticContact CZ-ND1 3.7Å; Y551-H576 PolarHBondContact OH-ND1 2.74Å; Y551-F580 AromaticContact CD2-CD1 3.74Å; Y551-F580 HydrophobicContact CD2-CD1 3.74Å; Y551-F580 AromaticContact CD2-CE1 3.25Å; Y551-F580 HydrophobicContact CD2-CE1 3.25Å; Y551-F580 HydrophobicContact CD2-CZ 4.06Å; Y551-F580 HydrophobicContact CE2-CD1 4.21Å; Y551-F580 AromaticContact CE2-CE1 3.91Å; Y551-F580 HydrophobicContact CE2-CE1 3.91Å; Y551-F580 AromaticContact CG-CE1 3.68Å; Y551-F580 HydrophobicContact CG-CE1 3.68Å; Y551-F580 HydrophobicContact CG-CZ 4.1Å
552	R	93.8	Very high	79	Confident	121 Å²	121	87.3 Å²	87.3	46%	0.457	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	143.4	160.5	-77	-176.3	-172.2	144.7	7.4	109.8	K533 I535 S570 L573	K533-R552 PolarHBondContact N-O 3.11Å; K533-R552 PolarHBondContact O-N 3.37Å; I535-R552 HydrophobicContact CD1-CB 4.27Å; I535-R552 HydrophobicContact CD1-CG 3.75Å; R552-S570 WeakPolarHBondContact CD-O 3.29Å; R552-L573 HydrophobicContact CG-CD1 4.45Å
553	V	94.8	Very high	81	Confident	1 Å²	1	86.7 Å²	86.7	1%	0.006	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	126.2	-175.6	177.1	0	0	0	0	111.4	I530 L531 V532 I568 F574 F580 L584	I530-V553 HydrophobicContact CG2-CG1 4.05Å; L531-V553 VanDerWaalsContact O-CA 3.32Å; L531-V553 WeakPolarHBondContact O-CA 3.5Å; V532-V553 HydrophobicContact CG1-CG2 4.39Å; V532-V553 HydrophobicContact CG2-CG2 4.26Å; V553-I568 HydrophobicContact CB-CG2 3.95Å; V553-I568 HydrophobicContact CG1-CD1 4.31Å; V553-I568 HydrophobicContact CG1-CG2 4.06Å; V553-F574 HydrophobicContact CB-CD2 4.49Å; V553-F574 HydrophobicContact CB-CE2 4.19Å; V553-F574 HydrophobicContact CG2-CD2 4.07Å; V553-F574 HydrophobicContact CG2-CE2 4.22Å; V553-F580 HydrophobicContact CG2-CE2 3.58Å; V553-F580 HydrophobicContact CG2-CZ 3.55Å; V553-L584 HydrophobicContact CG1-CD2 4.16Å; V553-L584 HydrophobicContact CG2-CD2 4.18Å
554	A	93.3	Very high	83.3	Confident	39 Å²	39	78.7 Å²	78.7	32%	0.322	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	150	173.8	0	0	0	0	0	110.5	L531	L531-A554 HydrophobicContact CB-CB 4.28Å; L531-A554 PolarHBondContact N-O 3.14Å; L531-A554 PolarHBondContact O-N 2.6Å
555	V	94.1	Very high	85.2	Confident	46 Å²	46	70.3 Å²	70.3	28%	0.279	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	108.2	-175.9	-177.9	0	0	0	0	110.6	V528 F529 I530 F564	V528-V555 HydrophobicContact CG1-CG1 4.09Å; F529-V555 WeakPolarHBondContact O-CA 3.5Å; I530-V555 HydrophobicContact CG1-CG2 4.44Å; I530-V555 HydrophobicContact CG2-CG2 4.5Å; V555-F564 HydrophobicContact CG1-CE2 4.13Å; V555-F564 HydrophobicContact CG1-CZ 3.64Å
556	C	92.7	Very high	87	Confident	37 Å²	37	63.3 Å²	63.3	25%	0.25	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	135.5	173.1	-57.6	0	0	0	0	109.6	P518 V528 F529 L531	P518-C556 HydrophobicContact CB-CB 4.5Å; P518-C556 HydrophobicContact CG-CB 3.78Å; V528-C556 CarbonylContact C-O 3.57Å; V528-C556 WeakPolarHBondContact CA-O 3.5Å; F529-C556 HydrophobicContact CB-CB 4.32Å; F529-C556 HydrophobicContact CD2-CB 4.46Å; F529-C556 PolarHBondContact N-O 3.27Å; F529-C556 PolarHBondContact O-N 2.98Å; L531-C556 HydrophobicContact CD1-CB 4.45Å
557	R	93.3	Very high	88.5	Confident	115 Å²	115	63.2 Å²	63.2	43%	0.434	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	148	177.4	63.7	179.4	171.8	78.8	6	111	K527 V528 V561 F564	K527-R557 WeakPolarHBondContact O-CA 3.43Å; V528-R557 HydrophobicContact CG2-CB 4.09Å; R557-V561 HydrophobicContact CB-CB 4.41Å; R557-V561 WeakPolarHBondContact CD-O 3.22Å; R557-V561 PolarHBondContact NH1-O 2.87Å; R557-F564 HydrophobicContact CB-CE1 4.36Å
558	A	92.1	Very high	89.9	Confident	31 Å²	31	56 Å²	56	26%	0.256	28%	0.28	S	S	.	.			trans	-60.7	142.1	168.4	0	0	0	0	0	110.2	K527 D560 V561	K527-A558 HydrophobicContact CB-CB 4.36Å; K527-A558 HydrophobicContact CD-CB 3.87Å; K527-A558 PolarHBondContact O-N 2.96Å; A558-D560 VanDerWaalsContact C-N 3.26Å; A558-D560 PolarHBondContact O-N 2.85Å; A558-D560 VanDerWaalsContact O-N 3.12Å; A558-V561 HydrophobicContact CB-CG2 4.14Å; A558-V561 WeakPolarHBondContact O-CB 3.42Å; A558-V561 PolarHBondContact O-N 3.46Å
559	K	89.7	Confident	90.1	Very high	194 Å²	194	54.1 Å²	54.1	84%	0.843	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-42.4	-172	-172.7	175.7	-179.3	176.9	0	114.2	V561	K559-V561 VanDerWaalsContact C-N 3.31Å; K559-V561 PolarHBondContact O-N 3.41Å
560	D	88.1	Confident	89.5	Confident	90 Å²	90	55.5 Å²	55.5	48%	0.481	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-12.2	-179.8	-66.9	16.3	0	0	0	114.5	A558 Y598 S599	A558-D560 VanDerWaalsContact C-N 3.26Å; A558-D560 PolarHBondContact O-N 2.85Å; A558-D560 VanDerWaalsContact O-N 3.12Å; D560-Y598 HydrophobicContact CB-CD2 3.47Å; D560-Y598 VanDerWaalsContact CB-CD2 3.47Å; D560-Y598 HydrophobicContact CB-CE2 3.62Å; D560-Y598 WeakPolarHBondContact OD2-CE2 3.36Å; D560-S599 PolarHBondContact OD2-OG 3.37Å
561	V	91.6	Very high	89	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.323	C	S	.	.	S	Bend	trans	-83.2	124.6	173.7	179.4	0	0	0	0	107.1	K527 V528 R557 A558 K559 F564 A594 V595 Y598	K527-V561 HydrophobicContact CB-CG2 4.13Å; V528-V561 HydrophobicContact CG2-CG1 4.19Å; R557-V561 HydrophobicContact CB-CB 4.41Å; R557-V561 WeakPolarHBondContact CD-O 3.22Å; R557-V561 PolarHBondContact NH1-O 2.87Å; A558-V561 HydrophobicContact CB-CG2 4.14Å; A558-V561 WeakPolarHBondContact O-CB 3.42Å; A558-V561 PolarHBondContact O-N 3.46Å; K559-V561 VanDerWaalsContact C-N 3.31Å; K559-V561 PolarHBondContact O-N 3.41Å; V561-F564 HydrophobicContact CG1-CD1 4.3Å; V561-F564 HydrophobicContact CG1-CE1 4.25Å; V561-A594 HydrophobicContact CG1-CB 3.9Å; V561-V595 HydrophobicContact CG1-CG2 4.02Å; V561-V595 HydrophobicContact CG2-CG2 4.07Å; V561-Y598 HydrophobicContact CG2-CD2 4.38Å; V561-Y598 HydrophobicContact CG2-CG 4.47Å
562	P	90.3	Very high	88.7	Confident	49 Å²	49	66.4 Å²	66.4	32%	0.318	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-65.6	171.5	179.4	27.4	-33.8	0	0	0	111.9	F564 A594 K597	P562-F564 VanDerWaalsContact O-CD1 3.31Å; P562-F564 WeakPolarHBondContact O-CD1 3.25Å; P562-A594 HydrophobicContact CG-CB 4.23Å; P562-K597 HydrophobicContact CG-CB 4.18Å; P562-K597 HydrophobicContact CG-CD 3.79Å
563	Q	89.8	Confident	88.5	Confident	126 Å²	126	63.6 Å²	63.6	59%	0.589	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-65.6	150.5	166	-176.1	164.3	-20.5	0	0	110.4
564	F	91.2	Very high	88.4	Confident	5 Å²	5	64.3 Å²	64.3	2%	0.022	34%	0.34	C	S	.	.			trans	-155.9	153.1	-174	58.3	-99.1	0	0	0	112	E139 V528 V555 R557 V561 P562 K587 N590 A591 A594	E139-F564 VanDerWaalsContact OE2-CA 3.25Å; E139-F564 WeakPolarHBondContact OE2-CA 3.35Å; E139-F564 WeakPolarHBondContact OE2-CB 3.18Å; V528-F564 HydrophobicContact CB-CZ 4.42Å; V528-F564 HydrophobicContact CG1-CE1 4.32Å; V528-F564 HydrophobicContact CG1-CE2 4.45Å; V528-F564 HydrophobicContact CG1-CZ 3.62Å; V528-F564 HydrophobicContact CG2-CE1 3.71Å; V528-F564 HydrophobicContact CG2-CZ 3.86Å; V555-F564 HydrophobicContact CG1-CE2 4.13Å; V555-F564 HydrophobicContact CG1-CZ 3.64Å; R557-F564 HydrophobicContact CB-CE1 4.36Å; V561-F564 HydrophobicContact CG1-CD1 4.3Å; V561-F564 HydrophobicContact CG1-CE1 4.25Å; P562-F564 VanDerWaalsContact O-CD1 3.31Å; P562-F564 WeakPolarHBondContact O-CD1 3.25Å; F564-K587 HydrophobicContact CD2-CD 4.23Å; F564-K587 HydrophobicContact CE2-CD 4.09Å; F564-K587 HydrophobicContact CE2-CG 4.35Å; F564-K587 PolarHBondContact O-NZ 2.99Å; F564-N590 HydrophobicContact CB-CB 4.38Å; F564-A591 VanDerWaalsContact CD2-CA 3.48Å; F564-A591 HydrophobicContact CD2-CB 3.77Å; F564-A591 HydrophobicContact CE1-CB 4.25Å; F564-A591 HydrophobicContact CE2-CB 3.38Å; F564-A591 HydrophobicContact CG-CB 4.41Å; F564-A591 HydrophobicContact CZ-CB 3.66Å; F564-A594 HydrophobicContact CB-CB 3.64Å; F564-A594 HydrophobicContact CD1-CB 3.5Å; F564-A594 HydrophobicContact CE1-CB 4.48Å; F564-A594 HydrophobicContact CG-CB 3.82Å
565	G	87.3	Confident	88.2	Confident	8 Å²	8	67.2 Å²	67.2	8%	0.082	35%	0.347	C	S	.	.	S	Bend	trans	61.4	179	174.5	0	0	0	0	0	114.8	E139 I567	E139-G565 WeakPolarHBondContact OE1-CA 3.17Å; E139-G565 PolarHBondContact OE1-N 3.03Å; E139-G565 PolarHBondContact OE2-N 3.28Å; G565-I567 PolarHBondContact O-N 3.47Å
566	P	85.8	Confident	88.1	Confident	12 Å²	12	68.1 Å²	68.1	8%	0.078	35%	0.348	C	S	.	.	S	Bend	trans	-50.6	135.6	177.9	18.3	-31.3	0	0	0	111.7	Y136 I568 L583 K587	Y136-P566 HydrophobicContact CD1-CB 3.8Å; Y136-P566 HydrophobicContact CD1-CG 4.4Å; Y136-P566 HydrophobicContact CD2-CB 3.75Å; Y136-P566 HydrophobicContact CD2-CG 3.81Å; Y136-P566 HydrophobicContact CE1-CB 3.81Å; Y136-P566 HydrophobicContact CE2-CB 3.74Å; Y136-P566 HydrophobicContact CE2-CG 4.21Å; Y136-P566 HydrophobicContact CG-CB 3.78Å; Y136-P566 HydrophobicContact CG-CG 3.91Å; P566-I568 PolarHBondContact O-N 3.22Å; P566-L583 HydrophobicContact CB-CD1 3.9Å; P566-L583 HydrophobicContact CG-CD1 3.43Å; P566-L583 VanDerWaalsContact CG-CD1 3.43Å; P566-K587 HydrophobicContact CG-CD 4.49Å; P566-K587 PolarHBondContact O-NZ 2.75Å
567	I	85.3	Confident	88	Confident	138 Å²	138	69.3 Å²	69.3	71%	0.708	35%	0.352	S	S	*	.			trans	-70.3	126.9	177.8	-56.5	-178.2	0	0	0	107.7	G565	G565-I567 PolarHBondContact O-N 3.47Å
568	I	85.4	Confident	87.9	Confident	30 Å²	30	69.6 Å²	69.6	15%	0.154	36%	0.361	C	S	.	.			trans	-117.6	122.8	-179.4	-66.7	170.4	0	0	0	106.2	V553 P566 F574 L583 K587	V553-I568 HydrophobicContact CB-CG2 3.95Å; V553-I568 HydrophobicContact CG1-CD1 4.31Å; V553-I568 HydrophobicContact CG1-CG2 4.06Å; P566-I568 PolarHBondContact O-N 3.22Å; I568-F574 HydrophobicContact CG2-CE2 3.84Å; I568-F574 HydrophobicContact CG2-CZ 3.91Å; I568-L583 HydrophobicContact CD1-CD1 4.17Å; I568-L583 HydrophobicContact CD1-CD2 3.99Å; I568-L583 HydrophobicContact CD1-CG 4.06Å; I568-L583 HydrophobicContact CG1-CD1 4.35Å; I568-L583 HydrophobicContact CG1-CD2 4.22Å; I568-K587 HydrophobicContact CD1-CB 4.44Å; I568-K587 HydrophobicContact CD1-CD 4.06Å; I568-K587 HydrophobicContact CD1-CG 4Å
569	S	80.6	Confident	87.8	Confident	60 Å²	60	69.9 Å²	69.9	42%	0.42	36%	0.362	S	S	.	.			trans	-74.9	139.2	169	178.8	0	0	0	0	109.6	D571	S569-D571 PolarHBondContact O-N 3.34Å; S569-D571 PolarHBondContact OG-N 2.92Å
570	S	74.7	Confident	88	Confident	63 Å²	63	60.8 Å²	60.8	44%	0.441	32%	0.322	S	S	.	.	S	Bend	trans	-60.4	-25.9	172.1	42.3	0	0	0	0	113.3	R552	R552-S570 WeakPolarHBondContact CD-O 3.29Å
571	D	80.9	Confident	88.3	Confident	119 Å²	119	56.6 Å²	56.6	64%	0.636	30%	0.3	S	S	*	.	S	Bend	trans	-94.8	-18.7	-165.3	-46	-21.2	0	0	0	111	S569	S569-D571 PolarHBondContact O-N 3.34Å; S569-D571 PolarHBondContact OG-N 2.92Å
572	Y	87.2	Confident	88.4	Confident	111 Å²	111	58 Å²	58	44%	0.435	31%	0.308	S	S	.	.			trans	-69.6	129.1	177.4	-169.9	-88.4	0	0	0	110.8	A130 F574	A130-Y572 HydrophobicContact CB-CE2 4.27Å; Y572-F574 AromaticContact CD1-CD1 3.68Å; Y572-F574 HydrophobicContact CD1-CD1 3.68Å; Y572-F574 AromaticContact CD1-CD2 3.82Å; Y572-F574 HydrophobicContact CD1-CD2 3.82Å; Y572-F574 AromaticContact CD1-CE1 3.54Å; Y572-F574 HydrophobicContact CD1-CE1 3.54Å; Y572-F574 AromaticContact CD1-CE2 3.69Å; Y572-F574 HydrophobicContact CD1-CE2 3.69Å; Y572-F574 AromaticContact CD1-CG 3.81Å; Y572-F574 HydrophobicContact CD1-CG 3.81Å; Y572-F574 AromaticContact CD1-CZ 3.55Å; Y572-F574 HydrophobicContact CD1-CZ 3.55Å; Y572-F574 AromaticContact CE1-CD1 3.54Å; Y572-F574 HydrophobicContact CE1-CD1 3.54Å; Y572-F574 HydrophobicContact CE1-CD2 4.45Å; Y572-F574 AromaticContact CE1-CE1 3.63Å; Y572-F574 HydrophobicContact CE1-CE1 3.63Å; Y572-F574 AromaticContact CE1-CG 3.97Å; Y572-F574 HydrophobicContact CE1-CG 3.97Å; Y572-F574 HydrophobicContact CE1-CZ 4.14Å; Y572-F574 HydrophobicContact CG-CZ 4.39Å
573	L	90.6	Very high	88.5	Confident	62 Å²	62	55.8 Å²	55.8	33%	0.325	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	111.3	176.1	-177.5	74.1	0	0	0	109.1	I535 L537 R552	I535-L573 HydrophobicContact CB-CD1 4.39Å; I535-L573 HydrophobicContact CD1-CD1 4.25Å; L537-L573 HydrophobicContact CD1-CD2 4.04Å; L537-L573 HydrophobicContact CD2-CD2 3.77Å; R552-L573 HydrophobicContact CG-CD1 4.45Å
574	F	92.1	Very high	88.8	Confident	16 Å²	16	49.8 Å²	49.8	7%	0.07	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	135	174.5	-63	-86.5	0	0	0	110.8	M133 G550 Y551 V553 I568 Y572 F580 L583	M133-F574 HydrophobicContact CE-CE1 4.31Å; G550-F574 CarbonylContact C-O 3.58Å; G550-F574 VanDerWaalsContact CA-O 3.23Å; G550-F574 WeakPolarHBondContact CA-O 3.49Å; Y551-F574 PolarHBondContact N-O 2.84Å; Y551-F574 PolarHBondContact O-N 2.86Å; V553-F574 HydrophobicContact CB-CD2 4.49Å; V553-F574 HydrophobicContact CB-CE2 4.19Å; V553-F574 HydrophobicContact CG2-CD2 4.07Å; V553-F574 HydrophobicContact CG2-CE2 4.22Å; I568-F574 HydrophobicContact CG2-CE2 3.84Å; I568-F574 HydrophobicContact CG2-CZ 3.91Å; Y572-F574 AromaticContact CD1-CD1 3.68Å; Y572-F574 HydrophobicContact CD1-CD1 3.68Å; Y572-F574 AromaticContact CD1-CD2 3.82Å; Y572-F574 HydrophobicContact CD1-CD2 3.82Å; Y572-F574 AromaticContact CD1-CE1 3.54Å; Y572-F574 HydrophobicContact CD1-CE1 3.54Å; Y572-F574 AromaticContact CD1-CE2 3.69Å; Y572-F574 HydrophobicContact CD1-CE2 3.69Å; Y572-F574 AromaticContact CD1-CG 3.81Å; Y572-F574 HydrophobicContact CD1-CG 3.81Å; Y572-F574 AromaticContact CD1-CZ 3.55Å; Y572-F574 HydrophobicContact CD1-CZ 3.55Å; Y572-F574 AromaticContact CE1-CD1 3.54Å; Y572-F574 HydrophobicContact CE1-CD1 3.54Å; Y572-F574 HydrophobicContact CE1-CD2 4.45Å; Y572-F574 AromaticContact CE1-CE1 3.63Å; Y572-F574 HydrophobicContact CE1-CE1 3.63Å; Y572-F574 AromaticContact CE1-CG 3.97Å; Y572-F574 HydrophobicContact CE1-CG 3.97Å; Y572-F574 HydrophobicContact CE1-CZ 4.14Å; Y572-F574 HydrophobicContact CG-CZ 4.39Å; F574-F580 HydrophobicContact CB-CB 4.47Å; F574-F580 HydrophobicContact CB-CD1 4.34Å; F574-F580 HydrophobicContact CB-CD2 3.39Å; F574-F580 HydrophobicContact CB-CE1 4.48Å; F574-F580 HydrophobicContact CB-CE2 3.53Å; F574-F580 HydrophobicContact CB-CG 3.82Å; F574-F580 HydrophobicContact CB-CZ 4.09Å; F574-F580 AromaticContact CD1-CD2 3.49Å; F574-F580 HydrophobicContact CD1-CD2 3.49Å; F574-F580 VanDerWaalsContact CD1-CD2 3.49Å; F574-F580 AromaticContact CD1-CE2 3.93Å; F574-F580 HydrophobicContact CD1-CE2 3.93Å; F574-F580 HydrophobicContact CD1-CG 4.41Å; F574-F580 HydrophobicContact CD2-CD2 4.02Å; F574-F580 AromaticContact CD2-CE2 3.57Å; F574-F580 HydrophobicContact CD2-CE2 3.57Å; F574-F580 HydrophobicContact CD2-CZ 4.41Å; F574-F580 HydrophobicContact CE1-CD2 4.26Å; F574-F580 HydrophobicContact CE2-CE2 4.26Å; F574-F580 AromaticContact CG-CD2 3.34Å; F574-F580 HydrophobicContact CG-CD2 3.34Å; F574-F580 AromaticContact CG-CE2 3.38Å; F574-F580 HydrophobicContact CG-CE2 3.38Å; F574-F580 HydrophobicContact CG-CG 4.25Å; F574-F580 HydrophobicContact CG-CZ 4.33Å; F574-L583 HydrophobicContact CD1-CD2 4.08Å; F574-L583 HydrophobicContact CE1-CD2 3.35Å; F574-L583 HydrophobicContact CZ-CD2 3.64Å
575	E	90.4	Very high	89	Confident	99 Å²	99	49.8 Å²	49.8	46%	0.463	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	156.3	168.6	-58.8	-169.9	137.2	0	0	111.1	K548 N577	K548-E575 VanDerWaalsContact CE-OE1 3.25Å; K548-E575 WeakPolarHBondContact CE-OE1 3.38Å; K548-E575 IonicContact NZ-OE1 3.91Å; K548-E575 PolarHBondContact NZ-OE1 3.28Å; E575-N577 PolarHBondContact O-N 3.33Å
576	H	90.9	Very high	89.3	Confident	65 Å²	65	49.5 Å²	49.5	30%	0.301	26%	0.262	S	S	.	.	S	Bend	trans	-73.2	93.5	173.6	-172.7	103.4	0	0	0	110.4	E433 F549 Y551	E433-H576 VanDerWaalsContact CG-CE1 3.44Å; E433-H576 WeakPolarHBondContact CG-CE1 3.27Å; F549-H576 HydrophobicContact CD2-CB 4.4Å; F549-H576 HydrophobicContact CE2-CB 3.49Å; F549-H576 VanDerWaalsContact CE2-CB 3.49Å; F549-H576 AromaticContact CE2-CG 3.79Å; F549-H576 AromaticContact CE2-ND1 3.66Å; F549-H576 HydrophobicContact CZ-CB 3.69Å; F549-H576 AromaticContact CZ-CG 3.79Å; F549-H576 AromaticContact CZ-ND1 3.85Å; Y551-H576 HydrophobicContact CE2-CB 3.95Å; Y551-H576 AromaticContact CE2-ND1 3.54Å; Y551-H576 AromaticContact CZ-ND1 3.7Å; Y551-H576 PolarHBondContact OH-ND1 2.74Å
577	N	90.9	Very high	89.8	Confident	63 Å²	63	49.6 Å²	49.6	34%	0.337	26%	0.261	S	S	.	.	S	Bend	trans	-147.4	162.4	176.4	66.1	47.5	0	0	0	112.4	L437 E575 S579 F580 G581	L437-N577 WeakPolarHBondContact CD1-O 3.35Å; E575-N577 PolarHBondContact O-N 3.33Å; N577-S579 PolarHBondContact O-N 3.36Å; N577-S579 PolarHBondContact OD1-N 3.09Å; N577-F580 WeakPolarHBondContact O-CB 3.39Å; N577-F580 PolarHBondContact O-N 3.35Å; N577-F580 VanDerWaalsContact O-N 3.07Å; N577-F580 PolarHBondContact OD1-N 3.39Å; N577-G581 PolarHBondContact O-N 3.02Å
578	L	91.5	Very high	90.3	Very high	120 Å²	120	43 Å²	43	63%	0.628	23%	0.227	S	C	*	.	H	α-helix	trans	-60.9	-31.3	-175.7	-176	61	0	0	0	113.1	F580 G581 N582	L578-F580 VanDerWaalsContact C-N 3.34Å; L578-F580 PolarHBondContact O-N 2.92Å; L578-G581 CarbonylContact O-C 3.59Å; L578-G581 WeakPolarHBondContact O-CA 3.39Å; L578-G581 PolarHBondContact O-N 2.91Å; L578-G581 VanDerWaalsContact O-N 3.11Å; L578-N582 VanDerWaalsContact O-CG 3.29Å; L578-N582 PolarHBondContact O-N 3.27Å
579	S	89.9	Confident	90.7	Very high	38 Å²	38	41.6 Å²	41.6	27%	0.266	22%	0.22	S	C	.	.	H	α-helix	trans	-66.5	-34.5	176.3	-56.2	0	0	0	0	112.1	N577 N582 L583	N577-S579 PolarHBondContact O-N 3.36Å; N577-S579 PolarHBondContact OD1-N 3.09Å; S579-N582 PolarHBondContact O-N 2.76Å; S579-L583 WeakPolarHBondContact O-CB 3.39Å; S579-L583 PolarHBondContact O-N 3.25Å
580	F	93.5	Very high	91.3	Very high	3 Å²	3	38.8 Å²	38.8	1%	0.013	20%	0.2	C	C	.	.	H	α-helix	trans	-65.2	-39.4	168.4	177	-120.8	0	0	0	112.1	L437 V532 Y551 V553 F574 N577 L578 L583 L584	L437-F580 HydrophobicContact CD2-CD1 3.78Å; L437-F580 HydrophobicContact CD2-CE1 4.45Å; V532-F580 HydrophobicContact CG1-CZ 4.23Å; Y551-F580 AromaticContact CD2-CD1 3.74Å; Y551-F580 HydrophobicContact CD2-CD1 3.74Å; Y551-F580 AromaticContact CD2-CE1 3.25Å; Y551-F580 HydrophobicContact CD2-CE1 3.25Å; Y551-F580 HydrophobicContact CD2-CZ 4.06Å; Y551-F580 HydrophobicContact CE2-CD1 4.21Å; Y551-F580 AromaticContact CE2-CE1 3.91Å; Y551-F580 HydrophobicContact CE2-CE1 3.91Å; Y551-F580 AromaticContact CG-CE1 3.68Å; Y551-F580 HydrophobicContact CG-CE1 3.68Å; Y551-F580 HydrophobicContact CG-CZ 4.1Å; V553-F580 HydrophobicContact CG2-CE2 3.58Å; V553-F580 HydrophobicContact CG2-CZ 3.55Å; F574-F580 HydrophobicContact CB-CB 4.47Å; F574-F580 HydrophobicContact CB-CD1 4.34Å; F574-F580 HydrophobicContact CB-CD2 3.39Å; F574-F580 HydrophobicContact CB-CE1 4.48Å; F574-F580 HydrophobicContact CB-CE2 3.53Å; F574-F580 HydrophobicContact CB-CG 3.82Å; F574-F580 HydrophobicContact CB-CZ 4.09Å; F574-F580 AromaticContact CD1-CD2 3.49Å; F574-F580 HydrophobicContact CD1-CD2 3.49Å; F574-F580 VanDerWaalsContact CD1-CD2 3.49Å; F574-F580 AromaticContact CD1-CE2 3.93Å; F574-F580 HydrophobicContact CD1-CE2 3.93Å; F574-F580 HydrophobicContact CD1-CG 4.41Å; F574-F580 HydrophobicContact CD2-CD2 4.02Å; F574-F580 AromaticContact CD2-CE2 3.57Å; F574-F580 HydrophobicContact CD2-CE2 3.57Å; F574-F580 HydrophobicContact CD2-CZ 4.41Å; F574-F580 HydrophobicContact CE1-CD2 4.26Å; F574-F580 HydrophobicContact CE2-CE2 4.26Å; F574-F580 AromaticContact CG-CD2 3.34Å; F574-F580 HydrophobicContact CG-CD2 3.34Å; F574-F580 AromaticContact CG-CE2 3.38Å; F574-F580 HydrophobicContact CG-CE2 3.38Å; F574-F580 HydrophobicContact CG-CG 4.25Å; F574-F580 HydrophobicContact CG-CZ 4.33Å; N577-F580 WeakPolarHBondContact O-CB 3.39Å; N577-F580 PolarHBondContact O-N 3.35Å; N577-F580 VanDerWaalsContact O-N 3.07Å; N577-F580 PolarHBondContact OD1-N 3.39Å; L578-F580 VanDerWaalsContact C-N 3.34Å; L578-F580 PolarHBondContact O-N 2.92Å; F580-L583 HydrophobicContact CD2-CD2 4.24Å; F580-L583 WeakPolarHBondContact O-CB 3.38Å; F580-L583 PolarHBondContact O-N 3.49Å; F580-L584 HydrophobicContact CD1-CD1 4.39Å; F580-L584 HydrophobicContact CD2-CG 4.4Å; F580-L584 HydrophobicContact CE1-CD1 3.76Å; F580-L584 HydrophobicContact CE1-CG 4.43Å; F580-L584 HydrophobicContact CE2-CD1 4.15Å; F580-L584 HydrophobicContact CE2-CD2 4.09Å; F580-L584 HydrophobicContact CE2-CG 3.98Å; F580-L584 HydrophobicContact CZ-CD1 3.64Å; F580-L584 HydrophobicContact CZ-CD2 4.19Å; F580-L584 HydrophobicContact CZ-CG 4Å; F580-L584 WeakPolarHBondContact O-CG 3.5Å; F580-L584 PolarHBondContact O-N 3.37Å
581	G	94.6	Very high	92.2	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-56.8	-52	169.3	0	0	0	0	0	112.2	N577 L578 L583 L584 L585	N577-G581 PolarHBondContact O-N 3.02Å; L578-G581 CarbonylContact O-C 3.59Å; L578-G581 WeakPolarHBondContact O-CA 3.39Å; L578-G581 PolarHBondContact O-N 2.91Å; L578-G581 VanDerWaalsContact O-N 3.11Å; G581-L583 VanDerWaalsContact C-N 3.3Å; G581-L583 PolarHBondContact O-N 3.03Å; G581-L584 PolarHBondContact O-N 3.33Å; G581-L584 VanDerWaalsContact O-N 3.14Å; G581-L585 WeakPolarHBondContact O-CG 3.17Å; G581-L585 PolarHBondContact O-N 3Å
582	N	93.9	Very high	92.8	Very high	31 Å²	31	30.2 Å²	30.2	17%	0.166	15%	0.15	C	C	.	.	H	α-helix	trans	-56.9	-40.4	177.3	-67.8	-18.1	0	0	0	112.4	D134 F470 L578 S579 T586	D134-N582 PolarHBondContact OD1-ND2 3.03Å; F470-N582 HydrophobicContact CE2-CB 4.06Å; F470-N582 WeakPolarHBondContact CE2-OD1 3.41Å; F470-N582 HydrophobicContact CZ-CB 4.21Å; L578-N582 VanDerWaalsContact O-CG 3.29Å; L578-N582 PolarHBondContact O-N 3.27Å; S579-N582 PolarHBondContact O-N 2.76Å; N582-T586 WeakPolarHBondContact O-CB 3.3Å; N582-T586 PolarHBondContact O-N 3.36Å; N582-T586 PolarHBondContact O-OG1 3.02Å
583	L	92.8	Very high	92.9	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-60	-51.4	174.1	174.9	69	0	0	0	111.2	M133 Y136 P566 I568 F574 S579 F580 G581 L585 T586 K587	M133-L583 HydrophobicContact CE-CD1 4.43Å; M133-L583 HydrophobicContact CE-CD2 4.22Å; M133-L583 HydrophobicContact SD-CB 3.87Å; M133-L583 HydrophobicContact SD-CD1 3.83Å; M133-L583 HydrophobicContact SD-CD2 3.77Å; M133-L583 HydrophobicContact SD-CG 4.02Å; Y136-L583 HydrophobicContact CD2-CD1 4.12Å; Y136-L583 HydrophobicContact CE2-CD1 3.97Å; P566-L583 HydrophobicContact CB-CD1 3.9Å; P566-L583 HydrophobicContact CG-CD1 3.43Å; P566-L583 VanDerWaalsContact CG-CD1 3.43Å; I568-L583 HydrophobicContact CD1-CD1 4.17Å; I568-L583 HydrophobicContact CD1-CD2 3.99Å; I568-L583 HydrophobicContact CD1-CG 4.06Å; I568-L583 HydrophobicContact CG1-CD1 4.35Å; I568-L583 HydrophobicContact CG1-CD2 4.22Å; F574-L583 HydrophobicContact CD1-CD2 4.08Å; F574-L583 HydrophobicContact CE1-CD2 3.35Å; F574-L583 HydrophobicContact CZ-CD2 3.64Å; S579-L583 WeakPolarHBondContact O-CB 3.39Å; S579-L583 PolarHBondContact O-N 3.25Å; F580-L583 HydrophobicContact CD2-CD2 4.24Å; F580-L583 WeakPolarHBondContact O-CB 3.38Å; F580-L583 PolarHBondContact O-N 3.49Å; G581-L583 VanDerWaalsContact C-N 3.3Å; G581-L583 PolarHBondContact O-N 3.03Å; L583-L585 PolarHBondContact O-N 3.02Å; L583-T586 PolarHBondContact O-N 2.9Å; L583-K587 VanDerWaalsContact O-CB 3.27Å; L583-K587 WeakPolarHBondContact O-CB 3.49Å; L583-K587 PolarHBondContact O-N 3.49Å
584	L	95.7	Very high	93	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.5	-42.6	-179.5	-71.4	-176.8	0	0	0	112.3	F434 L438 F506 I530 V532 V553 F580 G581 K587 A588	F434-L584 HydrophobicContact CE2-CD1 3.74Å; F434-L584 HydrophobicContact CZ-CD1 4.36Å; L438-L584 HydrophobicContact CD2-CB 4.05Å; L438-L584 HydrophobicContact CD2-CD1 4.05Å; F506-L584 HydrophobicContact CE1-CB 4.11Å; F506-L584 HydrophobicContact CE1-CD1 4.42Å; F506-L584 HydrophobicContact CE1-CD2 4.32Å; F506-L584 HydrophobicContact CZ-CB 4.39Å; I530-L584 HydrophobicContact CG2-CD2 4.16Å; V532-L584 HydrophobicContact CG2-CD1 4.18Å; V532-L584 HydrophobicContact CG2-CD2 4.32Å; V553-L584 HydrophobicContact CG1-CD2 4.16Å; V553-L584 HydrophobicContact CG2-CD2 4.18Å; F580-L584 HydrophobicContact CD1-CD1 4.39Å; F580-L584 HydrophobicContact CD2-CG 4.4Å; F580-L584 HydrophobicContact CE1-CD1 3.76Å; F580-L584 HydrophobicContact CE1-CG 4.43Å; F580-L584 HydrophobicContact CE2-CD1 4.15Å; F580-L584 HydrophobicContact CE2-CD2 4.09Å; F580-L584 HydrophobicContact CE2-CG 3.98Å; F580-L584 HydrophobicContact CZ-CD1 3.64Å; F580-L584 HydrophobicContact CZ-CD2 4.19Å; F580-L584 HydrophobicContact CZ-CG 4Å; F580-L584 WeakPolarHBondContact O-CG 3.5Å; F580-L584 PolarHBondContact O-N 3.37Å; G581-L584 PolarHBondContact O-N 3.33Å; G581-L584 VanDerWaalsContact O-N 3.14Å; L584-K587 PolarHBondContact O-N 2.87Å; L584-A588 WeakPolarHBondContact O-CB 3.2Å; L584-A588 PolarHBondContact O-N 2.72Å
585	L	95.6	Very high	93	Very high	6 Å²	6	22 Å²	22	3%	0.031	11%	0.114	C	C	.	.	H	α-helix	trans	-62.7	-46.8	176.1	-63.6	178.3	0	0	0	111.2	L438 T468 F470 I475 F477 G581 L583 K587 A588 I589	L438-L585 HydrophobicContact CD2-CD2 4.21Å; T468-L585 HydrophobicContact CG2-CD1 4.01Å; T468-L585 HydrophobicContact CG2-CD2 4.11Å; F470-L585 HydrophobicContact CB-CD1 4.12Å; F470-L585 HydrophobicContact CD1-CB 3.96Å; F470-L585 HydrophobicContact CD2-CB 4.44Å; F470-L585 HydrophobicContact CD2-CD1 3.8Å; F470-L585 HydrophobicContact CE1-CB 4.09Å; F470-L585 HydrophobicContact CE2-CD1 4.37Å; F470-L585 HydrophobicContact CG-CB 4.13Å; F470-L585 HydrophobicContact CG-CD1 3.93Å; F470-L585 HydrophobicContact CZ-CB 4.4Å; I475-L585 HydrophobicContact CD1-CB 4.47Å; I475-L585 HydrophobicContact CD1-CD2 3.9Å; F477-L585 HydrophobicContact CZ-CD2 3.88Å; G581-L585 WeakPolarHBondContact O-CG 3.17Å; G581-L585 PolarHBondContact O-N 3Å; L583-L585 PolarHBondContact O-N 3.02Å; L585-K587 PolarHBondContact O-N 3.01Å; L585-A588 PolarHBondContact O-N 3.4Å; L585-I589 WeakPolarHBondContact O-CG1 3.49Å; L585-I589 PolarHBondContact O-N 3.25Å
586	T	93.6	Very high	92.8	Very high	2 Å²	2	19 Å²	19	1%	0.012	10%	0.101	C	C	.	.	H	α-helix	trans	-62	-42.9	176.9	-54.6	0	0	0	0	111.7	F138 F470 N582 L583 A588 I589 N590	F138-T586 HydrophobicContact CD1-CG2 4.35Å; F138-T586 HydrophobicContact CE1-CG2 4.33Å; F470-T586 VanDerWaalsContact CE1-OG1 3.3Å; F470-T586 WeakPolarHBondContact CE1-OG1 3.31Å; F470-T586 WeakPolarHBondContact CZ-OG1 3.47Å; N582-T586 WeakPolarHBondContact O-CB 3.3Å; N582-T586 PolarHBondContact O-N 3.36Å; N582-T586 PolarHBondContact O-OG1 3.02Å; L583-T586 PolarHBondContact O-N 2.9Å; T586-A588 PolarHBondContact O-N 3.28Å; T586-I589 PolarHBondContact O-N 2.56Å; T586-N590 WeakPolarHBondContact O-CB 3.44Å; T586-N590 PolarHBondContact O-N 3.27Å; T586-N590 PolarHBondContact O-ND2 2.99Å
587	K	94.8	Very high	92.6	Very high	13 Å²	13	20.3 Å²	20.3	6%	0.057	11%	0.106	C	C	.	.	H	α-helix	trans	-63.3	-40.2	177.1	-169.4	67.4	169.9	-177	0	111.8	I530 F564 P566 I568 L583 L584 L585 A591	I530-K587 HydrophobicContact CD1-CG 4.3Å; F564-K587 HydrophobicContact CD2-CD 4.23Å; F564-K587 HydrophobicContact CE2-CD 4.09Å; F564-K587 HydrophobicContact CE2-CG 4.35Å; F564-K587 PolarHBondContact O-NZ 2.99Å; P566-K587 HydrophobicContact CG-CD 4.49Å; P566-K587 PolarHBondContact O-NZ 2.75Å; I568-K587 HydrophobicContact CD1-CB 4.44Å; I568-K587 HydrophobicContact CD1-CD 4.06Å; I568-K587 HydrophobicContact CD1-CG 4Å; L583-K587 VanDerWaalsContact O-CB 3.27Å; L583-K587 WeakPolarHBondContact O-CB 3.49Å; L583-K587 PolarHBondContact O-N 3.49Å; L584-K587 PolarHBondContact O-N 2.87Å; L585-K587 PolarHBondContact O-N 3.01Å; K587-A591 VanDerWaalsContact O-CB 3.28Å; K587-A591 WeakPolarHBondContact O-CB 3.44Å; K587-A591 PolarHBondContact O-N 3.44Å
588	A	96.1	Very high	92.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-73.3	-34.2	178.6	0	0	0	0	0	113.6	F406 V504 F506 I530 L584 L585 T586 A591 A592	F406-A588 HydrophobicContact CD1-CB 4.48Å; F406-A588 HydrophobicContact CD2-CB 4.11Å; F406-A588 HydrophobicContact CE1-CB 4.04Å; F406-A588 WeakPolarHBondContact CE1-O 3.33Å; F406-A588 HydrophobicContact CE2-CB 3.62Å; F406-A588 HydrophobicContact CZ-CB 3.58Å; F406-A588 WeakPolarHBondContact CZ-O 3.16Å; V504-A588 HydrophobicContact CG1-CB 4.37Å; F506-A588 HydrophobicContact CE2-CB 3.96Å; F506-A588 HydrophobicContact CZ-CB 3.71Å; I530-A588 HydrophobicContact CD1-CB 3.92Å; L584-A588 WeakPolarHBondContact O-CB 3.2Å; L584-A588 PolarHBondContact O-N 2.72Å; L585-A588 PolarHBondContact O-N 3.4Å; T586-A588 PolarHBondContact O-N 3.28Å; A588-A591 WeakPolarHBondContact O-CB 3.31Å; A588-A592 PolarHBondContact O-N 2.93Å
589	I	93.8	Very high	92.3	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.3	-49.9	172.2	-70.2	168.9	0	0	0	110.3	F138 F406 F470 T473 I475 L585 T586 A591 A592 Y593	F138-I589 HydrophobicContact CD1-CB 4.36Å; F138-I589 HydrophobicContact CD1-CG2 3.77Å; F138-I589 HydrophobicContact CD2-CG2 4.46Å; F138-I589 HydrophobicContact CE1-CB 4.07Å; F138-I589 HydrophobicContact CE1-CD1 3.6Å; F138-I589 HydrophobicContact CE1-CG1 4.46Å; F138-I589 HydrophobicContact CE1-CG2 3.79Å; F138-I589 HydrophobicContact CE2-CD1 4.37Å; F138-I589 HydrophobicContact CE2-CG2 4.47Å; F138-I589 HydrophobicContact CG-CG2 4.13Å; F138-I589 HydrophobicContact CZ-CD1 3.45Å; F138-I589 VanDerWaalsContact CZ-CD1 3.45Å; F138-I589 HydrophobicContact CZ-CG2 4.15Å; F406-I589 HydrophobicContact CZ-CG1 4.34Å; F470-I589 HydrophobicContact CD1-CD1 3.78Å; F470-I589 HydrophobicContact CE1-CD1 4.43Å; T473-I589 WeakPolarHBondContact OG1-CD1 3.31Å; I475-I589 HydrophobicContact CD1-CD1 4.12Å; I475-I589 HydrophobicContact CD1-CG1 4.48Å; L585-I589 WeakPolarHBondContact O-CG1 3.49Å; L585-I589 PolarHBondContact O-N 3.25Å; T586-I589 PolarHBondContact O-N 2.56Å; I589-A591 VanDerWaalsContact C-N 3.27Å; I589-A591 PolarHBondContact O-N 3.19Å; I589-A592 WeakPolarHBondContact O-CB 3.45Å; I589-A592 PolarHBondContact O-N 3.37Å; I589-Y593 HydrophobicContact CG2-CD2 3.88Å; I589-Y593 HydrophobicContact CG2-CE2 3.67Å; I589-Y593 VanDerWaalsContact O-CD2 3.32Å; I589-Y593 WeakPolarHBondContact O-CD2 3.21Å; I589-Y593 PolarHBondContact O-N 3.22Å; I589-Y593 VanDerWaalsContact O-N 3.09Å
590	N	93	Very high	92.1	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-63.1	-34.2	176.9	-74.3	-27.8	0	0	0	111.7	D137 F138 E139 F564 T586 A592 Y593 A594	D137-N590 PolarHBondContact O-ND2 3.24Å; D137-N590 VanDerWaalsContact O-ND2 3.12Å; F138-N590 WeakPolarHBondContact CA-OD1 3.28Å; E139-N590 PolarHBondContact N-OD1 3.25Å; F564-N590 HydrophobicContact CB-CB 4.38Å; T586-N590 WeakPolarHBondContact O-CB 3.44Å; T586-N590 PolarHBondContact O-N 3.27Å; T586-N590 PolarHBondContact O-ND2 2.99Å; N590-A592 PolarHBondContact O-N 3.01Å; N590-Y593 PolarHBondContact O-N 3.11Å; N590-A594 WeakPolarHBondContact O-CB 3.38Å; N590-A594 PolarHBondContact O-N 2.73Å
591	A	94.6	Very high	91.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59	-44.4	168.9	0	0	0	0	0	112.7	V504 V528 F564 K587 A588 I589 A594 V595	V504-A591 HydrophobicContact CG1-CB 4.02Å; V504-A591 HydrophobicContact CG2-CB 3.69Å; V528-A591 HydrophobicContact CB-CB 4.34Å; V528-A591 HydrophobicContact CG1-CB 4Å; V528-A591 HydrophobicContact CG2-CB 4.28Å; F564-A591 VanDerWaalsContact CD2-CA 3.48Å; F564-A591 HydrophobicContact CD2-CB 3.77Å; F564-A591 HydrophobicContact CE1-CB 4.25Å; F564-A591 HydrophobicContact CE2-CB 3.38Å; F564-A591 HydrophobicContact CG-CB 4.41Å; F564-A591 HydrophobicContact CZ-CB 3.66Å; K587-A591 VanDerWaalsContact O-CB 3.28Å; K587-A591 WeakPolarHBondContact O-CB 3.44Å; K587-A591 PolarHBondContact O-N 3.44Å; A588-A591 WeakPolarHBondContact O-CB 3.31Å; I589-A591 VanDerWaalsContact C-N 3.27Å; I589-A591 PolarHBondContact O-N 3.19Å; A591-A594 PolarHBondContact O-N 2.93Å; A591-V595 VanDerWaalsContact O-CG2 3.31Å; A591-V595 WeakPolarHBondContact O-CG2 3.45Å; A591-V595 PolarHBondContact O-N 3.48Å
592	A	93.6	Very high	91.3	Very high	3 Å²	3	26.9 Å²	26.9	3%	0.025	12%	0.122	C	C	.	.	H	α-helix	trans	-63.5	-42.1	178.9	0	0	0	0	0	112	L401 F406 V504 A588 I589 N590 V595 L596	L401-A592 HydrophobicContact CD1-CB 4.09Å; F406-A592 HydrophobicContact CE1-CB 4.37Å; V504-A592 HydrophobicContact CG2-CB 4.31Å; A588-A592 PolarHBondContact O-N 2.93Å; I589-A592 WeakPolarHBondContact O-CB 3.45Å; I589-A592 PolarHBondContact O-N 3.37Å; N590-A592 PolarHBondContact O-N 3.01Å; A592-V595 PolarHBondContact O-N 3.12Å; A592-L596 PolarHBondContact O-N 2.71Å
593	Y	90	Very high	90.9	Very high	13 Å²	13	31.4 Å²	31.4	5%	0.051	14%	0.142	C	C	.	.	H	α-helix	trans	-65	-38.4	173.3	-77.3	-68.4	0	0	0	112.9	Y140 L401 I589 N590 V595 L596	Y140-Y593 AromaticContact CD1-CD1 3.96Å; Y140-Y593 HydrophobicContact CD1-CD1 3.96Å; Y140-Y593 HydrophobicContact CD1-CE1 4.36Å; Y140-Y593 HydrophobicContact CG-CD1 4.26Å; L401-Y593 HydrophobicContact CB-CE1 4.12Å; L401-Y593 HydrophobicContact CG-CE1 4.17Å; L401-Y593 PolarHBondContact N-OH 3.37Å; L401-Y593 PolarHBondContact O-OH 2.97Å; I589-Y593 HydrophobicContact CG2-CD2 3.88Å; I589-Y593 HydrophobicContact CG2-CE2 3.67Å; I589-Y593 VanDerWaalsContact O-CD2 3.32Å; I589-Y593 WeakPolarHBondContact O-CD2 3.21Å; I589-Y593 PolarHBondContact O-N 3.22Å; I589-Y593 VanDerWaalsContact O-N 3.09Å; N590-Y593 PolarHBondContact O-N 3.11Å; Y593-V595 VanDerWaalsContact C-N 3.35Å; Y593-L596 HydrophobicContact CD1-CD1 4.22Å; Y593-L596 WeakPolarHBondContact O-CB 3.44Å; Y593-L596 PolarHBondContact O-N 2.71Å
594	A	91.7	Very high	90.6	Very high	2 Å²	2	36.3 Å²	36.3	2%	0.017	17%	0.167	C	C	.	.	H	α-helix	trans	-66.2	-36.1	174.9	0	0	0	0	0	112.7	V561 P562 F564 N590 A591 L596 K597	V561-A594 HydrophobicContact CG1-CB 3.9Å; P562-A594 HydrophobicContact CG-CB 4.23Å; F564-A594 HydrophobicContact CB-CB 3.64Å; F564-A594 HydrophobicContact CD1-CB 3.5Å; F564-A594 HydrophobicContact CE1-CB 4.48Å; F564-A594 HydrophobicContact CG-CB 3.82Å; N590-A594 WeakPolarHBondContact O-CB 3.38Å; N590-A594 PolarHBondContact O-N 2.73Å; A591-A594 PolarHBondContact O-N 2.93Å; A594-L596 VanDerWaalsContact C-N 3.26Å; A594-L596 PolarHBondContact O-N 3.28Å; A594-K597 VanDerWaalsContact O-CB 3.3Å; A594-K597 WeakPolarHBondContact O-CB 3.32Å; A594-K597 PolarHBondContact O-N 3.46Å
595	V	92.3	Very high	89.9	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	18%	0.177	C	C	.	.	H	α-helix	trans	-68.6	-21.5	176.2	171.9	0	0	0	0	112.5	K527 V528 V561 A591 A592 Y593 K597 Y598 F601	K527-V595 HydrophobicContact CB-CG1 4.12Å; K527-V595 HydrophobicContact CB-CG2 4Å; K527-V595 HydrophobicContact CG-CG1 4.48Å; V528-V595 HydrophobicContact CG2-CG2 3.69Å; V561-V595 HydrophobicContact CG1-CG2 4.02Å; V561-V595 HydrophobicContact CG2-CG2 4.07Å; A591-V595 VanDerWaalsContact O-CG2 3.31Å; A591-V595 WeakPolarHBondContact O-CG2 3.45Å; A591-V595 PolarHBondContact O-N 3.48Å; A592-V595 PolarHBondContact O-N 3.12Å; Y593-V595 VanDerWaalsContact C-N 3.35Å; V595-K597 PolarHBondContact O-N 2.76Å; V595-Y598 WeakPolarHBondContact O-CB 3.45Å; V595-Y598 PolarHBondContact O-N 2.99Å; V595-F601 HydrophobicContact CG1-CD2 3.53Å; V595-F601 HydrophobicContact CG1-CE2 3.43Å; V595-F601 VanDerWaalsContact CG1-CE2 3.43Å; V595-F601 HydrophobicContact CG1-CZ 4.49Å; V595-F601 WeakPolarHBondContact O-CD2 3.23Å
596	L	86.9	Confident	89.3	Confident	37 Å²	37	41.7 Å²	41.7	19%	0.194	19%	0.193	C	C	.	.	H	α-helix	trans	-64.5	-25.8	167.5	-62.4	-179.3	0	0	0	112.9	L401 A592 Y593 A594 Y598 R602 M605	L401-L596 HydrophobicContact CD1-CD1 3.98Å; L401-L596 HydrophobicContact CD1-CD2 4.4Å; L401-L596 HydrophobicContact CD1-CG 4.23Å; L401-L596 HydrophobicContact CG-CD1 4.16Å; A592-L596 PolarHBondContact O-N 2.71Å; Y593-L596 HydrophobicContact CD1-CD1 4.22Å; Y593-L596 WeakPolarHBondContact O-CB 3.44Å; Y593-L596 PolarHBondContact O-N 2.71Å; A594-L596 VanDerWaalsContact C-N 3.26Å; A594-L596 PolarHBondContact O-N 3.28Å; L596-Y598 VanDerWaalsContact C-N 3.31Å; L596-R602 PolarHBondContact O-N 2.82Å; L596-M605 HydrophobicContact CD2-CG 4.48Å
597	K	85.5	Confident	89	Confident	91 Å²	91	49.7 Å²	49.7	40%	0.396	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-13.2	178.3	-55	170.1	-175.5	170.4	0	112.2	P562 A594 V595 S599	P562-K597 HydrophobicContact CG-CB 4.18Å; P562-K597 HydrophobicContact CG-CD 3.79Å; A594-K597 VanDerWaalsContact O-CB 3.3Å; A594-K597 WeakPolarHBondContact O-CB 3.32Å; A594-K597 PolarHBondContact O-N 3.46Å; V595-K597 PolarHBondContact O-N 2.76Å; K597-S599 PolarHBondContact O-N 3.43Å
598	Y	89.7	Confident	88.6	Confident	20 Å²	20	50.7 Å²	50.7	8%	0.078	23%	0.231	C	C	.	.	S	Bend	trans	-57.3	130.1	175.7	177.3	-128.9	0	0	0	111.3	K527 D560 V561 V595 L596 K600 F601 R602	K527-Y598 HydrophobicContact CD-CD1 4.2Å; K527-Y598 HydrophobicContact CD-CE1 3.83Å; K527-Y598 HydrophobicContact CG-CD1 4.21Å; K527-Y598 HydrophobicContact CG-CE1 4.29Å; D560-Y598 HydrophobicContact CB-CD2 3.47Å; D560-Y598 VanDerWaalsContact CB-CD2 3.47Å; D560-Y598 HydrophobicContact CB-CE2 3.62Å; D560-Y598 WeakPolarHBondContact OD2-CE2 3.36Å; V561-Y598 HydrophobicContact CG2-CD2 4.38Å; V561-Y598 HydrophobicContact CG2-CG 4.47Å; V595-Y598 WeakPolarHBondContact O-CB 3.45Å; V595-Y598 PolarHBondContact O-N 2.99Å; L596-Y598 VanDerWaalsContact C-N 3.31Å; Y598-K600 HydrophobicContact CD1-CB 4.29Å; Y598-K600 HydrophobicContact CE1-CB 3.84Å; Y598-K600 HydrophobicContact CE1-CD 4.08Å; Y598-K600 HydrophobicContact CE1-CG 4.15Å; Y598-K600 PolarHBondContact O-N 2.9Å; Y598-K600 PolarHBondContact OH-NZ 3.01Å; Y598-F601 HydrophobicContact CD1-CB 4.42Å; Y598-F601 AromaticContact CD1-CD1 3.97Å; Y598-F601 HydrophobicContact CD1-CD1 3.97Å; Y598-F601 HydrophobicContact CD1-CE1 4.4Å; Y598-F601 HydrophobicContact CD1-CG 4.1Å; Y598-F601 PolarHBondContact O-N 3.41Å; Y598-R602 WeakPolarHBondContact O-CB 3.27Å; Y598-R602 PolarHBondContact O-N 2.9Å
599	S	86.4	Confident	88.2	Confident	42 Å²	42	51.5 Å²	51.5	29%	0.294	24%	0.235	S	C	.	.	H	α-helix	trans	-33.9	-63.8	-176.5	49.5	0	0	0	0	114.5	D560 K597 F601 R602 E603	D560-S599 PolarHBondContact OD2-OG 3.37Å; K597-S599 PolarHBondContact O-N 3.43Å; S599-F601 VanDerWaalsContact C-N 3.34Å; S599-F601 PolarHBondContact O-N 3.37Å; S599-R602 PolarHBondContact O-N 3.33Å; S599-E603 WeakPolarHBondContact O-CG 3.48Å; S599-E603 PolarHBondContact O-N 2.86Å
600	K	86.3	Confident	87.9	Confident	124 Å²	124	56 Å²	56	54%	0.539	25%	0.252	S	S	.	.	H	α-helix	trans	-66.3	-29.5	-177.1	-60.6	175.3	-173.3	162.2	0	114.3	Y598 I604	Y598-K600 HydrophobicContact CD1-CB 4.29Å; Y598-K600 HydrophobicContact CE1-CB 3.84Å; Y598-K600 HydrophobicContact CE1-CD 4.08Å; Y598-K600 HydrophobicContact CE1-CG 4.15Å; Y598-K600 PolarHBondContact O-N 2.9Å; Y598-K600 PolarHBondContact OH-NZ 3.01Å; K600-I604 WeakPolarHBondContact O-CD1 3.44Å; K600-I604 VanDerWaalsContact O-CG1 3.29Å; K600-I604 WeakPolarHBondContact O-CG1 3.23Å; K600-I604 PolarHBondContact O-N 2.78Å
601	F	85.9	Confident	87.6	Confident	35 Å²	35	60.3 Å²	60.3	15%	0.154	28%	0.275	C	S	.	.	H	α-helix	trans	-81.3	-41	178.3	-77.7	16.7	0	0	0	110.5	F525 V595 Y598 S599 E603 I604 M605	F525-F601 HydrophobicContact CB-CZ 4.47Å; F525-F601 HydrophobicContact CD1-CE1 4.04Å; F525-F601 AromaticContact CD1-CZ 3.68Å; F525-F601 HydrophobicContact CD1-CZ 3.68Å; F525-F601 HydrophobicContact CE1-CE1 4.31Å; F525-F601 HydrophobicContact CE1-CZ 4.33Å; F525-F601 HydrophobicContact CG-CZ 4.44Å; V595-F601 HydrophobicContact CG1-CD2 3.53Å; V595-F601 HydrophobicContact CG1-CE2 3.43Å; V595-F601 VanDerWaalsContact CG1-CE2 3.43Å; V595-F601 HydrophobicContact CG1-CZ 4.49Å; V595-F601 WeakPolarHBondContact O-CD2 3.23Å; Y598-F601 HydrophobicContact CD1-CB 4.42Å; Y598-F601 AromaticContact CD1-CD1 3.97Å; Y598-F601 HydrophobicContact CD1-CD1 3.97Å; Y598-F601 HydrophobicContact CD1-CE1 4.4Å; Y598-F601 HydrophobicContact CD1-CG 4.1Å; Y598-F601 PolarHBondContact O-N 3.41Å; S599-F601 VanDerWaalsContact C-N 3.34Å; S599-F601 PolarHBondContact O-N 3.37Å; F601-E603 VanDerWaalsContact C-N 3.31Å; F601-E603 PolarHBondContact O-N 3.45Å; F601-I604 PolarHBondContact O-N 3.39Å; F601-I604 VanDerWaalsContact O-N 3.13Å; F601-M605 WeakPolarHBondContact O-CB 3.27Å; F601-M605 WeakPolarHBondContact O-CG 3.39Å; F601-M605 PolarHBondContact O-N 2.85Å
602	R	85	Confident	87.4	Confident	143 Å²	143	61.9 Å²	61.9	54%	0.54	28%	0.281	S	S	.	.	H	α-helix	trans	-55.2	-45.5	172.1	-176.1	-178.5	178.7	-175.8	3	111.1	L596 Y598 S599 I604 M605 Q606	L596-R602 PolarHBondContact O-N 2.82Å; Y598-R602 WeakPolarHBondContact O-CB 3.27Å; Y598-R602 PolarHBondContact O-N 2.9Å; S599-R602 PolarHBondContact O-N 3.33Å; R602-I604 PolarHBondContact O-N 3.35Å; R602-M605 PolarHBondContact O-N 3.22Å; R602-Q606 HydrophobicContact CG-CG 4.25Å; R602-Q606 VanDerWaalsContact O-CB 3.22Å; R602-Q606 WeakPolarHBondContact O-CB 3.39Å; R602-Q606 VanDerWaalsContact O-CG 3.24Å; R602-Q606 WeakPolarHBondContact O-CG 3.3Å; R602-Q606 PolarHBondContact O-N 2.84Å
603	E	86	Confident	87.2	Confident	126 Å²	126	61.8 Å²	61.8	59%	0.589	28%	0.28	S	S	*	.	H	α-helix	trans	-57.7	-45.8	174.2	-76	171.4	-162.5	0	0	112.8	S599 F601 R607	S599-E603 WeakPolarHBondContact O-CG 3.48Å; S599-E603 PolarHBondContact O-N 2.86Å; F601-E603 VanDerWaalsContact C-N 3.31Å; F601-E603 PolarHBondContact O-N 3.45Å; E603-R607 VanDerWaalsContact O-CB 3.25Å; E603-R607 WeakPolarHBondContact O-CB 3.21Å; E603-R607 PolarHBondContact O-N 3.45Å
604	I	85.8	Confident	87.2	Confident	103 Å²	103	64.9 Å²	64.9	53%	0.528	29%	0.294	S	S	.	.	H	α-helix	trans	-67.9	-41.5	-179.6	-67.7	166.9	0	0	0	111.2	K600 F601 R602 S608	K600-I604 WeakPolarHBondContact O-CD1 3.44Å; K600-I604 VanDerWaalsContact O-CG1 3.29Å; K600-I604 WeakPolarHBondContact O-CG1 3.23Å; K600-I604 PolarHBondContact O-N 2.78Å; F601-I604 PolarHBondContact O-N 3.39Å; F601-I604 VanDerWaalsContact O-N 3.13Å; R602-I604 PolarHBondContact O-N 3.35Å; I604-S608 WeakPolarHBondContact O-CB 3.5Å; I604-S608 PolarHBondContact O-N 2.72Å; I604-S608 PolarHBondContact O-OG 3.23Å
605	M	82.1	Confident	87.1	Confident	42 Å²	42	69.7 Å²	69.7	21%	0.207	32%	0.317	C	S	.	.	H	α-helix	trans	-68.2	-47.9	177.4	-70.1	-61.4	-71.1	0	0	111.3	M398 L596 F601 R602 R607 S608 R609	M398-M605 VanDerWaalsContact O-CE 3.31Å; M398-M605 WeakPolarHBondContact O-CE 3.38Å; L596-M605 HydrophobicContact CD2-CG 4.48Å; F601-M605 WeakPolarHBondContact O-CB 3.27Å; F601-M605 WeakPolarHBondContact O-CG 3.39Å; F601-M605 PolarHBondContact O-N 2.85Å; R602-M605 PolarHBondContact O-N 3.22Å; M605-R607 PolarHBondContact O-N 2.86Å; M605-S608 PolarHBondContact O-N 3.21Å; M605-S608 VanDerWaalsContact O-N 3.14Å; M605-R609 PolarHBondContact O-N 3.08Å
606	Q	82.6	Confident	87	Confident	78 Å²	78	69.8 Å²	69.8	36%	0.364	32%	0.317	S	S	.	.	H	α-helix	trans	-58.4	-47.8	175.2	-76	-178.7	-26.6	0	0	110.9	R602 S608 R609 R610	R602-Q606 HydrophobicContact CG-CG 4.25Å; R602-Q606 VanDerWaalsContact O-CB 3.22Å; R602-Q606 WeakPolarHBondContact O-CB 3.39Å; R602-Q606 VanDerWaalsContact O-CG 3.24Å; R602-Q606 WeakPolarHBondContact O-CG 3.3Å; R602-Q606 PolarHBondContact O-N 2.84Å; Q606-S608 VanDerWaalsContact C-N 3.31Å; Q606-S608 PolarHBondContact O-N 3.16Å; Q606-R609 PolarHBondContact O-N 3.43Å; Q606-R610 WeakPolarHBondContact O-CB 3.44Å; Q606-R610 VanDerWaalsContact O-CG 3.27Å; Q606-R610 WeakPolarHBondContact O-CG 3.49Å; Q606-R610 PolarHBondContact O-N 2.87Å
607	R	87.7	Confident	87.2	Confident	169 Å²	169	68.2 Å²	68.2	64%	0.638	31%	0.309	S	S	*	.	H	α-helix	trans	-57.1	-44.5	174.6	-178.8	178	179.7	149.4	11.1	112.1	E603 M605 R609 R610 D611	E603-R607 VanDerWaalsContact O-CB 3.25Å; E603-R607 WeakPolarHBondContact O-CB 3.21Å; E603-R607 PolarHBondContact O-N 3.45Å; M605-R607 PolarHBondContact O-N 2.86Å; R607-R609 VanDerWaalsContact C-N 3.34Å; R607-R609 PolarHBondContact O-N 3.24Å; R607-R610 PolarHBondContact O-N 2.81Å; R607-D611 IonicContact NE-OD2 3.48Å; R607-D611 WeakPolarHBondContact O-CB 3.28Å; R607-D611 VanDerWaalsContact O-CG 3.27Å; R607-D611 PolarHBondContact O-N 2.99Å
608	S	86.3	Confident	87.2	Confident	34 Å²	34	68.2 Å²	68.2	24%	0.238	31%	0.313	C	S	.	.	H	α-helix	trans	-64.4	-38.3	179.2	-56.9	0	0	0	0	112.3	I604 M605 Q606 Y612	I604-S608 WeakPolarHBondContact O-CB 3.5Å; I604-S608 PolarHBondContact O-N 2.72Å; I604-S608 PolarHBondContact O-OG 3.23Å; M605-S608 PolarHBondContact O-N 3.21Å; M605-S608 VanDerWaalsContact O-N 3.14Å; Q606-S608 VanDerWaalsContact C-N 3.31Å; Q606-S608 PolarHBondContact O-N 3.16Å; S608-Y612 VanDerWaalsContact O-CB 3.3Å; S608-Y612 WeakPolarHBondContact O-CB 3.45Å; S608-Y612 PolarHBondContact O-N 3Å; S608-Y612 VanDerWaalsContact O-N 3.13Å
609	R	86.1	Confident	87.1	Confident	18 Å²	18	72.3 Å²	72.3	7%	0.068	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-43.3	173	-176.1	-179.7	177.9	75.1	6.7	111.5	D248 L395 D396 M605 Q606 R607 L613	D248-R609 IonicContact OD1-CZ 3.54Å; D248-R609 IonicContact OD1-NE 2.8Å; D248-R609 IonicContact OD1-NH2 2.83Å; D248-R609 PolarHBondContact OD1-NH2 2.82Å; D248-R609 IonicContact OD2-CZ 3.44Å; D248-R609 IonicContact OD2-NE 2.72Å; D248-R609 PolarHBondContact OD2-NE 3.46Å; D248-R609 IonicContact OD2-NH2 2.6Å; D248-R609 PolarHBondContact OD2-NH2 3.23Å; D248-R609 VanDerWaalsContact OD2-NH2 3.08Å; L395-R609 PolarHBondContact O-NH1 2.91Å; D396-R609 IonicContact OD1-NH2 3.52Å; D396-R609 PolarHBondContact OD1-NH2 3.33Å; M605-R609 PolarHBondContact O-N 3.08Å; Q606-R609 PolarHBondContact O-N 3.43Å; R607-R609 VanDerWaalsContact C-N 3.34Å; R607-R609 PolarHBondContact O-N 3.24Å; R609-L613 VanDerWaalsContact O-CB 3.3Å; R609-L613 WeakPolarHBondContact O-CB 3.44Å; R609-L613 PolarHBondContact O-N 3.11Å
610	R	87.6	Confident	87.1	Confident	94 Å²	94	71 Å²	71	36%	0.355	32%	0.322	S	S	.	.	H	α-helix	trans	-62.7	-54.7	176	-70.3	-175.1	177.1	163.3	1.4	112.2	E244 Q606 R607 Y612 L613 H614	E244-R610 HydrophobicContact CB-CG 4.43Å; E244-R610 HydrophobicContact CG-CB 3.71Å; E244-R610 HydrophobicContact CG-CG 3.43Å; E244-R610 VanDerWaalsContact CG-CG 3.43Å; E244-R610 PolarHBondContact O-NE 2.87Å; E244-R610 PolarHBondContact O-NH2 2.72Å; Q606-R610 WeakPolarHBondContact O-CB 3.44Å; Q606-R610 VanDerWaalsContact O-CG 3.27Å; Q606-R610 WeakPolarHBondContact O-CG 3.49Å; Q606-R610 PolarHBondContact O-N 2.87Å; R607-R610 PolarHBondContact O-N 2.81Å; R610-Y612 PolarHBondContact O-N 3.05Å; R610-L613 PolarHBondContact O-N 3.36Å; R610-H614 VanDerWaalsContact O-CB 3.28Å; R610-H614 WeakPolarHBondContact O-CB 3.27Å; R610-H614 PolarHBondContact O-N 3.44Å
611	D	88.3	Confident	86.9	Confident	91 Å²	91	66.1 Å²	66.1	49%	0.487	30%	0.303	S	S	.	.	H	α-helix	trans	-55.5	-39.9	179.4	-70.4	-14.8	0	0	0	110.3	R607 Q615	R607-D611 IonicContact NE-OD2 3.48Å; R607-D611 WeakPolarHBondContact O-CB 3.28Å; R607-D611 VanDerWaalsContact O-CG 3.27Å; R607-D611 PolarHBondContact O-N 2.99Å; D611-Q615 WeakPolarHBondContact O-CB 3.5Å; D611-Q615 PolarHBondContact O-N 3.49Å; D611-Q615 VanDerWaalsContact O-N 3.09Å
612	Y	89.1	Confident	86.5	Confident	34 Å²	34	66.4 Å²	66.4	13%	0.133	31%	0.306	C	S	.	.	H	α-helix	trans	-73.5	-44.3	177.4	-172.7	-114.8	0	0	0	113.7	L395 M398 S608 R610 Q615 F616 L1276	L395-Y612 HydrophobicContact CB-CD1 4.11Å; L395-Y612 HydrophobicContact CB-CE1 3.81Å; L395-Y612 HydrophobicContact CD1-CD1 3.7Å; L395-Y612 HydrophobicContact CD1-CE1 3.98Å; L395-Y612 HydrophobicContact CG-CD1 3.82Å; L395-Y612 HydrophobicContact CG-CE1 4.04Å; M398-Y612 HydrophobicContact SD-CD1 3.75Å; M398-Y612 HydrophobicContact SD-CE1 4.47Å; M398-Y612 HydrophobicContact SD-CG 4.28Å; S608-Y612 VanDerWaalsContact O-CB 3.3Å; S608-Y612 WeakPolarHBondContact O-CB 3.45Å; S608-Y612 PolarHBondContact O-N 3Å; S608-Y612 VanDerWaalsContact O-N 3.13Å; R610-Y612 PolarHBondContact O-N 3.05Å; Y612-Q615 PolarHBondContact O-N 2.8Å; Y612-F616 WeakPolarHBondContact O-CB 3.3Å; Y612-F616 PolarHBondContact O-N 2.9Å; Y612-L1276 HydrophobicContact CD2-CD1 4.06Å; Y612-L1276 HydrophobicContact CE2-CD1 3.71Å
613	L	90.7	Very high	85.4	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62	-44	175.9	180	62.4	0	0	0	111.3	A171 A173 R242 R243 E244 L395 R609 R610 F616 C617	A171-L613 HydrophobicContact CB-CD2 4.4Å; A171-L613 HydrophobicContact CB-CG 4.05Å; A171-L613 WeakPolarHBondContact O-CD2 3.49Å; A173-L613 HydrophobicContact CB-CD1 3.79Å; R242-L613 HydrophobicContact CB-CD1 4.43Å; R243-L613 VanDerWaalsContact C-CD2 3.42Å; E244-L613 HydrophobicContact CB-CD2 4.47Å; L395-L613 HydrophobicContact CD1-CB 4.03Å; L395-L613 HydrophobicContact CD1-CD1 3.76Å; R609-L613 VanDerWaalsContact O-CB 3.3Å; R609-L613 WeakPolarHBondContact O-CB 3.44Å; R609-L613 PolarHBondContact O-N 3.11Å; R610-L613 PolarHBondContact O-N 3.36Å; L613-F616 PolarHBondContact O-N 3.12Å; L613-C617 PolarHBondContact O-N 2.88Å; L613-C617 PolarHBondContact O-SG 2.99Å; L613-C617 VanDerWaalsContact O-SG 3.33Å
614	H	90.2	Very high	83.8	Confident	78 Å²	78	61.3 Å²	61.3	36%	0.361	30%	0.297	S	S	.	.	H	α-helix	trans	-64.5	-43	177.6	-173.5	-78.1	0	0	0	111.6	A171 E244 R610 N618	A171-H614 HydrophobicContact CB-CB 4Å; E244-H614 IonicContact OE2-CD2 2.69Å; R610-H614 VanDerWaalsContact O-CB 3.28Å; R610-H614 WeakPolarHBondContact O-CB 3.27Å; R610-H614 PolarHBondContact O-N 3.44Å; H614-N618 PolarHBondContact CE1-ND2 2.9Å; H614-N618 VanDerWaalsContact CE1-ND2 3.33Å; H614-N618 PolarHBondContact ND1-ND2 3.24Å; H614-N618 PolarHBondContact O-N 3.11Å; H614-N618 PolarHBondContact O-ND2 2.89Å
615	Q	88.9	Confident	82	Confident	103 Å²	103	64 Å²	64	48%	0.481	31%	0.307	S	S	.	.	H	α-helix	trans	-59.7	-47.6	170.9	-179.6	177.1	-6.3	0	0	111.1	D611 Y612 C617 N618 E619	D611-Q615 WeakPolarHBondContact O-CB 3.5Å; D611-Q615 PolarHBondContact O-N 3.49Å; D611-Q615 VanDerWaalsContact O-N 3.09Å; Y612-Q615 PolarHBondContact O-N 2.8Å; Q615-C617 PolarHBondContact O-N 2.8Å; Q615-N618 PolarHBondContact O-N 3.27Å; Q615-E619 HydrophobicContact CG-CG 4.4Å; Q615-E619 WeakPolarHBondContact CG-OE1 3.24Å; Q615-E619 PolarHBondContact NE2-OE1 2.7Å; Q615-E619 WeakPolarHBondContact O-CG 3.46Å; Q615-E619 PolarHBondContact O-N 3Å; Q615-E619 VanDerWaalsContact O-N 3.08Å
616	F	90.5	Very high	79.9	Confident	4 Å²	4	67.9 Å²	67.9	2%	0.018	33%	0.329	C	S	.	.	H	α-helix	trans	-60.7	-44.9	-177.1	173.2	-87.7	0	0	0	112.9	F163 V388 K391 L392 Y612 L613 N618 E619 H620	F163-F616 AromaticContact CD1-CE1 3.85Å; F163-F616 HydrophobicContact CD1-CE1 3.85Å; F163-F616 HydrophobicContact CD2-CE1 4.06Å; F163-F616 AromaticContact CE1-CE1 3.52Å; F163-F616 HydrophobicContact CE1-CE1 3.52Å; F163-F616 AromaticContact CE1-CZ 3.99Å; F163-F616 HydrophobicContact CE1-CZ 3.99Å; F163-F616 AromaticContact CE2-CE1 3.74Å; F163-F616 HydrophobicContact CE2-CE1 3.74Å; F163-F616 AromaticContact CE2-CZ 3.79Å; F163-F616 HydrophobicContact CE2-CZ 3.79Å; F163-F616 HydrophobicContact CG-CE1 4.13Å; F163-F616 AromaticContact CZ-CE1 3.48Å; F163-F616 HydrophobicContact CZ-CE1 3.48Å; F163-F616 VanDerWaalsContact CZ-CE1 3.48Å; F163-F616 AromaticContact CZ-CZ 3.5Å; F163-F616 HydrophobicContact CZ-CZ 3.5Å; F163-F616 VanDerWaalsContact CZ-CZ 3.5Å; V388-F616 HydrophobicContact CG1-CE2 3.97Å; V388-F616 HydrophobicContact CG1-CZ 3.6Å; K391-F616 HydrophobicContact CB-CD2 3.94Å; K391-F616 HydrophobicContact CB-CE2 3.68Å; K391-F616 HydrophobicContact CD-CD2 4.45Å; K391-F616 HydrophobicContact CD-CE2 4.45Å; L392-F616 HydrophobicContact CD1-CZ 4.33Å; L392-F616 HydrophobicContact CD2-CD1 4.28Å; L392-F616 HydrophobicContact CD2-CE1 3.46Å; L392-F616 VanDerWaalsContact CD2-CE1 3.46Å; L392-F616 HydrophobicContact CD2-CE2 4.27Å; L392-F616 HydrophobicContact CD2-CZ 3.46Å; L392-F616 VanDerWaalsContact CD2-CZ 3.46Å; L392-F616 HydrophobicContact CG-CE1 4.09Å; L392-F616 HydrophobicContact CG-CE2 4.21Å; L392-F616 HydrophobicContact CG-CZ 3.55Å; Y612-F616 WeakPolarHBondContact O-CB 3.3Å; Y612-F616 PolarHBondContact O-N 2.9Å; L613-F616 PolarHBondContact O-N 3.12Å; F616-N618 VanDerWaalsContact C-N 3.32Å; F616-N618 PolarHBondContact O-N 2.91Å; F616-E619 PolarHBondContact O-N 2.82Å; F616-H620 AromaticContact CD2-CE1 3.67Å; F616-H620 AromaticContact CD2-ND1 3.31Å; F616-H620 VanDerWaalsContact CD2-ND1 3.31Å; F616-H620 WeakPolarHBondContact CD2-ND1 3.48Å; F616-H620 HydrophobicContact CE2-CB 4.49Å; F616-H620 AromaticContact CE2-CG 3.97Å; F616-H620 AromaticContact CE2-ND1 3.52Å; F616-H620 AromaticContact CG-ND1 3.8Å; F616-H620 HydrophobicContact CZ-CB 4.4Å; F616-H620 PolarHBondContact O-N 3.06Å; F616-H620 VanDerWaalsContact O-N 3.16Å; F616-H620 PolarHBondContact O-ND1 3.15Å
617	C	90.5	Very high	77.9	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.02	33%	0.33	C	S	.	.	H	α-helix	trans	-65.5	-33.7	178	-66.4	0	0	0	0	112.7	F163 I172 L613 Q615 T621	F163-C617 HydrophobicContact CB-CB 4.32Å; I172-C617 PolarHBondContact O-SG 2.73Å; L613-C617 PolarHBondContact O-N 2.88Å; L613-C617 PolarHBondContact O-SG 2.99Å; L613-C617 VanDerWaalsContact O-SG 3.33Å; Q615-C617 PolarHBondContact O-N 2.8Å; C617-T621 VanDerWaalsContact O-CG2 3.31Å; C617-T621 WeakPolarHBondContact O-CG2 3.22Å; C617-T621 PolarHBondContact O-OG1 3.39Å; C617-T621 VanDerWaalsContact O-OG1 3.11Å
618	N	86.4	Confident	75.3	Confident	91 Å²	91	67.1 Å²	67.1	49%	0.487	34%	0.337	S	S	.	.	H	α-helix	trans	-71	-31.3	174.5	-79.7	-74.9	0	0	0	113.1	I165 H614 Q615 F616	I165-N618 WeakPolarHBondContact CD1-ND2 3.3Å; H614-N618 PolarHBondContact CE1-ND2 2.9Å; H614-N618 VanDerWaalsContact CE1-ND2 3.33Å; H614-N618 PolarHBondContact ND1-ND2 3.24Å; H614-N618 PolarHBondContact O-N 3.11Å; H614-N618 PolarHBondContact O-ND2 2.89Å; Q615-N618 PolarHBondContact O-N 3.27Å; F616-N618 VanDerWaalsContact C-N 3.32Å; F616-N618 PolarHBondContact O-N 2.91Å
619	E	86.9	Confident	73	Confident	106 Å²	106	73.2 Å²	73.2	50%	0.495	37%	0.366	S	S	.	.	H	α-helix	trans	-85	-28.2	-176.1	-76.9	179.2	-176.8	0	0	114.5	Q615 F616	Q615-E619 HydrophobicContact CG-CG 4.4Å; Q615-E619 WeakPolarHBondContact CG-OE1 3.24Å; Q615-E619 PolarHBondContact NE2-OE1 2.7Å; Q615-E619 WeakPolarHBondContact O-CG 3.46Å; Q615-E619 PolarHBondContact O-N 3Å; Q615-E619 VanDerWaalsContact O-N 3.08Å; F616-E619 PolarHBondContact O-N 2.82Å
620	H	86.4	Confident	70.5	Confident	15 Å²	15	79.3 Å²	79.3	7%	0.069	39%	0.393	C	S	.	.	H	α-helix	trans	-120.6	13	-165.7	-50.5	92.8	0	0	0	115.3	F163 G382 V383 V388 K391 F616	F163-H620 HydrophobicContact CD2-CB 4.08Å; F163-H620 WeakPolarHBondContact CD2-O 3.31Å; F163-H620 HydrophobicContact CE2-CB 3.85Å; G382-H620 WeakPolarHBondContact CA-O 3.4Å; V383-H620 PolarHBondContact N-O 3.11Å; V388-H620 HydrophobicContact CG1-CB 4.11Å; V388-H620 HydrophobicContact CG2-CB 4.24Å; K391-H620 WeakPolarHBondContact CD-NE2 3.35Å; K391-H620 PolarHBondContact NZ-NE2 2.9Å; F616-H620 AromaticContact CD2-CE1 3.67Å; F616-H620 AromaticContact CD2-ND1 3.31Å; F616-H620 VanDerWaalsContact CD2-ND1 3.31Å; F616-H620 WeakPolarHBondContact CD2-ND1 3.48Å; F616-H620 HydrophobicContact CE2-CB 4.49Å; F616-H620 AromaticContact CE2-CG 3.97Å; F616-H620 AromaticContact CE2-ND1 3.52Å; F616-H620 AromaticContact CG-ND1 3.8Å; F616-H620 HydrophobicContact CZ-CB 4.4Å; F616-H620 PolarHBondContact O-N 3.06Å; F616-H620 VanDerWaalsContact O-N 3.16Å; F616-H620 PolarHBondContact O-ND1 3.15Å
621	T	81.7	Confident	67.9	Low	22 Å²	22	83 Å²	83	14%	0.135	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-79.9	137	171.7	34.7	0	0	0	0	111.9	F163 K380 C617 N623	F163-T621 HydrophobicContact CB-CG2 3.69Å; F163-T621 WeakPolarHBondContact O-CG2 3.31Å; K380-T621 HydrophobicContact CB-CG2 4.03Å; C617-T621 VanDerWaalsContact O-CG2 3.31Å; C617-T621 WeakPolarHBondContact O-CG2 3.22Å; C617-T621 PolarHBondContact O-OG1 3.39Å; C617-T621 VanDerWaalsContact O-OG1 3.11Å; T621-N623 PolarHBondContact O-N 3.25Å
622	I	77.1	Confident	65.1	Low	40 Å²	40	82.4 Å²	82.4	21%	0.205	43%	0.43	C	S	.	.			trans	-71.8	111.7	170.9	-62.3	178.9	0	0	0	109	P381 V383 T624	P381-I622 HydrophobicContact CB-CD1 4.31Å; P381-I622 WeakPolarHBondContact O-CG1 3.39Å; P381-I622 PolarHBondContact O-N 3.29Å; V383-I622 HydrophobicContact CG2-CG1 3.88Å; I622-T624 PolarHBondContact O-N 2.86Å
623	N	62.6	Low	62.5	Low	68 Å²	68	89.1 Å²	89.1	36%	0.364	46%	0.459	S	S	.	.			trans	-91	88.6	179.2	-80.5	-57.5	0	0	0	111.5	K380 T621 E625 N626	K380-N623 PolarHBondContact NZ-OD1 3.4Å; T621-N623 PolarHBondContact O-N 3.25Å; N623-E625 PolarHBondContact O-N 2.9Å; N623-N626 PolarHBondContact O-N 2.79Å; N623-N626 VanDerWaalsContact O-N 3.17Å
624	T	51.9	Low	59.9	Low	94 Å²	94	94.2 Å²	94.2	58%	0.577	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48	-22.4	179.2	44.2	0	0	0	0	116.1	I622	I622-T624 PolarHBondContact O-N 2.86Å
625	E	47.9	Very low	57.3	Low	160 Å²	160	96.7 Å²	96.7	75%	0.748	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-14.6	-175.9	-64	174.3	159.9	0	0	114.2	N623	N623-E625 PolarHBondContact O-N 2.9Å
626	N	39.4	Very low	54.8	Low	124 Å²	124	96.6 Å²	96.6	66%	0.663	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	-11.3	-174.2	-78.7	-70.9	0	0	0	115.6	N623	N623-N626 PolarHBondContact O-N 2.79Å; N623-N626 VanDerWaalsContact O-N 3.17Å
627	E	38.9	Very low	52.1	Low	85 Å²	85	104.9 Å²	104.9	40%	0.397	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-85.1	-16.4	-172.2	-63.8	-157.3	137.3	0	0	115.1	L629 K630 I634	E627-L629 PolarHBondContact O-N 3.35Å; E627-K630 PolarHBondContact O-N 3.44Å; E627-I634 WeakPolarHBondContact OE1-CD1 3.46Å; E627-I634 VanDerWaalsContact OE2-CD1 3.31Å; E627-I634 WeakPolarHBondContact OE2-CD1 3.26Å
628	N	34.2	Very low	49.6	Very low	146 Å²	146	113.8 Å²	113.8	78%	0.781	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-60.4	-8	178.2	-73.8	-24.9	0	0	0	114.5
629	L	38.1	Very low	47.1	Very low	161 Å²	161	116.4 Å²	116.4	84%	0.843	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-114.9	-1	179.5	-79.2	152.6	0	0	0	114.1	E627	E627-L629 PolarHBondContact O-N 3.35Å
630	K	33.6	Very low	44.7	Very low	147 Å²	147	118 Å²	118	64%	0.639	58%	0.575	S	S	*	*	S	Bend	trans	-140.7	94.4	-177.9	-70.9	-172.1	179.5	178.6	0	114.5	E627	E627-K630 PolarHBondContact O-N 3.44Å
631	H	32.2	Very low	42.4	Very low	171 Å²	171	120.8 Å²	120.8	79%	0.792	60%	0.596	S	S	*	*			trans	67.9	60.7	147	-58	88	0	0	0	119.5	K633	H631-K633 VanDerWaalsContact C-N 3.28Å; H631-K633 PolarHBondContact O-N 3.26Å
632	G	30	Very low	40.4	Very low	79 Å²	79	124.9 Å²	124.9	81%	0.814	61%	0.614	S	S	*	*	S	Bend		63.9	-7.1	114.2	0	0	0	0	0	122.1
633	K	34.1	Very low	38.7	Very low	174 Å²	174	126 Å²	126	76%	0.757	62%	0.62	S	S	*	*	S	Bend	trans	-104.6	-25.9	-178.8	-70.5	-170.1	175.5	-174.1	0	114.4	H631 H635	H631-K633 VanDerWaalsContact C-N 3.28Å; H631-K633 PolarHBondContact O-N 3.26Å; K633-H635 VanDerWaalsContact C-N 3.26Å; K633-H635 PolarHBondContact O-N 3.12Å
634	I	36.8	Very low	37.6	Very low	108 Å²	108	129.9 Å²	129.9	55%	0.554	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-71.9	-18.9	-174.2	-66.2	171.2	0	0	0	112.6	E627 L636	E627-I634 WeakPolarHBondContact OE1-CD1 3.46Å; E627-I634 VanDerWaalsContact OE2-CD1 3.31Å; E627-I634 WeakPolarHBondContact OE2-CD1 3.26Å; I634-L636 PolarHBondContact O-N 2.75Å; I634-L636 VanDerWaalsContact O-N 3.14Å
635	H	35	Very low	37	Very low	129 Å²	129	130 Å²	130	60%	0.597	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-69.6	-5.5	-179.9	-99.9	-67.6	0	0	0	116.3	K633	K633-H635 VanDerWaalsContact C-N 3.26Å; K633-H635 PolarHBondContact O-N 3.12Å
636	L	35.7	Very low	36.6	Very low	101 Å²	101	128.5 Å²	128.5	53%	0.529	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-75.9	-41.3	-175.7	-78.2	162.1	0	0	0	113.8	I634 R638 R639 H640	I634-L636 PolarHBondContact O-N 2.75Å; I634-L636 VanDerWaalsContact O-N 3.14Å; L636-R638 PolarHBondContact O-N 3.22Å; L636-R639 PolarHBondContact O-N 3.01Å; L636-R639 VanDerWaalsContact O-N 3.15Å; L636-H640 PolarHBondContact O-N 3.36Å
637	Y	35.7	Very low	36.7	Very low	178 Å²	178	129.1 Å²	129.1	70%	0.698	62%	0.62	S	S	*	*	H	α-helix	trans	-67.1	-34.3	-173.9	-80.5	-98.5	0	0	0	113.3	R639	Y637-R639 VanDerWaalsContact C-N 3.25Å; Y637-R639 PolarHBondContact O-N 3.43Å
638	R	36	Very low	36.7	Very low	190 Å²	190	129.9 Å²	129.9	72%	0.717	63%	0.627	S	S	*	*	H	α-helix	trans	-73.1	-15.2	177.4	-152.6	171.1	-168.5	166.9	3.4	113.5	L636 Q642	L636-R638 PolarHBondContact O-N 3.22Å; R638-Q642 WeakPolarHBondContact O-CG 3.25Å
639	R	33.9	Very low	36.6	Very low	147 Å²	147	130.2 Å²	130.2	56%	0.555	62%	0.621	S	S	*	*	H	α-helix	trans	-83.7	-41.6	176.5	-77.2	-175.7	178	166.6	0.8	112.9	L636 Y637 S641 Q642 D643	L636-R639 PolarHBondContact O-N 3.01Å; L636-R639 VanDerWaalsContact O-N 3.15Å; Y637-R639 VanDerWaalsContact C-N 3.25Å; Y637-R639 PolarHBondContact O-N 3.43Å; R639-S641 VanDerWaalsContact C-N 3.27Å; R639-S641 PolarHBondContact O-N 3.46Å; R639-S641 VanDerWaalsContact O-N 3.14Å; R639-Q642 CarbonylContact O-C 3.56Å; R639-Q642 PolarHBondContact O-N 3.18Å; R639-D643 WeakPolarHBondContact O-CB 3.39Å; R639-D643 PolarHBondContact O-N 2.93Å
640	H	37	Very low	36.5	Very low	139 Å²	139	128.4 Å²	128.4	64%	0.644	61%	0.612	S	S	*	*	H	α-helix	trans	-60.6	-29.3	-175.2	-87.8	-65.1	0	0	0	115.2	L636	L636-H640 PolarHBondContact O-N 3.36Å
641	S	37.7	Very low	36.6	Very low	74 Å²	74	125.2 Å²	125.2	52%	0.517	61%	0.609	S	S	.	*	H	α-helix	trans	-77	-45.6	170.6	56	0	0	0	0	112.1	R639 D643 L645	R639-S641 VanDerWaalsContact C-N 3.27Å; R639-S641 PolarHBondContact O-N 3.46Å; R639-S641 VanDerWaalsContact O-N 3.14Å; S641-D643 PolarHBondContact O-N 3.21Å; S641-L645 PolarHBondContact O-N 3.43Å; S641-L645 VanDerWaalsContact O-N 3.1Å
642	Q	40.4	Very low	36.5	Very low	107 Å²	107	123.2 Å²	123.2	50%	0.5	60%	0.603	S	S	.	*	H	α-helix	trans	-66.6	-35.1	-179.5	-70.4	-174.4	-14.3	0	0	113.6	R638 R639 L645 K646	R638-Q642 WeakPolarHBondContact O-CG 3.25Å; R639-Q642 CarbonylContact O-C 3.56Å; R639-Q642 PolarHBondContact O-N 3.18Å; Q642-L645 CarbonylContact O-C 3.49Å; Q642-L645 WeakPolarHBondContact O-CB 3.49Å; Q642-L645 PolarHBondContact O-N 3.42Å; Q642-K646 PolarHBondContact O-N 2.78Å
643	D	40.9	Very low	36.2	Very low	64 Å²	64	127.9 Å²	127.9	34%	0.342	60%	0.6	S	S	.	*	H	α-helix	trans	-78.3	-32.8	-178.9	-70	-37	0	0	0	112	R639 S641 L645 K646 Q647	R639-D643 WeakPolarHBondContact O-CB 3.39Å; R639-D643 PolarHBondContact O-N 2.93Å; S641-D643 PolarHBondContact O-N 3.21Å; D643-L645 VanDerWaalsContact C-N 3.29Å; D643-L645 PolarHBondContact O-N 2.98Å; D643-K646 PolarHBondContact O-N 3.25Å; D643-K646 IonicContact OD1-NZ 3.79Å; D643-Q647 WeakPolarHBondContact O-CB 3.38Å; D643-Q647 VanDerWaalsContact O-CG 3.31Å; D643-Q647 WeakPolarHBondContact O-CG 3.3Å; D643-Q647 PolarHBondContact O-N 3.23Å
644	K	40.5	Very low	35.8	Very low	149 Å²	149	129 Å²	129	65%	0.648	61%	0.606	S	S	*	*	H	α-helix	trans	-61.6	-38.8	163.8	-80.5	-174.7	175.4	-179.9	0	111.4	Q647 L648	K644-Q647 PolarHBondContact O-N 3.37Å; K644-L648 WeakPolarHBondContact O-CB 3.25Å; K644-L648 PolarHBondContact O-N 3.01Å
645	L	39.6	Very low	35.2	Very low	97 Å²	97	133.9 Å²	133.9	51%	0.508	62%	0.617	S	S	.	*	H	α-helix	trans	-70.6	-33.2	177	-129.3	158.9	0	0	0	112.5	S641 Q642 D643 K649	S641-L645 PolarHBondContact O-N 3.43Å; S641-L645 VanDerWaalsContact O-N 3.1Å; Q642-L645 CarbonylContact O-C 3.49Å; Q642-L645 WeakPolarHBondContact O-CB 3.49Å; Q642-L645 PolarHBondContact O-N 3.42Å; D643-L645 VanDerWaalsContact C-N 3.29Å; D643-L645 PolarHBondContact O-N 2.98Å; L645-K649 HydrophobicContact CD2-CD 4.1Å; L645-K649 HydrophobicContact CD2-CG 4.26Å; L645-K649 WeakPolarHBondContact O-CB 3.46Å; L645-K649 WeakPolarHBondContact O-CG 3.45Å; L645-K649 PolarHBondContact O-N 2.9Å
646	K	38.1	Very low	34.7	Very low	129 Å²	129	135.3 Å²	135.3	56%	0.561	63%	0.627	S	S	*	*	H	α-helix	trans	-67.4	-43.4	168.4	-81.9	179.4	176.7	170.6	0	112.1	Q642 D643 L648 K649 N650	Q642-K646 PolarHBondContact O-N 2.78Å; D643-K646 PolarHBondContact O-N 3.25Å; D643-K646 IonicContact OD1-NZ 3.79Å; K646-L648 VanDerWaalsContact C-N 3.34Å; K646-L648 PolarHBondContact O-N 3.32Å; K646-K649 PolarHBondContact O-N 3.49Å; K646-N650 VanDerWaalsContact O-CB 3.28Å; K646-N650 WeakPolarHBondContact O-CB 3.02Å; K646-N650 PolarHBondContact O-N 2.96Å
647	Q	42.4	Very low	34.2	Very low	136 Å²	136	137.6 Å²	137.6	64%	0.636	64%	0.635	S	S	*	*	H	α-helix	trans	-61.8	-42.4	176.8	-74.8	174	-4.3	0	0	111.3	D643 K644 N650 S651	D643-Q647 WeakPolarHBondContact O-CB 3.38Å; D643-Q647 VanDerWaalsContact O-CG 3.31Å; D643-Q647 WeakPolarHBondContact O-CG 3.3Å; D643-Q647 PolarHBondContact O-N 3.23Å; K644-Q647 PolarHBondContact O-N 3.37Å; Q647-N650 PolarHBondContact O-N 3.28Å; Q647-S651 PolarHBondContact O-N 3.31Å; Q647-S651 PolarHBondContact O-OG 3.16Å
648	L	38.2	Very low	33.7	Very low	102 Å²	102	135.3 Å²	135.3	53%	0.534	64%	0.639	S	S	.	*	H	α-helix	trans	-66	-41.5	172.5	-88.7	156	0	0	0	113.5	K644 K646 N650 S651 I652	K644-L648 WeakPolarHBondContact O-CB 3.25Å; K644-L648 PolarHBondContact O-N 3.01Å; K646-L648 VanDerWaalsContact C-N 3.34Å; K646-L648 PolarHBondContact O-N 3.32Å; L648-N650 VanDerWaalsContact C-N 3.27Å; L648-N650 PolarHBondContact O-N 2.74Å; L648-S651 PolarHBondContact O-N 3.35Å; L648-S651 PolarHBondContact O-OG 3.1Å; L648-I652 HydrophobicContact CD2-CD1 4.46Å; L648-I652 WeakPolarHBondContact O-CG1 3.46Å; L648-I652 PolarHBondContact O-N 2.85Å; L648-I652 VanDerWaalsContact O-N 3.1Å
649	K	33.6	Very low	33.2	Very low	153 Å²	153	131.9 Å²	131.9	67%	0.665	64%	0.64	S	S	*	*	H	α-helix	trans	-68.2	-24.8	174.3	-77.4	-177.7	174.1	-173.9	0	113.3	L645 K646	L645-K649 HydrophobicContact CD2-CD 4.1Å; L645-K649 HydrophobicContact CD2-CG 4.26Å; L645-K649 WeakPolarHBondContact O-CB 3.46Å; L645-K649 WeakPolarHBondContact O-CG 3.45Å; L645-K649 PolarHBondContact O-N 2.9Å; K646-K649 PolarHBondContact O-N 3.49Å
650	N	35.7	Very low	32.7	Very low	122 Å²	122	129.9 Å²	129.9	65%	0.652	65%	0.648	S	S	*	*	H	α-helix	trans	-84.3	-28.6	175.2	-73.9	-10	0	0	0	113	K646 Q647 L648	K646-N650 VanDerWaalsContact O-CB 3.28Å; K646-N650 WeakPolarHBondContact O-CB 3.02Å; K646-N650 PolarHBondContact O-N 2.96Å; Q647-N650 PolarHBondContact O-N 3.28Å; L648-N650 VanDerWaalsContact C-N 3.27Å; L648-N650 PolarHBondContact O-N 2.74Å
651	S	34.3	Very low	32.1	Very low	80 Å²	80	127.6 Å²	127.6	56%	0.559	65%	0.648	S	S	*	*	H	α-helix	trans	-81.3	-29.8	176.3	63.4	0	0	0	0	113.2	Q647 L648 K653	Q647-S651 PolarHBondContact O-N 3.31Å; Q647-S651 PolarHBondContact O-OG 3.16Å; L648-S651 PolarHBondContact O-N 3.35Å; L648-S651 PolarHBondContact O-OG 3.1Å; S651-K653 PolarHBondContact O-N 2.82Å
652	I	30.9	Very low	31.6	Very low	130 Å²	130	130.9 Å²	130.9	67%	0.667	66%	0.658	S	S	*	*			trans	-86.2	64.1	174.4	-52.3	171	0	0	0	109.7	L648	L648-I652 HydrophobicContact CD2-CD1 4.46Å; L648-I652 WeakPolarHBondContact O-CG1 3.46Å; L648-I652 PolarHBondContact O-N 2.85Å; L648-I652 VanDerWaalsContact O-N 3.1Å
653	K	24.1	Very low	30.7	Very low	176 Å²	176	132.9 Å²	132.9	77%	0.765	67%	0.667	S	S	*	*			trans	-115.7	42.2	179.9	-152.8	173.5	-175.9	179.3	0	113	S651 R655	S651-K653 PolarHBondContact O-N 2.82Å; K653-R655 PolarHBondContact O-N 3.47Å
654	F	26	Very low	30	Very low	198 Å²	198	136.9 Å²	136.9	87%	0.868	68%	0.684	S	S	*	*			trans	-77	80.4	-179.9	-106.1	-84	0	0	0	113.3	I656	F654-I656 PolarHBondContact O-N 2.81Å
655	R	23.4	Very low	29.2	Very low	210 Å²	210	137.4 Å²	137.4	79%	0.792	69%	0.689	S	S	*	*			trans	17.6	90.4	136.4	-162.2	-179.3	-158.4	170.1	4.3	116.8	K653	K653-R655 PolarHBondContact O-N 3.47Å
656	I	25.6	Very low	28.4	Very low	159 Å²	159	137.4 Å²	137.4	82%	0.815	70%	0.697	S	S	*	*			trans	-119.6	110.9	153.5	-62.4	-179.7	0	0	0	107.5	F654	F654-I656 PolarHBondContact O-N 2.81Å
657	H	23.6	Very low	27.7	Very low	149 Å²	149	139.4 Å²	139.4	69%	0.69	71%	0.71	S	S	*	*			trans	-82.9	125.1	170.3	-79.4	-109.8	0	0	0	109.6
658	V	26.1	Very low	27	Very low	130 Å²	130	137.8 Å²	137.8	79%	0.788	71%	0.712	S	S	*	*			trans	-141.9	129	137.1	-175	0	0	0	0	108.2
659	T	25.3	Very low	26.4	Very low	119 Å²	119	141.3 Å²	141.3	73%	0.73	73%	0.729	S	S	*	*			trans	-44.8	127.3	172.5	44.4	0	0	0	0	113.7
660	S	22.8	Very low	25.7	Very low	104 Å²	104	141.4 Å²	141.4	73%	0.727	73%	0.729	S	S	*	*				78.3	152.8	94.3	90.2	0	0	0	0	113.9
661	S	24.2	Very low	25.2	Very low	92 Å²	92	144.2 Å²	144.2	64%	0.643	73%	0.732	S	S	*	*			cis	-149.5	175	10.8	-46.7	0	0	0	0	111.3
662	I	27.5	Very low	24.7	Very low	142 Å²	142	146.8 Å²	146.8	73%	0.728	74%	0.735	S	S	*	*			trans	68.9	120.1	160.6	-56.9	152.7	0	0	0	115.8
663	E	22	Very low	24.3	Very low	149 Å²	149	148.5 Å²	148.5	70%	0.696	74%	0.738	S	S	*	*			cis	108.9	149.7	15.9	-63.7	167.3	129.1	0	0	114.6
664	H	25.6	Very low	24.2	Very low	149 Å²	149	145.7 Å²	145.7	69%	0.69	73%	0.731	S	S	*	*			trans	66	146.2	173.5	-56.1	-83.6	0	0	0	117.2
665	E	24.1	Very low	24.2	Very low	159 Å²	159	146.9 Å²	146.9	74%	0.743	73%	0.73	S	S	*	*			cis	-159.2	-172	-7.3	-126.2	165.3	-153	0	0	115.6
666	S	22.9	Very low	24.2	Very low	97 Å²	97	143.5 Å²	143.5	68%	0.678	73%	0.726	S	S	*	*			trans	-54.3	173.6	172.9	37.4	0	0	0	0	117.4
667	M	22.8	Very low	24.1	Very low	172 Å²	172	143.2 Å²	143.2	85%	0.847	73%	0.725	S	S	*	*			cis	-158.5	175.4	-3	-120.2	-173.6	76	0	0	110.2
668	P	28.7	Very low	24.4	Very low	102 Å²	102	141 Å²	141	66%	0.662	72%	0.724	S	S	*	*			trans	-106.8	158.2	-179.3	39.4	-32.2	0	0	0	115.9
669	I	25.2	Very low	24.3	Very low	176 Å²	176	143.7 Å²	143.7	90%	0.903	73%	0.725	S	S	*	*			trans	-151.3	166.4	169.7	-99.3	143.1	0	0	0	111.8
670	K	20.1	Very low	24.2	Very low	154 Å²	154	145.2 Å²	145.2	67%	0.67	72%	0.724	S	S	*	*			trans	-105.7	176.9	-173.2	-72	178.6	175.3	175.9	0	114.1
671	Y	23.1	Very low	24.3	Very low	181 Å²	181	146 Å²	146	71%	0.71	72%	0.72	S	S	*	*			trans	83.6	156.4	155.3	-58.7	-63.1	0	0	0	117.1
672	H	24.7	Very low	24.5	Very low	135 Å²	135	148.8 Å²	148.8	63%	0.625	72%	0.722	S	S	*	*			cis	-141.9	-153.7	-7.8	-135.1	-64.8	0	0	0	111.9
673	F	22.4	Very low	24.4	Very low	166 Å²	166	146.4 Å²	146.4	73%	0.728	71%	0.711	S	S	*	*			trans	-69.6	-173.7	-174.8	-54.6	168.1	0	0	0	113.5
674	D	23.1	Very low	24.6	Very low	117 Å²	117	146.2 Å²	146.2	63%	0.626	71%	0.714	S	S	*	*			cis	-172.4	-176.1	28.6	-143.4	-28.1	0	0	0	114.7
675	R	24.5	Very low	24.7	Very low	223 Å²	223	147 Å²	147	84%	0.842	72%	0.716	S	S	*	*			trans	86.6	114	166.1	-44.8	-162.7	178	-179.4	-1	116.2
676	I	23.3	Very low	24.9	Very low	139 Å²	139	141.9 Å²	141.9	71%	0.713	70%	0.698	S	S	*	*			cis	77.6	122.4	45.8	-50.3	159.9	0	0	0	109.5
677	I	24.2	Very low	25.2	Very low	153 Å²	153	144 Å²	144	79%	0.785	70%	0.695	S	S	*	*				-150.1	154.6	61.4	-71.7	171	0	0	0	112.5
678	P	29.1	Very low	25.7	Very low	102 Å²	102	138.3 Å²	138.3	66%	0.662	67%	0.668	S	S	*	*			trans	-121	173.6	179.4	43.4	-32.9	0	0	0	116.6
679	F	24.5	Very low	25.8	Very low	187 Å²	187	135.8 Å²	135.8	82%	0.82	65%	0.649	S	S	*	*			trans	-143	127	150.3	-94.5	-95.8	0	0	0	107.6
680	H	24.5	Very low	26	Very low	151 Å²	151	132.4 Å²	132.4	70%	0.699	63%	0.632	S	S	*	*				55	132.3	86.4	-86.8	-12.6	0	0	0	113.8
681	N	24.9	Very low	26.5	Very low	120 Å²	120	126.6 Å²	126.6	64%	0.642	61%	0.61	S	S	*	*			cis	-159.2	174.7	7.6	-118.5	-20.9	0	0	0	110
682	Q	27.8	Very low	26.9	Very low	150 Å²	150	121.8 Å²	121.8	70%	0.701	59%	0.593	S	S	*	*			cis	-138.7	-91.7	8.7	-151.3	-144.1	99.2	0	0	114.9
683	N	25.7	Very low	27.2	Very low	92 Å²	92	119.7 Å²	119.7	49%	0.492	59%	0.585	S	S	.	*			trans	-154.1	142.8	-165.8	-74.2	-64.8	0	0	0	114.3	K685	N683-K685 WeakPolarHBondContact OD1-CE 3.21Å; N683-K685 PolarHBondContact OD1-NZ 2.75Å
684	L	26.1	Very low	27.5	Very low	145 Å²	145	116.4 Å²	116.4	76%	0.759	58%	0.576	S	S	*	*				-154.5	130.9	127.3	-110.2	169.6	0	0	0	107.5
685	K	26.8	Very low	27.8	Very low	166 Å²	166	111.6 Å²	111.6	72%	0.722	55%	0.549	S	S	*	.			trans	-138.3	79.2	-161.1	-68.2	-180	178.1	164.3	0	114	N683	N683-K685 WeakPolarHBondContact OD1-CE 3.21Å; N683-K685 PolarHBondContact OD1-NZ 2.75Å
686	S	28.2	Very low	27.8	Very low	52 Å²	52	111 Å²	111	36%	0.364	55%	0.547	S	S	.	.			trans	-178.2	158.7	145.5	57.6	0	0	0	0	110.9	D688 D689	S686-D688 VanDerWaalsContact C-N 3.29Å; S686-D689 VanDerWaalsContact OG-CB 3.29Å; S686-D689 WeakPolarHBondContact OG-CB 3.08Å; S686-D689 PolarHBondContact OG-N 3.17Å; S686-D689 PolarHBondContact OG-OD2 3.29Å
687	F	29.3	Very low	28.1	Very low	141 Å²	141	108.6 Å²	108.6	62%	0.618	54%	0.539	S	S	*	.	H	α-helix	trans	-69.4	-34.5	165.7	-172	-105.6	0	0	0	109.8	D689 L690 C691 E1635	F687-D689 VanDerWaalsContact C-N 3.33Å; F687-D689 PolarHBondContact O-N 2.95Å; F687-L690 WeakPolarHBondContact O-CB 3.06Å; F687-L690 PolarHBondContact O-N 2.9Å; F687-C691 PolarHBondContact O-N 3.08Å; F687-E1635 WeakPolarHBondContact CB-OE1 3.25Å; F687-E1635 HydrophobicContact CD1-CG 4.09Å
688	D	33.1	Very low	28.2	Very low	53 Å²	53	108.7 Å²	108.7	28%	0.283	53%	0.534	S	S	.	.	H	α-helix	trans	-49.9	-42.9	168.4	-169	35.3	0	0	0	113.8	S686 C691 K692 N1634 E1635	S686-D688 VanDerWaalsContact C-N 3.29Å; D688-C691 PolarHBondContact O-N 2.93Å; D688-K692 VanDerWaalsContact CG-CE 3.49Å; D688-K692 WeakPolarHBondContact O-CE 3.24Å; D688-K692 PolarHBondContact O-N 2.93Å; D688-K692 IonicContact OD1-NZ 3.93Å; D688-K692 WeakPolarHBondContact OD2-CE 3.32Å; D688-K692 IonicContact OD2-NZ 2.73Å; D688-K692 PolarHBondContact OD2-NZ 3.48Å; D688-N1634 VanDerWaalsContact CA-ND2 3.35Å; D688-N1634 WeakPolarHBondContact CA-ND2 2.82Å; D688-N1634 PolarHBondContact O-ND2 2.94Å; D688-N1634 PolarHBondContact OD1-ND2 2.86Å; D688-E1635 WeakPolarHBondContact CA-OE1 3.35Å; D688-E1635 HydrophobicContact CB-CG 4.39Å; D688-E1635 PolarHBondContact N-OE1 3.22Å
689	D	31.1	Very low	28	Very low	48 Å²	48	110.7 Å²	110.7	26%	0.257	53%	0.528	S	S	.	.	H	α-helix	trans	-75.3	-31.1	178.9	-67.9	-38.6	0	0	0	113.8	S686 F687 C691 K692 I693	S686-D689 VanDerWaalsContact OG-CB 3.29Å; S686-D689 WeakPolarHBondContact OG-CB 3.08Å; S686-D689 PolarHBondContact OG-N 3.17Å; S686-D689 PolarHBondContact OG-OD2 3.29Å; F687-D689 VanDerWaalsContact C-N 3.33Å; F687-D689 PolarHBondContact O-N 2.95Å; D689-C691 PolarHBondContact O-N 2.95Å; D689-K692 WeakPolarHBondContact O-CA 3.07Å; D689-K692 WeakPolarHBondContact O-CB 3.28Å; D689-K692 PolarHBondContact O-N 2.83Å; D689-K692 WeakPolarHBondContact OD1-CD 3.2Å; D689-K692 WeakPolarHBondContact OD1-CE 3.11Å; D689-K692 IonicContact OD1-NZ 3.71Å; D689-K692 PolarHBondContact OD1-NZ 3.47Å; D689-I693 PolarHBondContact O-N 3.04Å
690	L	30.4	Very low	28	Very low	105 Å²	105	107.8 Å²	107.8	55%	0.55	52%	0.521	S	S	.	.	H	α-helix	trans	-58	-35.2	172.2	-110.9	166.4	0	0	0	111	F687 I693 N694	F687-L690 WeakPolarHBondContact O-CB 3.06Å; F687-L690 PolarHBondContact O-N 2.9Å; L690-I693 PolarHBondContact O-N 3.32Å; L690-N694 PolarHBondContact O-N 3.24Å
691	C	30.4	Very low	28.2	Very low	33 Å²	33	105.9 Å²	105.9	22%	0.223	51%	0.512	C	S	.	.	H	α-helix	trans	-82.1	-15.1	174.6	-106	0	0	0	0	114.8	F687 D688 D689 Q695 N1633 N1634	F687-C691 PolarHBondContact O-N 3.08Å; D688-C691 PolarHBondContact O-N 2.93Å; D689-C691 PolarHBondContact O-N 2.95Å; C691-Q695 VanDerWaalsContact O-CD 3.3Å; C691-Q695 VanDerWaalsContact O-CG 3.23Å; C691-Q695 WeakPolarHBondContact O-CG 3.13Å; C691-Q695 PolarHBondContact O-N 2.82Å; C691-Q695 PolarHBondContact O-NE2 2.85Å; C691-Q695 VanDerWaalsContact O-NE2 3.16Å; C691-N1633 HydrophobicContact CB-CB 4.08Å; C691-N1633 PolarHBondContact O-ND2 3.13Å; C691-N1633 PolarHBondContact SG-ND2 3.08Å; C691-N1634 VanDerWaalsContact CB-CG 3.42Å; C691-N1634 WeakPolarHBondContact CB-ND2 3.46Å; C691-N1634 WeakPolarHBondContact CB-OD1 3.39Å; C691-N1634 PolarHBondContact SG-OD1 3.33Å; C691-N1634 VanDerWaalsContact SG-OD1 3.34Å
692	K	30.9	Very low	28.3	Very low	79 Å²	79	104.1 Å²	104.1	34%	0.343	51%	0.509	S	S	.	.	H	α-helix	trans	-78.4	-33.1	166.1	-63.8	165.8	-149.5	157.7	0	110.9	D688 D689 Q695 R696	D688-K692 VanDerWaalsContact CG-CE 3.49Å; D688-K692 WeakPolarHBondContact O-CE 3.24Å; D688-K692 PolarHBondContact O-N 2.93Å; D688-K692 IonicContact OD1-NZ 3.93Å; D688-K692 WeakPolarHBondContact OD2-CE 3.32Å; D688-K692 IonicContact OD2-NZ 2.73Å; D688-K692 PolarHBondContact OD2-NZ 3.48Å; D689-K692 WeakPolarHBondContact O-CA 3.07Å; D689-K692 WeakPolarHBondContact O-CB 3.28Å; D689-K692 PolarHBondContact O-N 2.83Å; D689-K692 WeakPolarHBondContact OD1-CD 3.2Å; D689-K692 WeakPolarHBondContact OD1-CE 3.11Å; D689-K692 IonicContact OD1-NZ 3.71Å; D689-K692 PolarHBondContact OD1-NZ 3.47Å; K692-Q695 PolarHBondContact O-N 3.42Å; K692-R696 PolarHBondContact O-N 2.62Å; K692-R696 VanDerWaalsContact O-N 3.14Å
693	I	30.1	Very low	28.2	Very low	91 Å²	91	102.1 Å²	102.1	47%	0.467	50%	0.503	S	S	.	.	H	α-helix	trans	-64.8	-45	168.6	-65.7	169.6	0	0	0	110.2	D689 L690 Q695 R696 V697	D689-I693 PolarHBondContact O-N 3.04Å; L690-I693 PolarHBondContact O-N 3.32Å; I693-Q695 PolarHBondContact O-N 2.9Å; I693-R696 PolarHBondContact O-N 2.97Å; I693-V697 PolarHBondContact O-N 2.95Å
694	N	29.4	Very low	28.3	Very low	98 Å²	98	104 Å²	104	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-67.6	2.2	173.7	-123.4	-41.2	0	0	0	114.9	L690	L690-N694 PolarHBondContact O-N 3.24Å
695	Q	29.6	Very low	28.2	Very low	15 Å²	15	105.8 Å²	105.8	7%	0.07	51%	0.514	C	S	.	.	H	α-helix	trans	-108	-23.5	167.4	-69.6	163.3	25.7	0	0	112.9	C691 K692 I693 K698 N1633	C691-Q695 VanDerWaalsContact O-CD 3.3Å; C691-Q695 VanDerWaalsContact O-CG 3.23Å; C691-Q695 WeakPolarHBondContact O-CG 3.13Å; C691-Q695 PolarHBondContact O-N 2.82Å; C691-Q695 PolarHBondContact O-NE2 2.85Å; C691-Q695 VanDerWaalsContact O-NE2 3.16Å; K692-Q695 PolarHBondContact O-N 3.42Å; I693-Q695 PolarHBondContact O-N 2.9Å; Q695-K698 PolarHBondContact O-N 2.81Å; Q695-N1633 VanDerWaalsContact NE2-CG 3.27Å; Q695-N1633 PolarHBondContact NE2-ND2 3.43Å
696	R	25.3	Very low	28.1	Very low	211 Å²	211	106.2 Å²	106.2	80%	0.796	52%	0.516	S	S	*	.	H	α-helix	trans	-72.3	-26.8	173.5	-84.8	-178.4	162.6	152.9	-3.9	113.1	K692 I693 K698 R699	K692-R696 PolarHBondContact O-N 2.62Å; K692-R696 VanDerWaalsContact O-N 3.14Å; I693-R696 PolarHBondContact O-N 2.97Å; R696-K698 PolarHBondContact O-N 3.31Å; R696-R699 PolarHBondContact O-N 2.92Å; R696-R699 VanDerWaalsContact O-O 3.11Å
697	V	27.7	Very low	27.9	Very low	89 Å²	89	111.2 Å²	111.2	54%	0.539	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-10.6	171.8	-173.8	0	0	0	0	112.9	I693 R699	I693-V697 PolarHBondContact O-N 2.95Å; V697-R699 VanDerWaalsContact C-N 3.32Å
698	K	27.6	Very low	27.6	Very low	155 Å²	155	111.6 Å²	111.6	67%	0.674	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	7.6	175.9	-74.9	174.7	178.1	162.2	0	114.1	Q695 R696	Q695-K698 PolarHBondContact O-N 2.81Å; R696-K698 PolarHBondContact O-N 3.31Å
699	R	24.9	Very low	27.2	Very low	144 Å²	144	118.1 Å²	118.1	54%	0.543	57%	0.572	S	S	.	*	S	Bend	trans	-136.4	153.6	173	-63.2	178.9	172.6	108.6	-3	107.4	R696 V697	R696-R699 PolarHBondContact O-N 2.92Å; R696-R699 VanDerWaalsContact O-O 3.11Å; V697-R699 VanDerWaalsContact C-N 3.32Å
700	N	24.6	Very low	26.8	Very low	125 Å²	125	123.1 Å²	123.1	67%	0.668	60%	0.599	S	S	*	*			trans	80.5	12.2	175.5	-49	12.3	0	0	0	119.1	S702	N700-S702 PolarHBondContact O-N 3.45Å
701	H	27.6	Very low	26.5	Very low	111 Å²	111	127.2 Å²	127.2	51%	0.514	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.8	22.4	166.5	-83.6	-67.9	0	0	0	114.1
702	S	27.4	Very low	26.1	Very low	83 Å²	83	132.1 Å²	132.1	58%	0.58	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-27.8	171.7	30.9	0	0	0	0	113.1	N700	N700-S702 PolarHBondContact O-N 3.45Å
703	D	26.3	Very low	25.9	Very low	109 Å²	109	135.7 Å²	135.7	58%	0.583	65%	0.651	S	S	*	*	S	Bend	trans	-115.6	-6	-160.8	-55	-77.1	0	0	0	113.7	F705	D703-F705 PolarHBondContact O-N 3.14Å
704	I	26.5	Very low	25.6	Very low	132 Å²	132	138.4 Å²	138.4	68%	0.677	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	35.3	172.9	-40.9	177.2	0	0	0	110.5
705	F	25	Very low	25.5	Very low	182 Å²	182	138.7 Å²	138.7	80%	0.798	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.9	20.9	172.2	-87.2	-77.2	0	0	0	111.4	D703	D703-F705 PolarHBondContact O-N 3.14Å
706	K	23.6	Very low	25.2	Very low	174 Å²	174	140.5 Å²	140.5	76%	0.757	68%	0.677	S	S	*	*			trans	-137.2	56.2	-178.3	-72.7	-174.4	174.5	178.3	0	112.5
707	L	24.2	Very low	25.2	Very low	158 Å²	158	136.1 Å²	136.1	83%	0.827	67%	0.669	S	S	*	*	S	Bend	trans	-154.6	129.7	163	-108.7	152.3	0	0	0	109.9
708	N	24.1	Very low	25.1	Very low	148 Å²	148	136.4 Å²	136.4	79%	0.791	67%	0.671	S	S	*	*			trans	45.1	123.4	172.2	-63	-4.2	0	0	0	120
709	K	24.3	Very low	25.1	Very low	191 Å²	191	133.2 Å²	133.2	83%	0.83	66%	0.657	S	S	*	*	S	Bend	trans	-69.7	157.2	161.9	-53.2	171.7	-178.8	176.7	0	109.2
710	N	22.6	Very low	25.5	Very low	152 Å²	152	133.1 Å²	133.1	81%	0.813	66%	0.663	S	S	*	*			trans	89	30.9	163.4	-47.1	-5.7	0	0	0	119.5
711	E	23.8	Very low	25.9	Very low	191 Å²	191	130.1 Å²	130.1	89%	0.893	65%	0.647	S	S	*	*			trans	-115.9	127.3	165.7	-69.8	-170.5	159.8	0	0	112.7
712	Y	23.2	Very low	26.1	Very low	137 Å²	137	126.7 Å²	126.7	54%	0.537	63%	0.632	S	S	.	*			trans	-104.4	129.7	176.6	-71.4	-98.9	0	0	0	110	H714 S744 L748	Y712-H714 PolarHBondContact O-N 2.91Å; Y712-S744 PolarHBondContact OH-O 3.14Å; Y712-L748 HydrophobicContact CD2-CD1 3.54Å; Y712-L748 HydrophobicContact CE2-CD1 3.62Å; Y712-L748 HydrophobicContact CG-CD1 4.13Å
713	I	25.1	Very low	26.3	Very low	153 Å²	153	127.3 Å²	127.3	79%	0.785	62%	0.624	S	S	*	*			trans	-83.1	101.8	179.8	-55.6	179.8	0	0	0	110.3	L715	I713-L715 HydrophobicContact CG2-CG 4.26Å; I713-L715 PolarHBondContact O-N 3.36Å
714	H	24.3	Very low	26.7	Very low	149 Å²	149	126 Å²	126	69%	0.69	62%	0.617	S	S	*	*			trans	-79.8	103.6	175.1	-147.5	-89.3	0	0	0	110.4	Y712 S716	Y712-H714 PolarHBondContact O-N 2.91Å; H714-S716 PolarHBondContact ND1-OG 2.85Å; H714-S716 VanDerWaalsContact ND1-OG 3.08Å; H714-S716 PolarHBondContact O-N 3.3Å
715	L	27.7	Very low	27.4	Very low	104 Å²	104	121.1 Å²	121.1	55%	0.545	59%	0.591	S	S	.	*			trans	-79.3	36.1	-172.3	-85.3	162.7	0	0	0	114.8	I713 N717 N721	I713-L715 HydrophobicContact CG2-CG 4.26Å; I713-L715 PolarHBondContact O-N 3.36Å; L715-N717 PolarHBondContact O-N 3.01Å; L715-N721 HydrophobicContact CD2-CB 3.66Å
716	S	24.2	Very low	27.9	Very low	53 Å²	53	113.2 Å²	113.2	37%	0.371	56%	0.561	S	S	.	*			trans	-95	44.9	-178.7	60.2	0	0	0	0	113	H714	H714-S716 PolarHBondContact ND1-OG 2.85Å; H714-S716 VanDerWaalsContact ND1-OG 3.08Å; H714-S716 PolarHBondContact O-N 3.3Å
717	N	23.6	Very low	28.5	Very low	119 Å²	119	109.5 Å²	109.5	64%	0.636	55%	0.547	S	S	*	.	S	Bend	trans	-161.2	137.4	174	-105.5	-53.9	0	0	0	113.9	L715 N721	L715-N717 PolarHBondContact O-N 3.01Å; N717-N721 PolarHBondContact O-ND2 2.83Å
718	T	27.1	Very low	29.1	Very low	94 Å²	94	106.2 Å²	106.2	58%	0.577	54%	0.536	S	S	*	.			trans	57	139.8	161.5	62.5	0	0	0	0	121.1	H720 N721	T718-H720 PolarHBondContact O-N 2.77Å; T718-N721 PolarHBondContact O-N 3.05Å
719	F	26.9	Very low	29.7	Very low	88 Å²	88	99.7 Å²	99.7	39%	0.386	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-17.8	-178.5	-124.5	-98.5	0	0	0	115.7	Y789 F831 K836	F719-Y789 HydrophobicContact CD2-CD1 4.17Å; F719-Y789 HydrophobicContact CD2-CE1 4.13Å; F719-Y789 HydrophobicContact CE2-CD1 4.42Å; F719-F831 HydrophobicContact CE1-CZ 4.39Å; F719-K836 HydrophobicContact CE1-CD 4.25Å; F719-K836 HydrophobicContact CE1-CG 4.06Å; F719-K836 HydrophobicContact CZ-CB 4.42Å; F719-K836 HydrophobicContact CZ-CD 3.77Å; F719-K836 HydrophobicContact CZ-CG 4Å
720	H	32.8	Very low	30.2	Very low	143 Å²	143	97.9 Å²	97.9	66%	0.662	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-36.7	177.6	-82.5	-76.8	0	0	0	112.5	T718 L722 F723 D724	T718-H720 PolarHBondContact O-N 2.77Å; H720-L722 PolarHBondContact O-N 3.05Å; H720-L722 VanDerWaalsContact O-N 3.1Å; H720-F723 VanDerWaalsContact O-CB 3.27Å; H720-F723 WeakPolarHBondContact O-CB 3.35Å; H720-F723 PolarHBondContact O-N 3.41Å; H720-D724 PolarHBondContact O-N 3.48Å
721	N	33.6	Very low	30.8	Very low	61 Å²	61	94.1 Å²	94.1	33%	0.326	47%	0.472	S	S	.	.	H	α-helix	trans	-64.4	-19.9	-177.5	-74.4	-38.9	0	0	0	113.4	L715 N717 T718 F725	L715-N721 HydrophobicContact CD2-CB 3.66Å; N717-N721 PolarHBondContact O-ND2 2.83Å; T718-N721 PolarHBondContact O-N 3.05Å; N721-F725 WeakPolarHBondContact O-CB 3.25Å; N721-F725 PolarHBondContact O-N 3.44Å
722	L	30.9	Very low	31.3	Very low	39 Å²	39	85.8 Å²	85.8	20%	0.204	44%	0.437	C	S	.	.	H	α-helix	trans	-74.1	-27.1	172.6	-105.8	158.5	0	0	0	113.1	H720 F725 G726 F831 L838	H720-L722 PolarHBondContact O-N 3.05Å; H720-L722 VanDerWaalsContact O-N 3.1Å; L722-F725 HydrophobicContact CD2-CD1 4.37Å; L722-G726 PolarHBondContact O-N 2.92Å; L722-F831 HydrophobicContact CB-CZ 4.47Å; L722-F831 HydrophobicContact CD2-CE2 4.25Å; L722-L838 HydrophobicContact CD2-CD2 4.28Å
723	F	32.7	Very low	31.8	Very low	96 Å²	96	82 Å²	82	42%	0.421	43%	0.426	S	S	.	.	H	α-helix	trans	-71.8	-45.6	172	-172.1	-111.9	0	0	0	110.4	H720 G726 Q727 H833	H720-F723 VanDerWaalsContact O-CB 3.27Å; H720-F723 WeakPolarHBondContact O-CB 3.35Å; H720-F723 PolarHBondContact O-N 3.41Å; F723-G726 PolarHBondContact O-N 3.41Å; F723-Q727 PolarHBondContact O-N 3.4Å; F723-H833 AromaticContact CD2-CD2 3.92Å; F723-H833 AromaticContact CD2-NE2 3.26Å; F723-H833 VanDerWaalsContact CD2-NE2 3.26Å; F723-H833 WeakPolarHBondContact CD2-NE2 3.35Å; F723-H833 AromaticContact CE2-NE2 3.7Å
724	D	35.4	Very low	32.2	Very low	81 Å²	81	82.3 Å²	82.3	43%	0.433	42%	0.422	S	S	.	.	H	α-helix	trans	-67.5	-35.4	174.9	-65.2	-40.1	0	0	0	111.8	H720 Q727 C728	H720-D724 PolarHBondContact O-N 3.48Å; D724-Q727 PolarHBondContact O-N 3.5Å; D724-C728 WeakPolarHBondContact O-CB 3.28Å; D724-C728 PolarHBondContact O-N 3.24Å; D724-C728 PolarHBondContact O-SG 2.92Å
725	F	40.6	Very low	32.6	Very low	30 Å²	30	81.8 Å²	81.8	13%	0.132	42%	0.417	C	S	.	.	H	α-helix	trans	-60.6	-44.9	170.3	-178.1	-98.1	0	0	0	112.1	N721 L722 Q727 C728 L729 I794 I796 L801 L838	N721-F725 WeakPolarHBondContact O-CB 3.25Å; N721-F725 PolarHBondContact O-N 3.44Å; L722-F725 HydrophobicContact CD2-CD1 4.37Å; F725-Q727 PolarHBondContact O-N 2.7Å; F725-C728 PolarHBondContact O-N 2.89Å; F725-L729 HydrophobicContact CD1-CD1 3.65Å; F725-L729 HydrophobicContact CD2-CD1 4.48Å; F725-L729 HydrophobicContact CE1-CD1 3.25Å; F725-L729 HydrophobicContact CE2-CD1 4.16Å; F725-L729 HydrophobicContact CG-CD1 4.26Å; F725-L729 HydrophobicContact CZ-CD1 3.53Å; F725-L729 PolarHBondContact O-N 2.72Å; F725-I794 HydrophobicContact CE1-CD1 4.47Å; F725-I794 HydrophobicContact CE1-CG2 4.39Å; F725-I794 HydrophobicContact CE2-CG2 4.33Å; F725-I794 HydrophobicContact CZ-CB 4.09Å; F725-I794 HydrophobicContact CZ-CG2 3.6Å; F725-I796 HydrophobicContact CD2-CD1 4.39Å; F725-I796 HydrophobicContact CE2-CD1 3.5Å; F725-I796 HydrophobicContact CE2-CG1 3.97Å; F725-I796 HydrophobicContact CZ-CD1 3.66Å; F725-I796 HydrophobicContact CZ-CG1 4.13Å; F725-L801 HydrophobicContact CZ-CD1 4.26Å; F725-L838 HydrophobicContact CD1-CD2 4.36Å; F725-L838 HydrophobicContact CE1-CD2 4.03Å
726	G	35.5	Very low	32.9	Very low	16 Å²	16	82.9 Å²	82.9	17%	0.165	42%	0.415	C	S	.	.	H	α-helix	trans	-61.6	-40.6	175	0	0	0	0	0	113	L722 F723 Y730	L722-G726 PolarHBondContact O-N 2.92Å; F723-G726 PolarHBondContact O-N 3.41Å; G726-Y730 WeakPolarHBondContact O-CB 3.45Å; G726-Y730 PolarHBondContact O-N 3.15Å
727	Q	35.5	Very low	33.2	Very low	97 Å²	97	89.1 Å²	89.1	45%	0.453	44%	0.438	S	S	.	.	H	α-helix	trans	-70.8	-37.5	173.6	-68	-166.3	55.2	0	0	112.5	F723 D724 F725 Y730 V731	F723-Q727 PolarHBondContact O-N 3.4Å; D724-Q727 PolarHBondContact O-N 3.5Å; F725-Q727 PolarHBondContact O-N 2.7Å; Q727-Y730 PolarHBondContact O-N 3.14Å; Q727-V731 WeakPolarHBondContact O-CB 3.36Å; Q727-V731 WeakPolarHBondContact O-CG2 3.5Å; Q727-V731 PolarHBondContact O-N 2.92Å
728	C	37.1	Very low	33.5	Very low	89 Å²	89	92.5 Å²	92.5	60%	0.601	45%	0.447	S	S	*	.	H	α-helix	trans	-70	-32.8	177.7	-77.3	0	0	0	0	112.9	D724 F725 G732	D724-C728 WeakPolarHBondContact O-CB 3.28Å; D724-C728 PolarHBondContact O-N 3.24Å; D724-C728 PolarHBondContact O-SG 2.92Å; F725-C728 PolarHBondContact O-N 2.89Å; C728-G732 WeakPolarHBondContact O-CA 3.41Å; C728-G732 PolarHBondContact O-N 3.16Å
729	L	36.9	Very low	33.6	Very low	11 Å²	11	93.2 Å²	93.2	6%	0.058	45%	0.447	C	S	.	.	H	α-helix	trans	-61.4	-51.2	165.2	-104.5	114.6	0	0	0	110.6	F725 V731 G732 L733 I796 C829	F725-L729 HydrophobicContact CD1-CD1 3.65Å; F725-L729 HydrophobicContact CD2-CD1 4.48Å; F725-L729 HydrophobicContact CE1-CD1 3.25Å; F725-L729 HydrophobicContact CE2-CD1 4.16Å; F725-L729 HydrophobicContact CG-CD1 4.26Å; F725-L729 HydrophobicContact CZ-CD1 3.53Å; F725-L729 PolarHBondContact O-N 2.72Å; L729-V731 PolarHBondContact O-N 2.72Å; L729-G732 PolarHBondContact O-N 2.67Å; L729-L733 HydrophobicContact CD2-CD1 4.14Å; L729-L733 VanDerWaalsContact O-CB 3.31Å; L729-L733 WeakPolarHBondContact O-CB 3.47Å; L729-L733 WeakPolarHBondContact O-CG 3.46Å; L729-L733 PolarHBondContact O-N 3.03Å; L729-I796 HydrophobicContact CD1-CD1 3.66Å; L729-I796 HydrophobicContact CG-CD1 4.02Å; L729-C829 HydrophobicContact CD2-CB 4.27Å
730	Y	35.6	Very low	33.6	Very low	153 Å²	153	96.4 Å²	96.4	60%	0.6	47%	0.468	S	S	*	.	H	α-helix	trans	-64.5	-37	-175.3	-172	-94.2	0	0	0	113.5	G726 Q727	G726-Y730 WeakPolarHBondContact O-CB 3.45Å; G726-Y730 PolarHBondContact O-N 3.15Å; Q727-Y730 PolarHBondContact O-N 3.14Å
731	V	34.3	Very low	33.3	Very low	72 Å²	72	92.5 Å²	92.5	44%	0.436	47%	0.466	S	S	.	.	H	α-helix	trans	-83.7	-37.4	176.3	174.8	0	0	0	0	111.5	Q727 L729 K734 K735	Q727-V731 WeakPolarHBondContact O-CB 3.36Å; Q727-V731 WeakPolarHBondContact O-CG2 3.5Å; Q727-V731 PolarHBondContact O-N 2.92Å; L729-V731 PolarHBondContact O-N 2.72Å; V731-K734 PolarHBondContact O-N 2.67Å; V731-K735 HydrophobicContact CG1-CD 4.09Å; V731-K735 PolarHBondContact O-N 3.26Å
732	G	33.9	Very low	33	Very low	16 Å²	16	95.5 Å²	95.5	17%	0.165	47%	0.473	C	S	.	.	H	α-helix	trans	-68	-51.7	-178.3	0	0	0	0	0	112.8	C728 L729 K734 K735 W736	C728-G732 WeakPolarHBondContact O-CA 3.41Å; C728-G732 PolarHBondContact O-N 3.16Å; L729-G732 PolarHBondContact O-N 2.67Å; G732-K734 PolarHBondContact O-N 2.83Å; G732-K735 PolarHBondContact O-N 3.34Å; G732-W736 WeakPolarHBondContact O-CB 3.42Å; G732-W736 PolarHBondContact O-N 3.31Å
733	L	35.2	Very low	32.6	Very low	58 Å²	58	102.1 Å²	102.1	30%	0.304	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-21.7	175.3	-73	171.1	0	0	0	112.9	L729 L823	L729-L733 HydrophobicContact CD2-CD1 4.14Å; L729-L733 VanDerWaalsContact O-CB 3.31Å; L729-L733 WeakPolarHBondContact O-CB 3.47Å; L729-L733 WeakPolarHBondContact O-CG 3.46Å; L729-L733 PolarHBondContact O-N 3.03Å; L733-L823 HydrophobicContact CD2-CB 4.23Å; L733-L823 HydrophobicContact CD2-CD2 4.41Å
734	K	32.2	Very low	32.2	Very low	160 Å²	160	101.5 Å²	101.5	70%	0.696	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-3.1	178.2	-129.3	171	-171.1	168	0	115	V731 G732	V731-K734 PolarHBondContact O-N 2.67Å; G732-K734 PolarHBondContact O-N 2.83Å
735	K	32.5	Very low	31.7	Very low	137 Å²	137	102.6 Å²	102.6	60%	0.596	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.5	-27.6	-179.6	-78.7	-173.4	173.8	-177.6	0	114.8	V731 G732 Q737	V731-K735 HydrophobicContact CG1-CD 4.09Å; V731-K735 PolarHBondContact O-N 3.26Å; G732-K735 PolarHBondContact O-N 3.34Å; K735-Q737 VanDerWaalsContact C-N 3.28Å; K735-Q737 PolarHBondContact O-N 2.84Å
736	W	35.1	Very low	30.9	Very low	128 Å²	128	110.2 Å²	110.2	49%	0.485	56%	0.558	S	S	.	*			trans	-73.6	-7.1	-169.4	-92.8	34.1	0	0	0	115.9	G732 K738 R798	G732-W736 WeakPolarHBondContact O-CB 3.42Å; G732-W736 PolarHBondContact O-N 3.31Å; W736-K738 PolarHBondContact O-N 3.3Å; W736-R798 HydrophobicContact CE3-CG 3.85Å; W736-R798 HydrophobicContact CZ3-CB 4.39Å; W736-R798 HydrophobicContact CZ3-CG 3.65Å
737	Q	30.6	Very low	30.3	Very low	183 Å²	183	117.9 Å²	117.9	86%	0.855	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	25.3	175.8	-63.7	-176.5	-27.8	0	0	114.3	K735	K735-Q737 VanDerWaalsContact C-N 3.28Å; K735-Q737 PolarHBondContact O-N 2.84Å
738	K	29.8	Very low	29.7	Very low	190 Å²	190	119.4 Å²	119.4	83%	0.826	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.6	18.1	-169.7	-72.3	-158.2	171.4	-162.2	0	115.9	W736	W736-K738 PolarHBondContact O-N 3.3Å
739	L	28.6	Very low	29.1	Very low	110 Å²	110	121.5 Å²	121.5	58%	0.576	60%	0.604	S	S	*	*			trans	-136.2	121.9	-178	-78.2	166.8	0	0	0	112.2	R798	L739-R798 PolarHBondContact O-NE 3.49Å; L739-R798 PolarHBondContact O-NH1 2.78Å; L739-R798 PolarHBondContact O-NH2 3.38Å
740	D	26.6	Very low	28.5	Very low	155 Å²	155	125.2 Å²	125.2	83%	0.829	63%	0.629	S	S	*	*			trans	-98	176.8	177.9	-71.3	-58.9	0	0	0	112.9	R798	D740-R798 VanDerWaalsContact C-NH2 3.29Å; D740-R798 PolarHBondContact O-NH1 2.69Å; D740-R798 PolarHBondContact O-NH2 3.07Å
741	G	27	Very low	28	Very low	61 Å²	61	125.5 Å²	125.5	63%	0.629	64%	0.641	S	S	*	*			trans	85.8	114.1	-177.2	0	0	0	0	0	115	R798	G741-R798 VanDerWaalsContact C-NH1 3.29Å; G741-R798 VanDerWaalsContact N-NH1 3.15Å; G741-R798 PolarHBondContact O-NH1 2.88Å; G741-R798 PolarHBondContact O-NH2 3.36Å
742	W	26.2	Very low	27.5	Very low	123 Å²	123	125.7 Å²	125.7	47%	0.466	65%	0.646	S	S	.	*			trans	-136.1	102.1	177.5	-129	61.6	0	0	0	109.2	N797	W742-N797 HydrophobicContact CH2-CB 3.84Å; W742-N797 HydrophobicContact CZ2-CB 3.65Å
743	H	24.1	Very low	27.1	Very low	178 Å²	178	133 Å²	133	82%	0.824	68%	0.68	S	S	*	*			trans	-142.1	161.9	174.5	-82.3	35.7	0	0	0	108
744	S	24	Very low	26.5	Very low	84 Å²	84	137.4 Å²	137.4	59%	0.587	70%	0.703	S	S	*	*			trans	70.2	55.4	167.4	-50.4	0	0	0	0	118.8	Y712	Y712-S744 PolarHBondContact OH-O 3.14Å
745	V	24.2	Very low	26.1	Very low	104 Å²	104	137.1 Å²	137.1	63%	0.63	71%	0.706	S	S	*	*			trans	-134.7	58.6	168.5	-163.2	0	0	0	0	112.5
746	M	24.2	Very low	25.7	Very low	189 Å²	189	137.6 Å²	137.6	93%	0.931	72%	0.715	S	S	*	*	S	Bend	trans	-146.5	-0	173.4	-91.8	-59.1	179.2	0	0	115.7
747	E	23	Very low	25.2	Very low	178 Å²	178	139.5 Å²	139.5	83%	0.832	74%	0.735	S	S	*	*			trans	-118.1	14.2	-156.4	-149.5	167.6	-162	0	0	115.9
748	L	23.7	Very low	24.8	Very low	129 Å²	129	140.2 Å²	140.2	68%	0.675	73%	0.731	S	S	*	*			trans	-133.4	69.5	-179.7	-73	175.2	0	0	0	113.1	Y712	Y712-L748 HydrophobicContact CD2-CD1 3.54Å; Y712-L748 HydrophobicContact CE2-CD1 3.62Å; Y712-L748 HydrophobicContact CG-CD1 4.13Å
749	L	24.3	Very low	24.5	Very low	132 Å²	132	138 Å²	138	69%	0.691	73%	0.729	S	S	*	*			trans	-94.8	124.8	158.7	-93.3	165.6	0	0	0	109.2	N751	L749-N751 PolarHBondContact O-N 2.71Å
750	P	23.9	Very low	24.3	Very low	90 Å²	90	140.5 Å²	140.5	58%	0.584	74%	0.742	S	S	*	*			trans	-74.3	90.8	178.5	29.2	-33.8	0	0	0	111.5	S752	P750-S752 PolarHBondContact O-N 3.3Å
751	N	23.8	Very low	24.1	Very low	159 Å²	159	137.8 Å²	137.8	85%	0.85	74%	0.735	S	S	*	*			trans	-68.7	35	171.8	-79.5	-27	0	0	0	113.5	L749	L749-N751 PolarHBondContact O-N 2.71Å
752	S	25.1	Very low	23.9	Very low	76 Å²	76	140.2 Å²	140.2	53%	0.531	74%	0.738	S	S	.	*			trans	-135.2	22.5	-163.6	67.7	0	0	0	0	115	P750	P750-S752 PolarHBondContact O-N 3.3Å
753	L	24.2	Very low	23.8	Very low	170 Å²	170	140.1 Å²	140.1	89%	0.89	75%	0.751	S	S	*	*	S	Bend	trans	-119.6	3.5	169.5	-88.3	168.2	0	0	0	114.3
754	L	24.1	Very low	23.8	Very low	149 Å²	149	137 Å²	137	78%	0.78	75%	0.745	S	S	*	*	S	Bend	trans	-98.1	154.9	137.9	-82.4	81.6	0	0	0	107.6
755	M	23	Very low	23.8	Very low	154 Å²	154	138 Å²	138	76%	0.759	75%	0.747	S	S	*	*	S	Bend	trans	62.4	58.9	179.2	-57	-56.1	-174.3	0	0	116.3
756	N	23.9	Very low	23.8	Very low	147 Å²	147	139.2 Å²	139.2	79%	0.786	75%	0.75	S	S	*	*	S	Bend	trans	-151.1	57.3	148.2	-117.3	-18.2	0	0	0	113.5
757	N	24.7	Very low	23.8	Very low	168 Å²	168	135.6 Å²	135.6	90%	0.898	74%	0.735	S	S	*	*	S	Bend	trans	-156.5	41.2	153.5	-108.7	-15.2	0	0	0	110.8
758	Y	22.7	Very low	23.9	Very low	199 Å²	199	132.8 Å²	132.8	78%	0.78	73%	0.726	S	S	*	*			trans	-115.6	91.3	164	-106.1	-82.2	0	0	0	107.3
759	N	22.8	Very low	23.9	Very low	144 Å²	144	132.5 Å²	132.5	77%	0.77	73%	0.725	S	S	*	*			trans	167.7	148	146.3	-84.9	-26.6	0	0	0	109.8
760	N	24.5	Very low	23.8	Very low	162 Å²	162	132.7 Å²	132.7	87%	0.866	73%	0.726	S	S	*	*			trans	68.4	125.5	-174	-49.6	-26	0	0	0	114.2
761	S	23	Very low	23.8	Very low	97 Å²	97	132.8 Å²	132.8	68%	0.678	73%	0.729	S	S	*	*			cis	-159.9	143.8	-6.3	49.9	0	0	0	0	112.3
762	T	23	Very low	23.7	Very low	112 Å²	112	132 Å²	132	69%	0.687	73%	0.725	S	S	*	*			trans	55.3	121.5	148.2	54.1	0	0	0	0	120.8
763	T	23.2	Very low	23.6	Very low	122 Å²	122	135.1 Å²	135.1	75%	0.748	74%	0.735	S	S	*	*			trans	65.1	135.6	136	61.2	0	0	0	0	119.4
764	T	23.8	Very low	23.5	Very low	113 Å²	113	137.3 Å²	137.3	69%	0.693	73%	0.732	S	S	*	*			cis	-164.2	154.6	0	8.3	0	0	0	0	111.4
765	T	24.1	Very low	23.4	Very low	103 Å²	103	135 Å²	135	63%	0.632	73%	0.728	S	S	*	*			trans	56.1	127	146.7	56.7	0	0	0	0	122.1
766	N	24.8	Very low	23.4	Very low	130 Å²	130	133.5 Å²	133.5	70%	0.695	73%	0.729	S	S	*	*			trans	74.8	146.2	131.5	-61.8	4.9	0	0	0	119.3
767	N	24.6	Very low	23.3	Very low	114 Å²	114	133.9 Å²	133.9	61%	0.61	73%	0.731	S	S	*	*			cis	-163.2	158.9	-17.3	-112.6	-9.5	0	0	0	111.6
768	N	24.2	Very low	23.3	Very low	118 Å²	118	133.7 Å²	133.7	63%	0.631	73%	0.73	S	S	*	*			trans	58.3	121.5	140.3	-65	-2.3	0	0	0	122.2
769	N	24	Very low	23.4	Very low	124 Å²	124	129.5 Å²	129.5	66%	0.663	73%	0.729	S	S	*	*				87.7	120.7	121.7	-65.7	4.2	0	0	0	121.8
770	N	23.1	Very low	23.4	Very low	135 Å²	135	128.3 Å²	128.3	72%	0.722	73%	0.727	S	S	*	*				80.9	104.8	126.9	-63.6	0.9	0	0	0	120.9
771	S	22.9	Very low	23.4	Very low	92 Å²	92	127.9 Å²	127.9	64%	0.643	72%	0.72	S	S	*	*				86.6	129.3	113.8	76.5	0	0	0	0	120.7
772	N	22.2	Very low	23.4	Very low	143 Å²	143	133.6 Å²	133.6	77%	0.765	73%	0.726	S	S	*	*			trans	80.3	145.8	138.1	-65.1	-9.5	0	0	0	120.9
773	I	22.1	Very low	23.4	Very low	142 Å²	142	137.5 Å²	137.5	73%	0.728	74%	0.736	S	S	*	*			trans	80.8	94.2	153.7	-66.6	150.4	0	0	0	117.9
774	Y	22.1	Very low	23.3	Very low	215 Å²	215	136.3 Å²	136.3	84%	0.843	73%	0.733	S	S	*	*				56.1	148.8	129.8	-71	-82.7	0	0	0	123.9
775	S	22.8	Very low	23.3	Very low	100 Å²	100	136.2 Å²	136.2	70%	0.699	74%	0.737	S	S	*	*			trans	75	115.5	150.3	47.3	0	0	0	0	121.4
776	T	23.2	Very low	23.3	Very low	124 Å²	124	138 Å²	138	76%	0.761	74%	0.742	S	S	*	*			trans	67.9	128.4	138.8	51.2	0	0	0	0	121.7
777	D	22.5	Very low	23.2	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	74%	0.74	S	S	*	*			trans	71.4	174.5	152.7	-60.2	-17.9	0	0	0	119.8
778	D	23.6	Very low	23.2	Very low	164 Å²	164	139.5 Å²	139.5	88%	0.877	75%	0.745	S	S	*	*			trans	62.7	104.9	-175.7	-70.1	-19.2	0	0	0	120.1
779	S	25.8	Very low	23.2	Very low	110 Å²	110	141.5 Å²	141.5	77%	0.769	75%	0.745	S	S	*	*			trans	-68	153.1	159.1	60	0	0	0	0	112.8
780	V	22.7	Very low	23.5	Very low	120 Å²	120	141.4 Å²	141.4	73%	0.727	74%	0.739	S	S	*	*			trans	-167.9	160.6	139.1	129.2	0	0	0	0	111.3
781	H	24.6	Very low	24	Very low	153 Å²	153	140.2 Å²	140.2	71%	0.708	73%	0.729	S	S	*	*			trans	83.6	122	176	-63.6	-23.3	0	0	0	118
782	R	22.1	Very low	24.8	Very low	216 Å²	216	138 Å²	138	82%	0.815	71%	0.712	S	S	*	*			cis	-144	136.3	-20.6	-73.1	-174.2	-175.4	-178.7	0.1	108.1
783	H	22.2	Very low	26.1	Very low	195 Å²	195	134.7 Å²	134.7	90%	0.903	69%	0.692	S	S	*	*			trans	-75.8	135.5	171.6	-72.6	-76.9	0	0	0	111.5
784	S	22.9	Very low	27.5	Very low	97 Å²	97	129.1 Å²	129.1	68%	0.678	66%	0.663	S	S	*	*			trans	-107.8	89	161	46.2	0	0	0	0	109.3	N786	S784-N786 PolarHBondContact O-N 2.85Å; S784-N786 VanDerWaalsContact O-N 3.08Å
785	S	23.4	Very low	28.6	Very low	110 Å²	110	120 Å²	120	77%	0.769	64%	0.635	S	S	*	*			trans	-74.6	94	174	48.4	0	0	0	0	110.4
786	N	22.7	Very low	29.9	Very low	140 Å²	140	118.6 Å²	118.6	75%	0.749	62%	0.618	S	S	*	*	S	Bend	trans	-158.1	166.3	165.8	-112	-42.1	0	0	0	112.9	S784 H788	S784-N786 PolarHBondContact O-N 2.85Å; S784-N786 VanDerWaalsContact O-N 3.08Å; N786-H788 PolarHBondContact O-N 3.09Å
787	N	23.5	Very low	31.2	Very low	122 Å²	122	114.6 Å²	114.6	65%	0.652	59%	0.592	S	S	*	*			trans	-59.3	106.8	174.1	-62	-81.5	0	0	0	110.2	Y789	N787-Y789 VanDerWaalsContact C-N 3.3Å; N787-Y789 HydrophobicContact CB-CD2 4.22Å; N787-Y789 HydrophobicContact CB-CE2 3.98Å; N787-Y789 VanDerWaalsContact O-CD2 3.25Å; N787-Y789 WeakPolarHBondContact O-CD2 3.42Å; N787-Y789 PolarHBondContact O-N 3.24Å
788	H	25.3	Very low	32.1	Very low	155 Å²	155	110.8 Å²	110.8	72%	0.718	57%	0.567	S	S	*	*			trans	-71.9	91.3	165.9	-82.2	-54.2	0	0	0	109.3	N786 F790	N786-H788 PolarHBondContact O-N 3.09Å; H788-F790 PolarHBondContact O-N 3.46Å
789	Y	24.2	Very low	33.4	Very low	159 Å²	159	107.7 Å²	107.7	62%	0.624	55%	0.55	S	S	*	.			trans	-57.5	128.2	168.2	-73.1	-92.5	0	0	0	109.4	F719 N787 E791	F719-Y789 HydrophobicContact CD2-CD1 4.17Å; F719-Y789 HydrophobicContact CD2-CE1 4.13Å; F719-Y789 HydrophobicContact CE2-CD1 4.42Å; N787-Y789 VanDerWaalsContact C-N 3.3Å; N787-Y789 HydrophobicContact CB-CD2 4.22Å; N787-Y789 HydrophobicContact CB-CE2 3.98Å; N787-Y789 VanDerWaalsContact O-CD2 3.25Å; N787-Y789 WeakPolarHBondContact O-CD2 3.42Å; N787-Y789 PolarHBondContact O-N 3.24Å; Y789-E791 VanDerWaalsContact C-N 3.27Å; Y789-E791 PolarHBondContact O-N 2.88Å
790	F	30.2	Very low	35.1	Very low	122 Å²	122	105.5 Å²	105.5	54%	0.535	53%	0.525	S	S	.	.			trans	-70.2	87.8	165.3	-75.7	-89.6	0	0	0	108.6	H788 T792	H788-F790 PolarHBondContact O-N 3.46Å; F790-T792 HydrophobicContact CB-CG2 4.34Å; F790-T792 PolarHBondContact O-N 2.86Å; F790-T792 PolarHBondContact O-OG1 3.37Å
791	E	33.5	Very low	37.5	Very low	111 Å²	111	100 Å²	100	52%	0.519	49%	0.491	S	S	.	.			trans	-64.9	90	167.1	-71.3	-157.4	129.3	0	0	109.2	Y789 Q793	Y789-E791 VanDerWaalsContact C-N 3.27Å; Y789-E791 PolarHBondContact O-N 2.88Å; E791-Q793 PolarHBondContact O-N 2.74Å
792	T	39.6	Very low	39.4	Very low	46 Å²	46	93.6 Å²	93.6	28%	0.282	46%	0.463	S	S	.	.			trans	-86.8	89.3	-178.3	33.5	0	0	0	0	108.7	F790 I794 Y854	F790-T792 HydrophobicContact CB-CG2 4.34Å; F790-T792 PolarHBondContact O-N 2.86Å; F790-T792 PolarHBondContact O-OG1 3.37Å; T792-I794 PolarHBondContact O-N 3.45Å; T792-I794 VanDerWaalsContact O-N 3.09Å; T792-Y854 HydrophobicContact CG2-CD2 4.27Å; T792-Y854 HydrophobicContact CG2-CE2 3.51Å
793	Q	49.2	Very low	41.5	Very low	72 Å²	72	83.3 Å²	83.3	34%	0.336	42%	0.424	S	S	.	.			trans	-63.5	111	169.2	-78.5	-172.3	-4.3	0	0	109.3	E791 F804	E791-Q793 PolarHBondContact O-N 2.74Å; Q793-F804 HydrophobicContact CB-CB 3.85Å; Q793-F804 HydrophobicContact CB-CD2 4.04Å; Q793-F804 HydrophobicContact CB-CG 4.24Å; Q793-F804 WeakPolarHBondContact O-CD2 3.38Å; Q793-F804 PolarHBondContact O-N 3.21Å; Q793-F804 VanDerWaalsContact O-N 3.08Å
794	I	51.1	Low	43.2	Very low	26 Å²	26	76.3 Å²	76.3	13%	0.133	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	112.4	175.2	-55.4	171.1	0	0	0	107.6	F725 T792 L801 V802 L838 I850	F725-I794 HydrophobicContact CE1-CD1 4.47Å; F725-I794 HydrophobicContact CE1-CG2 4.39Å; F725-I794 HydrophobicContact CE2-CG2 4.33Å; F725-I794 HydrophobicContact CZ-CB 4.09Å; F725-I794 HydrophobicContact CZ-CG2 3.6Å; T792-I794 PolarHBondContact O-N 3.45Å; T792-I794 VanDerWaalsContact O-N 3.09Å; I794-L801 HydrophobicContact CG2-CD1 3.45Å; I794-L801 VanDerWaalsContact CG2-CD1 3.45Å; I794-L801 HydrophobicContact CG2-CG 4.4Å; I794-V802 CarbonylContact C-O 3.09Å; I794-V802 VanDerWaalsContact CA-O 3.31Å; I794-V802 WeakPolarHBondContact CA-O 3.31Å; I794-V802 WeakPolarHBondContact CG2-O 3.47Å; I794-L838 HydrophobicContact CD1-CD2 4.46Å; I794-I850 HydrophobicContact CD1-CD1 3.73Å
795	G	45.9	Very low	44.5	Very low	24 Å²	24	72 Å²	72	25%	0.247	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	148.7	173.6	0	0	0	0	0	111.6	V802	G795-V802 PolarHBondContact N-O 2.77Å; G795-V802 PolarHBondContact O-N 2.91Å
796	I	50.8	Low	45.9	Very low	69 Å²	69	67.3 Å²	67.3	35%	0.354	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.9	166.7	-63.4	-178.9	0	0	0	109.2	F725 L729 L801 L823	F725-I796 HydrophobicContact CD2-CD1 4.39Å; F725-I796 HydrophobicContact CE2-CD1 3.5Å; F725-I796 HydrophobicContact CE2-CG1 3.97Å; F725-I796 HydrophobicContact CZ-CD1 3.66Å; F725-I796 HydrophobicContact CZ-CG1 4.13Å; L729-I796 HydrophobicContact CD1-CD1 3.66Å; L729-I796 HydrophobicContact CG-CD1 4.02Å; I796-L801 HydrophobicContact CD1-CD1 4.19Å; I796-L801 HydrophobicContact CG1-CD1 3.73Å; I796-L823 HydrophobicContact CG2-CD1 3.98Å; I796-L823 HydrophobicContact CG2-CD2 4.43Å
797	N	48.7	Very low	46.7	Very low	40 Å²	40	66.8 Å²	66.8	21%	0.214	32%	0.317	C	S	.	.			trans	-126.4	158	180	127.8	-4.9	0	0	0	107.1	W742 N799 W800 L823	W742-N797 HydrophobicContact CH2-CB 3.84Å; W742-N797 HydrophobicContact CZ2-CB 3.65Å; N797-N799 PolarHBondContact O-N 3.39Å; N797-N799 PolarHBondContact OD1-N 2.76Å; N797-W800 PolarHBondContact N-O 3.19Å; N797-W800 PolarHBondContact O-N 2.74Å; N797-W800 VanDerWaalsContact O-N 3.15Å; N797-W800 VanDerWaalsContact O-O 3.13Å; N797-W800 PolarHBondContact OD1-N 2.85Å; N797-W800 VanDerWaalsContact OD1-N 3.11Å; N797-L823 WeakPolarHBondContact O-CD1 3.49Å
798	R	42.3	Very low	47.6	Very low	76 Å²	76	65.7 Å²	65.7	29%	0.287	31%	0.314	S	S	.	.	S	Bend	trans	-54	-29.5	-173.1	-87.8	-171.3	-172.8	153.7	6	115	W736 L739 D740 G741	W736-R798 HydrophobicContact CE3-CG 3.85Å; W736-R798 HydrophobicContact CZ3-CB 4.39Å; W736-R798 HydrophobicContact CZ3-CG 3.65Å; L739-R798 PolarHBondContact O-NE 3.49Å; L739-R798 PolarHBondContact O-NH1 2.78Å; L739-R798 PolarHBondContact O-NH2 3.38Å; D740-R798 VanDerWaalsContact C-NH2 3.29Å; D740-R798 PolarHBondContact O-NH1 2.69Å; D740-R798 PolarHBondContact O-NH2 3.07Å; G741-R798 VanDerWaalsContact C-NH1 3.29Å; G741-R798 VanDerWaalsContact N-NH1 3.15Å; G741-R798 PolarHBondContact O-NH1 2.88Å; G741-R798 PolarHBondContact O-NH2 3.36Å
799	N	51.4	Low	48	Very low	98 Å²	98	60.7 Å²	60.7	52%	0.524	29%	0.292	S	S	.	.	S	Bend	trans	-108.7	-17.8	-179.1	-67.7	-36.3	0	0	0	113	N797 P822 L823	N797-N799 PolarHBondContact O-N 3.39Å; N797-N799 PolarHBondContact OD1-N 2.76Å; N799-P822 CarbonylContact O-C 3.51Å; N799-P822 VanDerWaalsContact O-CA 3.23Å; N799-P822 WeakPolarHBondContact O-CA 3.46Å; N799-L823 PolarHBondContact O-N 2.9Å
800	W	61.4	Low	48.4	Very low	65 Å²	65	56.2 Å²	56.2	25%	0.246	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	138.4	-166.6	-56.5	91	0	0	0	114.4	N797 V802 A820 I821 P822 I955	N797-W800 PolarHBondContact N-O 3.19Å; N797-W800 PolarHBondContact O-N 2.74Å; N797-W800 VanDerWaalsContact O-N 3.15Å; N797-W800 VanDerWaalsContact O-O 3.13Å; N797-W800 PolarHBondContact OD1-N 2.85Å; N797-W800 VanDerWaalsContact OD1-N 3.11Å; W800-V802 HydrophobicContact CB-CG2 4.25Å; W800-A820 HydrophobicContact CE3-CB 3.8Å; W800-A820 HydrophobicContact CZ3-CB 4.22Å; W800-I821 CarbonylContact C-O 3.51Å; W800-I821 WeakPolarHBondContact CA-O 3.46Å; W800-P822 HydrophobicContact CE3-CB 4.42Å; W800-P822 HydrophobicContact CE3-CG 3.96Å; W800-P822 HydrophobicContact CH2-CG 4.05Å; W800-P822 HydrophobicContact CZ3-CB 4.47Å; W800-P822 HydrophobicContact CZ3-CG 3.59Å; W800-I955 HydrophobicContact CH2-CD1 4.09Å; W800-I955 HydrophobicContact CH2-CG2 4.18Å; W800-I955 HydrophobicContact CZ2-CD1 3.86Å
801	L	73.2	Confident	48.7	Very low	4 Å²	4	57.4 Å²	57.4	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124	159	174.8	68.5	0	0	0	107.9	F725 I794 I796 A820 I821 L823 I826 I840	F725-L801 HydrophobicContact CZ-CD1 4.26Å; I794-L801 HydrophobicContact CG2-CD1 3.45Å; I794-L801 VanDerWaalsContact CG2-CD1 3.45Å; I794-L801 HydrophobicContact CG2-CG 4.4Å; I796-L801 HydrophobicContact CD1-CD1 4.19Å; I796-L801 HydrophobicContact CG1-CD1 3.73Å; L801-A820 CarbonylContact O-C 3.56Å; L801-A820 WeakPolarHBondContact O-CA 3.49Å; L801-I821 HydrophobicContact CB-CB 4.41Å; L801-I821 HydrophobicContact CD2-CD1 4.35Å; L801-I821 PolarHBondContact N-O 2.76Å; L801-I821 PolarHBondContact O-N 3.39Å; L801-L823 HydrophobicContact CB-CD2 3.9Å; L801-I826 HydrophobicContact CB-CD1 4.09Å; L801-I826 HydrophobicContact CD2-CD1 3.65Å; L801-I840 HydrophobicContact CD2-CD1 3.64Å; L801-I840 HydrophobicContact CD2-CG1 4.21Å
802	V	63.1	Low	48.7	Very low	18 Å²	18	55.5 Å²	55.5	11%	0.109	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127	-174.4	-175.4	0	0	0	0	109.3	I794 G795 W800 F804 I817 L819	I794-V802 CarbonylContact C-O 3.09Å; I794-V802 VanDerWaalsContact CA-O 3.31Å; I794-V802 WeakPolarHBondContact CA-O 3.31Å; I794-V802 WeakPolarHBondContact CG2-O 3.47Å; G795-V802 PolarHBondContact N-O 2.77Å; G795-V802 PolarHBondContact O-N 2.91Å; W800-V802 HydrophobicContact CB-CG2 4.25Å; V802-F804 HydrophobicContact CB-CE2 4.26Å; V802-F804 HydrophobicContact CG1-CD2 4.28Å; V802-F804 HydrophobicContact CG1-CE1 4.36Å; V802-F804 HydrophobicContact CG1-CE2 3.75Å; V802-F804 HydrophobicContact CG1-CZ 3.79Å; V802-I817 HydrophobicContact CG1-CB 4.41Å; V802-I817 HydrophobicContact CG1-CD1 4.05Å; V802-I817 HydrophobicContact CG1-CG1 3.85Å; V802-I817 HydrophobicContact CG1-CG2 3.86Å; V802-L819 WeakPolarHBondContact CA-O 3.49Å
803	I	66.5	Low	48.5	Very low	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.6	178	-57.1	178.3	0	0	0	107.7	L818 L819 I840 I850 I853 Y854	I803-L818 WeakPolarHBondContact O-CA 3.38Å; I803-L818 WeakPolarHBondContact O-CB 3.24Å; I803-L818 PolarHBondContact O-N 3.04Å; I803-L819 HydrophobicContact CB-CB 4.37Å; I803-L819 HydrophobicContact CD1-CD2 4.4Å; I803-L819 PolarHBondContact N-O 3.39Å; I803-L819 PolarHBondContact O-N 3.06Å; I803-L819 VanDerWaalsContact O-N 3.15Å; I803-I840 HydrophobicContact CD1-CD1 4.33Å; I803-I850 HydrophobicContact CD1-CD1 4.24Å; I803-I850 HydrophobicContact CD1-CG1 4.28Å; I803-I853 HydrophobicContact CD1-CD1 3.59Å; I803-Y854 HydrophobicContact CG2-CE2 4.32Å; I803-Y854 WeakPolarHBondContact CG2-OH 3.28Å
804	F	57.8	Low	47.7	Very low	49 Å²	49	53.1 Å²	53.1	22%	0.215	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	155.3	-179.3	-65.3	-92.6	0	0	0	112	Q793 V802 K816 I817 Y854	Q793-F804 HydrophobicContact CB-CB 3.85Å; Q793-F804 HydrophobicContact CB-CD2 4.04Å; Q793-F804 HydrophobicContact CB-CG 4.24Å; Q793-F804 WeakPolarHBondContact O-CD2 3.38Å; Q793-F804 PolarHBondContact O-N 3.21Å; Q793-F804 VanDerWaalsContact O-N 3.08Å; V802-F804 HydrophobicContact CB-CE2 4.26Å; V802-F804 HydrophobicContact CG1-CD2 4.28Å; V802-F804 HydrophobicContact CG1-CE1 4.36Å; V802-F804 HydrophobicContact CG1-CE2 3.75Å; V802-F804 HydrophobicContact CG1-CZ 3.79Å; F804-K816 WeakPolarHBondContact CA-O 3.34Å; F804-I817 HydrophobicContact CD1-CG1 4.13Å; F804-I817 HydrophobicContact CE1-CG1 3.72Å; F804-I817 HydrophobicContact CZ-CG1 4.36Å; F804-Y854 WeakPolarHBondContact O-CE1 3.49Å; F804-Y854 PolarHBondContact O-OH 2.83Å
805	A	51.6	Low	47.4	Very low	6 Å²	6	55.6 Å²	55.6	5%	0.05	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-64.1	145.6	172.2	0	0	0	0	0	111.7	K816 L818 Y857	A805-K816 PolarHBondContact N-O 2.81Å; A805-L818 HydrophobicContact CB-CD1 4.08Å; A805-Y857 HydrophobicContact CB-CE1 4.49Å
806	P	52.4	Low	47.6	Very low	11 Å²	11	59.5 Å²	59.5	7%	0.071	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-77.2	147.7	-177.4	33.4	-32.7	0	0	0	111.2	T808 Y854	P806-T808 PolarHBondContact O-N 2.82Å; P806-Y854 HydrophobicContact CB-CE1 4.44Å; P806-Y854 HydrophobicContact CG-CD1 4.17Å; P806-Y854 HydrophobicContact CG-CE1 4.27Å
807	Y	40.1	Very low	47.8	Very low	130 Å²	130	61.3 Å²	61.3	51%	0.51	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-9.7	178.5	-87.6	-73	0	0	0	115.2	I809 A814 N815	Y807-I809 PolarHBondContact O-N 2.92Å; Y807-A814 HydrophobicContact CD1-CB 3.62Å; Y807-A814 HydrophobicContact CE1-CB 3.78Å; Y807-A814 HydrophobicContact CG-CB 4.48Å; Y807-N815 PolarHBondContact OH-OD1 2.9Å
808	T	41.2	Very low	48.4	Very low	98 Å²	98	60.5 Å²	60.5	60%	0.601	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-7.4	-176.7	48.5	0	0	0	0	114.6	P806	P806-T808 PolarHBondContact O-N 2.82Å
809	I	33.3	Very low	49.6	Very low	51 Å²	51	57.5 Å²	57.5	26%	0.262	31%	0.312	S	S	.	.	S	Bend	trans	-127	95.4	-178	-50.4	171.2	0	0	0	110.1	Y807 L813 Y857	Y807-I809 PolarHBondContact O-N 2.92Å; I809-L813 VanDerWaalsContact O-CB 3.26Å; I809-L813 WeakPolarHBondContact O-CB 3.3Å; I809-Y857 HydrophobicContact CD1-CD1 3.84Å; I809-Y857 HydrophobicContact CD1-CE1 3.87Å
810	S	34.3	Very low	50.3	Low	65 Å²	65	54.3 Å²	54.3	46%	0.455	30%	0.3	S	S	.	.			trans	57.5	135.6	171.3	-175.2	0	0	0	0	117.5	A812 L813 A814	S810-A812 PolarHBondContact O-N 2.9Å; S810-A812 PolarHBondContact OG-N 2.9Å; S810-L813 PolarHBondContact O-N 2.83Å; S810-A814 PolarHBondContact O-N 2.84Å
811	T	34.6	Very low	50.7	Low	146 Å²	146	51.2 Å²	51.2	90%	0.896	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-15.3	171.5	47.9	0	0	0	0	113.8
812	A	34.9	Very low	50.4	Low	71 Å²	71	51.7 Å²	51.7	59%	0.587	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	1.4	175.4	0	0	0	0	0	114.7	S810 K816	S810-A812 PolarHBondContact O-N 2.9Å; S810-A812 PolarHBondContact OG-N 2.9Å; A812-K816 WeakPolarHBondContact O-CE 3.09Å; A812-K816 PolarHBondContact O-NZ 3.47Å
813	L	34.4	Very low	50.5	Low	55 Å²	55	51.6 Å²	51.6	29%	0.288	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125	-21.5	178	-86.3	130.1	0	0	0	113.4	I809 S810 K816 Y857	I809-L813 VanDerWaalsContact O-CB 3.26Å; I809-L813 WeakPolarHBondContact O-CB 3.3Å; S810-L813 PolarHBondContact O-N 2.83Å; L813-K816 HydrophobicContact CD2-CD 4.14Å; L813-K816 HydrophobicContact CG-CD 4.45Å; L813-K816 WeakPolarHBondContact O-CB 3.36Å; L813-K816 PolarHBondContact O-N 3.05Å; L813-Y857 WeakPolarHBondContact CD2-OH 3.2Å
814	A	33.6	Very low	50.4	Low	14 Å²	14	54.7 Å²	54.7	12%	0.116	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	150.1	161.3	0	0	0	0	0	111.8	Y807 S810 K816	Y807-A814 HydrophobicContact CD1-CB 3.62Å; Y807-A814 HydrophobicContact CE1-CB 3.78Å; Y807-A814 HydrophobicContact CG-CB 4.48Å; S810-A814 PolarHBondContact O-N 2.84Å; A814-K816 PolarHBondContact O-N 3.09Å
815	N	44.5	Very low	50.7	Low	78 Å²	78	52.5 Å²	52.5	42%	0.417	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	-0.2	-176.6	-46.9	-26.5	0	0	0	116.5	Y807	Y807-N815 PolarHBondContact OH-OD1 2.9Å
816	K	50.1	Low	51.5	Low	105 Å²	105	52.7 Å²	52.7	46%	0.457	30%	0.298	S	S	.	.			trans	-71	134.4	173.2	-71.8	-176.8	-178.9	172.7	0	111.3	F804 A805 A812 L813 A814 L818	F804-K816 WeakPolarHBondContact CA-O 3.34Å; A805-K816 PolarHBondContact N-O 2.81Å; A812-K816 WeakPolarHBondContact O-CE 3.09Å; A812-K816 PolarHBondContact O-NZ 3.47Å; L813-K816 HydrophobicContact CD2-CD 4.14Å; L813-K816 HydrophobicContact CG-CD 4.45Å; L813-K816 WeakPolarHBondContact O-CB 3.36Å; L813-K816 PolarHBondContact O-N 3.05Å; A814-K816 PolarHBondContact O-N 3.09Å; K816-L818 PolarHBondContact O-N 2.84Å
817	I	55.3	Low	52.2	Low	108 Å²	108	58 Å²	58	55%	0.554	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.3	121.5	168.5	-64.2	175.2	0	0	0	107.7	V802 F804	V802-I817 HydrophobicContact CG1-CB 4.41Å; V802-I817 HydrophobicContact CG1-CD1 4.05Å; V802-I817 HydrophobicContact CG1-CG1 3.85Å; V802-I817 HydrophobicContact CG1-CG2 3.86Å; F804-I817 HydrophobicContact CD1-CG1 4.13Å; F804-I817 HydrophobicContact CE1-CG1 3.72Å; F804-I817 HydrophobicContact CZ-CG1 4.36Å
818	L	61.1	Low	53.3	Low	23 Å²	23	52.7 Å²	52.7	12%	0.12	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-31.1	-178.5	-165.3	157.5	0	0	0	110.4	I803 A805 K816 I853 Y854 Y857 L865	I803-L818 WeakPolarHBondContact O-CA 3.38Å; I803-L818 WeakPolarHBondContact O-CB 3.24Å; I803-L818 PolarHBondContact O-N 3.04Å; A805-L818 HydrophobicContact CB-CD1 4.08Å; K816-L818 PolarHBondContact O-N 2.84Å; L818-I853 HydrophobicContact CD2-CG2 3.3Å; L818-Y854 HydrophobicContact CD1-CD1 4.44Å; L818-Y854 HydrophobicContact CD1-CE1 4.28Å; L818-Y857 HydrophobicContact CD1-CD1 4.05Å; L818-Y857 HydrophobicContact CD1-CD2 3.54Å; L818-Y857 HydrophobicContact CD1-CE1 4.31Å; L818-Y857 HydrophobicContact CD1-CE2 3.84Å; L818-Y857 HydrophobicContact CD1-CG 3.65Å; L818-Y857 HydrophobicContact CD2-CD2 4.38Å; L818-Y857 HydrophobicContact CG-CD2 3.86Å; L818-Y857 HydrophobicContact CG-CE2 4.04Å; L818-Y857 HydrophobicContact CG-CG 4.44Å; L818-L865 HydrophobicContact CD2-CD1 4.44Å
819	L	68	Low	54.4	Low	12 Å²	12	49.4 Å²	49.4	6%	0.063	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	145.8	171.1	-173.1	68.3	0	0	0	112.2	V802 I803 I821 I853 I872	V802-L819 WeakPolarHBondContact CA-O 3.49Å; I803-L819 HydrophobicContact CB-CB 4.37Å; I803-L819 HydrophobicContact CD1-CD2 4.4Å; I803-L819 PolarHBondContact N-O 3.39Å; I803-L819 PolarHBondContact O-N 3.06Å; I803-L819 VanDerWaalsContact O-N 3.15Å; L819-I821 HydrophobicContact CD2-CD1 3.68Å; L819-I821 HydrophobicContact CD2-CG1 3.64Å; L819-I821 HydrophobicContact CG-CG1 4Å; L819-I853 HydrophobicContact CD2-CD1 4.09Å; L819-I872 HydrophobicContact CD2-CD1 3.38Å; L819-I872 HydrophobicContact CD2-CG2 4.45Å
820	A	65.7	Low	55.8	Low	32 Å²	32	50.6 Å²	50.6	26%	0.264	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	117.1	167	0	0	0	0	0	110.8	W800 L801	W800-A820 HydrophobicContact CE3-CB 3.8Å; W800-A820 HydrophobicContact CZ3-CB 4.22Å; L801-A820 CarbonylContact O-C 3.56Å; L801-A820 WeakPolarHBondContact O-CA 3.49Å
821	I	68.9	Low	57.1	Low	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.2	179.3	-60.2	164.4	0	0	0	109	W800 L801 L819 L823 I826 I840 F842 I872 I876	W800-I821 CarbonylContact C-O 3.51Å; W800-I821 WeakPolarHBondContact CA-O 3.46Å; L801-I821 HydrophobicContact CB-CB 4.41Å; L801-I821 HydrophobicContact CD2-CD1 4.35Å; L801-I821 PolarHBondContact N-O 2.76Å; L801-I821 PolarHBondContact O-N 3.39Å; L819-I821 HydrophobicContact CD2-CD1 3.68Å; L819-I821 HydrophobicContact CD2-CG1 3.64Å; L819-I821 HydrophobicContact CG-CG1 4Å; I821-L823 PolarHBondContact O-N 3.04Å; I821-I826 HydrophobicContact CB-CD1 4.44Å; I821-I826 HydrophobicContact CG2-CD1 3.78Å; I821-I826 HydrophobicContact CG2-CG1 3.78Å; I821-I840 HydrophobicContact CD1-CD1 3.83Å; I821-I840 HydrophobicContact CD1-CG2 4.49Å; I821-F842 HydrophobicContact CD1-CZ 4.15Å; I821-F842 HydrophobicContact CG2-CE1 3.72Å; I821-F842 HydrophobicContact CG2-CZ 4.26Å; I821-I872 HydrophobicContact CG1-CG2 4.13Å; I821-I876 HydrophobicContact CG2-CD1 4.44Å
822	P	67.6	Low	58	Low	13 Å²	13	44.5 Å²	44.5	8%	0.084	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	126.8	173.9	-19.6	30.3	0	0	0	111.2	N799 W800 N824 S825 I876	N799-P822 CarbonylContact O-C 3.51Å; N799-P822 VanDerWaalsContact O-CA 3.23Å; N799-P822 WeakPolarHBondContact O-CA 3.46Å; W800-P822 HydrophobicContact CE3-CB 4.42Å; W800-P822 HydrophobicContact CE3-CG 3.96Å; W800-P822 HydrophobicContact CH2-CG 4.05Å; W800-P822 HydrophobicContact CZ3-CB 4.47Å; W800-P822 HydrophobicContact CZ3-CG 3.59Å; P822-N824 PolarHBondContact O-N 2.96Å; P822-S825 WeakPolarHBondContact O-CB 3.36Å; P822-S825 PolarHBondContact O-N 2.97Å; P822-I876 HydrophobicContact CG-CD1 4.42Å; P822-I876 HydrophobicContact CG-CG2 4.18Å
823	L	65.1	Low	58.4	Low	17 Å²	17	46.2 Å²	46.2	9%	0.089	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-56.5	-34.6	175.2	-72.9	-173.1	0	0	0	111.4	L733 I796 N797 N799 L801 I821 S825 I826	L733-L823 HydrophobicContact CD2-CB 4.23Å; L733-L823 HydrophobicContact CD2-CD2 4.41Å; I796-L823 HydrophobicContact CG2-CD1 3.98Å; I796-L823 HydrophobicContact CG2-CD2 4.43Å; N797-L823 WeakPolarHBondContact O-CD1 3.49Å; N799-L823 PolarHBondContact O-N 2.9Å; L801-L823 HydrophobicContact CB-CD2 3.9Å; I821-L823 PolarHBondContact O-N 3.04Å; L823-S825 PolarHBondContact O-N 3.15Å; L823-I826 HydrophobicContact CD2-CD1 4.33Å; L823-I826 PolarHBondContact O-N 3.03Å; L823-I826 VanDerWaalsContact O-N 3.13Å
824	N	64.3	Low	58.7	Low	65 Å²	65	51.7 Å²	51.7	35%	0.348	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-68.5	-0.8	176.9	79.6	-110.7	0	0	0	114.1	P822 K879 K883	P822-N824 PolarHBondContact O-N 2.96Å; N824-K879 VanDerWaalsContact O-CD 3.31Å; N824-K879 WeakPolarHBondContact O-CD 3.47Å; N824-K879 WeakPolarHBondContact O-CE 3.17Å; N824-K879 PolarHBondContact O-NZ 3.42Å; N824-K883 PolarHBondContact OD1-NZ 3.33Å
825	S	64.7	Low	59.3	Low	2 Å²	2	57.9 Å²	57.9	1%	0.014	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-109.4	0	175	-59.9	0	0	0	0	113.5	P822 L823 F842	P822-S825 WeakPolarHBondContact O-CB 3.36Å; P822-S825 PolarHBondContact O-N 2.97Å; L823-S825 PolarHBondContact O-N 3.15Å; S825-F842 WeakPolarHBondContact O-CA 3.09Å; S825-F842 WeakPolarHBondContact O-CD1 3.47Å
826	I	68.4	Low	59.6	Low	11 Å²	11	60.9 Å²	60.9	6%	0.056	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	121	178.5	-57.6	172.7	0	0	0	108.4	L801 I821 L823 G828 I840 Y841	L801-I826 HydrophobicContact CB-CD1 4.09Å; L801-I826 HydrophobicContact CD2-CD1 3.65Å; I821-I826 HydrophobicContact CB-CD1 4.44Å; I821-I826 HydrophobicContact CG2-CD1 3.78Å; I821-I826 HydrophobicContact CG2-CG1 3.78Å; L823-I826 HydrophobicContact CD2-CD1 4.33Å; L823-I826 PolarHBondContact O-N 3.03Å; L823-I826 VanDerWaalsContact O-N 3.13Å; I826-G828 WeakPolarHBondContact CG2-O 3.36Å; I826-I840 HydrophobicContact CB-CG2 4.48Å; I826-I840 HydrophobicContact CD1-CG2 3.77Å; I826-I840 HydrophobicContact CG1-CG2 3.78Å; I826-I840 HydrophobicContact CG2-CG2 3.94Å; I826-Y841 CarbonylContact C-O 3.55Å; I826-Y841 WeakPolarHBondContact CA-O 3.29Å
827	F	67	Low	60	Low	122 Å²	122	56.7 Å²	56.7	54%	0.535	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-15.3	174.7	89	-94.1	0	0	0	113.4	Y841 F842	F827-Y841 HydrophobicContact CE1-CD1 4.34Å; F827-Y841 HydrophobicContact CE1-CG 4.4Å; F827-Y841 HydrophobicContact CZ-CD1 4.23Å; F827-Y841 HydrophobicContact CZ-CG 4.45Å; F827-Y841 PolarHBondContact N-O 2.73Å; F827-F842 VanDerWaalsContact CD1-C 3.46Å; F827-F842 VanDerWaalsContact CD1-O 3.29Å; F827-F842 WeakPolarHBondContact CD1-O 3.23Å; F827-F842 VanDerWaalsContact CE1-O 3.28Å; F827-F842 WeakPolarHBondContact CE1-O 3.48Å
828	G	62.1	Low	60.5	Low	18 Å²	18	52.4 Å²	52.4	19%	0.186	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.2	171.6	176.9	0	0	0	0	0	114	I826 Y841	I826-G828 WeakPolarHBondContact CG2-O 3.36Å; G828-Y841 WeakPolarHBondContact O-CB 3.2Å; G828-Y841 PolarHBondContact O-N 3.36Å
829	C	64.1	Low	61.1	Low	30 Å²	30	52.6 Å²	52.6	20%	0.203	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	145	173.3	57.8	0	0	0	0	109.9	L729 L838 R839	L729-C829 HydrophobicContact CD2-CB 4.27Å; C829-L838 HydrophobicContact CB-CD1 4.23Å; C829-R839 CarbonylContact C-O 3.52Å; C829-R839 VanDerWaalsContact CA-O 3.22Å; C829-R839 WeakPolarHBondContact CA-O 3.44Å
830	L	64.1	Low	61.3	Low	76 Å²	76	52.2 Å²	52.2	40%	0.398	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	124.4	173.1	-175.9	67.3	0	0	0	109.4	E832 R839 Y841	L830-E832 HydrophobicContact CD2-CG 3.91Å; L830-E832 HydrophobicContact CG-CG 4.15Å; L830-R839 HydrophobicContact CB-CB 4.41Å; L830-R839 PolarHBondContact N-O 3.35Å; L830-R839 PolarHBondContact O-N 3.12Å; L830-Y841 HydrophobicContact CB-CE2 3.67Å
831	F	59.8	Low	61.8	Low	39 Å²	39	53 Å²	53	17%	0.171	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	105.7	169	-172.8	-110.3	0	0	0	109.3	F719 L722 H833 V837 L838	F719-F831 HydrophobicContact CE1-CZ 4.39Å; L722-F831 HydrophobicContact CB-CZ 4.47Å; L722-F831 HydrophobicContact CD2-CE2 4.25Å; F831-H833 AromaticContact CD1-CD2 3.81Å; F831-H833 AromaticContact CE1-CD2 3.97Å; F831-H833 PolarHBondContact O-N 3.15Å; F831-V837 CarbonylContact C-O 3.57Å; F831-V837 WeakPolarHBondContact CA-O 3.21Å; F831-L838 HydrophobicContact CB-CD1 4.44Å; F831-L838 HydrophobicContact CD2-CB 4.12Å
832	E	55.4	Low	62.2	Low	43 Å²	43	53 Å²	53	20%	0.201	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	86.3	178	-66.3	-170.8	136.7	0	0	109.6	L830 N834 R835 K836 V837 R839	L830-E832 HydrophobicContact CD2-CG 3.91Å; L830-E832 HydrophobicContact CG-CG 4.15Å; E832-N834 PolarHBondContact O-N 2.97Å; E832-N834 VanDerWaalsContact O-N 3.1Å; E832-R835 HydrophobicContact CB-CB 4.12Å; E832-R835 CarbonylContact O-C 3.47Å; E832-R835 WeakPolarHBondContact O-CA 2.92Å; E832-R835 PolarHBondContact O-N 3.19Å; E832-K836 PolarHBondContact O-N 3.37Å; E832-V837 HydrophobicContact CB-CB 4.36Å; E832-V837 PolarHBondContact N-O 3.42Å; E832-R839 VanDerWaalsContact CD-NE 3.34Å; E832-R839 IonicContact OE1-CZ 3.36Å; E832-R839 IonicContact OE1-NE 2.87Å; E832-R839 IonicContact OE1-NH2 2.75Å; E832-R839 PolarHBondContact OE1-NH2 3.28Å; E832-R839 IonicContact OE2-CZ 3.54Å; E832-R839 VanDerWaalsContact OE2-CZ 3.32Å; E832-R839 IonicContact OE2-NE 3.23Å; E832-R839 PolarHBondContact OE2-NE 2.95Å; E832-R839 VanDerWaalsContact OE2-NE 3.1Å; E832-R839 IonicContact OE2-NH2 3.97Å; E832-R839 PolarHBondContact OE2-NH2 3.35Å
833	H	42.7	Very low	61.7	Low	107 Å²	107	56.6 Å²	56.6	50%	0.495	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.4	-44.4	-176.8	-120.5	-74.2	0	0	0	113.8	F723 F831 R835	F723-H833 AromaticContact CD2-CD2 3.92Å; F723-H833 AromaticContact CD2-NE2 3.26Å; F723-H833 VanDerWaalsContact CD2-NE2 3.26Å; F723-H833 WeakPolarHBondContact CD2-NE2 3.35Å; F723-H833 AromaticContact CE2-NE2 3.7Å; F831-H833 AromaticContact CD1-CD2 3.81Å; F831-H833 AromaticContact CE1-CD2 3.97Å; F831-H833 PolarHBondContact O-N 3.15Å; H833-R835 PolarHBondContact O-N 3.38Å
834	N	41.4	Very low	61.4	Low	170 Å²	170	58.7 Å²	58.7	91%	0.909	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-8.6	-178.1	-62.9	1.8	0	0	0	113.8	E832	E832-N834 PolarHBondContact O-N 2.97Å; E832-N834 VanDerWaalsContact O-N 3.1Å
835	R	46.1	Very low	61.3	Low	144 Å²	144	57.9 Å²	57.9	54%	0.543	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-8.6	-179.3	-67.4	-175.9	173	-175.4	-1.8	113.9	E832 H833 V837	E832-R835 HydrophobicContact CB-CB 4.12Å; E832-R835 CarbonylContact O-C 3.47Å; E832-R835 WeakPolarHBondContact O-CA 2.92Å; E832-R835 PolarHBondContact O-N 3.19Å; H833-R835 PolarHBondContact O-N 3.38Å; R835-V837 HydrophobicContact CB-CB 4.37Å; R835-V837 HydrophobicContact CB-CG2 4.02Å; R835-V837 PolarHBondContact O-N 3.38Å
836	K	49.1	Very low	61.6	Low	141 Å²	141	59.1 Å²	59.1	61%	0.613	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	24.8	-172.4	-57.6	176.9	168.4	-174.8	0	113.9	F719 E832	F719-K836 HydrophobicContact CE1-CD 4.25Å; F719-K836 HydrophobicContact CE1-CG 4.06Å; F719-K836 HydrophobicContact CZ-CB 4.42Å; F719-K836 HydrophobicContact CZ-CD 3.77Å; F719-K836 HydrophobicContact CZ-CG 4Å; E832-K836 PolarHBondContact O-N 3.37Å
837	V	58.2	Low	62	Low	18 Å²	18	61.1 Å²	61.1	11%	0.109	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	126.1	-177.3	169.1	0	0	0	0	110.9	F831 E832 R835 R839 Q849	F831-V837 CarbonylContact C-O 3.57Å; F831-V837 WeakPolarHBondContact CA-O 3.21Å; E832-V837 HydrophobicContact CB-CB 4.36Å; E832-V837 PolarHBondContact N-O 3.42Å; R835-V837 HydrophobicContact CB-CB 4.37Å; R835-V837 HydrophobicContact CB-CG2 4.02Å; R835-V837 PolarHBondContact O-N 3.38Å; V837-R839 HydrophobicContact CG1-CG 3.68Å; V837-Q849 HydrophobicContact CG1-CB 4Å; V837-Q849 HydrophobicContact CG1-CG 3.94Å; V837-Q849 VanDerWaalsContact CG1-OE1 3.26Å
838	L	66.9	Low	62.2	Low	17 Å²	17	55.6 Å²	55.6	9%	0.089	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	119.5	163.9	-178.4	48.3	0	0	0	110	L722 F725 I794 C829 F831 Q849 I850	L722-L838 HydrophobicContact CD2-CD2 4.28Å; F725-L838 HydrophobicContact CD1-CD2 4.36Å; F725-L838 HydrophobicContact CE1-CD2 4.03Å; I794-L838 HydrophobicContact CD1-CD2 4.46Å; C829-L838 HydrophobicContact CB-CD1 4.23Å; F831-L838 HydrophobicContact CB-CD1 4.44Å; F831-L838 HydrophobicContact CD2-CB 4.12Å; L838-Q849 WeakPolarHBondContact O-CA 3.43Å; L838-I850 HydrophobicContact CB-CD1 4.17Å; L838-I850 HydrophobicContact CB-CG1 4.44Å; L838-I850 HydrophobicContact CD2-CD1 3.67Å; L838-I850 HydrophobicContact CG-CD1 3.84Å; L838-I850 HydrophobicContact CG-CG1 4.42Å; L838-I850 PolarHBondContact O-N 3.47Å
839	R	73	Confident	62.9	Low	27 Å²	27	56.8 Å²	56.8	10%	0.102	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.5	175.3	-50.9	-168.9	-177.7	-163.6	8.9	110.6	C829 L830 E832 V837 Y841 Y847 V848 Q849	C829-R839 CarbonylContact C-O 3.52Å; C829-R839 VanDerWaalsContact CA-O 3.22Å; C829-R839 WeakPolarHBondContact CA-O 3.44Å; L830-R839 HydrophobicContact CB-CB 4.41Å; L830-R839 PolarHBondContact N-O 3.35Å; L830-R839 PolarHBondContact O-N 3.12Å; E832-R839 VanDerWaalsContact CD-NE 3.34Å; E832-R839 IonicContact OE1-CZ 3.36Å; E832-R839 IonicContact OE1-NE 2.87Å; E832-R839 IonicContact OE1-NH2 2.75Å; E832-R839 PolarHBondContact OE1-NH2 3.28Å; E832-R839 IonicContact OE2-CZ 3.54Å; E832-R839 VanDerWaalsContact OE2-CZ 3.32Å; E832-R839 IonicContact OE2-NE 3.23Å; E832-R839 PolarHBondContact OE2-NE 2.95Å; E832-R839 VanDerWaalsContact OE2-NE 3.1Å; E832-R839 IonicContact OE2-NH2 3.97Å; E832-R839 PolarHBondContact OE2-NH2 3.35Å; V837-R839 HydrophobicContact CG1-CG 3.68Å; R839-Y841 HydrophobicContact CB-CD2 4.33Å; R839-Y841 HydrophobicContact CB-CE2 3.69Å; R839-Y847 HydrophobicContact CB-CD2 4.13Å; R839-Y847 HydrophobicContact CB-CG 4.47Å; R839-Y847 HydrophobicContact CG-CD2 4.22Å; R839-Y847 PolarHBondContact NH1-OH 2.66Å; R839-V848 CarbonylContact C-O 3.46Å; R839-V848 WeakPolarHBondContact CA-O 3.1Å; R839-Q849 HydrophobicContact CG-CG 4.28Å
840	I	73.6	Confident	63.1	Low	5 Å²	5	55.9 Å²	55.9	3%	0.026	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	123.4	174.8	-59.3	163.4	0	0	0	108	L801 I803 I821 I826 F842 Y847 V848 I850	L801-I840 HydrophobicContact CD2-CD1 3.64Å; L801-I840 HydrophobicContact CD2-CG1 4.21Å; I803-I840 HydrophobicContact CD1-CD1 4.33Å; I821-I840 HydrophobicContact CD1-CD1 3.83Å; I821-I840 HydrophobicContact CD1-CG2 4.49Å; I826-I840 HydrophobicContact CB-CG2 4.48Å; I826-I840 HydrophobicContact CD1-CG2 3.77Å; I826-I840 HydrophobicContact CG1-CG2 3.78Å; I826-I840 HydrophobicContact CG2-CG2 3.94Å; I840-F842 HydrophobicContact CG2-CE2 4.26Å; I840-F842 HydrophobicContact CG2-CZ 4.27Å; I840-Y847 CarbonylContact O-C 3.59Å; I840-Y847 WeakPolarHBondContact O-CA 3.27Å; I840-Y847 WeakPolarHBondContact O-CB 3.39Å; I840-V848 PolarHBondContact N-O 2.83Å; I840-V848 PolarHBondContact O-N 2.93Å; I840-I850 HydrophobicContact CD1-CD1 3.91Å; I840-I850 HydrophobicContact CD1-CG1 3.8Å; I840-I850 HydrophobicContact CG1-CD1 4.4Å; I840-I850 HydrophobicContact CG1-CG1 4.33Å
841	Y	76	Confident	63.2	Low	49 Å²	49	55.5 Å²	55.5	19%	0.192	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130.5	-177	-69.4	-106.7	0	0	0	112.3	I826 F827 G828 L830 R839 Q846 Y847	I826-Y841 CarbonylContact C-O 3.55Å; I826-Y841 WeakPolarHBondContact CA-O 3.29Å; F827-Y841 HydrophobicContact CE1-CD1 4.34Å; F827-Y841 HydrophobicContact CE1-CG 4.4Å; F827-Y841 HydrophobicContact CZ-CD1 4.23Å; F827-Y841 HydrophobicContact CZ-CG 4.45Å; F827-Y841 PolarHBondContact N-O 2.73Å; G828-Y841 WeakPolarHBondContact O-CB 3.2Å; G828-Y841 PolarHBondContact O-N 3.36Å; L830-Y841 HydrophobicContact CB-CE2 3.67Å; R839-Y841 HydrophobicContact CB-CD2 4.33Å; R839-Y841 HydrophobicContact CB-CE2 3.69Å; Y841-Q846 WeakPolarHBondContact CA-O 3.3Å; Y841-Y847 HydrophobicContact CD1-CD1 4.38Å; Y841-Y847 HydrophobicContact CD1-CG 4.5Å; Y841-Y847 AromaticContact CE1-CD1 3.85Å; Y841-Y847 HydrophobicContact CE1-CD1 3.85Å; Y841-Y847 HydrophobicContact CE1-CG 4.19Å
842	F	75.7	Confident	63.4	Low	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	150.3	-179.6	-58.9	-95.8	0	0	0	111.1	I821 S825 F827 I840 C844 G845 Q846 V848 I872 C875 I876	I821-F842 HydrophobicContact CD1-CZ 4.15Å; I821-F842 HydrophobicContact CG2-CE1 3.72Å; I821-F842 HydrophobicContact CG2-CZ 4.26Å; S825-F842 WeakPolarHBondContact O-CA 3.09Å; S825-F842 WeakPolarHBondContact O-CD1 3.47Å; F827-F842 VanDerWaalsContact CD1-C 3.46Å; F827-F842 VanDerWaalsContact CD1-O 3.29Å; F827-F842 WeakPolarHBondContact CD1-O 3.23Å; F827-F842 VanDerWaalsContact CE1-O 3.28Å; F827-F842 WeakPolarHBondContact CE1-O 3.48Å; I840-F842 HydrophobicContact CG2-CE2 4.26Å; I840-F842 HydrophobicContact CG2-CZ 4.27Å; F842-C844 PolarHBondContact O-N 3.38Å; F842-G845 PolarHBondContact O-N 3.13Å; F842-Q846 PolarHBondContact N-O 3.5Å; F842-V848 HydrophobicContact CE2-CB 4.28Å; F842-V848 HydrophobicContact CE2-CG2 4.01Å; F842-I872 HydrophobicContact CE1-CG2 4.17Å; F842-I872 HydrophobicContact CE2-CG1 4.49Å; F842-I872 HydrophobicContact CZ-CB 4.49Å; F842-I872 HydrophobicContact CZ-CG1 4.07Å; F842-I872 HydrophobicContact CZ-CG2 4Å; F842-C875 HydrophobicContact CB-CB 3.81Å; F842-C875 HydrophobicContact CD1-CB 3.71Å; F842-C875 HydrophobicContact CD2-CB 4.15Å; F842-C875 HydrophobicContact CE1-CB 4.28Å; F842-C875 HydrophobicContact CG-CB 3.64Å; F842-I876 HydrophobicContact CE1-CG1 4.26Å
843	D	58.1	Low	63.9	Low	87 Å²	87	54.5 Å²	54.5	47%	0.465	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-15.2	-172.4	-65.5	59.9	0	0	0	115.4	G845 K879	D843-G845 PolarHBondContact O-N 2.66Å; D843-K879 VanDerWaalsContact CG-CE 3.42Å; D843-K879 IonicContact OD1-NZ 3.39Å; D843-K879 PolarHBondContact OD1-NZ 3.49Å; D843-K879 VanDerWaalsContact OD2-CE 3.24Å; D843-K879 WeakPolarHBondContact OD2-CE 3.43Å; D843-K879 IonicContact OD2-NZ 3.26Å; D843-K879 PolarHBondContact OD2-NZ 3.12Å
844	C	58.7	Low	64.7	Low	62 Å²	62	49.8 Å²	49.8	42%	0.419	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-4	167.6	57	0	0	0	0	114	F842 Q846 C875	F842-C844 PolarHBondContact O-N 3.38Å; C844-Q846 PolarHBondContact SG-OE1 3.09Å; C844-C875 VanDerWaalsContact SG-SG 3.63Å
845	G	61.7	Low	65.7	Low	47 Å²	47	45.7 Å²	45.7	49%	0.485	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.3	7.9	-177.8	0	0	0	0	0	114.1	F842 D843	F842-G845 PolarHBondContact O-N 3.13Å; D843-G845 PolarHBondContact O-N 2.66Å
846	Q	70.8	Confident	66.3	Low	29 Å²	29	39.2 Å²	39.2	14%	0.136	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	167.4	-177.6	-55.9	170.5	-26.4	0	0	110.8	N276 N277 Y841 F842 C844 F871	N276-Q846 PolarHBondContact O-NE2 3.02Å; N277-Q846 PolarHBondContact ND2-NE2 3.07Å; N277-Q846 PolarHBondContact OD1-NE2 3.27Å; Y841-Q846 WeakPolarHBondContact CA-O 3.3Å; F842-Q846 PolarHBondContact N-O 3.5Å; C844-Q846 PolarHBondContact SG-OE1 3.09Å; Q846-F871 HydrophobicContact CB-CZ 3.98Å; Q846-F871 VanDerWaalsContact OE1-CE2 3.24Å
847	Y	77.3	Confident	66.5	Low	53 Å²	53	35 Å²	35	21%	0.208	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	160.7	179.1	68.1	-92.7	0	0	0	112.5	N274 R839 I840 Y841 Q849	N274-Y847 WeakPolarHBondContact ND2-CE1 3.47Å; N274-Y847 PolarHBondContact ND2-OH 3.07Å; R839-Y847 HydrophobicContact CB-CD2 4.13Å; R839-Y847 HydrophobicContact CB-CG 4.47Å; R839-Y847 HydrophobicContact CG-CD2 4.22Å; R839-Y847 PolarHBondContact NH1-OH 2.66Å; I840-Y847 CarbonylContact O-C 3.59Å; I840-Y847 WeakPolarHBondContact O-CA 3.27Å; I840-Y847 WeakPolarHBondContact O-CB 3.39Å; Y841-Y847 HydrophobicContact CD1-CD1 4.38Å; Y841-Y847 HydrophobicContact CD1-CG 4.5Å; Y841-Y847 AromaticContact CE1-CD1 3.85Å; Y841-Y847 HydrophobicContact CE1-CD1 3.85Å; Y841-Y847 HydrophobicContact CE1-CG 4.19Å; Y847-Q849 HydrophobicContact CD2-CG 4.22Å; Y847-Q849 HydrophobicContact CE2-CG 3.89Å
848	V	72.1	Confident	66.2	Low	5 Å²	5	38.3 Å²	38.3	3%	0.03	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	141.1	165.8	169.1	0	0	0	0	109.1	R839 I840 F842 I853 L868 F871 I872	R839-V848 CarbonylContact C-O 3.46Å; R839-V848 WeakPolarHBondContact CA-O 3.1Å; I840-V848 PolarHBondContact N-O 2.83Å; I840-V848 PolarHBondContact O-N 2.93Å; F842-V848 HydrophobicContact CE2-CB 4.28Å; F842-V848 HydrophobicContact CE2-CG2 4.01Å; V848-I853 HydrophobicContact CG1-CD1 3.94Å; V848-I853 HydrophobicContact CG1-CG1 3.8Å; V848-L868 HydrophobicContact CG1-CD2 4.12Å; V848-F871 HydrophobicContact CG2-CD1 3.71Å; V848-F871 HydrophobicContact CG2-CE1 3.58Å; V848-I872 HydrophobicContact CB-CD1 4.4Å; V848-I872 HydrophobicContact CG1-CD1 4.2Å; V848-I872 HydrophobicContact CG2-CD1 3.94Å; V848-I872 HydrophobicContact CG2-CG1 3.71Å
849	Q	77.1	Confident	65.4	Low	44 Å²	44	40 Å²	40	21%	0.206	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	134.9	167.6	-46.8	175.2	83	0	0	108.7	V837 L838 R839 Y847 Q851 D852	V837-Q849 HydrophobicContact CG1-CB 4Å; V837-Q849 HydrophobicContact CG1-CG 3.94Å; V837-Q849 VanDerWaalsContact CG1-OE1 3.26Å; L838-Q849 WeakPolarHBondContact O-CA 3.43Å; R839-Q849 HydrophobicContact CG-CG 4.28Å; Y847-Q849 HydrophobicContact CD2-CG 4.22Å; Y847-Q849 HydrophobicContact CE2-CG 3.89Å; Q849-Q851 PolarHBondContact O-N 3.31Å; Q849-D852 HydrophobicContact CB-CB 4.46Å; Q849-D852 WeakPolarHBondContact CB-OD2 3.16Å; Q849-D852 VanDerWaalsContact CG-OD2 3.27Å; Q849-D852 WeakPolarHBondContact CG-OD2 3.24Å; Q849-D852 PolarHBondContact NE2-OD1 3.33Å; Q849-D852 PolarHBondContact NE2-OD2 3.4Å; Q849-D852 WeakPolarHBondContact O-CB 3.24Å; Q849-D852 PolarHBondContact O-N 3.44Å
850	I	67.2	Low	64	Low	10 Å²	10	46 Å²	46	5%	0.051	25%	0.247	C	C	.	.	H	α-helix	trans	-62.6	-27	177.2	-63.4	-173.8	0	0	0	111.4	I794 I803 L838 I840 D852 I853 Y854	I794-I850 HydrophobicContact CD1-CD1 3.73Å; I803-I850 HydrophobicContact CD1-CD1 4.24Å; I803-I850 HydrophobicContact CD1-CG1 4.28Å; L838-I850 HydrophobicContact CB-CD1 4.17Å; L838-I850 HydrophobicContact CB-CG1 4.44Å; L838-I850 HydrophobicContact CD2-CD1 3.67Å; L838-I850 HydrophobicContact CG-CD1 3.84Å; L838-I850 HydrophobicContact CG-CG1 4.42Å; L838-I850 PolarHBondContact O-N 3.47Å; I840-I850 HydrophobicContact CD1-CD1 3.91Å; I840-I850 HydrophobicContact CD1-CG1 3.8Å; I840-I850 HydrophobicContact CG1-CD1 4.4Å; I840-I850 HydrophobicContact CG1-CG1 4.33Å; I850-D852 VanDerWaalsContact C-N 3.33Å; I850-D852 PolarHBondContact O-N 3.36Å; I850-I853 WeakPolarHBondContact O-CB 3.31Å; I850-I853 PolarHBondContact O-N 3.43Å; I850-Y854 HydrophobicContact CG2-CD2 3.76Å; I850-Y854 HydrophobicContact CG2-CE2 3.45Å; I850-Y854 VanDerWaalsContact CG2-CE2 3.45Å; I850-Y854 WeakPolarHBondContact O-CD2 3.21Å; I850-Y854 PolarHBondContact O-N 2.71Å
851	Q	66	Low	62.8	Low	69 Å²	69	50.4 Å²	50.4	32%	0.322	27%	0.268	S	S	.	.	H	α-helix	trans	-63.2	-36.7	172.8	-166.4	63.7	51.7	0	0	112.7	Q849 I853 Y854 N855	Q849-Q851 PolarHBondContact O-N 3.31Å; Q851-I853 VanDerWaalsContact C-N 3.28Å; Q851-I853 PolarHBondContact O-N 3.49Å; Q851-Y854 PolarHBondContact O-N 3.37Å; Q851-N855 PolarHBondContact NE2-OD1 3.14Å; Q851-N855 VanDerWaalsContact O-CB 3.31Å; Q851-N855 WeakPolarHBondContact O-CB 3.32Å; Q851-N855 PolarHBondContact O-N 2.94Å; Q851-N855 PolarHBondContact O-ND2 3.02Å; Q851-N855 PolarHBondContact O-OD1 2.94Å
852	D	65.1	Low	61.5	Low	59 Å²	59	55.9 Å²	55.9	32%	0.316	30%	0.295	S	S	.	.	H	α-helix	trans	-65	-37.6	179.2	-57.1	-28.3	0	0	0	110.3	Q849 I850 N855 S856 L868	Q849-D852 HydrophobicContact CB-CB 4.46Å; Q849-D852 WeakPolarHBondContact CB-OD2 3.16Å; Q849-D852 VanDerWaalsContact CG-OD2 3.27Å; Q849-D852 WeakPolarHBondContact CG-OD2 3.24Å; Q849-D852 PolarHBondContact NE2-OD1 3.33Å; Q849-D852 PolarHBondContact NE2-OD2 3.4Å; Q849-D852 WeakPolarHBondContact O-CB 3.24Å; Q849-D852 PolarHBondContact O-N 3.44Å; I850-D852 VanDerWaalsContact C-N 3.33Å; I850-D852 PolarHBondContact O-N 3.36Å; D852-N855 PolarHBondContact O-N 3.3Å; D852-S856 WeakPolarHBondContact O-CB 3.28Å; D852-S856 PolarHBondContact O-N 2.99Å; D852-S856 PolarHBondContact O-OG 3.21Å; D852-L868 HydrophobicContact CB-CD1 3.85Å
853	I	64.6	Low	60.1	Low	2 Å²	2	60.3 Å²	60.3	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-59.2	-56.7	173.9	-52.9	175.4	0	0	0	110.3	I803 L818 L819 V848 I850 Q851 N855 S856 Y857 L868	I803-I853 HydrophobicContact CD1-CD1 3.59Å; L818-I853 HydrophobicContact CD2-CG2 3.3Å; L819-I853 HydrophobicContact CD2-CD1 4.09Å; V848-I853 HydrophobicContact CG1-CD1 3.94Å; V848-I853 HydrophobicContact CG1-CG1 3.8Å; I850-I853 WeakPolarHBondContact O-CB 3.31Å; I850-I853 PolarHBondContact O-N 3.43Å; Q851-I853 VanDerWaalsContact C-N 3.28Å; Q851-I853 PolarHBondContact O-N 3.49Å; I853-N855 VanDerWaalsContact C-N 3.33Å; I853-N855 PolarHBondContact O-N 3.32Å; I853-S856 PolarHBondContact O-N 3.18Å; I853-S856 PolarHBondContact O-OG 3.25Å; I853-Y857 PolarHBondContact O-N 2.83Å; I853-Y857 VanDerWaalsContact O-N 3.1Å; I853-L868 HydrophobicContact CG1-CD1 4.48Å; I853-L868 HydrophobicContact CG1-CD2 3.74Å
854	Y	60.6	Low	59.7	Low	7 Å²	7	58.2 Å²	58.2	3%	0.027	31%	0.309	C	S	.	.	H	α-helix	trans	-65.5	-33.8	-178.7	-73	-64.1	0	0	0	113.2	T792 I803 F804 P806 L818 I850 Q851 Y857 H858	T792-Y854 HydrophobicContact CG2-CD2 4.27Å; T792-Y854 HydrophobicContact CG2-CE2 3.51Å; I803-Y854 HydrophobicContact CG2-CE2 4.32Å; I803-Y854 WeakPolarHBondContact CG2-OH 3.28Å; F804-Y854 WeakPolarHBondContact O-CE1 3.49Å; F804-Y854 PolarHBondContact O-OH 2.83Å; P806-Y854 HydrophobicContact CB-CE1 4.44Å; P806-Y854 HydrophobicContact CG-CD1 4.17Å; P806-Y854 HydrophobicContact CG-CE1 4.27Å; L818-Y854 HydrophobicContact CD1-CD1 4.44Å; L818-Y854 HydrophobicContact CD1-CE1 4.28Å; I850-Y854 HydrophobicContact CG2-CD2 3.76Å; I850-Y854 HydrophobicContact CG2-CE2 3.45Å; I850-Y854 VanDerWaalsContact CG2-CE2 3.45Å; I850-Y854 WeakPolarHBondContact O-CD2 3.21Å; I850-Y854 PolarHBondContact O-N 2.71Å; Q851-Y854 PolarHBondContact O-N 3.37Å; Y854-Y857 PolarHBondContact O-N 3.23Å; Y854-H858 WeakPolarHBondContact O-CB 3.11Å; Y854-H858 PolarHBondContact O-N 2.87Å
855	N	62.3	Low	59.6	Low	84 Å²	84	56.9 Å²	56.9	45%	0.449	30%	0.298	S	S	.	.	H	α-helix	trans	-62.5	-46.7	174.4	-69.4	-5.3	0	0	0	111	Q851 D852 I853 Y857 H858 S859	Q851-N855 PolarHBondContact NE2-OD1 3.14Å; Q851-N855 VanDerWaalsContact O-CB 3.31Å; Q851-N855 WeakPolarHBondContact O-CB 3.32Å; Q851-N855 PolarHBondContact O-N 2.94Å; Q851-N855 PolarHBondContact O-ND2 3.02Å; Q851-N855 PolarHBondContact O-OD1 2.94Å; D852-N855 PolarHBondContact O-N 3.3Å; I853-N855 VanDerWaalsContact C-N 3.33Å; I853-N855 PolarHBondContact O-N 3.32Å; N855-Y857 VanDerWaalsContact C-N 3.26Å; N855-Y857 PolarHBondContact O-N 2.91Å; N855-H858 PolarHBondContact O-N 2.98Å; N855-S859 PolarHBondContact O-N 3.26Å; N855-S859 VanDerWaalsContact O-N 3.07Å; N855-S859 PolarHBondContact O-OG 3.39Å
856	S	58.2	Low	59.4	Low	8 Å²	8	59.2 Å²	59.2	6%	0.056	30%	0.296	C	S	.	.	H	α-helix	trans	-66.4	-24.1	177.4	69.4	0	0	0	0	114	D852 I853 S859 L865	D852-S856 WeakPolarHBondContact O-CB 3.28Å; D852-S856 PolarHBondContact O-N 2.99Å; D852-S856 PolarHBondContact O-OG 3.21Å; I853-S856 PolarHBondContact O-N 3.18Å; I853-S856 PolarHBondContact O-OG 3.25Å; S856-S859 PolarHBondContact O-OG 3.37Å; S856-L865 WeakPolarHBondContact OG-CD1 3.45Å
857	Y	54.4	Low	58.6	Low	53 Å²	53	61.2 Å²	61.2	21%	0.208	31%	0.306	C	S	.	.	H	α-helix	trans	-79.5	-37	172.6	-161.1	-95.6	0	0	0	112.2	A805 I809 L813 L818 I853 Y854 N855 L865	A805-Y857 HydrophobicContact CB-CE1 4.49Å; I809-Y857 HydrophobicContact CD1-CD1 3.84Å; I809-Y857 HydrophobicContact CD1-CE1 3.87Å; L813-Y857 WeakPolarHBondContact CD2-OH 3.2Å; L818-Y857 HydrophobicContact CD1-CD1 4.05Å; L818-Y857 HydrophobicContact CD1-CD2 3.54Å; L818-Y857 HydrophobicContact CD1-CE1 4.31Å; L818-Y857 HydrophobicContact CD1-CE2 3.84Å; L818-Y857 HydrophobicContact CD1-CG 3.65Å; L818-Y857 HydrophobicContact CD2-CD2 4.38Å; L818-Y857 HydrophobicContact CG-CD2 3.86Å; L818-Y857 HydrophobicContact CG-CE2 4.04Å; L818-Y857 HydrophobicContact CG-CG 4.44Å; I853-Y857 PolarHBondContact O-N 2.83Å; I853-Y857 VanDerWaalsContact O-N 3.1Å; Y854-Y857 PolarHBondContact O-N 3.23Å; N855-Y857 VanDerWaalsContact C-N 3.26Å; N855-Y857 PolarHBondContact O-N 2.91Å; Y857-L865 HydrophobicContact CD2-CD2 3.83Å; Y857-L865 HydrophobicContact CE2-CD2 4.39Å
858	H	50.1	Low	57.8	Low	87 Å²	87	60 Å²	60	40%	0.403	30%	0.302	S	S	.	.	H	α-helix	trans	-77.6	-21.5	-179.9	-96.1	-64.9	0	0	0	114.4	Y854 N855 N860	Y854-H858 WeakPolarHBondContact O-CB 3.11Å; Y854-H858 PolarHBondContact O-N 2.87Å; N855-H858 PolarHBondContact O-N 2.98Å; H858-N860 VanDerWaalsContact C-N 3.31Å; H858-N860 PolarHBondContact O-N 3.06Å
859	S	51	Low	57.4	Low	53 Å²	53	61.8 Å²	61.8	37%	0.371	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-5.7	-178.4	61.9	0	0	0	0	114.7	N855 S856 E861	N855-S859 PolarHBondContact O-N 3.26Å; N855-S859 VanDerWaalsContact O-N 3.07Å; N855-S859 PolarHBondContact O-OG 3.39Å; S856-S859 PolarHBondContact O-OG 3.37Å; S859-E861 WeakPolarHBondContact CB-OE2 3.28Å; S859-E861 PolarHBondContact O-N 2.73Å; S859-E861 VanDerWaalsContact O-N 3.1Å; S859-E861 WeakPolarHBondContact OG-CB 3.28Å; S859-E861 WeakPolarHBondContact OG-CG 3.13Å; S859-E861 PolarHBondContact OG-N 2.89Å; S859-E861 PolarHBondContact OG-OE2 2.89Å
860	N	43	Very low	56.5	Low	152 Å²	152	62.7 Å²	62.7	81%	0.813	32%	0.318	S	S	*	.			trans	57.1	7.9	-166.8	-79.5	-22.4	0	0	0	114.7	H858 Q862	H858-N860 VanDerWaalsContact C-N 3.31Å; H858-N860 PolarHBondContact O-N 3.06Å; N860-Q862 PolarHBondContact O-N 2.66Å
861	E	49.5	Very low	56.4	Low	98 Å²	98	64.1 Å²	64.1	46%	0.458	32%	0.324	S	S	.	.			trans	-77.7	84.7	177.2	-63.8	167.9	143.6	0	0	110.2	S859 N863 T864 L865	S859-E861 WeakPolarHBondContact CB-OE2 3.28Å; S859-E861 PolarHBondContact O-N 2.73Å; S859-E861 VanDerWaalsContact O-N 3.1Å; S859-E861 WeakPolarHBondContact OG-CB 3.28Å; S859-E861 WeakPolarHBondContact OG-CG 3.13Å; S859-E861 PolarHBondContact OG-N 2.89Å; S859-E861 PolarHBondContact OG-OE2 2.89Å; E861-N863 PolarHBondContact O-N 2.97Å; E861-T864 HydrophobicContact CB-CG2 4.13Å; E861-T864 VanDerWaalsContact CB-OG1 3.29Å; E861-T864 WeakPolarHBondContact CB-OG1 3.33Å; E861-T864 PolarHBondContact O-N 2.98Å; E861-T864 PolarHBondContact O-OG1 3.09Å; E861-T864 WeakPolarHBondContact OE2-CG2 3.29Å; E861-T864 PolarHBondContact OE2-OG1 2.91Å; E861-T864 VanDerWaalsContact OE2-OG1 3.06Å; E861-L865 PolarHBondContact O-N 2.79Å
862	Q	47.7	Very low	56.4	Low	165 Å²	165	61 Å²	61	77%	0.771	31%	0.309	S	S	*	.	H	α-helix	trans	-49.1	-36.4	174.9	-69.3	-176.3	-47.2	0	0	112	N860 T864 E866	N860-Q862 PolarHBondContact O-N 2.66Å; Q862-T864 PolarHBondContact O-N 3.27Å; Q862-E866 WeakPolarHBondContact O-CB 3.33Å; Q862-E866 PolarHBondContact O-N 3.28Å
863	N	47.2	Very low	56.3	Low	92 Å²	92	59.7 Å²	59.7	49%	0.492	31%	0.305	S	S	.	.	H	α-helix	trans	-58.3	-41.1	174.6	-73.8	-18.2	0	0	0	114.5	E861 Q867	E861-N863 PolarHBondContact O-N 2.97Å; N863-Q867 VanDerWaalsContact O-CB 3.27Å; N863-Q867 WeakPolarHBondContact O-CB 3.47Å; N863-Q867 WeakPolarHBondContact O-CG 3.47Å; N863-Q867 PolarHBondContact O-N 2.74Å
864	T	49.2	Very low	56.2	Low	43 Å²	43	67.1 Å²	67.1	26%	0.264	33%	0.334	S	S	.	.	H	α-helix	trans	-79.5	-36.1	-177.1	58.8	0	0	0	0	111.3	E861 Q862 L868	E861-T864 HydrophobicContact CB-CG2 4.13Å; E861-T864 VanDerWaalsContact CB-OG1 3.29Å; E861-T864 WeakPolarHBondContact CB-OG1 3.33Å; E861-T864 PolarHBondContact O-N 2.98Å; E861-T864 PolarHBondContact O-OG1 3.09Å; E861-T864 WeakPolarHBondContact OE2-CG2 3.29Å; E861-T864 PolarHBondContact OE2-OG1 2.91Å; E861-T864 VanDerWaalsContact OE2-OG1 3.06Å; Q862-T864 PolarHBondContact O-N 3.27Å; T864-L868 VanDerWaalsContact O-CB 3.29Å; T864-L868 WeakPolarHBondContact O-CB 3.43Å; T864-L868 PolarHBondContact O-N 3.45Å
865	L	55.8	Low	56.1	Low	35 Å²	35	67.1 Å²	67.1	18%	0.183	34%	0.335	C	S	.	.	H	α-helix	trans	-64.3	-44	170.8	-176.7	67.3	0	0	0	111.2	L818 S856 Y857 E861 L868 I869	L818-L865 HydrophobicContact CD2-CD1 4.44Å; S856-L865 WeakPolarHBondContact OG-CD1 3.45Å; Y857-L865 HydrophobicContact CD2-CD2 3.83Å; Y857-L865 HydrophobicContact CE2-CD2 4.39Å; E861-L865 PolarHBondContact O-N 2.79Å; L865-L868 PolarHBondContact O-N 2.78Å; L865-I869 HydrophobicContact CD1-CD1 4.32Å; L865-I869 HydrophobicContact CG-CD1 3.97Å; L865-I869 WeakPolarHBondContact O-CB 3.45Å; L865-I869 VanDerWaalsContact O-CG1 3.32Å; L865-I869 WeakPolarHBondContact O-CG1 3.25Å; L865-I869 PolarHBondContact O-N 3.44Å
866	E	57.4	Low	56.3	Low	95 Å²	95	63.8 Å²	63.8	44%	0.444	32%	0.317	S	S	.	.	H	α-helix	trans	-67.1	-40.3	177.2	-178.9	167.9	-153.1	0	0	112	Q862 L868 I869 N870	Q862-E866 WeakPolarHBondContact O-CB 3.33Å; Q862-E866 PolarHBondContact O-N 3.28Å; E866-L868 VanDerWaalsContact C-N 3.29Å; E866-L868 PolarHBondContact O-N 3.45Å; E866-I869 PolarHBondContact O-N 2.8Å; E866-N870 WeakPolarHBondContact CG-ND2 3.25Å; E866-N870 VanDerWaalsContact O-CB 3.25Å; E866-N870 WeakPolarHBondContact O-CB 3.34Å; E866-N870 VanDerWaalsContact O-CG 3.31Å; E866-N870 PolarHBondContact O-N 3.08Å; E866-N870 PolarHBondContact O-ND2 3.26Å
867	Q	54.5	Low	56	Low	72 Å²	72	68.7 Å²	68.7	34%	0.336	34%	0.335	S	S	.	.	H	α-helix	trans	-59.3	-40.2	170.9	-79.1	170.9	23.1	0	0	111.8	N863 N870 F871	N863-Q867 VanDerWaalsContact O-CB 3.27Å; N863-Q867 WeakPolarHBondContact O-CB 3.47Å; N863-Q867 WeakPolarHBondContact O-CG 3.47Å; N863-Q867 PolarHBondContact O-N 2.74Å; Q867-N870 PolarHBondContact O-N 3.15Å; Q867-F871 VanDerWaalsContact O-CB 3.28Å; Q867-F871 WeakPolarHBondContact O-CB 3.41Å; Q867-F871 PolarHBondContact O-N 2.93Å
868	L	60.3	Low	55.8	Low	26 Å²	26	69.9 Å²	69.9	14%	0.136	35%	0.349	C	S	.	.	H	α-helix	trans	-74.7	-37	-178.6	-161.5	154.5	0	0	0	111.9	V848 D852 I853 T864 L865 E866 F871 I872	V848-L868 HydrophobicContact CG1-CD2 4.12Å; D852-L868 HydrophobicContact CB-CD1 3.85Å; I853-L868 HydrophobicContact CG1-CD1 4.48Å; I853-L868 HydrophobicContact CG1-CD2 3.74Å; T864-L868 VanDerWaalsContact O-CB 3.29Å; T864-L868 WeakPolarHBondContact O-CB 3.43Å; T864-L868 PolarHBondContact O-N 3.45Å; L865-L868 PolarHBondContact O-N 2.78Å; E866-L868 VanDerWaalsContact C-N 3.29Å; E866-L868 PolarHBondContact O-N 3.45Å; L868-F871 PolarHBondContact O-N 3.01Å; L868-I872 HydrophobicContact CD2-CD1 3.64Å; L868-I872 HydrophobicContact CD2-CG1 4.32Å; L868-I872 WeakPolarHBondContact O-CG1 3.29Å; L868-I872 PolarHBondContact O-N 2.99Å
869	I	63.9	Low	55.8	Low	44 Å²	44	67.8 Å²	67.8	23%	0.226	34%	0.338	C	S	.	.	H	α-helix	trans	-64.6	-44.2	170.1	-70.5	168	0	0	0	110.9	L865 E866 F871 I872 S873 L957	L865-I869 HydrophobicContact CD1-CD1 4.32Å; L865-I869 HydrophobicContact CG-CD1 3.97Å; L865-I869 WeakPolarHBondContact O-CB 3.45Å; L865-I869 VanDerWaalsContact O-CG1 3.32Å; L865-I869 WeakPolarHBondContact O-CG1 3.25Å; L865-I869 PolarHBondContact O-N 3.44Å; E866-I869 PolarHBondContact O-N 2.8Å; I869-F871 VanDerWaalsContact C-N 3.31Å; I869-F871 PolarHBondContact O-N 2.82Å; I869-I872 PolarHBondContact O-N 3.04Å; I869-S873 VanDerWaalsContact O-CB 3.3Å; I869-S873 WeakPolarHBondContact O-CB 3.49Å; I869-S873 PolarHBondContact O-N 2.83Å; I869-S873 PolarHBondContact O-OG 3.17Å; I869-L957 HydrophobicContact CG2-CD2 3.81Å
870	N	59.7	Low	55.6	Low	63 Å²	63	68.4 Å²	68.4	34%	0.337	34%	0.34	S	S	.	.	H	α-helix	trans	-61.9	-39	174.1	-80.5	-51.5	0	0	0	111.7	E866 Q867 S873 Y874	E866-N870 WeakPolarHBondContact CG-ND2 3.25Å; E866-N870 VanDerWaalsContact O-CB 3.25Å; E866-N870 WeakPolarHBondContact O-CB 3.34Å; E866-N870 VanDerWaalsContact O-CG 3.31Å; E866-N870 PolarHBondContact O-N 3.08Å; E866-N870 PolarHBondContact O-ND2 3.26Å; Q867-N870 PolarHBondContact O-N 3.15Å; N870-S873 WeakPolarHBondContact O-CB 3.5Å; N870-S873 PolarHBondContact O-N 3.4Å; N870-Y874 WeakPolarHBondContact O-CB 3.31Å; N870-Y874 PolarHBondContact O-N 3.2Å
871	F	65	Low	55.6	Low	40 Å²	40	65 Å²	65	18%	0.175	32%	0.321	C	S	.	.	H	α-helix	trans	-64.4	-46	176.3	175.8	-118.4	0	0	0	112.5	N277 Q846 V848 Q867 L868 I869 S873 Y874 C875	N277-F871 WeakPolarHBondContact ND2-CE2 3.4Å; N277-F871 WeakPolarHBondContact ND2-CZ 3.48Å; Q846-F871 HydrophobicContact CB-CZ 3.98Å; Q846-F871 VanDerWaalsContact OE1-CE2 3.24Å; V848-F871 HydrophobicContact CG2-CD1 3.71Å; V848-F871 HydrophobicContact CG2-CE1 3.58Å; Q867-F871 VanDerWaalsContact O-CB 3.28Å; Q867-F871 WeakPolarHBondContact O-CB 3.41Å; Q867-F871 PolarHBondContact O-N 2.93Å; L868-F871 PolarHBondContact O-N 3.01Å; I869-F871 VanDerWaalsContact C-N 3.31Å; I869-F871 PolarHBondContact O-N 2.82Å; F871-S873 VanDerWaalsContact C-N 3.33Å; F871-Y874 WeakPolarHBondContact O-CB 3.42Å; F871-Y874 PolarHBondContact O-N 3.05Å; F871-C875 VanDerWaalsContact CE2-SG 3.56Å; F871-C875 VanDerWaalsContact CZ-SG 3.52Å; F871-C875 PolarHBondContact O-N 3.48Å; F871-C875 PolarHBondContact O-SG 3.33Å
872	I	65.1	Low	55.4	Low	2 Å²	2	65.5 Å²	65.5	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-65.2	-39.5	175.7	-70.3	177.6	0	0	0	110.8	L819 I821 F842 V848 L868 I869 Y874 C875 I876	L819-I872 HydrophobicContact CD2-CD1 3.38Å; L819-I872 HydrophobicContact CD2-CG2 4.45Å; I821-I872 HydrophobicContact CG1-CG2 4.13Å; F842-I872 HydrophobicContact CE1-CG2 4.17Å; F842-I872 HydrophobicContact CE2-CG1 4.49Å; F842-I872 HydrophobicContact CZ-CB 4.49Å; F842-I872 HydrophobicContact CZ-CG1 4.07Å; F842-I872 HydrophobicContact CZ-CG2 4Å; V848-I872 HydrophobicContact CB-CD1 4.4Å; V848-I872 HydrophobicContact CG1-CD1 4.2Å; V848-I872 HydrophobicContact CG2-CD1 3.94Å; V848-I872 HydrophobicContact CG2-CG1 3.71Å; L868-I872 HydrophobicContact CD2-CD1 3.64Å; L868-I872 HydrophobicContact CD2-CG1 4.32Å; L868-I872 WeakPolarHBondContact O-CG1 3.29Å; L868-I872 PolarHBondContact O-N 2.99Å; I869-I872 PolarHBondContact O-N 3.04Å; I872-Y874 PolarHBondContact O-N 3.19Å; I872-C875 WeakPolarHBondContact O-CB 3.46Å; I872-C875 PolarHBondContact O-N 2.89Å; I872-I876 HydrophobicContact CG2-CD1 3.61Å; I872-I876 WeakPolarHBondContact O-CD1 3.41Å; I872-I876 VanDerWaalsContact O-CG1 3.28Å; I872-I876 WeakPolarHBondContact O-CG1 3.31Å; I872-I876 PolarHBondContact O-N 3.15Å
873	S	62.1	Low	55.2	Low	33 Å²	33	62.4 Å²	62.4	23%	0.231	31%	0.308	C	S	.	.	H	α-helix	trans	-59.1	-46.1	173.1	-59.3	0	0	0	0	111.2	I869 N870 F871 C875 I876 Y877 L957	I869-S873 VanDerWaalsContact O-CB 3.3Å; I869-S873 WeakPolarHBondContact O-CB 3.49Å; I869-S873 PolarHBondContact O-N 2.83Å; I869-S873 PolarHBondContact O-OG 3.17Å; N870-S873 WeakPolarHBondContact O-CB 3.5Å; N870-S873 PolarHBondContact O-N 3.4Å; F871-S873 VanDerWaalsContact C-N 3.33Å; S873-C875 VanDerWaalsContact C-N 3.33Å; S873-C875 PolarHBondContact O-N 3.26Å; S873-I876 CarbonylContact O-C 3.59Å; S873-I876 PolarHBondContact O-N 3.41Å; S873-I876 VanDerWaalsContact O-N 3.12Å; S873-Y877 VanDerWaalsContact O-CB 3.3Å; S873-Y877 WeakPolarHBondContact O-CB 3.47Å; S873-Y877 PolarHBondContact O-N 3.32Å; S873-L957 WeakPolarHBondContact OG-CD2 3.37Å
874	Y	63.4	Low	54.8	Low	158 Å²	158	60.7 Å²	60.7	62%	0.62	30%	0.303	S	S	*	.	H	α-helix	trans	-60.7	-38.7	174.9	-176.2	-94.1	0	0	0	112.6	N870 F871 I872 I876 P878	N870-Y874 WeakPolarHBondContact O-CB 3.31Å; N870-Y874 PolarHBondContact O-N 3.2Å; F871-Y874 WeakPolarHBondContact O-CB 3.42Å; F871-Y874 PolarHBondContact O-N 3.05Å; I872-Y874 PolarHBondContact O-N 3.19Å; Y874-I876 VanDerWaalsContact C-N 3.31Å; Y874-I876 PolarHBondContact O-N 3.5Å; Y874-P878 WeakPolarHBondContact O-CD 3.36Å
875	C	59.3	Low	54.2	Low	7 Å²	7	61.9 Å²	61.9	5%	0.047	31%	0.312	C	S	.	.	H	α-helix	trans	-66.7	-30.8	174.6	-65.7	0	0	0	0	113.3	F842 C844 F871 I872 S873	F842-C875 HydrophobicContact CB-CB 3.81Å; F842-C875 HydrophobicContact CD1-CB 3.71Å; F842-C875 HydrophobicContact CD2-CB 4.15Å; F842-C875 HydrophobicContact CE1-CB 4.28Å; F842-C875 HydrophobicContact CG-CB 3.64Å; C844-C875 VanDerWaalsContact SG-SG 3.63Å; F871-C875 VanDerWaalsContact CE2-SG 3.56Å; F871-C875 VanDerWaalsContact CZ-SG 3.52Å; F871-C875 PolarHBondContact O-N 3.48Å; F871-C875 PolarHBondContact O-SG 3.33Å; I872-C875 WeakPolarHBondContact O-CB 3.46Å; I872-C875 PolarHBondContact O-N 2.89Å; S873-C875 VanDerWaalsContact C-N 3.33Å; S873-C875 PolarHBondContact O-N 3.26Å
876	I	65.2	Low	53.6	Low	14 Å²	14	65.2 Å²	65.2	7%	0.072	33%	0.327	C	S	.	.	H	α-helix	trans	-85.4	-32.1	179.1	-68.2	161.6	0	0	0	111.7	I821 P822 F842 I872 S873 Y874 K879 V880	I821-I876 HydrophobicContact CG2-CD1 4.44Å; P822-I876 HydrophobicContact CG-CD1 4.42Å; P822-I876 HydrophobicContact CG-CG2 4.18Å; F842-I876 HydrophobicContact CE1-CG1 4.26Å; I872-I876 HydrophobicContact CG2-CD1 3.61Å; I872-I876 WeakPolarHBondContact O-CD1 3.41Å; I872-I876 VanDerWaalsContact O-CG1 3.28Å; I872-I876 WeakPolarHBondContact O-CG1 3.31Å; I872-I876 PolarHBondContact O-N 3.15Å; S873-I876 CarbonylContact O-C 3.59Å; S873-I876 PolarHBondContact O-N 3.41Å; S873-I876 VanDerWaalsContact O-N 3.12Å; Y874-I876 VanDerWaalsContact C-N 3.31Å; Y874-I876 PolarHBondContact O-N 3.5Å; I876-K879 PolarHBondContact O-N 3.34Å; I876-V880 HydrophobicContact CG2-CG2 3.66Å; I876-V880 PolarHBondContact O-N 3.21Å; I876-V880 VanDerWaalsContact O-N 3.09Å
877	Y	53.1	Low	52.9	Low	111 Å²	111	65.1 Å²	65.1	44%	0.435	33%	0.329	S	S	.	.	H	α-helix	trans	-55.4	-41.4	-169.6	-167.1	-106.6	0	0	0	114.4	S873 K879 V880 L881 I965	S873-Y877 VanDerWaalsContact O-CB 3.3Å; S873-Y877 WeakPolarHBondContact O-CB 3.47Å; S873-Y877 PolarHBondContact O-N 3.32Å; Y877-K879 VanDerWaalsContact C-N 3.27Å; Y877-K879 PolarHBondContact O-N 2.97Å; Y877-V880 PolarHBondContact O-N 3.23Å; Y877-V880 VanDerWaalsContact O-N 3.15Å; Y877-L881 HydrophobicContact CD1-CD1 3.84Å; Y877-L881 HydrophobicContact CE1-CD1 3.39Å; Y877-L881 HydrophobicContact CE1-CG 4.12Å; Y877-L881 WeakPolarHBondContact O-CB 3.28Å; Y877-L881 PolarHBondContact O-N 2.93Å; Y877-I965 HydrophobicContact CE1-CD1 4.23Å
878	P	50.7	Low	52.1	Low	77 Å²	77	66.3 Å²	66.3	50%	0.5	34%	0.336	S	S	.	.	H	α-helix	trans	-59.1	-34.7	175	-26.1	35	0	0	0	113.7	Y874 Q882	Y874-P878 WeakPolarHBondContact O-CD 3.36Å; P878-Q882 VanDerWaalsContact O-CB 3.31Å; P878-Q882 WeakPolarHBondContact O-CB 3.29Å; P878-Q882 PolarHBondContact O-N 3.05Å
879	K	49.5	Very low	51	Low	43 Å²	43	70 Å²	70	19%	0.187	35%	0.354	C	S	.	.	H	α-helix	trans	-79.6	-29.7	176.9	-80.7	-177.9	165.3	-176.7	0	112.8	N824 D843 I876 Y877 K883	N824-K879 VanDerWaalsContact O-CD 3.31Å; N824-K879 WeakPolarHBondContact O-CD 3.47Å; N824-K879 WeakPolarHBondContact O-CE 3.17Å; N824-K879 PolarHBondContact O-NZ 3.42Å; D843-K879 VanDerWaalsContact CG-CE 3.42Å; D843-K879 IonicContact OD1-NZ 3.39Å; D843-K879 PolarHBondContact OD1-NZ 3.49Å; D843-K879 VanDerWaalsContact OD2-CE 3.24Å; D843-K879 WeakPolarHBondContact OD2-CE 3.43Å; D843-K879 IonicContact OD2-NZ 3.26Å; D843-K879 PolarHBondContact OD2-NZ 3.12Å; I876-K879 PolarHBondContact O-N 3.34Å; Y877-K879 VanDerWaalsContact C-N 3.27Å; Y877-K879 PolarHBondContact O-N 2.97Å; K879-K883 WeakPolarHBondContact O-CB 3.27Å; K879-K883 PolarHBondContact O-N 3.34Å
880	V	46.3	Very low	49.8	Very low	67 Å²	67	74.8 Å²	74.8	41%	0.406	37%	0.373	S	S	.	.	H	α-helix	trans	-67.8	-47.5	168.8	174.8	0	0	0	0	109.7	I876 Y877 Q882 K883 C884	I876-V880 HydrophobicContact CG2-CG2 3.66Å; I876-V880 PolarHBondContact O-N 3.21Å; I876-V880 VanDerWaalsContact O-N 3.09Å; Y877-V880 PolarHBondContact O-N 3.23Å; Y877-V880 VanDerWaalsContact O-N 3.15Å; V880-Q882 VanDerWaalsContact C-N 3.3Å; V880-Q882 PolarHBondContact O-N 2.84Å; V880-K883 PolarHBondContact O-N 3.2Å; V880-C884 VanDerWaalsContact O-CB 3.27Å; V880-C884 WeakPolarHBondContact O-CB 3.45Å; V880-C884 PolarHBondContact O-N 2.91Å; V880-C884 PolarHBondContact O-SG 2.97Å
881	L	42.3	Very low	48.7	Very low	79 Å²	79	76.5 Å²	76.5	41%	0.414	38%	0.381	S	S	.	.	H	α-helix	trans	-58.3	-39.5	172.2	-100.3	169.8	0	0	0	112.4	Y877 S885 I965	Y877-L881 HydrophobicContact CD1-CD1 3.84Å; Y877-L881 HydrophobicContact CE1-CD1 3.39Å; Y877-L881 HydrophobicContact CE1-CG 4.12Å; Y877-L881 WeakPolarHBondContact O-CB 3.28Å; Y877-L881 PolarHBondContact O-N 2.93Å; L881-S885 WeakPolarHBondContact O-CB 3.08Å; L881-S885 PolarHBondContact O-N 3.39Å; L881-I965 HydrophobicContact CD1-CD1 3.98Å
882	Q	45.4	Very low	47.2	Very low	110 Å²	110	80.1 Å²	80.1	51%	0.514	40%	0.397	S	S	.	.	H	α-helix	trans	-69.1	-41.9	176.2	-168.2	178.3	21.1	0	0	112.4	P878 V880 S885 Q886	P878-Q882 VanDerWaalsContact O-CB 3.31Å; P878-Q882 WeakPolarHBondContact O-CB 3.29Å; P878-Q882 PolarHBondContact O-N 3.05Å; V880-Q882 VanDerWaalsContact C-N 3.3Å; V880-Q882 PolarHBondContact O-N 2.84Å; Q882-S885 PolarHBondContact O-N 2.91Å; Q882-Q886 WeakPolarHBondContact O-CB 3.48Å; Q882-Q886 VanDerWaalsContact O-CG 3.27Å; Q882-Q886 WeakPolarHBondContact O-CG 3.39Å; Q882-Q886 PolarHBondContact O-N 2.88Å
883	K	44.3	Very low	45.7	Very low	99 Å²	99	84.6 Å²	84.6	43%	0.43	42%	0.421	S	S	.	.	H	α-helix	trans	-65.5	-44.9	173.2	-92.3	-177.6	169.8	178.1	0	111.5	N824 K879 V880 S885 Q886 I887	N824-K883 PolarHBondContact OD1-NZ 3.33Å; K879-K883 WeakPolarHBondContact O-CB 3.27Å; K879-K883 PolarHBondContact O-N 3.34Å; V880-K883 PolarHBondContact O-N 3.2Å; K883-S885 VanDerWaalsContact C-N 3.34Å; K883-S885 PolarHBondContact O-N 2.98Å; K883-Q886 CarbonylContact O-C 3.52Å; K883-Q886 PolarHBondContact O-N 3.4Å; K883-I887 VanDerWaalsContact O-CB 3.32Å; K883-I887 WeakPolarHBondContact O-CB 3.12Å; K883-I887 WeakPolarHBondContact O-CG1 3.3Å; K883-I887 PolarHBondContact O-N 3Å
884	C	38	Very low	44.3	Very low	57 Å²	57	89 Å²	89	39%	0.385	44%	0.442	S	S	.	.	H	α-helix	trans	-64.3	-37.5	175.6	-68.9	0	0	0	0	111.4	V880 I887 I888	V880-C884 VanDerWaalsContact O-CB 3.27Å; V880-C884 WeakPolarHBondContact O-CB 3.45Å; V880-C884 PolarHBondContact O-N 2.91Å; V880-C884 PolarHBondContact O-SG 2.97Å; C884-I887 PolarHBondContact O-N 3.13Å; C884-I888 VanDerWaalsContact O-CB 3.24Å; C884-I888 WeakPolarHBondContact O-CB 3.45Å; C884-I888 WeakPolarHBondContact O-CD1 3.36Å; C884-I888 WeakPolarHBondContact O-CG1 3.47Å; C884-I888 PolarHBondContact O-N 3.41Å
885	S	37.2	Very low	42.7	Very low	67 Å²	67	85.6 Å²	85.6	47%	0.469	44%	0.441	S	S	.	.	H	α-helix	trans	-64.1	-44.5	170.8	175.9	0	0	0	0	111.4	L881 Q882 K883 I887 I888 M889	L881-S885 WeakPolarHBondContact O-CB 3.08Å; L881-S885 PolarHBondContact O-N 3.39Å; Q882-S885 PolarHBondContact O-N 2.91Å; K883-S885 VanDerWaalsContact C-N 3.34Å; K883-S885 PolarHBondContact O-N 2.98Å; S885-I887 VanDerWaalsContact C-N 3.33Å; S885-I887 PolarHBondContact O-N 2.78Å; S885-I888 PolarHBondContact O-N 3.36Å; S885-M889 VanDerWaalsContact O-CB 3.25Å; S885-M889 WeakPolarHBondContact O-CB 3.47Å; S885-M889 WeakPolarHBondContact O-CG 3.26Å; S885-M889 PolarHBondContact O-N 2.9Å
886	Q	43.9	Very low	41.3	Very low	106 Å²	106	91 Å²	91	50%	0.495	47%	0.468	S	S	.	.	H	α-helix	trans	-66.4	-32.2	174.9	-74.6	172.6	-5.8	0	0	113	Q882 K883 K890	Q882-Q886 WeakPolarHBondContact O-CB 3.48Å; Q882-Q886 VanDerWaalsContact O-CG 3.27Å; Q882-Q886 WeakPolarHBondContact O-CG 3.39Å; Q882-Q886 PolarHBondContact O-N 2.88Å; K883-Q886 CarbonylContact O-C 3.52Å; K883-Q886 PolarHBondContact O-N 3.4Å; Q886-K890 VanDerWaalsContact O-CB 3.29Å; Q886-K890 WeakPolarHBondContact O-CB 3.5Å; Q886-K890 VanDerWaalsContact O-CG 3.3Å; Q886-K890 WeakPolarHBondContact O-CG 3.2Å; Q886-K890 PolarHBondContact O-N 3.03Å
887	I	42.7	Very low	39.4	Very low	93 Å²	93	97.1 Å²	97.1	48%	0.477	50%	0.497	S	S	.	.	H	α-helix	trans	-75.8	-40.6	175.4	-71.8	164.1	0	0	0	110.2	K883 C884 S885 M889 K890 I891	K883-I887 VanDerWaalsContact O-CB 3.32Å; K883-I887 WeakPolarHBondContact O-CB 3.12Å; K883-I887 WeakPolarHBondContact O-CG1 3.3Å; K883-I887 PolarHBondContact O-N 3Å; C884-I887 PolarHBondContact O-N 3.13Å; S885-I887 VanDerWaalsContact C-N 3.33Å; S885-I887 PolarHBondContact O-N 2.78Å; I887-M889 VanDerWaalsContact C-N 3.34Å; I887-K890 CarbonylContact O-C 3.58Å; I887-K890 PolarHBondContact O-N 3.14Å; I887-I891 HydrophobicContact CG2-CD1 3.66Å; I887-I891 HydrophobicContact CG2-CG1 4.33Å; I887-I891 VanDerWaalsContact O-CB 3.28Å; I887-I891 WeakPolarHBondContact O-CB 3.46Å; I887-I891 WeakPolarHBondContact O-CG1 3.35Å; I887-I891 PolarHBondContact O-N 3.44Å
888	I	37.3	Very low	38.1	Very low	97 Å²	97	99.5 Å²	99.5	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-67.7	-34.8	173.1	-70.8	164	0	0	0	110.9	C884 S885 K892	C884-I888 VanDerWaalsContact O-CB 3.24Å; C884-I888 WeakPolarHBondContact O-CB 3.45Å; C884-I888 WeakPolarHBondContact O-CD1 3.36Å; C884-I888 WeakPolarHBondContact O-CG1 3.47Å; C884-I888 PolarHBondContact O-N 3.41Å; S885-I888 PolarHBondContact O-N 3.36Å; I888-K892 VanDerWaalsContact O-CB 3.28Å; I888-K892 WeakPolarHBondContact O-CB 3.21Å; I888-K892 WeakPolarHBondContact O-CG 3.45Å; I888-K892 PolarHBondContact O-N 3.5Å
889	M	37.5	Very low	36.9	Very low	104 Å²	104	102.3 Å²	102.3	51%	0.512	52%	0.522	S	S	.	.	H	α-helix	trans	-71.5	-37.3	172.1	-71.8	-72.7	-72.1	0	0	111.6	S885 I887 N893	S885-M889 VanDerWaalsContact O-CB 3.25Å; S885-M889 WeakPolarHBondContact O-CB 3.47Å; S885-M889 WeakPolarHBondContact O-CG 3.26Å; S885-M889 PolarHBondContact O-N 2.9Å; I887-M889 VanDerWaalsContact C-N 3.34Å; M889-N893 WeakPolarHBondContact O-CB 3.26Å; M889-N893 PolarHBondContact O-N 3.02Å; M889-N893 PolarHBondContact O-OD1 3.15Å; M889-N893 VanDerWaalsContact O-OD1 3.1Å
890	K	38	Very low	35.9	Very low	144 Å²	144	108.2 Å²	108.2	63%	0.626	56%	0.556	S	S	*	*	H	α-helix	trans	-70	-37.4	171.6	-80.8	-176.7	173.6	-167.7	0	112.6	Q886 I887 N894	Q886-K890 VanDerWaalsContact O-CB 3.29Å; Q886-K890 WeakPolarHBondContact O-CB 3.5Å; Q886-K890 VanDerWaalsContact O-CG 3.3Å; Q886-K890 WeakPolarHBondContact O-CG 3.2Å; Q886-K890 PolarHBondContact O-N 3.03Å; I887-K890 CarbonylContact O-C 3.58Å; I887-K890 PolarHBondContact O-N 3.14Å; K890-N894 WeakPolarHBondContact O-CB 3.4Å; K890-N894 PolarHBondContact O-N 2.77Å; K890-N894 PolarHBondContact O-OD1 2.73Å
891	I	36.8	Very low	34.8	Very low	99 Å²	99	114.7 Å²	114.7	51%	0.508	57%	0.574	S	S	.	*	H	α-helix	trans	-69.3	-45	175	-71.5	168.3	0	0	0	109.3	I887 N893 N894 S895	I887-I891 HydrophobicContact CG2-CD1 3.66Å; I887-I891 HydrophobicContact CG2-CG1 4.33Å; I887-I891 VanDerWaalsContact O-CB 3.28Å; I887-I891 WeakPolarHBondContact O-CB 3.46Å; I887-I891 WeakPolarHBondContact O-CG1 3.35Å; I887-I891 PolarHBondContact O-N 3.44Å; I891-N893 PolarHBondContact O-N 3.48Å; I891-N894 PolarHBondContact O-N 3.3Å; I891-S895 WeakPolarHBondContact O-CA 3.33Å; I891-S895 WeakPolarHBondContact O-CB 3.31Å; I891-S895 PolarHBondContact O-N 2.84Å; I891-S895 PolarHBondContact O-OG 3.37Å; I891-S895 VanDerWaalsContact O-OG 3.09Å
892	K	32.5	Very low	34.2	Very low	116 Å²	116	116.7 Å²	116.7	50%	0.504	58%	0.581	S	S	.	*	H	α-helix	trans	-57.9	-51.1	171.1	-79.5	-171.3	172.5	-168	0	111.3	I888 N894 S895 I896	I888-K892 VanDerWaalsContact O-CB 3.28Å; I888-K892 WeakPolarHBondContact O-CB 3.21Å; I888-K892 WeakPolarHBondContact O-CG 3.45Å; I888-K892 PolarHBondContact O-N 3.5Å; K892-N894 VanDerWaalsContact C-N 3.29Å; K892-N894 PolarHBondContact O-N 2.94Å; K892-S895 CarbonylContact O-C 3.33Å; K892-S895 PolarHBondContact O-N 3.44Å; K892-I896 HydrophobicContact CB-CD1 4.21Å; K892-I896 VanDerWaalsContact O-CB 3.24Å; K892-I896 WeakPolarHBondContact O-CB 3.48Å; K892-I896 WeakPolarHBondContact O-CD1 3.34Å; K892-I896 WeakPolarHBondContact O-CG1 3.2Å; K892-I896 PolarHBondContact O-N 3.42Å
893	N	34.8	Very low	33.2	Very low	96 Å²	96	117.2 Å²	117.2	51%	0.513	59%	0.586	S	S	.	*	H	α-helix	trans	-68	-25.9	-177.9	-66.4	12	0	0	0	113.5	M889 I891	M889-N893 WeakPolarHBondContact O-CB 3.26Å; M889-N893 PolarHBondContact O-N 3.02Å; M889-N893 PolarHBondContact O-OD1 3.15Å; M889-N893 VanDerWaalsContact O-OD1 3.1Å; I891-N893 PolarHBondContact O-N 3.48Å
894	N	32.1	Very low	32.5	Very low	124 Å²	124	119.4 Å²	119.4	66%	0.663	60%	0.603	S	S	*	*	H	α-helix	trans	-93.5	-15.4	176.2	-65.3	15.1	0	0	0	113.5	K890 I891 K892	K890-N894 WeakPolarHBondContact O-CB 3.4Å; K890-N894 PolarHBondContact O-N 2.77Å; K890-N894 PolarHBondContact O-OD1 2.73Å; I891-N894 PolarHBondContact O-N 3.3Å; K892-N894 VanDerWaalsContact C-N 3.29Å; K892-N894 PolarHBondContact O-N 2.94Å
895	S	30.7	Very low	32	Very low	88 Å²	88	122.4 Å²	122.4	62%	0.615	62%	0.615	S	S	*	*	H	α-helix	trans	-108.4	10.8	176	-57	0	0	0	0	113	I891 K892	I891-S895 WeakPolarHBondContact O-CA 3.33Å; I891-S895 WeakPolarHBondContact O-CB 3.31Å; I891-S895 PolarHBondContact O-N 2.84Å; I891-S895 PolarHBondContact O-OG 3.37Å; I891-S895 VanDerWaalsContact O-OG 3.09Å; K892-S895 CarbonylContact O-C 3.33Å; K892-S895 PolarHBondContact O-N 3.44Å
896	I	28.5	Very low	31.4	Very low	119 Å²	119	125.4 Å²	125.4	61%	0.61	63%	0.626	S	S	*	*	S	Bend	trans	-100.7	-1.2	167	-73.7	167.8	0	0	0	111	K892	K892-I896 HydrophobicContact CB-CD1 4.21Å; K892-I896 VanDerWaalsContact O-CB 3.24Å; K892-I896 WeakPolarHBondContact O-CB 3.48Å; K892-I896 WeakPolarHBondContact O-CD1 3.34Å; K892-I896 WeakPolarHBondContact O-CG1 3.2Å; K892-I896 PolarHBondContact O-N 3.42Å
897	H	26.6	Very low	30.7	Very low	144 Å²	144	129.9 Å²	129.9	67%	0.667	65%	0.647	S	S	*	*	S	Bend	trans	-117	52.9	176.9	-79	-58.1	0	0	0	114
898	H	25.5	Very low	30	Very low	161 Å²	161	133.3 Å²	133.3	75%	0.745	66%	0.658	S	S	*	*	S	Bend	trans	-163.1	125.9	153.1	-85.3	-53.5	0	0	0	107.4
899	N	25.2	Very low	29.3	Very low	136 Å²	136	136.7 Å²	136.7	73%	0.727	67%	0.669	S	S	*	*	S	Bend	cis	-143	137.7	-12.6	-78.9	-43.1	0	0	0	107.9
900	D	27.6	Very low	28.8	Very low	167 Å²	167	139.5 Å²	139.5	89%	0.893	69%	0.686	S	S	*	*			trans	-166	118.6	143.6	-104.8	-24.5	0	0	0	108.3
901	Y	25	Very low	28.1	Very low	203 Å²	203	137.4 Å²	137.4	80%	0.796	68%	0.68	S	S	*	*			trans	-150.4	119.4	-175.7	-113.4	-71.2	0	0	0	107.8
902	H	27.9	Very low	27.6	Very low	121 Å²	121	140.4 Å²	140.4	56%	0.56	69%	0.692	S	S	*	*			trans	-142.2	106.6	159.2	-103	-89	0	0	0	111.8
903	I	26	Very low	27.4	Very low	121 Å²	121	141.7 Å²	141.7	62%	0.621	70%	0.704	S	S	*	*			trans	51.2	112	131.1	-56.7	-178.5	0	0	0	117.8
904	N	28.2	Very low	27	Very low	144 Å²	144	143.4 Å²	143.4	77%	0.77	71%	0.711	S	S	*	*				-152.5	110.9	107.2	-127.9	29.9	0	0	0	113.3
905	D	27.3	Very low	26.7	Very low	121 Å²	121	142.9 Å²	142.9	65%	0.647	71%	0.708	S	S	*	*			trans	55	135.3	145.6	-63.3	-12.3	0	0	0	125.1
906	N	26.4	Very low	26.8	Very low	129 Å²	129	145.6 Å²	145.6	69%	0.69	72%	0.716	S	S	*	*			trans	76.6	74.4	154.1	-57.8	-40.3	0	0	0	119.5
907	E	28.4	Very low	26.7	Very low	200 Å²	200	146.6 Å²	146.6	94%	0.935	72%	0.721	S	S	*	*				-151.4	164.6	89.9	-101.6	178.6	176	0	0	110.4
908	K	27	Very low	26.6	Very low	166 Å²	166	147.7 Å²	147.7	72%	0.722	73%	0.726	S	S	*	*			trans	-120.6	166.2	-154.1	-73.6	-177.8	177.2	175.6	0	116
909	F	24.6	Very low	26.7	Very low	167 Å²	167	148.9 Å²	148.9	73%	0.732	73%	0.729	S	S	*	*			trans	78.9	120.2	172.2	-57.5	-85.7	0	0	0	115.2	I911	F909-I911 HydrophobicContact CD1-CD1 3.51Å; F909-I911 HydrophobicContact CE1-CD1 3.93Å; F909-I911 HydrophobicContact CG-CD1 4.27Å
910	L	25.4	Very low	26.6	Very low	164 Å²	164	147.7 Å²	147.7	86%	0.859	73%	0.727	S	S	*	*			cis	-131.5	168.6	1.5	-71.4	91.4	0	0	0	110.8
911	I	24.1	Very low	26.5	Very low	100 Å²	100	145.8 Å²	145.8	51%	0.513	72%	0.716	S	S	.	*				-178	144.2	-53.2	-100.9	162.9	0	0	0	107.6	F909	F909-I911 HydrophobicContact CD1-CD1 3.51Å; F909-I911 HydrophobicContact CE1-CD1 3.93Å; F909-I911 HydrophobicContact CG-CD1 4.27Å
912	H	26.6	Very low	26.6	Very low	161 Å²	161	141.5 Å²	141.5	75%	0.745	71%	0.707	S	S	*	*			trans	67.2	140.7	178.8	-61.3	-45.8	0	0	0	117.3
913	N	27.8	Very low	26.4	Very low	143 Å²	143	142.5 Å²	142.5	77%	0.765	72%	0.717	S	S	*	*			cis	-155.3	160.8	-13.7	-114.3	4.4	0	0	0	110.5
914	M	26.8	Very low	26.5	Very low	132 Å²	132	141.9 Å²	141.9	65%	0.65	72%	0.715	S	S	*	*			trans	-122.3	178.8	-179.8	-90.9	-68.8	-137.9	0	0	112.3
915	D	25.2	Very low	26.3	Very low	114 Å²	114	142.3 Å²	142.3	61%	0.61	71%	0.712	S	S	*	*			trans	76.6	122.5	154.2	-59.8	-46.9	0	0	0	121.5
916	N	33	Very low	26.2	Very low	144 Å²	144	143 Å²	143	77%	0.77	72%	0.715	S	S	*	*			trans	-175.4	105.7	131.1	-96.1	-65.2	0	0	0	108
917	I	25.6	Very low	26.1	Very low	140 Å²	140	144.3 Å²	144.3	72%	0.718	72%	0.715	S	S	*	*				85.6	129.3	86.8	-78.6	-179.1	0	0	0	115
918	H	25.7	Very low	25.8	Very low	167 Å²	167	141.6 Å²	141.6	77%	0.773	70%	0.702	S	S	*	*			trans	-20.5	146.4	173.9	-51.2	-89	0	0	0	119.6
919	K	26.5	Very low	25.6	Very low	187 Å²	187	139.7 Å²	139.7	81%	0.813	70%	0.704	S	S	*	*				-177.2	129.9	102.1	-101.4	172.8	-175.3	178.6	0	117.2
920	T	23.9	Very low	25.5	Very low	111 Å²	111	139.3 Å²	139.3	68%	0.681	70%	0.702	S	S	*	*			trans	41.1	124.3	135.8	61.7	0	0	0	0	122.6
921	N	25.1	Very low	25.4	Very low	126 Å²	126	138.5 Å²	138.5	67%	0.674	69%	0.694	S	S	*	*				81	133.3	122.8	-77.2	54.1	0	0	0	123
922	D	26.3	Very low	25.3	Very low	114 Å²	114	139 Å²	139	61%	0.61	70%	0.702	S	S	*	*				76.9	119.5	128.5	-63.1	-5.2	0	0	0	121.6
923	N	25.6	Very low	25.1	Very low	141 Å²	141	137.8 Å²	137.8	75%	0.754	70%	0.7	S	S	*	*				74.2	152	128.5	-65.2	-13.1	0	0	0	119.1
924	D	26.6	Very low	25	Very low	108 Å²	108	137.8 Å²	137.8	58%	0.578	70%	0.695	S	S	*	*			cis	-169.5	169.2	-27.5	-175.3	18.5	0	0	0	104.6
925	Q	24.9	Very low	24.8	Very low	153 Å²	153	138 Å²	138	72%	0.715	69%	0.694	S	S	*	*			trans	64.5	160.5	160.8	-76.6	161.3	65.8	0	0	116.3
926	L	24.7	Very low	24.7	Very low	135 Å²	135	138.6 Å²	138.6	71%	0.707	70%	0.696	S	S	*	*			cis	-164	-176.5	-41	-149.7	66.6	0	0	0	105.3
927	K	23.5	Very low	24.2	Very low	157 Å²	157	136.9 Å²	136.9	68%	0.683	69%	0.687	S	S	*	*			trans	70.1	115.3	149.4	-74.3	-178.3	166.3	-175	0	120.5
928	E	23.3	Very low	24.2	Very low	143 Å²	143	135.6 Å²	135.6	67%	0.668	68%	0.682	S	S	*	*				58.5	140.3	115	-58.1	176.6	110.3	0	0	120.1
929	T	22.1	Very low	24.1	Very low	126 Å²	126	133.7 Å²	133.7	77%	0.773	68%	0.678	S	S	*	*			trans	68.6	154.8	165.5	77.7	0	0	0	0	116.1
930	K	22.1	Very low	24	Very low	159 Å²	159	132.9 Å²	132.9	69%	0.691	68%	0.676	S	S	*	*			cis	-156.7	147	-27.7	-112.2	178.4	173.5	-164.9	0	106.6
931	E	24.4	Very low	23.9	Very low	147 Å²	147	134 Å²	134	69%	0.687	67%	0.672	S	S	*	*			trans	39.2	178.9	135.1	-56	177.3	103	0	0	121.5
932	T	22.4	Very low	23.8	Very low	112 Å²	112	137.3 Å²	137.3	69%	0.687	68%	0.676	S	S	*	*			trans	65.5	115.7	152.5	43.6	0	0	0	0	120.8
933	I	22.7	Very low	23.6	Very low	135 Å²	135	136.5 Å²	136.5	69%	0.692	68%	0.679	S	S	*	*				89.1	86.1	124.5	-66	171.3	0	0	0	116.7
934	H	23.7	Very low	23.5	Very low	142 Å²	142	135.5 Å²	135.5	66%	0.657	68%	0.679	S	S	*	*				85	148	112.5	-88.3	-138.1	0	0	0	121
935	H	23.5	Very low	23.5	Very low	138 Å²	138	139.4 Å²	139.4	64%	0.639	70%	0.696	S	S	*	*			trans	81.9	124.8	132.6	-81.5	-16.9	0	0	0	121.1
936	L	23	Very low	23.4	Very low	125 Å²	125	139 Å²	139	65%	0.654	70%	0.698	S	S	*	*				65.2	137	125.2	-53.9	171.7	0	0	0	116.3
937	N	23.7	Very low	23.5	Very low	108 Å²	108	139.6 Å²	139.6	58%	0.578	70%	0.702	S	S	*	*			cis	-165.7	157.6	8.1	-125.9	-10.7	0	0	0	111
938	N	23.7	Very low	23.5	Very low	113 Å²	113	138.7 Å²	138.7	60%	0.604	71%	0.705	S	S	*	*			trans	37.2	126.1	133.4	-61.1	-14.8	0	0	0	120.5
939	N	24.2	Very low	23.5	Very low	128 Å²	128	143 Å²	143	68%	0.684	72%	0.716	S	S	*	*			trans	62.4	105.2	131	-54.9	-17	0	0	0	117.7
940	H	25.6	Very low	23.7	Very low	170 Å²	170	146.4 Å²	146.4	79%	0.787	72%	0.717	S	S	*	*				-179.9	153.9	113.1	-87.5	-11.3	0	0	0	109
941	K	21.4	Very low	23.7	Very low	134 Å²	134	141.1 Å²	141.1	58%	0.583	70%	0.7	S	S	*	*			cis	168.6	130.7	-16.5	-147.5	179.3	178.2	-176.9	0	102.4
942	Y	22.3	Very low	23.8	Very low	196 Å²	196	141.8 Å²	141.8	77%	0.769	71%	0.706	S	S	*	*			trans	66.6	154	173.5	-49.4	-58.8	0	0	0	116
943	S	22.3	Very low	23.9	Very low	97 Å²	97	141.3 Å²	141.3	68%	0.678	71%	0.708	S	S	*	*			cis	-161.4	139.4	-13.9	40.1	0	0	0	0	112.5
944	T	23.8	Very low	24.1	Very low	120 Å²	120	141 Å²	141	74%	0.736	71%	0.708	S	S	*	*			trans	43.6	102.6	146.1	59.9	0	0	0	0	120.2
945	M	25.3	Very low	24.2	Very low	190 Å²	190	138.4 Å²	138.4	94%	0.936	70%	0.698	S	S	*	*			trans	-139.8	129.8	139.8	-100.3	-67.8	177.8	0	0	107.1
946	N	24.3	Very low	24.2	Very low	143 Å²	143	135.7 Å²	135.7	77%	0.765	71%	0.706	S	S	*	*			trans	-86.7	158.1	-161	-74	-2	0	0	0	114.8
947	D	26.4	Very low	24.3	Very low	149 Å²	149	133.6 Å²	133.6	80%	0.797	70%	0.696	S	S	*	*			trans	-67.1	142.3	-167.9	-48.7	-87.9	0	0	0	115.2
948	N	22.5	Very low	24.3	Very low	137 Å²	137	132 Å²	132	73%	0.733	69%	0.693	S	S	*	*			trans	-169.1	49.8	155.2	-105.7	-57.6	0	0	0	113.1
949	Y	25	Very low	24.3	Very low	233 Å²	233	134.2 Å²	134.2	91%	0.914	70%	0.704	S	S	*	*			trans	-123.9	110.3	172.5	-74.9	-81.8	0	0	0	110.8	S951	Y949-S951 PolarHBondContact O-N 2.91Å
950	Y	24.4	Very low	24.3	Very low	198 Å²	198	131.3 Å²	131.3	78%	0.776	69%	0.694	S	S	*	*			trans	-59.7	127.5	-173.6	-73.8	-85.7	0	0	0	112.5
951	S	23.5	Very low	24.3	Very low	48 Å²	48	127.2 Å²	127.2	34%	0.336	68%	0.684	S	S	.	*			trans	-71.5	146.7	175.9	101.3	0	0	0	0	110.9	Y949 S953 D954	Y949-S951 PolarHBondContact O-N 2.91Å; S951-S953 WeakPolarHBondContact CB-OG 3.27Å; S951-S953 PolarHBondContact O-N 3.07Å; S951-S953 PolarHBondContact OG-N 3.33Å; S951-S953 VanDerWaalsContact OG-N 3.16Å; S951-S953 PolarHBondContact OG-OG 2.88Å; S951-D954 WeakPolarHBondContact CB-OD2 3.45Å; S951-D954 PolarHBondContact OG-N 2.97Å; S951-D954 PolarHBondContact OG-OD2 3.49Å
952	I	25.6	Very low	24.3	Very low	161 Å²	161	126.3 Å²	126.3	83%	0.826	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-4.9	173.5	-69.2	173.4	0	0	0	111.2
953	S	25.4	Very low	24.5	Very low	103 Å²	103	120.4 Å²	120.4	72%	0.72	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-17.3	178.9	17	0	0	0	0	115	S951 I955	S951-S953 WeakPolarHBondContact CB-OG 3.27Å; S951-S953 PolarHBondContact O-N 3.07Å; S951-S953 PolarHBondContact OG-N 3.33Å; S951-S953 VanDerWaalsContact OG-N 3.16Å; S951-S953 PolarHBondContact OG-OG 2.88Å; S953-I955 VanDerWaalsContact C-N 3.35Å; S953-I955 PolarHBondContact O-N 3.2Å
954	D	26.2	Very low	24.7	Very low	129 Å²	129	120.5 Å²	120.5	69%	0.69	67%	0.67	S	S	*	*	S	Bend	trans	-88.9	8.7	-172	-61.2	-53.7	0	0	0	114.8	S951	S951-D954 WeakPolarHBondContact CB-OD2 3.45Å; S951-D954 PolarHBondContact OG-N 2.97Å; S951-D954 PolarHBondContact OG-OD2 3.49Å
955	I	27	Very low	24.7	Very low	87 Å²	87	120.1 Å²	120.1	45%	0.446	66%	0.662	S	S	.	*	S	Bend	trans	-122.4	108.2	177.9	-58.5	176.4	0	0	0	109.1	W800 S953 L957	W800-I955 HydrophobicContact CH2-CD1 4.09Å; W800-I955 HydrophobicContact CH2-CG2 4.18Å; W800-I955 HydrophobicContact CZ2-CD1 3.86Å; S953-I955 VanDerWaalsContact C-N 3.35Å; S953-I955 PolarHBondContact O-N 3.2Å; I955-L957 VanDerWaalsContact C-N 3.34Å; I955-L957 PolarHBondContact O-N 3.34Å
956	G	22.5	Very low	24.8	Very low	80 Å²	80	118.9 Å²	118.9	83%	0.825	66%	0.659	S	S	*	*			trans	-71.3	75.7	-175.8	0	0	0	0	0	114.8
957	L	25.4	Very low	24.8	Very low	81 Å²	81	118.6 Å²	118.6	42%	0.424	66%	0.658	S	S	.	*			trans	-135.4	132.1	166.3	-69.2	175.6	0	0	0	109.8	I869 S873 I955	I869-L957 HydrophobicContact CG2-CD2 3.81Å; S873-L957 WeakPolarHBondContact OG-CD2 3.37Å; I955-L957 VanDerWaalsContact C-N 3.34Å; I955-L957 PolarHBondContact O-N 3.34Å
958	S	24.5	Very low	24.8	Very low	76 Å²	76	119.9 Å²	119.9	53%	0.531	65%	0.653	S	S	.	*			trans	-78.6	138.8	-172.7	47.1	0	0	0	0	113.3	S960	S958-S960 PolarHBondContact O-N 3.34Å
959	L	23.2	Very low	25	Very low	158 Å²	158	120.3 Å²	120.3	83%	0.827	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	24.8	-172.1	-88.1	159.6	0	0	0	115.4
960	S	24.7	Very low	24.9	Very low	67 Å²	67	115.9 Å²	115.9	47%	0.469	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.9	-14.4	-174.7	55.6	0	0	0	0	114.9	S958 L962	S958-S960 PolarHBondContact O-N 3.34Å; S960-L962 PolarHBondContact O-N 2.96Å; S960-L962 VanDerWaalsContact O-N 3.11Å
961	C	24	Very low	25	Very low	85 Å²	85	112.3 Å²	112.3	57%	0.574	64%	0.641	S	S	*	*			trans	-89.2	62.1	-167.3	-67.4	0	0	0	0	114.9
962	L	22.3	Very low	25	Very low	115 Å²	115	118.2 Å²	118.2	60%	0.602	67%	0.668	S	S	*	*			trans	-130.5	120.1	171.7	-70.6	173.7	0	0	0	112.8	S960 K1031	S960-L962 PolarHBondContact O-N 2.96Å; S960-L962 VanDerWaalsContact O-N 3.11Å; L962-K1031 PolarHBondContact O-NZ 2.91Å
963	S	25.8	Very low	24.9	Very low	72 Å²	72	115.5 Å²	115.5	50%	0.503	66%	0.663	S	S	.	*	S	Bend	trans	155.7	145.8	162	59	0	0	0	0	109.5	K1031	S963-K1031 WeakPolarHBondContact OG-CD 3.31Å; S963-K1031 WeakPolarHBondContact OG-CE 3.37Å; S963-K1031 PolarHBondContact OG-NZ 2.84Å
964	P	26.3	Very low	24.8	Very low	98 Å²	98	115.3 Å²	115.3	64%	0.636	66%	0.662	S	S	*	*	P	Polyproline II helix		-94.9	152.8	-103.4	1.7	17.6	0	0	0	113.2	L1035	P964-L1035 HydrophobicContact CG-CD1 3.96Å
965	I	25.4	Very low	24.8	Very low	112 Å²	112	120.4 Å²	120.4	57%	0.574	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-83.6	145.1	158.3	-66.5	171.2	0	0	0	107.4	Y877 L881 N967	Y877-I965 HydrophobicContact CE1-CD1 4.23Å; L881-I965 HydrophobicContact CD1-CD1 3.98Å; I965-N967 PolarHBondContact O-N 3.26Å
966	D	27.1	Very low	24.6	Very low	164 Å²	164	121.3 Å²	121.3	88%	0.877	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-53.9	120.9	-177.6	-59.4	-66.7	0	0	0	112.5
967	N	24.8	Very low	24.7	Very low	138 Å²	138	125.6 Å²	125.6	74%	0.738	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-90.2	122.6	178.4	-107	-9.4	0	0	0	109.8	I965	I965-N967 PolarHBondContact O-N 3.26Å
968	Y	24.9	Very low	24.5	Very low	175 Å²	175	126.7 Å²	126.7	69%	0.686	71%	0.705	S	S	*	*			trans	56.1	143.8	146.3	-70.7	-102.1	0	0	0	118.6
969	N	28	Very low	24.5	Very low	146 Å²	146	130.9 Å²	130.9	78%	0.781	72%	0.72	S	S	*	*			cis	-129.2	135	28	-73	-77.8	0	0	0	113.2
970	N	22.4	Very low	24.5	Very low	141 Å²	141	127.8 Å²	127.8	75%	0.754	71%	0.712	S	S	*	*			trans	-104.5	163.4	137.5	-163.4	-1.2	0	0	0	106.6
971	I	25.4	Very low	24.5	Very low	123 Å²	123	129.6 Å²	129.6	63%	0.631	73%	0.725	S	S	*	*			trans	74.7	98.1	-174.8	-46.3	161.4	0	0	0	113.7
972	N	24.1	Very low	25	Very low	172 Å²	172	130.7 Å²	130.7	92%	0.92	73%	0.731	S	S	*	*				-152.3	67.9	125.5	-119.1	-4	0	0	0	112
973	S	23.1	Very low	25	Very low	103 Å²	103	130.6 Å²	130.6	72%	0.72	74%	0.74	S	S	*	*			trans	-133.7	142.7	145.2	61.4	0	0	0	0	105.5
974	S	23.9	Very low	24.9	Very low	99 Å²	99	132.3 Å²	132.3	69%	0.692	75%	0.752	S	S	*	*			cis	-152.2	147.6	13.6	50.3	0	0	0	0	111
975	Y	26.3	Very low	25.3	Very low	236 Å²	236	133.9 Å²	133.9	93%	0.925	76%	0.762	S	S	*	*			trans	-146.4	123.5	146	-99.4	-69.7	0	0	0	110.2
976	S	22.1	Very low	25.2	Very low	107 Å²	107	133.9 Å²	133.9	75%	0.748	77%	0.772	S	S	*	*			trans	-91.7	130.6	170.2	52.3	0	0	0	0	109.8
977	L	24.5	Very low	25.1	Very low	170 Å²	170	130.8 Å²	130.8	89%	0.89	76%	0.763	S	S	*	*			trans	-154.5	127.6	153.8	-111.4	165.6	0	0	0	109.4
978	S	21.3	Very low	25	Very low	103 Å²	103	131.9 Å²	131.9	72%	0.72	77%	0.768	S	S	*	*			trans	-89.4	142.8	178.2	51.9	0	0	0	0	111.2
979	L	23.9	Very low	24.9	Very low	164 Å²	164	127.9 Å²	127.9	86%	0.859	77%	0.766	S	S	*	*			trans	-168.6	131.2	142	-103.3	152.1	0	0	0	113
980	S	23.3	Very low	24.7	Very low	94 Å²	94	128.1 Å²	128.1	66%	0.657	77%	0.766	S	S	*	*			trans	0.1	122.6	161.4	54.8	0	0	0	0	122.5
981	S	25.1	Very low	24.6	Very low	104 Å²	104	129 Å²	129	73%	0.727	77%	0.77	S	S	*	*				-14	168	125.2	56.9	0	0	0	0	120
982	P	34.1	Very low	24.4	Very low	109 Å²	109	127.1 Å²	127.1	71%	0.708	77%	0.768	S	S	*	*			cis	-139	-160.7	-29.3	38.4	-18.8	0	0	0	112.8
983	S	23.8	Very low	24.3	Very low	113 Å²	113	125.9 Å²	125.9	79%	0.79	76%	0.761	S	S	*	*			trans	71.6	152.2	168.6	77.3	0	0	0	0	116.6
984	S	23.4	Very low	24.3	Very low	107 Å²	107	129.1 Å²	129.1	75%	0.748	77%	0.77	S	S	*	*			cis	-154.4	155.6	-14.4	38.8	0	0	0	0	110
985	P	33.6	Very low	24.2	Very low	131 Å²	131	131.7 Å²	131.7	85%	0.851	78%	0.776	S	S	*	*			trans	-96.5	132.5	-167	35.6	-34	0	0	0	115.6
986	S	24.5	Very low	23.9	Very low	113 Å²	113	128.7 Å²	128.7	79%	0.79	78%	0.775	S	S	*	*			trans	-169.9	144.6	162.7	54.8	0	0	0	0	109.9
987	S	24.1	Very low	24	Very low	98 Å²	98	128.2 Å²	128.2	69%	0.685	77%	0.772	S	S	*	*			cis	-171.4	178.3	-10.4	51.1	0	0	0	0	109
988	L	23.6	Very low	23.8	Very low	161 Å²	161	125 Å²	125	84%	0.843	76%	0.763	S	S	*	*			trans	75.6	134.6	170.4	-53.7	163	0	0	0	115.8
989	S	23.1	Very low	23.8	Very low	92 Å²	92	129.7 Å²	129.7	64%	0.643	77%	0.771	S	S	*	*			cis	-163	167.4	-11.3	47.7	0	0	0	0	111
990	L	22.8	Very low	23.9	Very low	151 Å²	151	126.3 Å²	126.3	79%	0.791	76%	0.761	S	S	*	*			trans	73	102.3	178.9	-49.5	173.9	0	0	0	113
991	L	21.3	Very low	23.9	Very low	158 Å²	158	129.9 Å²	129.9	83%	0.827	77%	0.772	S	S	*	*			cis	58.8	131.3	38.1	-55.4	158.5	0	0	0	113
992	S	21.7	Very low	24	Very low	85 Å²	85	131.9 Å²	131.9	59%	0.594	77%	0.774	S	S	*	*			cis	-169.9	172.9	-7.8	50.6	0	0	0	0	112
993	N	21.6	Very low	23.9	Very low	145 Å²	145	131 Å²	131	78%	0.775	77%	0.769	S	S	*	*			trans	93.6	147.9	156.5	-54.1	-24.8	0	0	0	120.5
994	L	21.7	Very low	23.9	Very low	172 Å²	172	133 Å²	133	90%	0.901	76%	0.763	S	S	*	*			trans	82.8	114.2	160.9	-66.1	161.7	0	0	0	119.8
995	N	22.1	Very low	24	Very low	152 Å²	152	133.2 Å²	133.2	81%	0.813	76%	0.762	S	S	*	*			trans	-68	140.3	158.2	-60.4	-29.7	0	0	0	110.3
996	L	21.2	Very low	23.5	Very low	173 Å²	173	137.9 Å²	137.9	91%	0.906	76%	0.764	S	S	*	*				-172.8	176.1	125.8	-123.3	69.7	0	0	0	111.4
997	S	22.8	Very low	23.4	Very low	98 Å²	98	138.7 Å²	138.7	69%	0.685	76%	0.758	S	S	*	*			trans	-82.4	147.2	-170	54.2	0	0	0	0	116
998	S	21.3	Very low	23.3	Very low	101 Å²	101	141.5 Å²	141.5	71%	0.706	76%	0.764	S	S	*	*			trans	77.3	159.1	154.4	78	0	0	0	0	120
999	F	21	Very low	23.4	Very low	203 Å²	203	140 Å²	140	89%	0.89	76%	0.757	S	S	*	*			trans	76.2	167.2	176.4	-77.5	-82.7	0	0	0	119.3
1000	S	25.4	Very low	23.5	Very low	92 Å²	92	142.7 Å²	142.7	64%	0.643	76%	0.757	S	S	*	*			trans	-122.9	154.3	-150.6	57.8	0	0	0	0	113.9
1001	L	23.1	Very low	23.5	Very low	169 Å²	169	141 Å²	141	89%	0.885	76%	0.758	S	S	*	*			trans	-160.9	107.6	156.6	-109.5	152.7	0	0	0	116.3
1002	N	27.1	Very low	23.7	Very low	146 Å²	146	142 Å²	142	78%	0.781	76%	0.756	S	S	*	*				-8.8	175.9	127.7	-95.4	-21	0	0	0	120.3
1003	P	32.4	Very low	23.9	Very low	91 Å²	91	144.9 Å²	144.9	59%	0.591	76%	0.758	S	S	*	*			cis	-146.7	-173.2	-24.9	40.1	-20.7	0	0	0	116
1004	F	24.3	Very low	24.1	Very low	156 Å²	156	144.3 Å²	144.3	68%	0.684	75%	0.754	S	S	*	*			trans	49	128.1	150.1	-82.1	-64.3	0	0	0	121.7	I1007	F1004-I1007 HydrophobicContact CE1-CB 4.35Å; F1004-I1007 HydrophobicContact CE1-CD1 3.65Å; F1004-I1007 HydrophobicContact CE1-CG1 3.83Å; F1004-I1007 HydrophobicContact CZ-CD1 4.07Å
1005	P	24.6	Very low	24.3	Very low	110 Å²	110	142.7 Å²	142.7	71%	0.714	74%	0.742	S	S	*	*				-132.6	-170.4	101.5	37.7	-29.2	0	0	0	114.7
1006	Y	23.3	Very low	24.5	Very low	229 Å²	229	142.3 Å²	142.3	90%	0.898	74%	0.739	S	S	*	*			trans	72	35.5	-179.9	-64.6	-74.6	0	0	0	119.2
1007	I	23.1	Very low	24.7	Very low	130 Å²	130	139.2 Å²	139.2	67%	0.667	72%	0.723	S	S	*	*			trans	-119.4	74.5	147.1	-55.7	-176.2	0	0	0	109.8	F1004	F1004-I1007 HydrophobicContact CE1-CB 4.35Å; F1004-I1007 HydrophobicContact CE1-CD1 3.65Å; F1004-I1007 HydrophobicContact CE1-CG1 3.83Å; F1004-I1007 HydrophobicContact CZ-CD1 4.07Å
1008	I	22.3	Very low	24.8	Very low	158 Å²	158	140 Å²	140	81%	0.81	72%	0.718	S	S	*	*	S	Bend	trans	-137.6	75.9	167.5	-51.1	-179.2	0	0	0	109.6
1009	N	24.4	Very low	25	Very low	130 Å²	130	141.6 Å²	141.6	70%	0.695	72%	0.719	S	S	*	*	S	Bend	trans	-173.3	-26.6	145.9	-119.2	-33.8	0	0	0	115	S1011 K1012	N1009-S1011 PolarHBondContact O-N 3.22Å; N1009-K1012 PolarHBondContact O-N 3.41Å
1010	F	26.4	Very low	25.1	Very low	148 Å²	148	140.5 Å²	140.5	65%	0.649	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-70.2	-3.2	-169.7	-108.9	-86.6	0	0	0	116	K1012 K1013	F1010-K1012 PolarHBondContact O-N 3.26Å; F1010-K1013 HydrophobicContact CD1-CB 4.35Å; F1010-K1013 HydrophobicContact CE1-CB 4.24Å
1011	S	22.9	Very low	25.2	Very low	115 Å²	115	144.8 Å²	144.8	80%	0.804	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-72.4	-4.8	172.2	52.2	0	0	0	0	115.1	N1009	N1009-S1011 PolarHBondContact O-N 3.22Å
1012	K	26	Very low	25.2	Very low	180 Å²	180	144.3 Å²	144.3	78%	0.783	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-115.1	-5	175.5	-81	-171.5	173.7	-177.4	0	116.1	N1009 F1010	N1009-K1012 PolarHBondContact O-N 3.41Å; F1010-K1012 PolarHBondContact O-N 3.26Å
1013	K	25.9	Very low	25.3	Very low	145 Å²	145	144.4 Å²	144.4	63%	0.63	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-23.3	177.5	-113.1	-178.8	178.5	-178.5	0	114.5	F1010 Q1015	F1010-K1013 HydrophobicContact CD1-CB 4.35Å; F1010-K1013 HydrophobicContact CE1-CB 4.24Å; K1013-Q1015 PolarHBondContact O-N 3.23Å
1014	L	24.7	Very low	25.3	Very low	133 Å²	133	148.6 Å²	148.6	70%	0.696	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	0.8	-176.4	-125.3	142.5	0	0	0	114.4
1015	Q	26	Very low	25.6	Very low	138 Å²	138	148.4 Å²	148.4	65%	0.645	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-17.4	177.9	-161.6	61.6	54.5	0	0	113.2	K1013 I1018	K1013-Q1015 PolarHBondContact O-N 3.23Å; Q1015-I1018 WeakPolarHBondContact O-CD1 3.3Å
1016	N	26.6	Very low	25.8	Very low	143 Å²	143	148.6 Å²	148.6	77%	0.765	72%	0.72	S	S	*	*	S	Bend	trans	-117	10	-173.2	-70.7	23.4	0	0	0	113.6
1017	I	25.6	Very low	26.3	Very low	109 Å²	109	144.5 Å²	144.5	56%	0.559	71%	0.709	S	S	*	*			trans	-125.1	65	170	-49.1	179.8	0	0	0	107.2
1018	I	24.5	Very low	26.8	Very low	113 Å²	113	143.8 Å²	143.8	58%	0.579	70%	0.702	S	S	*	*			trans	-103.4	-16.2	177.8	-74.4	177.6	0	0	0	111	Q1015	Q1015-I1018 WeakPolarHBondContact O-CD1 3.3Å
1019	D	24.5	Very low	27.1	Very low	135 Å²	135	140.5 Å²	140.5	72%	0.722	69%	0.686	S	S	*	*	S	Bend	trans	-109.4	148.3	177.8	-64.2	-67.9	0	0	0	112.5
1020	F	24.7	Very low	27.5	Very low	181 Å²	181	137.7 Å²	137.7	79%	0.794	67%	0.671	S	S	*	*	S	Bend	trans	72.2	122.7	178.2	-97.6	-109.3	0	0	0	119.7
1021	Q	27.1	Very low	27.9	Very low	182 Å²	182	134.4 Å²	134.4	85%	0.85	66%	0.656	S	S	*	*			trans	55.4	49.7	157	-66.1	-171.1	-19.9	0	0	119.7	N1023	Q1021-N1023 PolarHBondContact O-N 2.9Å
1022	F	23.8	Very low	28.5	Very low	159 Å²	159	135.3 Å²	135.3	70%	0.697	65%	0.648	S	S	*	*			trans	-84.3	95.4	161.8	-95.7	-98.9	0	0	0	112.6
1023	N	27.2	Very low	28.7	Very low	148 Å²	148	130.7 Å²	130.7	79%	0.791	63%	0.631	S	S	*	*			trans	-169.5	76.4	160	-106.7	-33.1	0	0	0	114.1	Q1021	Q1021-N1023 PolarHBondContact O-N 2.9Å
1024	Q	32.7	Very low	28.9	Very low	179 Å²	179	127.9 Å²	127.9	84%	0.836	62%	0.622	S	S	*	*	S	Bend	trans	-170.1	-43.7	155.1	-112.2	167	38.4	0	0	113.8	Q1026	Q1024-Q1026 VanDerWaalsContact C-N 3.26Å; Q1024-Q1026 PolarHBondContact O-N 3.27Å
1025	Q	31.5	Very low	29.4	Very low	151 Å²	151	126 Å²	126	71%	0.706	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-21.3	-172.2	-69.3	-178.2	-12.4	0	0	114.9	Q1027 Q1028 I1029	Q1025-Q1027 PolarHBondContact O-N 2.77Å; Q1025-Q1028 PolarHBondContact O-N 3.39Å; Q1025-Q1028 VanDerWaalsContact O-N 3.16Å; Q1025-I1029 PolarHBondContact O-N 3.32Å
1026	Q	28.2	Very low	29.6	Very low	114 Å²	114	125.8 Å²	125.8	53%	0.533	61%	0.611	S	S	.	*	H	α-helix	trans	-63.1	-26.6	-174.1	-153.1	172	20	0	0	113.3	Q1024 N1030	Q1024-Q1026 VanDerWaalsContact C-N 3.26Å; Q1024-Q1026 PolarHBondContact O-N 3.27Å; Q1026-N1030 VanDerWaalsContact O-CB 3.3Å; Q1026-N1030 WeakPolarHBondContact O-CB 3.44Å; Q1026-N1030 PolarHBondContact O-N 3.01Å; Q1026-N1030 VanDerWaalsContact O-N 3.12Å; Q1026-N1030 PolarHBondContact O-ND2 3.21Å
1027	Q	33.3	Very low	29.9	Very low	143 Å²	143	122.2 Å²	122.2	67%	0.668	59%	0.592	S	S	*	*	H	α-helix	trans	-73.8	-32.8	176.9	-68.1	-172.3	-2.8	0	0	113.6	Q1025 K1031	Q1025-Q1027 PolarHBondContact O-N 2.77Å; Q1027-K1031 WeakPolarHBondContact O-CB 3.27Å; Q1027-K1031 WeakPolarHBondContact O-CG 3.37Å; Q1027-K1031 PolarHBondContact O-N 3.42Å; Q1027-K1031 VanDerWaalsContact O-N 3.14Å
1028	Q	33.5	Very low	30.2	Very low	115 Å²	115	123.2 Å²	123.2	54%	0.537	60%	0.598	S	S	.	*	H	α-helix	trans	-74.4	-41.9	178.4	-73	-177.7	-15.5	0	0	111.5	Q1025 K1031 Q1032	Q1025-Q1028 PolarHBondContact O-N 3.39Å; Q1025-Q1028 VanDerWaalsContact O-N 3.16Å; Q1028-K1031 WeakPolarHBondContact O-CB 3.19Å; Q1028-K1031 PolarHBondContact O-N 2.76Å; Q1028-Q1032 PolarHBondContact O-N 2.98Å
1029	I	30.3	Very low	30.7	Very low	90 Å²	90	123.3 Å²	123.3	46%	0.462	60%	0.604	S	S	.	*	H	α-helix	trans	-63.9	-45	175.7	-64.3	172.4	0	0	0	110.3	Q1025 K1031 Q1032 I1033	Q1025-I1029 PolarHBondContact O-N 3.32Å; I1029-K1031 VanDerWaalsContact C-N 3.28Å; I1029-K1031 PolarHBondContact O-N 2.82Å; I1029-Q1032 PolarHBondContact O-N 3.26Å; I1029-I1033 HydrophobicContact CG2-CD1 3.81Å; I1029-I1033 HydrophobicContact CG2-CG1 4.48Å; I1029-I1033 WeakPolarHBondContact O-CG1 3.3Å; I1029-I1033 PolarHBondContact O-N 3.18Å
1030	N	32.4	Very low	31	Very low	71 Å²	71	123.3 Å²	123.3	38%	0.38	60%	0.595	S	S	.	*	H	α-helix	trans	-60.4	-35.9	175.5	-75.1	-11.9	0	0	0	112.5	Q1026 L1034	Q1026-N1030 VanDerWaalsContact O-CB 3.3Å; Q1026-N1030 WeakPolarHBondContact O-CB 3.44Å; Q1026-N1030 PolarHBondContact O-N 3.01Å; Q1026-N1030 VanDerWaalsContact O-N 3.12Å; Q1026-N1030 PolarHBondContact O-ND2 3.21Å; N1030-L1034 WeakPolarHBondContact O-CB 3.31Å; N1030-L1034 PolarHBondContact O-N 3.47Å
1031	K	35.4	Very low	31.4	Very low	78 Å²	78	122.1 Å²	122.1	34%	0.339	59%	0.591	S	S	.	*	H	α-helix	trans	-66.8	-40.3	174.2	-82.4	169	159.7	-167.1	0	113.1	L962 S963 Q1027 Q1028 I1029 L1034 L1035	L962-K1031 PolarHBondContact O-NZ 2.91Å; S963-K1031 WeakPolarHBondContact OG-CD 3.31Å; S963-K1031 WeakPolarHBondContact OG-CE 3.37Å; S963-K1031 PolarHBondContact OG-NZ 2.84Å; Q1027-K1031 WeakPolarHBondContact O-CB 3.27Å; Q1027-K1031 WeakPolarHBondContact O-CG 3.37Å; Q1027-K1031 PolarHBondContact O-N 3.42Å; Q1027-K1031 VanDerWaalsContact O-N 3.14Å; Q1028-K1031 WeakPolarHBondContact O-CB 3.19Å; Q1028-K1031 PolarHBondContact O-N 2.76Å; I1029-K1031 VanDerWaalsContact C-N 3.28Å; I1029-K1031 PolarHBondContact O-N 2.82Å; K1031-L1034 PolarHBondContact O-N 3.22Å; K1031-L1035 WeakPolarHBondContact O-CG 3.49Å; K1031-L1035 PolarHBondContact O-N 3.13Å; K1031-L1035 VanDerWaalsContact O-N 3.15Å
1032	Q	34.2	Very low	32	Very low	135 Å²	135	116.8 Å²	116.8	63%	0.631	57%	0.568	S	S	*	*	H	α-helix	trans	-66	-41	174.9	-75.2	-176.4	-26.9	0	0	112	Q1028 I1029 L1035 Q1036	Q1028-Q1032 PolarHBondContact O-N 2.98Å; I1029-Q1032 PolarHBondContact O-N 3.26Å; Q1032-L1035 PolarHBondContact O-N 3.29Å; Q1032-Q1036 PolarHBondContact O-N 2.74Å
1033	I	30.1	Very low	32.6	Very low	82 Å²	82	113.4 Å²	113.4	42%	0.421	56%	0.562	S	S	.	*	H	α-helix	trans	-64.7	-40.5	175.8	-67.4	170.3	0	0	0	110.9	I1029 L1035 Q1036 I1037	I1029-I1033 HydrophobicContact CG2-CD1 3.81Å; I1029-I1033 HydrophobicContact CG2-CG1 4.48Å; I1029-I1033 WeakPolarHBondContact O-CG1 3.3Å; I1029-I1033 PolarHBondContact O-N 3.18Å; I1033-L1035 VanDerWaalsContact C-N 3.32Å; I1033-L1035 PolarHBondContact O-N 2.81Å; I1033-Q1036 PolarHBondContact O-N 2.84Å; I1033-I1037 HydrophobicContact CG2-CD1 3.71Å; I1033-I1037 HydrophobicContact CG2-CG1 4.36Å; I1033-I1037 WeakPolarHBondContact O-CG1 3.37Å; I1033-I1037 PolarHBondContact O-N 2.94Å
1034	L	31.4	Very low	33.3	Very low	87 Å²	87	109.3 Å²	109.3	46%	0.455	54%	0.538	S	S	.	.	H	α-helix	trans	-60.9	-40.1	176.1	-137.6	73.3	0	0	0	112.3	N1030 K1031 Q1036 I1037 N1038 I1070	N1030-L1034 WeakPolarHBondContact O-CB 3.31Å; N1030-L1034 PolarHBondContact O-N 3.47Å; K1031-L1034 PolarHBondContact O-N 3.22Å; L1034-Q1036 VanDerWaalsContact C-N 3.34Å; L1034-Q1036 PolarHBondContact O-N 2.88Å; L1034-I1037 PolarHBondContact O-N 2.87Å; L1034-N1038 PolarHBondContact O-N 3.1Å; L1034-I1070 HydrophobicContact CD1-CD1 4.44Å
1035	L	34.3	Very low	33.7	Very low	92 Å²	92	102.4 Å²	102.4	48%	0.482	51%	0.507	S	S	.	.	H	α-helix	trans	-66.6	-32.4	177.6	-77	163.4	0	0	0	112.9	P964 K1031 Q1032 I1033	P964-L1035 HydrophobicContact CG-CD1 3.96Å; K1031-L1035 WeakPolarHBondContact O-CG 3.49Å; K1031-L1035 PolarHBondContact O-N 3.13Å; K1031-L1035 VanDerWaalsContact O-N 3.15Å; Q1032-L1035 PolarHBondContact O-N 3.29Å; I1033-L1035 VanDerWaalsContact C-N 3.32Å; I1033-L1035 PolarHBondContact O-N 2.81Å
1036	Q	30.9	Very low	34.3	Very low	135 Å²	135	98.3 Å²	98.3	63%	0.631	49%	0.489	S	S	*	.	H	α-helix	trans	-82.1	-24.4	174.6	-70.6	-174.9	-30.1	0	0	113.5	Q1032 I1033 L1034 T1039 Y1040	Q1032-Q1036 PolarHBondContact O-N 2.74Å; I1033-Q1036 PolarHBondContact O-N 2.84Å; L1034-Q1036 VanDerWaalsContact C-N 3.34Å; L1034-Q1036 PolarHBondContact O-N 2.88Å; Q1036-T1039 PolarHBondContact O-OG1 2.98Å; Q1036-Y1040 WeakPolarHBondContact O-CD2 3.14Å; Q1036-Y1040 WeakPolarHBondContact O-CE2 3.34Å
1037	I	32.1	Very low	35	Very low	68 Å²	68	100.1 Å²	100.1	35%	0.349	49%	0.491	S	S	.	.	H	α-helix	trans	-70.2	-36.3	176	-76.2	170.1	0	0	0	111.4	I1033 L1034 T1039 Y1040 L1045	I1033-I1037 HydrophobicContact CG2-CD1 3.71Å; I1033-I1037 HydrophobicContact CG2-CG1 4.36Å; I1033-I1037 WeakPolarHBondContact O-CG1 3.37Å; I1033-I1037 PolarHBondContact O-N 2.94Å; L1034-I1037 PolarHBondContact O-N 2.87Å; I1037-T1039 PolarHBondContact O-N 2.84Å; I1037-Y1040 PolarHBondContact O-N 3.23Å; I1037-L1045 HydrophobicContact CG2-CD1 4.07Å
1038	N	32	Very low	35.4	Very low	130 Å²	130	97.4 Å²	97.4	70%	0.695	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-7	179.7	-73.6	-4.5	0	0	0	114.8	L1034	L1034-N1038 PolarHBondContact O-N 3.1Å
1039	T	34.4	Very low	36	Very low	115 Å²	115	95.1 Å²	95.1	71%	0.706	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	6.2	178.6	44.2	0	0	0	0	114.7	Q1036 I1037	Q1036-T1039 PolarHBondContact O-OG1 2.98Å; I1037-T1039 PolarHBondContact O-N 2.84Å
1040	Y	31.4	Very low	36.4	Very low	135 Å²	135	95.7 Å²	95.7	53%	0.529	47%	0.472	S	S	.	.	S	Bend	trans	-95.8	139.4	-179.7	-77	-85	0	0	0	113.9	Q1036 I1037 L1042	Q1036-Y1040 WeakPolarHBondContact O-CD2 3.14Å; Q1036-Y1040 WeakPolarHBondContact O-CE2 3.34Å; I1037-Y1040 PolarHBondContact O-N 3.23Å; Y1040-L1042 PolarHBondContact O-N 3.12Å
1041	H	34.4	Very low	37.2	Very low	155 Å²	155	94.5 Å²	94.5	72%	0.718	47%	0.469	S	S	*	.			trans	-57.8	127.4	166.3	-124.9	-73.3	0	0	0	109.9	P1043 E1044 L1045	H1041-P1043 VanDerWaalsContact C-N 3.3Å; H1041-P1043 VanDerWaalsContact O-N 3.1Å; H1041-E1044 PolarHBondContact O-N 3Å; H1041-L1045 PolarHBondContact O-N 3.42Å
1042	L	38	Very low	37.5	Very low	71 Å²	71	99.9 Å²	99.9	37%	0.372	49%	0.493	S	S	.	.	H	α-helix	trans	-48.4	-39.3	-176.3	-170.2	66.5	0	0	0	114.6	Y1040 E1044 L1045 I1046 D1077	Y1040-L1042 PolarHBondContact O-N 3.12Å; L1042-E1044 PolarHBondContact O-N 3.2Å; L1042-L1045 PolarHBondContact O-N 2.98Å; L1042-I1046 HydrophobicContact CG-CD1 4.33Å; L1042-I1046 WeakPolarHBondContact O-CG1 3.38Å; L1042-I1046 PolarHBondContact O-N 2.85Å; L1042-D1077 HydrophobicContact CD2-CB 3.94Å
1043	P	37	Very low	37.8	Very low	87 Å²	87	101.6 Å²	101.6	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-63.1	-34.1	176.4	-24.4	36	0	0	0	115.1	H1041 R1047	H1041-P1043 VanDerWaalsContact C-N 3.3Å; H1041-P1043 VanDerWaalsContact O-N 3.1Å; P1043-R1047 PolarHBondContact O-N 3.38Å; P1043-R1047 VanDerWaalsContact O-N 3.09Å
1044	E	41.2	Very low	38.6	Very low	63 Å²	63	99 Å²	99	29%	0.294	49%	0.487	S	S	.	.	H	α-helix	trans	-74.7	-36.9	178	-84.2	-69.4	178.6	0	0	111.6	H1041 L1042 I1046 R1047 I1048	H1041-E1044 PolarHBondContact O-N 3Å; L1042-E1044 PolarHBondContact O-N 3.2Å; E1044-I1046 VanDerWaalsContact C-N 3.28Å; E1044-I1046 PolarHBondContact O-N 3.11Å; E1044-R1047 PolarHBondContact O-N 3.49Å; E1044-R1047 VanDerWaalsContact O-N 3.13Å; E1044-R1047 IonicContact OE1-CZ 3.54Å; E1044-R1047 IonicContact OE1-NE 3.32Å; E1044-R1047 IonicContact OE1-NH1 3.1Å; E1044-R1047 PolarHBondContact OE1-NH1 3.18Å; E1044-R1047 IonicContact OE1-NH2 3.34Å; E1044-R1047 PolarHBondContact OE1-NH2 3.44Å; E1044-R1047 IonicContact OE2-CZ 3.96Å; E1044-R1047 IonicContact OE2-NE 3.97Å; E1044-R1047 PolarHBondContact OE2-NE 3.28Å; E1044-R1047 IonicContact OE2-NH1 3.35Å; E1044-R1047 IonicContact OE2-NH2 2.76Å; E1044-R1047 PolarHBondContact OE2-NH2 3.05Å; E1044-I1048 VanDerWaalsContact O-CG1 3.31Å; E1044-I1048 WeakPolarHBondContact O-CG1 3.19Å; E1044-I1048 PolarHBondContact O-N 2.84Å
1045	L	40.9	Very low	39.2	Very low	34 Å²	34	96.6 Å²	96.6	18%	0.178	47%	0.474	C	S	.	.	H	α-helix	trans	-59.5	-42.8	174	-157	79.7	0	0	0	110.9	I1037 H1041 L1042 I1048 I1049 I1074	I1037-L1045 HydrophobicContact CG2-CD1 4.07Å; H1041-L1045 PolarHBondContact O-N 3.42Å; L1042-L1045 PolarHBondContact O-N 2.98Å; L1045-I1048 PolarHBondContact O-N 2.93Å; L1045-I1049 HydrophobicContact CD2-CD1 4.49Å; L1045-I1049 HydrophobicContact CG-CD1 4.24Å; L1045-I1049 WeakPolarHBondContact O-CD1 3.48Å; L1045-I1049 VanDerWaalsContact O-CG1 3.27Å; L1045-I1049 WeakPolarHBondContact O-CG1 3.17Å; L1045-I1049 PolarHBondContact O-N 2.84Å; L1045-I1074 HydrophobicContact CD2-CD1 4.35Å
1046	I	44.2	Very low	39.7	Very low	64 Å²	64	100.3 Å²	100.3	33%	0.328	48%	0.482	S	S	.	.	H	α-helix	trans	-60.5	-46	173.6	-67.9	166.3	0	0	0	110.9	L1042 E1044 I1048 I1049 Q1050	L1042-I1046 HydrophobicContact CG-CD1 4.33Å; L1042-I1046 WeakPolarHBondContact O-CG1 3.38Å; L1042-I1046 PolarHBondContact O-N 2.85Å; E1044-I1046 VanDerWaalsContact C-N 3.28Å; E1044-I1046 PolarHBondContact O-N 3.11Å; I1046-I1048 VanDerWaalsContact C-N 3.32Å; I1046-I1048 PolarHBondContact O-N 3.05Å; I1046-I1049 PolarHBondContact O-N 2.84Å; I1046-Q1050 HydrophobicContact CG2-CG 4.47Å; I1046-Q1050 VanDerWaalsContact O-CG 3.3Å; I1046-Q1050 WeakPolarHBondContact O-CG 3.36Å; I1046-Q1050 PolarHBondContact O-N 3.29Å
1047	R	44.1	Very low	39.9	Very low	152 Å²	152	96.8 Å²	96.8	57%	0.574	47%	0.472	S	S	*	.	H	α-helix	trans	-64.8	-33.8	179.7	-154.7	-175.1	72.2	-154.5	-8.7	112.8	P1043 E1044	P1043-R1047 PolarHBondContact O-N 3.38Å; P1043-R1047 VanDerWaalsContact O-N 3.09Å; E1044-R1047 PolarHBondContact O-N 3.49Å; E1044-R1047 VanDerWaalsContact O-N 3.13Å; E1044-R1047 IonicContact OE1-CZ 3.54Å; E1044-R1047 IonicContact OE1-NE 3.32Å; E1044-R1047 IonicContact OE1-NH1 3.1Å; E1044-R1047 PolarHBondContact OE1-NH1 3.18Å; E1044-R1047 IonicContact OE1-NH2 3.34Å; E1044-R1047 PolarHBondContact OE1-NH2 3.44Å; E1044-R1047 IonicContact OE2-CZ 3.96Å; E1044-R1047 IonicContact OE2-NE 3.97Å; E1044-R1047 PolarHBondContact OE2-NE 3.28Å; E1044-R1047 IonicContact OE2-NH1 3.35Å; E1044-R1047 IonicContact OE2-NH2 2.76Å; E1044-R1047 PolarHBondContact OE2-NH2 3.05Å
1048	I	41.6	Very low	40.3	Very low	86 Å²	86	97.5 Å²	97.5	44%	0.441	48%	0.476	S	S	.	.	H	α-helix	trans	-70	-42	174.3	-68.5	164.2	0	0	0	111.1	E1044 L1045 I1046 Q1050 S1051 S1054	E1044-I1048 VanDerWaalsContact O-CG1 3.31Å; E1044-I1048 WeakPolarHBondContact O-CG1 3.19Å; E1044-I1048 PolarHBondContact O-N 2.84Å; L1045-I1048 PolarHBondContact O-N 2.93Å; I1046-I1048 VanDerWaalsContact C-N 3.32Å; I1046-I1048 PolarHBondContact O-N 3.05Å; I1048-Q1050 VanDerWaalsContact C-N 3.31Å; I1048-Q1050 PolarHBondContact O-N 3.24Å; I1048-S1051 PolarHBondContact O-N 2.92Å; I1048-S1054 PolarHBondContact O-OG 3.46Å
1049	I	45.5	Very low	40.7	Very low	68 Å²	68	97.2 Å²	97.2	35%	0.349	47%	0.47	S	S	.	.	H	α-helix	trans	-66.7	-31.9	178.5	-70.1	165.5	0	0	0	111.7	L1045 I1046 S1051	L1045-I1049 HydrophobicContact CD2-CD1 4.49Å; L1045-I1049 HydrophobicContact CG-CD1 4.24Å; L1045-I1049 WeakPolarHBondContact O-CD1 3.48Å; L1045-I1049 VanDerWaalsContact O-CG1 3.27Å; L1045-I1049 WeakPolarHBondContact O-CG1 3.17Å; L1045-I1049 PolarHBondContact O-N 2.84Å; I1046-I1049 PolarHBondContact O-N 2.84Å; I1049-S1051 VanDerWaalsContact C-N 3.26Å; I1049-S1051 PolarHBondContact O-N 2.72Å
1050	Q	39.4	Very low	40.8	Very low	101 Å²	101	99.3 Å²	99.3	47%	0.472	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-5.9	178.9	-74.4	173.8	-3.8	0	0	115.3	I1046 I1048	I1046-Q1050 HydrophobicContact CG2-CG 4.47Å; I1046-Q1050 VanDerWaalsContact O-CG 3.3Å; I1046-Q1050 WeakPolarHBondContact O-CG 3.36Å; I1046-Q1050 PolarHBondContact O-N 3.29Å; I1048-Q1050 VanDerWaalsContact C-N 3.31Å; I1048-Q1050 PolarHBondContact O-N 3.24Å
1051	S	49.3	Very low	40.9	Very low	47 Å²	47	97.8 Å²	97.8	33%	0.329	47%	0.47	S	S	.	.	S	Bend	trans	-75.8	140.9	-177.5	103.4	0	0	0	0	113.1	I1048 I1049 K1053 S1054 I1055	I1048-S1051 PolarHBondContact O-N 2.92Å; I1049-S1051 VanDerWaalsContact C-N 3.26Å; I1049-S1051 PolarHBondContact O-N 2.72Å; S1051-K1053 PolarHBondContact O-N 3.18Å; S1051-K1053 VanDerWaalsContact O-N 3.13Å; S1051-K1053 PolarHBondContact OG-N 2.98Å; S1051-S1054 WeakPolarHBondContact CB-OG 3.4Å; S1051-S1054 PolarHBondContact O-N 3.14Å; S1051-S1054 PolarHBondContact O-OG 2.89Å; S1051-S1054 PolarHBondContact OG-N 2.95Å; S1051-S1054 VanDerWaalsContact OG-N 3.1Å; S1051-S1054 PolarHBondContact OG-OG 3.32Å; S1051-I1055 WeakPolarHBondContact O-CG1 3.22Å; S1051-I1055 PolarHBondContact O-N 2.89Å; S1051-I1055 VanDerWaalsContact O-N 3.12Å
1052	K	42.1	Very low	40.8	Very low	190 Å²	190	96.9 Å²	96.9	83%	0.826	47%	0.47	S	S	*	.	H	α-helix	trans	-58.4	-27.4	175.2	-71.1	-175.8	177.6	178.7	0	113.5	W1056	K1052-W1056 WeakPolarHBondContact O-CB 3.4Å; K1052-W1056 PolarHBondContact O-N 2.97Å
1053	K	38.9	Very low	40.5	Very low	172 Å²	172	96.1 Å²	96.1	75%	0.748	47%	0.466	S	S	*	.	H	α-helix	trans	-76	-41.4	178	-79.5	-174.5	174.2	-180	0	112.5	S1051 W1056 C1057	S1051-K1053 PolarHBondContact O-N 3.18Å; S1051-K1053 VanDerWaalsContact O-N 3.13Å; S1051-K1053 PolarHBondContact OG-N 2.98Å; K1053-W1056 PolarHBondContact O-N 3.43Å; K1053-C1057 PolarHBondContact O-N 3.32Å; K1053-C1057 PolarHBondContact O-SG 3.15Å
1054	S	46.9	Very low	40.1	Very low	27 Å²	27	98.8 Å²	98.8	19%	0.189	47%	0.474	C	S	.	.	H	α-helix	trans	-68.2	-40.2	177.1	34.7	0	0	0	0	111.4	I1048 S1051 W1056 C1057 L1058	I1048-S1054 PolarHBondContact O-OG 3.46Å; S1051-S1054 WeakPolarHBondContact CB-OG 3.4Å; S1051-S1054 PolarHBondContact O-N 3.14Å; S1051-S1054 PolarHBondContact O-OG 2.89Å; S1051-S1054 PolarHBondContact OG-N 2.95Å; S1051-S1054 VanDerWaalsContact OG-N 3.1Å; S1051-S1054 PolarHBondContact OG-OG 3.32Å; S1054-W1056 VanDerWaalsContact C-N 3.34Å; S1054-W1056 PolarHBondContact O-N 3.43Å; S1054-C1057 PolarHBondContact O-N 3.4Å; S1054-L1058 WeakPolarHBondContact O-CB 3.37Å; S1054-L1058 VanDerWaalsContact O-CG 3.32Å; S1054-L1058 WeakPolarHBondContact O-CG 3.39Å; S1054-L1058 PolarHBondContact O-N 2.98Å
1055	I	43.8	Very low	39.5	Very low	37 Å²	37	101 Å²	101	19%	0.19	50%	0.497	C	S	.	.	H	α-helix	trans	-58.8	-43.9	172.3	-64.4	168.1	0	0	0	111.4	S1051 L1058 Q1059	S1051-I1055 WeakPolarHBondContact O-CG1 3.22Å; S1051-I1055 PolarHBondContact O-N 2.89Å; S1051-I1055 VanDerWaalsContact O-N 3.12Å; I1055-L1058 PolarHBondContact O-N 3.06Å; I1055-Q1059 WeakPolarHBondContact O-CG 3.23Å; I1055-Q1059 PolarHBondContact O-N 3.07Å
1056	W	45.8	Very low	39.1	Very low	169 Å²	169	102.7 Å²	102.7	64%	0.64	51%	0.51	S	S	*	.	H	α-helix	trans	-64.4	-40	176.8	-173.5	84.9	0	0	0	112.8	K1052 K1053 S1054 Q1059 K1060	K1052-W1056 WeakPolarHBondContact O-CB 3.4Å; K1052-W1056 PolarHBondContact O-N 2.97Å; K1053-W1056 PolarHBondContact O-N 3.43Å; S1054-W1056 VanDerWaalsContact C-N 3.34Å; S1054-W1056 PolarHBondContact O-N 3.43Å; W1056-Q1059 PolarHBondContact O-N 3.48Å; W1056-K1060 PolarHBondContact O-N 3.21Å
1057	C	35.5	Very low	38.5	Very low	61 Å²	61	103.3 Å²	103.3	41%	0.412	51%	0.51	S	S	.	.	H	α-helix	trans	-65.7	-43.3	175.2	-64.2	0	0	0	0	112.1	K1053 S1054 Q1059 K1060 L1061	K1053-C1057 PolarHBondContact O-N 3.32Å; K1053-C1057 PolarHBondContact O-SG 3.15Å; S1054-C1057 PolarHBondContact O-N 3.4Å; C1057-Q1059 VanDerWaalsContact C-N 3.31Å; C1057-Q1059 PolarHBondContact O-N 3.15Å; C1057-K1060 PolarHBondContact O-N 3.42Å; C1057-L1061 WeakPolarHBondContact O-CG 3.28Å; C1057-L1061 PolarHBondContact O-N 3.14Å
1058	L	40.6	Very low	37.8	Very low	83 Å²	83	102.4 Å²	102.4	44%	0.435	51%	0.508	S	S	.	.	H	α-helix	trans	-60.3	-40	176.8	-74.2	165.2	0	0	0	111.9	S1054 I1055 K1060 F1067	S1054-L1058 WeakPolarHBondContact O-CB 3.37Å; S1054-L1058 VanDerWaalsContact O-CG 3.32Å; S1054-L1058 WeakPolarHBondContact O-CG 3.39Å; S1054-L1058 PolarHBondContact O-N 2.98Å; I1055-L1058 PolarHBondContact O-N 3.06Å; L1058-K1060 VanDerWaalsContact C-N 3.25Å; L1058-K1060 PolarHBondContact O-N 3.49Å; L1058-F1067 HydrophobicContact CD2-CE1 4.27Å; L1058-F1067 HydrophobicContact CD2-CZ 3.94Å
1059	Q	39.2	Very low	37.5	Very low	125 Å²	125	105.1 Å²	105.1	58%	0.584	52%	0.523	S	S	*	.	H	α-helix	trans	-66.8	-22.4	175.1	-73.1	172.9	-5.2	0	0	113.7	I1055 W1056 C1057	I1055-Q1059 WeakPolarHBondContact O-CG 3.23Å; I1055-Q1059 PolarHBondContact O-N 3.07Å; W1056-Q1059 PolarHBondContact O-N 3.48Å; C1057-Q1059 VanDerWaalsContact C-N 3.31Å; C1057-Q1059 PolarHBondContact O-N 3.15Å
1060	K	36.8	Very low	37.1	Very low	158 Å²	158	105.2 Å²	105.2	69%	0.687	52%	0.524	S	S	*	.	H	α-helix	trans	-92.3	-19.9	-175.8	-111.6	-70.3	-176.9	177.3	0	114.8	W1056 C1057 L1058	W1056-K1060 PolarHBondContact O-N 3.21Å; C1057-K1060 PolarHBondContact O-N 3.42Å; L1058-K1060 VanDerWaalsContact C-N 3.25Å; L1058-K1060 PolarHBondContact O-N 3.49Å
1061	L	33.8	Very low	36.8	Very low	104 Å²	104	104.4 Å²	104.4	55%	0.545	52%	0.517	S	S	.	.	H	α-helix	trans	-88.6	-19	-167.9	-76.9	166.9	0	0	0	115.4	C1057 I1063	C1057-L1061 WeakPolarHBondContact O-CG 3.28Å; C1057-L1061 PolarHBondContact O-N 3.14Å; L1061-I1063 HydrophobicContact CB-CD1 3.91Å; L1061-I1063 HydrophobicContact CB-CG1 4.12Å; L1061-I1063 HydrophobicContact CD1-CD1 4.32Å; L1061-I1063 PolarHBondContact O-N 3.41Å
1062	N	32.1	Very low	36	Very low	135 Å²	135	107.9 Å²	107.9	72%	0.722	53%	0.526	S	S	*	.			trans	51.3	30.1	176.9	-157.3	36.3	0	0	0	115.3	I1064	N1062-I1064 PolarHBondContact O-N 3.32Å
1063	I	31.2	Very low	35.6	Very low	56 Å²	56	102.3 Å²	102.3	29%	0.287	51%	0.509	S	S	.	.			trans	-77.9	112.3	-179.3	-70.9	167.6	0	0	0	108.8	L1061 P1066 F1067	L1061-I1063 HydrophobicContact CB-CD1 3.91Å; L1061-I1063 HydrophobicContact CB-CG1 4.12Å; L1061-I1063 HydrophobicContact CD1-CD1 4.32Å; L1061-I1063 PolarHBondContact O-N 3.41Å; I1063-P1066 HydrophobicContact CG2-CG 3.43Å; I1063-P1066 VanDerWaalsContact CG2-CG 3.43Å; I1063-F1067 HydrophobicContact CB-CE2 3.9Å; I1063-F1067 HydrophobicContact CG2-CD2 4.07Å; I1063-F1067 HydrophobicContact CG2-CE2 3.77Å; I1063-F1067 WeakPolarHBondContact O-CD2 3.22Å; I1063-F1067 WeakPolarHBondContact O-CE2 3.07Å
1064	I	29.7	Very low	35.4	Very low	143 Å²	143	95.8 Å²	95.8	73%	0.733	48%	0.482	S	S	*	.			trans	-104.8	-22.5	-172.2	-70.4	170.6	0	0	0	113.6	N1062	N1062-I1064 PolarHBondContact O-N 3.32Å
1065	S	28.7	Very low	34.9	Very low	109 Å²	109	97.8 Å²	97.8	76%	0.762	49%	0.49	S	S	*	.	S	Bend	trans	-96	-36.4	-166.1	-172.6	0	0	0	0	118
1066	P	31.9	Very low	34.3	Very low	70 Å²	70	104.3 Å²	104.3	46%	0.455	51%	0.514	S	S	.	.	S	Bend	trans	-95.1	-2.7	-172.2	36	-36.2	0	0	0	116.2	I1063 Y1068	I1063-P1066 HydrophobicContact CG2-CG 3.43Å; I1063-P1066 VanDerWaalsContact CG2-CG 3.43Å; P1066-Y1068 VanDerWaalsContact C-N 3.33Å; P1066-Y1068 PolarHBondContact O-N 3.29Å
1067	F	31.6	Very low	33.7	Very low	76 Å²	76	101.6 Å²	101.6	33%	0.333	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-21.8	-170.9	-86.8	-70.2	0	0	0	115.5	L1058 I1063 N1069 I1070 Y1071	L1058-F1067 HydrophobicContact CD2-CE1 4.27Å; L1058-F1067 HydrophobicContact CD2-CZ 3.94Å; I1063-F1067 HydrophobicContact CB-CE2 3.9Å; I1063-F1067 HydrophobicContact CG2-CD2 4.07Å; I1063-F1067 HydrophobicContact CG2-CE2 3.77Å; I1063-F1067 WeakPolarHBondContact O-CD2 3.22Å; I1063-F1067 WeakPolarHBondContact O-CE2 3.07Å; F1067-N1069 VanDerWaalsContact C-N 3.3Å; F1067-N1069 PolarHBondContact O-N 2.63Å; F1067-I1070 PolarHBondContact O-N 2.83Å; F1067-I1070 VanDerWaalsContact O-N 3.17Å; F1067-Y1071 PolarHBondContact O-N 3.17Å
1068	Y	30.4	Very low	33.6	Very low	133 Å²	133	101.2 Å²	101.2	52%	0.522	51%	0.505	S	S	.	.	H	α-helix	trans	-54.3	-43.2	-179.2	-96.3	-88	0	0	0	113	P1066 I1070 Y1071 F1072 I1100 D1104	P1066-Y1068 VanDerWaalsContact C-N 3.33Å; P1066-Y1068 PolarHBondContact O-N 3.29Å; Y1068-I1070 VanDerWaalsContact C-N 3.27Å; Y1068-I1070 PolarHBondContact O-N 3.14Å; Y1068-Y1071 PolarHBondContact O-N 3.45Å; Y1068-F1072 PolarHBondContact O-N 3.48Å; Y1068-I1100 WeakPolarHBondContact OH-CG2 3.33Å; Y1068-D1104 PolarHBondContact OH-OD2 2.92Å
1069	N	35.2	Very low	33.2	Very low	143 Å²	143	105 Å²	105	77%	0.765	52%	0.52	S	S	*	.	H	α-helix	trans	-74.5	-14.8	-175.4	-67	-6.8	0	0	0	113.8	F1067	F1067-N1069 VanDerWaalsContact C-N 3.3Å; F1067-N1069 PolarHBondContact O-N 2.63Å
1070	I	36.5	Very low	32.8	Very low	71 Å²	71	107 Å²	107	36%	0.364	53%	0.528	S	S	.	.	H	α-helix	trans	-91.3	-37.5	178.3	-61.6	173	0	0	0	110.3	L1034 F1067 Y1068 I1074	L1034-I1070 HydrophobicContact CD1-CD1 4.44Å; F1067-I1070 PolarHBondContact O-N 2.83Å; F1067-I1070 VanDerWaalsContact O-N 3.17Å; Y1068-I1070 VanDerWaalsContact C-N 3.27Å; Y1068-I1070 PolarHBondContact O-N 3.14Å; I1070-I1074 HydrophobicContact CG2-CD1 3.89Å; I1070-I1074 WeakPolarHBondContact O-CD1 3.42Å; I1070-I1074 WeakPolarHBondContact O-CG1 3.49Å
1071	Y	32.7	Very low	32.6	Very low	83 Å²	83	103.2 Å²	103.2	33%	0.325	52%	0.518	S	S	.	.	H	α-helix	trans	-74.6	-33.8	-176.2	-105.1	-77.1	0	0	0	114.1	F1067 Y1068 I1074 I1075	F1067-Y1071 PolarHBondContact O-N 3.17Å; Y1068-Y1071 PolarHBondContact O-N 3.45Å; Y1071-I1074 PolarHBondContact O-N 2.79Å; Y1071-I1075 HydrophobicContact CD1-CD1 3.77Å; Y1071-I1075 HydrophobicContact CD1-CG1 4.04Å; Y1071-I1075 WeakPolarHBondContact O-CB 3.48Å; Y1071-I1075 WeakPolarHBondContact O-CG1 3.38Å; Y1071-I1075 PolarHBondContact O-N 2.91Å
1072	F	33.8	Very low	32.6	Very low	121 Å²	121	103.6 Å²	103.6	53%	0.531	53%	0.525	S	S	.	.	H	α-helix	trans	-63.2	-45.9	-172.4	-128.1	-91.1	0	0	0	114.3	Y1068 Y1076	Y1068-F1072 PolarHBondContact O-N 3.48Å; F1072-Y1076 PolarHBondContact O-N 3.24Å
1073	P	32.4	Very low	32.8	Very low	72 Å²	72	103 Å²	103	47%	0.468	52%	0.517	S	S	.	.	H	α-helix	trans	-67.6	-42.1	173.7	-19.7	33.4	0	0	0	112.3	I1075 Y1076 D1077	P1073-I1075 VanDerWaalsContact C-N 3.3Å; P1073-I1075 PolarHBondContact O-N 2.67Å; P1073-Y1076 WeakPolarHBondContact O-CB 3.07Å; P1073-Y1076 PolarHBondContact O-N 3.39Å; P1073-D1077 PolarHBondContact O-N 3.44Å
1074	I	35	Very low	33.3	Very low	36 Å²	36	102.6 Å²	102.6	19%	0.185	52%	0.515	C	S	.	.	H	α-helix	trans	-64.4	-33.5	-177.5	-64.9	177.9	0	0	0	111.8	L1045 I1070 Y1071 Y1076 I1078	L1045-I1074 HydrophobicContact CD2-CD1 4.35Å; I1070-I1074 HydrophobicContact CG2-CD1 3.89Å; I1070-I1074 WeakPolarHBondContact O-CD1 3.42Å; I1070-I1074 WeakPolarHBondContact O-CG1 3.49Å; Y1071-I1074 PolarHBondContact O-N 2.79Å; I1074-Y1076 VanDerWaalsContact C-N 3.35Å; I1074-I1078 HydrophobicContact CG2-CD1 3.74Å; I1074-I1078 VanDerWaalsContact O-CD1 3.3Å; I1074-I1078 WeakPolarHBondContact O-CD1 3.48Å; I1074-I1078 WeakPolarHBondContact O-CG1 3.15Å; I1074-I1078 PolarHBondContact O-N 3.26Å
1075	I	35.9	Very low	34	Very low	68 Å²	68	101.2 Å²	101.2	35%	0.349	51%	0.509	S	S	.	.	H	α-helix	trans	-71	-30.2	172.8	-73.6	170.4	0	0	0	112	Y1071 P1073	Y1071-I1075 HydrophobicContact CD1-CD1 3.77Å; Y1071-I1075 HydrophobicContact CD1-CG1 4.04Å; Y1071-I1075 WeakPolarHBondContact O-CB 3.48Å; Y1071-I1075 WeakPolarHBondContact O-CG1 3.38Å; Y1071-I1075 PolarHBondContact O-N 2.91Å; P1073-I1075 VanDerWaalsContact C-N 3.3Å; P1073-I1075 PolarHBondContact O-N 2.67Å
1076	Y	32.1	Very low	34.8	Very low	175 Å²	175	99.3 Å²	99.3	69%	0.686	49%	0.493	S	S	*	.	H	α-helix	trans	-72.4	-39.7	-178.2	-117.9	-96.5	0	0	0	112.9	F1072 P1073 I1074	F1072-Y1076 PolarHBondContact O-N 3.24Å; P1073-Y1076 WeakPolarHBondContact O-CB 3.07Å; P1073-Y1076 PolarHBondContact O-N 3.39Å; I1074-Y1076 VanDerWaalsContact C-N 3.35Å
1077	D	33.5	Very low	35.4	Very low	112 Å²	112	98.8 Å²	98.8	60%	0.599	49%	0.486	S	S	*	.	H	α-helix	trans	-88.1	-14.7	-177	-67.7	-28.5	0	0	0	114.2	L1042 P1073 Q1079	L1042-D1077 HydrophobicContact CD2-CB 3.94Å; P1073-D1077 PolarHBondContact O-N 3.44Å; D1077-Q1079 PolarHBondContact O-N 3.35Å; D1077-Q1079 VanDerWaalsContact O-N 3.12Å
1078	I	33	Very low	36.1	Very low	52 Å²	52	99.1 Å²	99.1	27%	0.267	49%	0.49	S	S	.	.	S	Bend	trans	-76.5	103.7	176.1	-70.6	170.4	0	0	0	110	I1074 F1080 L1084	I1074-I1078 HydrophobicContact CG2-CD1 3.74Å; I1074-I1078 VanDerWaalsContact O-CD1 3.3Å; I1074-I1078 WeakPolarHBondContact O-CD1 3.48Å; I1074-I1078 WeakPolarHBondContact O-CG1 3.15Å; I1074-I1078 PolarHBondContact O-N 3.26Å; I1078-F1080 PolarHBondContact O-N 2.89Å; I1078-L1084 HydrophobicContact CG2-CD1 4.49Å
1079	Q	32	Very low	36.8	Very low	162 Å²	162	98.7 Å²	98.7	76%	0.757	50%	0.497	S	S	*	.			trans	-50.9	129.8	167.6	-70.2	-173.5	-8.6	0	0	110.9	D1077 T1081	D1077-Q1079 PolarHBondContact O-N 3.35Å; D1077-Q1079 VanDerWaalsContact O-N 3.12Å; Q1079-T1081 VanDerWaalsContact C-N 3.3Å; Q1079-T1081 HydrophobicContact CB-CG2 4.45Å; Q1079-T1081 PolarHBondContact O-N 3.1Å; Q1079-T1081 PolarHBondContact O-OG1 3.49Å
1080	F	31.2	Very low	37.1	Very low	169 Å²	169	97.9 Å²	97.9	74%	0.741	49%	0.488	S	S	*	.	S	Bend	trans	-63.5	79.9	-170.8	-125.2	-88.8	0	0	0	112.8	I1078	I1078-F1080 PolarHBondContact O-N 2.89Å
1081	T	32.3	Very low	37.1	Very low	78 Å²	78	96 Å²	96	48%	0.479	48%	0.479	S	S	.	.			trans	-126.6	167.5	-173	56.1	0	0	0	0	110.9	Q1079 H1083 L1084	Q1079-T1081 VanDerWaalsContact C-N 3.3Å; Q1079-T1081 HydrophobicContact CB-CG2 4.45Å; Q1079-T1081 PolarHBondContact O-N 3.1Å; Q1079-T1081 PolarHBondContact O-OG1 3.49Å; T1081-H1083 PolarHBondContact O-N 2.88Å; T1081-L1084 PolarHBondContact O-N 3.07Å
1082	T	34.3	Very low	37.3	Very low	112 Å²	112	101.7 Å²	101.7	69%	0.687	51%	0.506	S	S	*	.	H	α-helix	trans	-55.5	-23.4	-172.1	48.2	0	0	0	0	114.8	L1084 L1085 T1086	T1082-L1084 VanDerWaalsContact C-N 3.34Å; T1082-L1084 PolarHBondContact O-N 2.9Å; T1082-L1085 PolarHBondContact O-N 3.26Å; T1082-T1086 PolarHBondContact O-N 3.27Å; T1082-T1086 PolarHBondContact O-OG1 2.86Å
1083	H	36.3	Very low	37.6	Very low	121 Å²	121	100.1 Å²	100.1	56%	0.56	50%	0.498	S	S	*	.	H	α-helix	trans	-60.4	-36	-178.9	-82.5	53.6	0	0	0	114.2	T1081 L1085 T1086 L1087	T1081-H1083 PolarHBondContact O-N 2.88Å; H1083-L1085 VanDerWaalsContact C-N 3.3Å; H1083-L1085 PolarHBondContact O-N 3.37Å; H1083-T1086 WeakPolarHBondContact CA-OG1 3.43Å; H1083-T1086 PolarHBondContact O-N 2.94Å; H1083-T1086 PolarHBondContact O-OG1 2.92Å; H1083-L1087 WeakPolarHBondContact O-CB 3.49Å; H1083-L1087 PolarHBondContact O-N 3.5Å
1084	L	40.9	Very low	37.7	Very low	48 Å²	48	101.4 Å²	101.4	25%	0.251	50%	0.502	S	S	.	.	H	α-helix	trans	-64.1	-39.7	178.8	-166.1	75.9	0	0	0	110.8	I1078 T1081 T1082 L1087 I1088	I1078-L1084 HydrophobicContact CG2-CD1 4.49Å; T1081-L1084 PolarHBondContact O-N 3.07Å; T1082-L1084 VanDerWaalsContact C-N 3.34Å; T1082-L1084 PolarHBondContact O-N 2.9Å; L1084-L1087 PolarHBondContact O-N 3.39Å; L1084-I1088 HydrophobicContact CD2-CD1 4.48Å; L1084-I1088 HydrophobicContact CG-CD1 4.11Å; L1084-I1088 VanDerWaalsContact O-CG1 3.28Å; L1084-I1088 WeakPolarHBondContact O-CG1 3.44Å; L1084-I1088 PolarHBondContact O-N 3.27Å
1085	L	45.3	Very low	37.8	Very low	115 Å²	115	108.1 Å²	108.1	60%	0.602	53%	0.529	S	S	*	.	H	α-helix	trans	-70.2	-33.4	178.2	-161.2	69.9	0	0	0	111.8	T1082 H1083 N1089	T1082-L1085 PolarHBondContact O-N 3.26Å; H1083-L1085 VanDerWaalsContact C-N 3.3Å; H1083-L1085 PolarHBondContact O-N 3.37Å; L1085-N1089 WeakPolarHBondContact O-CB 3.38Å; L1085-N1089 PolarHBondContact O-N 3.44Å; L1085-N1089 VanDerWaalsContact O-N 3.1Å; L1085-N1089 PolarHBondContact O-ND2 2.87Å
1086	T	45.6	Very low	37.9	Very low	69 Å²	69	109.9 Å²	109.9	42%	0.423	54%	0.54	S	S	.	.	H	α-helix	trans	-68.6	-39	170.7	-8.7	0	0	0	0	112	T1082 H1083 N1089 Q1090	T1082-T1086 PolarHBondContact O-N 3.27Å; T1082-T1086 PolarHBondContact O-OG1 2.86Å; H1083-T1086 WeakPolarHBondContact CA-OG1 3.43Å; H1083-T1086 PolarHBondContact O-N 2.94Å; H1083-T1086 PolarHBondContact O-OG1 2.92Å; T1086-N1089 PolarHBondContact O-N 3.43Å; T1086-Q1090 WeakPolarHBondContact O-CG 3.31Å; T1086-Q1090 PolarHBondContact O-N 3.22Å
1087	L	43.1	Very low	38.1	Very low	59 Å²	59	105 Å²	105	31%	0.309	53%	0.525	S	S	.	.	H	α-helix	trans	-63.3	-46.6	178	-151	82.3	0	0	0	111	H1083 L1084 N1089 Q1090 L1091	H1083-L1087 WeakPolarHBondContact O-CB 3.49Å; H1083-L1087 PolarHBondContact O-N 3.5Å; L1084-L1087 PolarHBondContact O-N 3.39Å; L1087-N1089 VanDerWaalsContact C-N 3.32Å; L1087-N1089 PolarHBondContact O-N 3.37Å; L1087-Q1090 PolarHBondContact O-N 3.29Å; L1087-L1091 HydrophobicContact CD2-CD1 4.32Å; L1087-L1091 HydrophobicContact CG-CD1 4.06Å; L1087-L1091 WeakPolarHBondContact O-CB 3.36Å; L1087-L1091 WeakPolarHBondContact O-CG 3.5Å; L1087-L1091 PolarHBondContact O-N 2.92Å
1088	I	47.2	Very low	38.4	Very low	82 Å²	82	102.7 Å²	102.7	42%	0.421	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-36.9	176	-69	165.2	0	0	0	111.6	L1084	L1084-I1088 HydrophobicContact CD2-CD1 4.48Å; L1084-I1088 HydrophobicContact CG-CD1 4.11Å; L1084-I1088 VanDerWaalsContact O-CG1 3.28Å; L1084-I1088 WeakPolarHBondContact O-CG1 3.44Å; L1084-I1088 PolarHBondContact O-N 3.27Å
1089	N	44.9	Very low	38.5	Very low	124 Å²	124	107.1 Å²	107.1	66%	0.663	53%	0.529	S	S	*	.	H	α-helix	trans	-77.4	-24.1	177.5	-78.6	-52.3	0	0	0	114.2	L1085 T1086 L1087	L1085-N1089 WeakPolarHBondContact O-CB 3.38Å; L1085-N1089 PolarHBondContact O-N 3.44Å; L1085-N1089 VanDerWaalsContact O-N 3.1Å; L1085-N1089 PolarHBondContact O-ND2 2.87Å; T1086-N1089 PolarHBondContact O-N 3.43Å; L1087-N1089 VanDerWaalsContact C-N 3.32Å; L1087-N1089 PolarHBondContact O-N 3.37Å
1090	Q	42	Very low	38.6	Very low	126 Å²	126	103.2 Å²	103.2	59%	0.589	51%	0.513	S	S	*	.	H	α-helix	trans	-84.7	-33.2	175.3	-73.1	-174.6	11.1	0	0	112.7	T1086 L1087 K1092	T1086-Q1090 WeakPolarHBondContact O-CG 3.31Å; T1086-Q1090 PolarHBondContact O-N 3.22Å; L1087-Q1090 PolarHBondContact O-N 3.29Å; Q1090-K1092 PolarHBondContact O-N 3.18Å
1091	L	35.5	Very low	38.8	Very low	33 Å²	33	98.5 Å²	98.5	17%	0.173	49%	0.494	C	S	.	.	S	Bend	trans	-84	98.1	176.3	-63.1	171.8	0	0	0	109.7	L1087 F1093	L1087-L1091 HydrophobicContact CD2-CD1 4.32Å; L1087-L1091 HydrophobicContact CG-CD1 4.06Å; L1087-L1091 WeakPolarHBondContact O-CB 3.36Å; L1087-L1091 WeakPolarHBondContact O-CG 3.5Å; L1087-L1091 PolarHBondContact O-N 2.92Å; L1091-F1093 HydrophobicContact CB-CD2 3.71Å; L1091-F1093 HydrophobicContact CB-CE2 3.53Å; L1091-F1093 HydrophobicContact CB-CZ 4.32Å; L1091-F1093 HydrophobicContact CD1-CE2 3.78Å; L1091-F1093 HydrophobicContact CD1-CZ 4.37Å; L1091-F1093 HydrophobicContact CG-CE2 4.21Å; L1091-F1093 PolarHBondContact O-N 3Å
1092	K	37.7	Very low	38.9	Very low	202 Å²	202	100.3 Å²	100.3	88%	0.878	50%	0.5	S	S	*	.			trans	-65.9	61.6	178.7	-66	-173.6	177.4	-176.8	0	113.5	Q1090	Q1090-K1092 PolarHBondContact O-N 3.18Å
1093	F	39.3	Very low	38.8	Very low	87 Å²	87	99.4 Å²	99.4	38%	0.382	50%	0.498	S	S	.	.			trans	-72.5	149.9	176.3	-73.5	-61.5	0	0	0	112	L1091 I1097 I1098	L1091-F1093 HydrophobicContact CB-CD2 3.71Å; L1091-F1093 HydrophobicContact CB-CE2 3.53Å; L1091-F1093 HydrophobicContact CB-CZ 4.32Å; L1091-F1093 HydrophobicContact CD1-CE2 3.78Å; L1091-F1093 HydrophobicContact CD1-CZ 4.37Å; L1091-F1093 HydrophobicContact CG-CE2 4.21Å; L1091-F1093 PolarHBondContact O-N 3Å; F1093-I1097 HydrophobicContact CB-CB 4.3Å; F1093-I1097 HydrophobicContact CB-CG2 4.19Å; F1093-I1097 HydrophobicContact CD1-CD1 4.16Å; F1093-I1097 HydrophobicContact CD1-CG2 4.04Å; F1093-I1097 HydrophobicContact CG-CG2 4.16Å; F1093-I1098 HydrophobicContact CB-CD1 4.45Å; F1093-I1098 HydrophobicContact CB-CG1 4.08Å
1094	N	33.8	Very low	38.6	Very low	100 Å²	100	98 Å²	98	54%	0.535	49%	0.494	S	S	.	.			trans	-63.1	143.7	175.2	-173.4	-21.4	0	0	0	110.3	N1096 I1097 I1098	N1094-N1096 PolarHBondContact O-N 3.29Å; N1094-N1096 PolarHBondContact OD1-N 2.76Å; N1094-I1097 HydrophobicContact CB-CD1 4.06Å; N1094-I1097 HydrophobicContact CB-CG1 4.24Å; N1094-I1097 WeakPolarHBondContact O-CA 3.4Å; N1094-I1097 WeakPolarHBondContact O-CB 3.39Å; N1094-I1097 PolarHBondContact O-N 3.28Å; N1094-I1098 PolarHBondContact O-N 2.81Å; N1094-I1098 VanDerWaalsContact O-N 3.09Å
1095	K	37.1	Very low	38.3	Very low	176 Å²	176	98.7 Å²	98.7	77%	0.765	50%	0.498	S	S	*	.	H	α-helix	trans	-48.7	-34.4	176.6	-88.9	-171.1	173.3	-176.1	0	113	I1098 K1099	K1095-I1098 PolarHBondContact O-N 3.31Å; K1095-K1099 PolarHBondContact O-N 2.81Å
1096	N	38.6	Very low	37.6	Very low	106 Å²	106	97.2 Å²	97.2	57%	0.567	50%	0.495	S	S	*	.	H	α-helix	trans	-70	-36.4	177.8	-68.2	-4.6	0	0	0	112.9	N1094 K1099 I1100	N1094-N1096 PolarHBondContact O-N 3.29Å; N1094-N1096 PolarHBondContact OD1-N 2.76Å; N1096-K1099 WeakPolarHBondContact O-CB 3.43Å; N1096-K1099 PolarHBondContact O-N 3.23Å; N1096-I1100 WeakPolarHBondContact O-CD1 3.26Å; N1096-I1100 VanDerWaalsContact O-CG1 3.3Å; N1096-I1100 WeakPolarHBondContact O-CG1 3.29Å; N1096-I1100 PolarHBondContact O-N 2.99Å
1097	I	36.9	Very low	36.8	Very low	72 Å²	72	100 Å²	100	37%	0.369	50%	0.503	S	S	.	.	H	α-helix	trans	-68.6	-41.6	175.3	-61.9	170.9	0	0	0	109.8	F1093 N1094 K1099 I1100 I1101	F1093-I1097 HydrophobicContact CB-CB 4.3Å; F1093-I1097 HydrophobicContact CB-CG2 4.19Å; F1093-I1097 HydrophobicContact CD1-CD1 4.16Å; F1093-I1097 HydrophobicContact CD1-CG2 4.04Å; F1093-I1097 HydrophobicContact CG-CG2 4.16Å; N1094-I1097 HydrophobicContact CB-CD1 4.06Å; N1094-I1097 HydrophobicContact CB-CG1 4.24Å; N1094-I1097 WeakPolarHBondContact O-CA 3.4Å; N1094-I1097 WeakPolarHBondContact O-CB 3.39Å; N1094-I1097 PolarHBondContact O-N 3.28Å; I1097-K1099 VanDerWaalsContact C-N 3.31Å; I1097-K1099 PolarHBondContact O-N 3.04Å; I1097-I1100 PolarHBondContact O-N 3.11Å; I1097-I1101 HydrophobicContact CG2-CD1 3.84Å; I1097-I1101 WeakPolarHBondContact O-CG1 3.43Å; I1097-I1101 PolarHBondContact O-N 2.86Å
1098	I	39.7	Very low	36.1	Very low	64 Å²	64	100.7 Å²	100.7	33%	0.328	51%	0.506	S	S	.	.	H	α-helix	trans	-62.2	-39.6	174.4	-63	171.7	0	0	0	110.8	F1093 N1094 K1095 L1102	F1093-I1098 HydrophobicContact CB-CD1 4.45Å; F1093-I1098 HydrophobicContact CB-CG1 4.08Å; N1094-I1098 PolarHBondContact O-N 2.81Å; N1094-I1098 VanDerWaalsContact O-N 3.09Å; K1095-I1098 PolarHBondContact O-N 3.31Å; I1098-L1102 HydrophobicContact CG2-CD1 3.91Å; I1098-L1102 WeakPolarHBondContact O-CB 3.23Å; I1098-L1102 VanDerWaalsContact O-CG 3.29Å; I1098-L1102 WeakPolarHBondContact O-CG 3.37Å; I1098-L1102 PolarHBondContact O-N 2.83Å; I1098-L1102 VanDerWaalsContact O-N 3.09Å
1099	K	35.4	Very low	35.4	Very low	144 Å²	144	101.1 Å²	101.1	63%	0.626	51%	0.507	S	S	*	.	H	α-helix	trans	-60.3	-47.8	171.4	-101.7	-169.6	171.7	-170.6	0	112.5	K1095 N1096 I1097 I1101 L1102 C1103	K1095-K1099 PolarHBondContact O-N 2.81Å; N1096-K1099 WeakPolarHBondContact O-CB 3.43Å; N1096-K1099 PolarHBondContact O-N 3.23Å; I1097-K1099 VanDerWaalsContact C-N 3.31Å; I1097-K1099 PolarHBondContact O-N 3.04Å; K1099-I1101 PolarHBondContact O-N 2.79Å; K1099-L1102 CarbonylContact O-C 3.33Å; K1099-L1102 PolarHBondContact O-N 3.27Å; K1099-L1102 VanDerWaalsContact O-N 3.12Å; K1099-C1103 WeakPolarHBondContact O-CB 3.46Å; K1099-C1103 PolarHBondContact O-N 2.83Å; K1099-C1103 PolarHBondContact O-SG 3.15Å
1100	I	34.5	Very low	34.7	Very low	81 Å²	81	98.7 Å²	98.7	42%	0.415	49%	0.493	S	S	.	.	H	α-helix	trans	-59.6	-47.9	179.8	-69.5	160.8	0	0	0	110.7	Y1068 N1096 I1097 L1102 C1103 D1104	Y1068-I1100 WeakPolarHBondContact OH-CG2 3.33Å; N1096-I1100 WeakPolarHBondContact O-CD1 3.26Å; N1096-I1100 VanDerWaalsContact O-CG1 3.3Å; N1096-I1100 WeakPolarHBondContact O-CG1 3.29Å; N1096-I1100 PolarHBondContact O-N 2.99Å; I1097-I1100 PolarHBondContact O-N 3.11Å; I1100-L1102 PolarHBondContact O-N 3.04Å; I1100-C1103 PolarHBondContact O-N 2.83Å; I1100-D1104 PolarHBondContact O-N 3.1Å
1101	I	34.7	Very low	34.1	Very low	69 Å²	69	98.2 Å²	98.2	35%	0.354	49%	0.489	S	S	.	.	H	α-helix	trans	-61.2	-28.2	177	-66.4	167.8	0	0	0	112.4	I1097 K1099 L1105	I1097-I1101 HydrophobicContact CG2-CD1 3.84Å; I1097-I1101 WeakPolarHBondContact O-CG1 3.43Å; I1097-I1101 PolarHBondContact O-N 2.86Å; K1099-I1101 PolarHBondContact O-N 2.79Å; I1101-L1105 WeakPolarHBondContact O-CD1 3.1Å
1102	L	33.9	Very low	33.9	Very low	116 Å²	116	100.9 Å²	100.9	61%	0.607	50%	0.504	S	S	*	.	H	α-helix	trans	-87.8	-26.9	177	-73	169.8	0	0	0	114.2	I1098 K1099 I1100	I1098-L1102 HydrophobicContact CG2-CD1 3.91Å; I1098-L1102 WeakPolarHBondContact O-CB 3.23Å; I1098-L1102 VanDerWaalsContact O-CG 3.29Å; I1098-L1102 WeakPolarHBondContact O-CG 3.37Å; I1098-L1102 PolarHBondContact O-N 2.83Å; I1098-L1102 VanDerWaalsContact O-N 3.09Å; K1099-L1102 CarbonylContact O-C 3.33Å; K1099-L1102 PolarHBondContact O-N 3.27Å; K1099-L1102 VanDerWaalsContact O-N 3.12Å; I1100-L1102 PolarHBondContact O-N 3.04Å
1103	C	32.4	Very low	33.6	Very low	94 Å²	94	99 Å²	99	64%	0.635	49%	0.491	S	S	*	.	H	α-helix	trans	-87	-29	-176.6	-70.7	0	0	0	0	113.9	K1099 I1100 L1105	K1099-C1103 WeakPolarHBondContact O-CB 3.46Å; K1099-C1103 PolarHBondContact O-N 2.83Å; K1099-C1103 PolarHBondContact O-SG 3.15Å; I1100-C1103 PolarHBondContact O-N 2.83Å; C1103-L1105 PolarHBondContact O-N 2.75Å
1104	D	32.2	Very low	33.1	Very low	90 Å²	90	97.1 Å²	97.1	48%	0.481	49%	0.492	S	S	.	.	S	Bend	trans	-81.2	9.9	178.7	-69.1	-23.1	0	0	0	113	Y1068 I1100	Y1068-D1104 PolarHBondContact OH-OD2 2.92Å; I1100-D1104 PolarHBondContact O-N 3.1Å
1105	L	34.2	Very low	32.9	Very low	64 Å²	64	100 Å²	100	34%	0.335	50%	0.495	S	S	.	.	S	Bend	trans	-95.5	129.2	-177.9	-86.6	173.7	0	0	0	111.7	I1101 C1103 E1107 I1110	I1101-L1105 WeakPolarHBondContact O-CD1 3.1Å; C1103-L1105 PolarHBondContact O-N 2.75Å; L1105-E1107 PolarHBondContact O-N 2.98Å; L1105-I1110 HydrophobicContact CB-CD1 3.59Å; L1105-I1110 HydrophobicContact CD1-CD1 4.33Å; L1105-I1110 HydrophobicContact CD2-CD1 3.97Å; L1105-I1110 HydrophobicContact CG-CD1 4.18Å
1106	P	30.7	Very low	32.7	Very low	83 Å²	83	96 Å²	96	54%	0.539	48%	0.481	S	S	.	.			trans	-62.7	97.7	-176.3	-26.1	35.7	0	0	0	114.6	I1108 E1109 I1110	P1106-I1108 PolarHBondContact O-N 2.74Å; P1106-I1108 VanDerWaalsContact O-N 3.07Å; P1106-E1109 PolarHBondContact O-N 3.38Å; P1106-E1109 VanDerWaalsContact O-N 3.15Å; P1106-I1110 PolarHBondContact O-N 2.92Å
1107	E	29.2	Very low	32.2	Very low	127 Å²	127	98.7 Å²	98.7	59%	0.593	48%	0.483	S	S	*	.	H	α-helix	trans	-52.6	-36.4	-175.8	-64.2	-168.6	126.4	0	0	113.3	L1105 E1109 I1110 F1111	L1105-E1107 PolarHBondContact O-N 2.98Å; E1107-E1109 PolarHBondContact O-N 3.03Å; E1107-I1110 PolarHBondContact O-N 3.2Å; E1107-F1111 WeakPolarHBondContact O-CB 3.34Å; E1107-F1111 PolarHBondContact O-N 3Å
1108	I	28.7	Very low	31.7	Very low	74 Å²	74	99.7 Å²	99.7	38%	0.379	50%	0.495	S	S	.	.	H	α-helix	trans	-66.9	-35.7	-176	-65.7	176.6	0	0	0	112.5	P1106 N1112	P1106-I1108 PolarHBondContact O-N 2.74Å; P1106-I1108 VanDerWaalsContact O-N 3.07Å; I1108-N1112 WeakPolarHBondContact O-CB 3.48Å; I1108-N1112 PolarHBondContact O-ND2 3.45Å
1109	E	31.5	Very low	31.2	Very low	92 Å²	92	105.3 Å²	105.3	43%	0.43	51%	0.513	S	S	.	.	H	α-helix	trans	-81.3	-36.5	174.5	-97.9	-156.1	101.8	0	0	112.2	P1106 E1107 N1112 R1113	P1106-E1109 PolarHBondContact O-N 3.38Å; P1106-E1109 VanDerWaalsContact O-N 3.15Å; E1107-E1109 PolarHBondContact O-N 3.03Å; E1109-N1112 PolarHBondContact O-N 2.96Å; E1109-R1113 WeakPolarHBondContact O-CB 3.49Å; E1109-R1113 VanDerWaalsContact O-CG 3.27Å; E1109-R1113 WeakPolarHBondContact O-CG 3.48Å; E1109-R1113 PolarHBondContact O-N 3.24Å; E1109-R1113 IonicContact OE1-CZ 2.99Å; E1109-R1113 IonicContact OE1-NE 3.81Å; E1109-R1113 PolarHBondContact OE1-NE 3.49Å; E1109-R1113 IonicContact OE1-NH2 3.72Å; E1109-R1113 PolarHBondContact OE1-NH2 2.89Å; E1109-R1113 IonicContact OE2-NH2 2.63Å
1110	I	31.8	Very low	30.9	Very low	72 Å²	72	103.8 Å²	103.8	37%	0.369	51%	0.507	S	S	.	.	H	α-helix	trans	-73	-43.8	-174.1	-66.2	164.3	0	0	0	110.9	L1105 P1106 E1107 N1112 R1113 A1114	L1105-I1110 HydrophobicContact CB-CD1 3.59Å; L1105-I1110 HydrophobicContact CD1-CD1 4.33Å; L1105-I1110 HydrophobicContact CD2-CD1 3.97Å; L1105-I1110 HydrophobicContact CG-CD1 4.18Å; P1106-I1110 PolarHBondContact O-N 2.92Å; E1107-I1110 PolarHBondContact O-N 3.2Å; I1110-N1112 VanDerWaalsContact C-N 3.32Å; I1110-N1112 PolarHBondContact O-N 3.35Å; I1110-R1113 PolarHBondContact O-N 2.84Å; I1110-A1114 VanDerWaalsContact O-CB 3.25Å; I1110-A1114 WeakPolarHBondContact O-CB 3.43Å; I1110-A1114 PolarHBondContact O-N 2.85Å
1111	F	29.3	Very low	30.6	Very low	116 Å²	116	107.1 Å²	107.1	51%	0.509	53%	0.526	S	S	.	.	H	α-helix	trans	-63.8	-36.8	172.7	-101	-83	0	0	0	112.2	E1107 R1115	E1107-F1111 WeakPolarHBondContact O-CB 3.34Å; E1107-F1111 PolarHBondContact O-N 3Å; F1111-R1115 WeakPolarHBondContact O-CB 3.31Å; F1111-R1115 PolarHBondContact O-N 3.27Å
1112	N	31.1	Very low	30.2	Very low	89 Å²	89	111.3 Å²	111.3	48%	0.476	54%	0.544	S	S	.	.	H	α-helix	trans	-70	-45.5	178	-78.3	-40.9	0	0	0	111.9	I1108 E1109 I1110 A1114 R1115 I1116	I1108-N1112 WeakPolarHBondContact O-CB 3.48Å; I1108-N1112 PolarHBondContact O-ND2 3.45Å; E1109-N1112 PolarHBondContact O-N 2.96Å; I1110-N1112 VanDerWaalsContact C-N 3.32Å; I1110-N1112 PolarHBondContact O-N 3.35Å; N1112-A1114 VanDerWaalsContact C-N 3.33Å; N1112-A1114 PolarHBondContact O-N 3.45Å; N1112-R1115 PolarHBondContact O-N 3Å; N1112-I1116 VanDerWaalsContact O-CG1 3.31Å; N1112-I1116 WeakPolarHBondContact O-CG1 3.45Å; N1112-I1116 PolarHBondContact O-N 3.41Å
1113	R	29.7	Very low	29.8	Very low	162 Å²	162	116 Å²	116	61%	0.611	56%	0.556	S	S	*	*	H	α-helix	trans	-62.3	-37.3	175.1	-69.1	172.2	-177.7	-143.5	6.7	112	E1109 I1110 R1117	E1109-R1113 WeakPolarHBondContact O-CB 3.49Å; E1109-R1113 VanDerWaalsContact O-CG 3.27Å; E1109-R1113 WeakPolarHBondContact O-CG 3.48Å; E1109-R1113 PolarHBondContact O-N 3.24Å; E1109-R1113 IonicContact OE1-CZ 2.99Å; E1109-R1113 IonicContact OE1-NE 3.81Å; E1109-R1113 PolarHBondContact OE1-NE 3.49Å; E1109-R1113 IonicContact OE1-NH2 3.72Å; E1109-R1113 PolarHBondContact OE1-NH2 2.89Å; E1109-R1113 IonicContact OE2-NH2 2.63Å; I1110-R1113 PolarHBondContact O-N 2.84Å; R1113-R1117 WeakPolarHBondContact O-CG 3.39Å; R1113-R1117 PolarHBondContact O-N 3.18Å
1114	A	30.4	Very low	29.4	Very low	48 Å²	48	117.5 Å²	117.5	40%	0.397	56%	0.561	S	S	.	*	H	α-helix	trans	-69.8	-45.1	174.1	0	0	0	0	0	113.1	I1110 N1112 I1116 R1117 C1118	I1110-A1114 VanDerWaalsContact O-CB 3.25Å; I1110-A1114 WeakPolarHBondContact O-CB 3.43Å; I1110-A1114 PolarHBondContact O-N 2.85Å; N1112-A1114 VanDerWaalsContact C-N 3.33Å; N1112-A1114 PolarHBondContact O-N 3.45Å; A1114-I1116 VanDerWaalsContact C-N 3.27Å; A1114-I1116 PolarHBondContact O-N 3.42Å; A1114-R1117 PolarHBondContact O-N 3.12Å; A1114-C1118 PolarHBondContact O-N 2.85Å
1115	R	29.8	Very low	29.1	Very low	160 Å²	160	122.1 Å²	122.1	60%	0.604	58%	0.577	S	S	*	*	H	α-helix	trans	-71.4	-19.4	-176.2	-164.4	175.4	-158.8	163.9	5.7	113.6	F1111 N1112	F1111-R1115 WeakPolarHBondContact O-CB 3.31Å; F1111-R1115 PolarHBondContact O-N 3.27Å; N1112-R1115 PolarHBondContact O-N 3Å
1116	I	31.8	Very low	28.7	Very low	92 Å²	92	128 Å²	128	47%	0.472	60%	0.602	S	S	.	*	H	α-helix	trans	-78.1	-48.9	167.9	-68.1	166.5	0	0	0	110.2	N1112 A1114 C1118 R1119 H1120	N1112-I1116 VanDerWaalsContact O-CG1 3.31Å; N1112-I1116 WeakPolarHBondContact O-CG1 3.45Å; N1112-I1116 PolarHBondContact O-N 3.41Å; A1114-I1116 VanDerWaalsContact C-N 3.27Å; A1114-I1116 PolarHBondContact O-N 3.42Å; I1116-C1118 VanDerWaalsContact C-N 3.32Å; I1116-C1118 PolarHBondContact O-N 3.37Å; I1116-R1119 PolarHBondContact O-N 3.16Å; I1116-H1120 PolarHBondContact O-N 2.9Å
1117	R	27.5	Very low	28.4	Very low	163 Å²	163	130.7 Å²	130.7	62%	0.615	61%	0.612	S	S	*	*	H	α-helix	trans	-59.8	-37.1	177.9	-75.6	-179.9	172.7	-177.1	-3.7	113.6	R1113 A1114 R1119	R1113-R1117 WeakPolarHBondContact O-CG 3.39Å; R1113-R1117 PolarHBondContact O-N 3.18Å; A1114-R1117 PolarHBondContact O-N 3.12Å; R1117-R1119 PolarHBondContact O-N 3.2Å
1118	C	28.1	Very low	28.3	Very low	93 Å²	93	132.1 Å²	132.1	63%	0.628	62%	0.619	S	S	*	*	H	α-helix	trans	-69.7	-10.3	174.1	-69.2	0	0	0	0	114.5	A1114 I1116	A1114-C1118 PolarHBondContact O-N 2.85Å; I1116-C1118 VanDerWaalsContact C-N 3.32Å; I1116-C1118 PolarHBondContact O-N 3.37Å
1119	R	27.8	Very low	28.1	Very low	183 Å²	183	134.6 Å²	134.6	69%	0.691	63%	0.633	S	S	*	*	H	α-helix	trans	-101.2	-28.8	178.4	-80.9	179.6	162.7	172	-6.7	114.2	I1116 R1117 N1121	I1116-R1119 PolarHBondContact O-N 3.16Å; R1117-R1119 PolarHBondContact O-N 3.2Å; R1119-N1121 VanDerWaalsContact C-N 3.31Å; R1119-N1121 PolarHBondContact O-N 3.3Å
1120	H	29.6	Very low	27.9	Very low	111 Å²	111	138 Å²	138	51%	0.514	65%	0.654	S	S	.	*	H	α-helix	trans	-70.9	-22.9	175.6	-85.6	133.6	0	0	0	114.1	E44 I1116 Q1122	E44-H1120 IonicContact OE1-CE1 2.99Å; E44-H1120 PolarHBondContact OE1-CE1 3.28Å; E44-H1120 IonicContact OE1-CG 2.66Å; E44-H1120 IonicContact OE1-ND1 3.02Å; E44-H1120 PolarHBondContact OE1-ND1 2.65Å; I1116-H1120 PolarHBondContact O-N 2.9Å; H1120-Q1122 VanDerWaalsContact C-N 3.34Å; H1120-Q1122 PolarHBondContact O-N 3.12Å
1121	N	28.1	Very low	27.6	Very low	151 Å²	151	138.2 Å²	138.2	81%	0.807	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	15.9	-179.8	-78.1	-13.8	0	0	0	115.8	R1119	R1119-N1121 VanDerWaalsContact C-N 3.31Å; R1119-N1121 PolarHBondContact O-N 3.3Å
1122	Q	26.8	Very low	27.3	Very low	157 Å²	157	143.6 Å²	143.6	73%	0.734	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.2	1.4	179.6	-79	-168.4	-28.4	0	0	116.2	H1120	H1120-Q1122 VanDerWaalsContact C-N 3.34Å; H1120-Q1122 PolarHBondContact O-N 3.12Å
1123	Y	25.4	Very low	27	Very low	216 Å²	216	147.3 Å²	147.3	85%	0.847	71%	0.711	S	S	*	*			trans	-123.7	50.4	178.6	-83.5	-82.9	0	0	0	113.7
1124	V	24.8	Very low	26.8	Very low	125 Å²	125	146.4 Å²	146.4	76%	0.758	71%	0.713	S	S	*	*	S	Bend	trans	-122.3	126.4	157.8	-179.1	0	0	0	0	107.2
1125	K	24.8	Very low	26.5	Very low	187 Å²	187	151.7 Å²	151.7	81%	0.813	73%	0.733	S	S	*	*	S	Bend	trans	72.2	95.5	-166	-50.3	174.3	-176.6	179.2	0	114.7
1126	H	26.3	Very low	26.1	Very low	187 Å²	187	153.7 Å²	153.7	87%	0.866	74%	0.741	S	S	*	*				-173	129.9	104.9	-105.2	-80.6	0	0	0	110.8
1127	N	24.1	Very low	25.7	Very low	139 Å²	139	158.9 Å²	158.9	74%	0.743	76%	0.76	S	S	*	*			trans	-79.8	136	167.4	-68.5	-18.3	0	0	0	109.3
1128	H	27	Very low	25.5	Very low	158 Å²	158	156.2 Å²	156.2	73%	0.731	77%	0.767	S	S	*	*				174.3	130	109.8	-93.5	-67.8	0	0	0	113.6
1129	N	25.1	Very low	25.3	Very low	125 Å²	125	161.3 Å²	161.3	67%	0.668	77%	0.774	S	S	*	*			trans	36	131.6	139.1	-55.6	4.5	0	0	0	122.2
1130	N	26.1	Very low	25.1	Very low	165 Å²	165	158.5 Å²	158.5	88%	0.882	78%	0.779	S	S	*	*			trans	70.8	144.8	152	-53.2	-11.8	0	0	0	117.2
1131	G	25.4	Very low	24.9	Very low	76 Å²	76	159.5 Å²	159.5	78%	0.784	79%	0.793	S	S	*	*			cis	-154.1	174.6	-1.9	0	0	0	0	0	111.8
1132	R	24	Very low	24.7	Very low	228 Å²	228	158.8 Å²	158.8	86%	0.86	79%	0.794	S	S	*	*			trans	-80.3	157.2	-174.2	-65.5	178.7	175.4	134.5	-2.7	113.2
1133	N	25.5	Very low	24.6	Very low	168 Å²	168	159.1 Å²	159.1	90%	0.898	80%	0.8	S	S	*	*				-160.3	139.1	113.4	-97.2	-21.5	0	0	0	112.7
1134	E	24.4	Very low	24.4	Very low	143 Å²	143	159.4 Å²	159.4	67%	0.668	80%	0.801	S	S	*	*			trans	-95.3	151.3	173.5	-64.6	-177.2	173.5	0	0	110.5	R1136	E1134-R1136 IonicContact OE2-NE 3.48Å
1135	I	23.9	Very low	24.5	Very low	159 Å²	159	158.8 Å²	158.8	82%	0.815	80%	0.8	S	S	*	*			trans	-130.4	118.3	151.7	-62.3	-176.5	0	0	0	108.8	F1137	I1135-F1137 HydrophobicContact CG2-CD2 4.36Å; I1135-F1137 HydrophobicContact CG2-CE2 4.3Å
1136	R	21.8	Very low	24.5	Very low	201 Å²	201	158.3 Å²	158.3	76%	0.758	80%	0.804	S	S	*	*			trans	-84	154	172.4	-54.1	170.5	-176.6	173	-2.1	109.8	E1134	E1134-R1136 IonicContact OE2-NE 3.48Å
1137	F	23.5	Very low	24.4	Very low	201 Å²	201	156.1 Å²	156.1	88%	0.882	80%	0.799	S	S	*	*			trans	-146.5	159.9	141.9	-92.1	-63	0	0	0	111.4	I1135	I1135-F1137 HydrophobicContact CG2-CD2 4.36Å; I1135-F1137 HydrophobicContact CG2-CE2 4.3Å
1138	S	24.2	Very low	24.5	Very low	107 Å²	107	156.6 Å²	156.6	75%	0.748	80%	0.797	S	S	*	*			trans	-114.8	155.1	-151.5	39.3	0	0	0	0	114.8
1139	Y	22.6	Very low	24.4	Very low	201 Å²	201	155.4 Å²	155.4	79%	0.788	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-86	137.1	170.9	-79.5	-95.6	0	0	0	111.3
1140	P	24.3	Very low	24.4	Very low	123 Å²	123	156 Å²	156	80%	0.799	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-84.8	139.6	171.4	33.2	-32.7	0	0	0	112.1
1141	V	26.1	Very low	24.4	Very low	133 Å²	133	154.3 Å²	154.3	81%	0.806	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-81.4	148.6	171.7	175	0	0	0	0	110.4
1142	T	23.7	Very low	24.4	Very low	135 Å²	135	158.9 Å²	158.9	83%	0.828	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-69.2	128.8	177.6	39.2	0	0	0	0	112.7
1143	L	24.1	Very low	24.6	Very low	164 Å²	164	154.8 Å²	154.8	86%	0.859	76%	0.761	S	S	*	*			trans	-138.3	141.5	171.6	-82.9	171.7	0	0	0	111.9
1144	Y	21.8	Very low	24.8	Very low	223 Å²	223	153.4 Å²	153.4	88%	0.875	75%	0.754	S	S	*	*			trans	-141.5	148.1	170.9	-92	-73.9	0	0	0	107
1145	P	27	Very low	25	Very low	111 Å²	111	151.1 Å²	151.1	72%	0.721	75%	0.746	S	S	*	*				-137.6	122.4	-52.4	33.1	-15.1	0	0	0	112.1
1146	I	24.9	Very low	25.2	Very low	178 Å²	178	150.1 Å²	150.1	91%	0.913	73%	0.732	S	S	*	*			trans	-133.8	155.7	175	-59.2	-176.6	0	0	0	110.7
1147	N	24	Very low	25.5	Very low	141 Å²	141	147.1 Å²	147.1	75%	0.754	73%	0.725	S	S	*	*			trans	-90.3	145.4	-155.8	-81.4	-23.9	0	0	0	117.5
1148	H	24.7	Very low	25.7	Very low	149 Å²	149	141 Å²	141	69%	0.69	70%	0.702	S	S	*	*			trans	62.4	121.9	140	-78.4	-74.1	0	0	0	124
1149	H	24.9	Very low	25.9	Very low	133 Å²	133	143.4 Å²	143.4	62%	0.616	70%	0.701	S	S	*	*			trans	82.5	120	132.5	-74.7	-54.4	0	0	0	124.1
1150	H	26.2	Very low	26.1	Very low	138 Å²	138	138.4 Å²	138.4	64%	0.639	69%	0.691	S	S	*	*			trans	69.4	146.4	133.6	-63.7	-41.4	0	0	0	119.9
1151	Q	24.9	Very low	26.2	Very low	128 Å²	128	138.5 Å²	138.5	60%	0.598	69%	0.685	S	S	*	*			cis	-166.2	150.4	-14.7	-123.1	165.1	-27.5	0	0	113.2
1152	Y	25.8	Very low	26.2	Very low	173 Å²	173	140.2 Å²	140.2	68%	0.678	68%	0.682	S	S	*	*			trans	76.5	131.2	141.6	-79.8	-48.2	0	0	0	127.5
1153	H	29	Very low	26.3	Very low	142 Å²	142	139 Å²	139	66%	0.657	67%	0.671	S	S	*	*			trans	73.8	150.9	136.3	-69.1	-46.3	0	0	0	122.7
1154	D	28.8	Very low	26.4	Very low	138 Å²	138	137.5 Å²	137.5	74%	0.738	66%	0.663	S	S	*	*			cis	-176.8	-158.3	-45.8	-85.5	-15.3	0	0	0	105.9
1155	D	28.6	Very low	26.6	Very low	95 Å²	95	132.3 Å²	132.3	51%	0.508	66%	0.659	S	S	.	*			cis	-169.1	163.6	7.1	-169	12.6	0	0	0	111.1
1156	R	27.6	Very low	26.5	Very low	139 Å²	139	131.5 Å²	131.5	53%	0.525	66%	0.657	S	S	.	*			trans	62.6	177.5	165.4	-82.6	169.4	-85.6	127.7	7.6	118.4	P77 V78	P77-R1156 CarbonylContact O-C 3.45Å; V78-R1156 HydrophobicContact CB-CG 4.07Å; V78-R1156 HydrophobicContact CG1-CG 4.02Å; V78-R1156 HydrophobicContact CG2-CG 4.18Å
1157	F	28.3	Very low	26.5	Very low	137 Å²	137	130.7 Å²	130.7	60%	0.601	65%	0.653	S	S	*	*			cis	-157.4	171.1	-6.4	-113.9	172.6	0	0	0	108.1	S76 P77	S76-F1157 CarbonylContact C-O 3.15Å; S76-F1157 WeakPolarHBondContact CB-O 3.25Å; P77-F1157 WeakPolarHBondContact O-CA 3.02Å; P77-F1157 PolarHBondContact O-N 2.83Å
1158	D	28.6	Very low	26.8	Very low	74 Å²	74	129.1 Å²	129.1	40%	0.396	65%	0.651	S	S	.	*				-165.3	176.4	-56.5	-131.5	-29.1	0	0	0	112.7	S76 P77 V78	S76-D1158 VanDerWaalsContact O-CA 3.28Å; S76-D1158 WeakPolarHBondContact O-CA 3.1Å; S76-D1158 PolarHBondContact O-N 2.79Å; P77-D1158 WeakPolarHBondContact CA-OD1 3.48Å; V78-D1158 PolarHBondContact N-OD1 3.37Å; V78-D1158 PolarHBondContact N-OD2 3.02Å; V78-D1158 VanDerWaalsContact N-OD2 3.14Å
1159	E	27.7	Very low	26.8	Very low	156 Å²	156	129 Å²	129	73%	0.729	65%	0.654	S	S	*	*			trans	77.3	-172.4	157.7	-102.6	-63.6	134.4	0	0	122.7
1160	T	27.4	Very low	26.9	Very low	96 Å²	96	130 Å²	130	59%	0.589	66%	0.662	S	S	*	*			trans	-138	-161.2	-153.6	63.7	0	0	0	0	114.1
1161	N	27.3	Very low	26.8	Very low	126 Å²	126	127.8 Å²	127.8	67%	0.674	66%	0.662	S	S	*	*			cis	-171	178.2	17.7	-142.5	-47.4	0	0	0	114.2
1162	K	25.3	Very low	26.9	Very low	168 Å²	168	129.5 Å²	129.5	73%	0.73	68%	0.675	S	S	*	*			trans	69.4	154.7	151.9	-72	-175.9	174.9	-174.2	0	121.7
1163	D	25.9	Very low	27.1	Very low	111 Å²	111	126.1 Å²	126.1	59%	0.594	67%	0.674	S	S	*	*			cis	-160.7	154	-13.1	-117.4	-21.9	0	0	0	114.3
1164	N	25.8	Very low	27	Very low	132 Å²	132	129.1 Å²	129.1	71%	0.706	68%	0.681	S	S	*	*			trans	65.9	140.6	145	-71	-48.3	0	0	0	127.3
1165	S	25.5	Very low	26.8	Very low	113 Å²	113	129.6 Å²	129.6	79%	0.79	68%	0.682	S	S	*	*			trans	84.3	142.6	145.9	74.7	0	0	0	0	121.7
1166	S	25.1	Very low	26.6	Very low	95 Å²	95	132.2 Å²	132.2	66%	0.664	69%	0.694	S	S	*	*			cis	-172.8	158.2	-21.2	56.9	0	0	0	0	114.7
1167	L	25.4	Very low	26.3	Very low	160 Å²	160	131.3 Å²	131.3	84%	0.838	70%	0.7	S	S	*	*			trans	81.7	150.1	149	-72.3	158.7	0	0	0	120.3
1168	P	31.1	Very low	26	Very low	109 Å²	109	130.7 Å²	130.7	71%	0.708	71%	0.707	S	S	*	*				-153.1	-126.5	-126.2	45.5	-20.9	0	0	0	117.1
1169	I	24.5	Very low	25.8	Very low	147 Å²	147	131 Å²	131	75%	0.754	72%	0.715	S	S	*	*			trans	95.8	139.7	163.7	-23.2	-174.1	0	0	0	119.3
1170	I	27.2	Very low	25.5	Very low	152 Å²	152	130.7 Å²	130.7	78%	0.779	72%	0.718	S	S	*	*			trans	80.6	127.6	162.9	-45	-178	0	0	0	117
1171	S	24	Very low	25.2	Very low	92 Å²	92	132.3 Å²	132.3	64%	0.643	73%	0.727	S	S	*	*			cis	-175.6	118.3	-45.7	49	0	0	0	0	108.2
1172	L	27	Very low	24.9	Very low	165 Å²	165	136.7 Å²	136.7	86%	0.864	74%	0.736	S	S	*	*				61.6	156.5	94.9	-93	75.5	0	0	0	116.7
1173	P	29.9	Very low	24.7	Very low	102 Å²	102	133.7 Å²	133.7	66%	0.662	74%	0.736	S	S	*	*			cis	-121.4	171.3	-16	32	-11.9	0	0	0	112.1
1174	Y	26.3	Very low	24.5	Very low	205 Å²	205	135.8 Å²	135.8	80%	0.804	75%	0.748	S	S	*	*			cis	-140.1	140.3	41.8	-106.4	-92.7	0	0	0	113.9
1175	I	23.9	Very low	24.3	Very low	148 Å²	148	136.5 Å²	136.5	76%	0.759	74%	0.74	S	S	*	*			trans	-138	127.7	173	-69.8	174.2	0	0	0	108.5	N1177	I1175-N1177 HydrophobicContact CG2-CB 3.71Å
1176	I	24	Very low	24.2	Very low	150 Å²	150	139.3 Å²	139.3	77%	0.769	74%	0.738	S	S	*	*			trans	-147.7	105.1	165.9	-62.6	-175.9	0	0	0	104.1
1177	N	23.2	Very low	24.1	Very low	120 Å²	120	139.3 Å²	139.3	64%	0.642	73%	0.73	S	S	*	*			cis	55.2	112	23.5	-153.1	23.7	0	0	0	111	I1175	I1175-N1177 HydrophobicContact CG2-CB 3.71Å
1178	V	21.4	Very low	23.9	Very low	124 Å²	124	137.8 Å²	137.8	75%	0.752	72%	0.718	S	S	*	*				-165.9	154.2	80.6	147.4	0	0	0	0	110.4
1179	S	23.3	Very low	23.4	Very low	80 Å²	80	139.1 Å²	139.1	56%	0.559	72%	0.718	S	S	*	*			trans	-77.7	176.6	173	52.5	0	0	0	0	113.6
1180	N	21.1	Very low	23.3	Very low	149 Å²	149	141 Å²	141	80%	0.797	72%	0.721	S	S	*	*			trans	74.6	176.2	167.6	-54.9	-28	0	0	0	117.5
1181	V	21.7	Very low	23	Very low	130 Å²	130	144.6 Å²	144.6	79%	0.788	73%	0.725	S	S	*	*			trans	79.4	94.1	164.6	-168.8	0	0	0	0	116.5
1182	Y	20.8	Very low	22.9	Very low	219 Å²	219	146.9 Å²	146.9	86%	0.859	73%	0.73	S	S	*	*			trans	-24.9	141.5	143.7	-65.8	-105.8	0	0	0	112.8
1183	S	21.7	Very low	22.9	Very low	105 Å²	105	143 Å²	143	73%	0.734	72%	0.717	S	S	*	*				172.3	171.9	78.8	49	0	0	0	0	111.7
1184	N	22.7	Very low	22.5	Very low	155 Å²	155	146.6 Å²	146.6	83%	0.829	72%	0.724	S	S	*	*			trans	-72.4	130.4	168.9	-65.8	-47.1	0	0	0	111.5
1185	R	20.9	Very low	22.4	Very low	146 Å²	146	144.1 Å²	144.1	55%	0.551	73%	0.725	S	S	*	*			trans	-156.9	133.8	144.3	-102.3	137.3	-155.6	-94.1	-12.2	111.3	E208 S209 N210	E208-R1185 WeakPolarHBondContact OE2-CD 3.27Å; E208-R1185 IonicContact OE2-CZ 2.72Å; E208-R1185 IonicContact OE2-NE 3Å; E208-R1185 IonicContact OE2-NH1 3.16Å; E208-R1185 PolarHBondContact OE2-NH1 3.2Å; S209-R1185 VanDerWaalsContact CB-NH1 3.28Å; S209-R1185 PolarHBondContact OG-NH1 3.23Å; N210-R1185 PolarHBondContact OD1-NH1 3.31Å; N210-R1185 PolarHBondContact OD1-NH2 3.27Å
1186	K	23.6	Very low	22.3	Very low	172 Å²	172	146.4 Å²	146.4	75%	0.748	73%	0.73	S	S	*	*			trans	-82.9	131.5	166.7	-65.7	176	166	-162.2	0	109.5	E1188	K1186-E1188 IonicContact NZ-OE1 3.43Å; K1186-E1188 PolarHBondContact NZ-OE1 2.64Å
1187	I	21.4	Very low	22.2	Very low	95 Å²	95	146.6 Å²	146.6	49%	0.487	73%	0.732	S	S	.	*			trans	-154.9	100	146.5	-47.8	166.3	0	0	0	103.3	K207 E208	K207-I1187 VanDerWaalsContact C-CD1 3.42Å; K207-I1187 WeakPolarHBondContact O-CD1 3.17Å; E208-I1187 HydrophobicContact CB-CD1 4.45Å; E208-I1187 HydrophobicContact CG-CD1 3.63Å
1188	E	22.3	Very low	22.2	Very low	128 Å²	128	145.3 Å²	145.3	60%	0.598	73%	0.725	S	S	*	*			cis	73.8	140.5	36.3	-145.4	179.6	-99.6	0	0	113	K1186	K1186-E1188 IonicContact NZ-OE1 3.43Å; K1186-E1188 PolarHBondContact NZ-OE1 2.64Å
1189	I	21.2	Very low	22.4	Very low	137 Å²	137	149.4 Å²	149.4	70%	0.703	73%	0.733	S	S	*	*			trans	72.3	131.5	175.4	-47.5	173.9	0	0	0	113.3
1190	K	20.9	Very low	22.5	Very low	188 Å²	188	150 Å²	150	82%	0.817	73%	0.73	S	S	*	*			cis	-128.9	144.5	1.2	-105.5	136	-167.2	174.5	0	107.2
1191	R	22	Very low	22.7	Very low	227 Å²	227	148.1 Å²	148.1	86%	0.857	72%	0.716	S	S	*	*				54.1	91.5	56	-84.5	-167.7	179	160.8	1.3	115
1192	N	22.6	Very low	22.9	Very low	139 Å²	139	150.1 Å²	150.1	74%	0.743	72%	0.719	S	S	*	*				-179.4	125.4	114	-82.2	-1.5	0	0	0	106.4
1193	S	25.2	Very low	23.2	Very low	85 Å²	85	147.3 Å²	147.3	59%	0.594	71%	0.711	S	S	*	*				74.2	131.6	51.2	78.3	0	0	0	0	112.5
1194	Q	22.2	Very low	23.3	Very low	176 Å²	176	145.5 Å²	145.5	82%	0.822	69%	0.691	S	S	*	*			trans	77.4	129.9	-157.5	-57.9	158.8	-62.7	0	0	110.5
1195	D	23.4	Very low	23.5	Very low	154 Å²	154	144.9 Å²	144.9	82%	0.824	69%	0.687	S	S	*	*			cis	-119.2	163.2	9.5	-81	-54.1	0	0	0	115.7
1196	F	21.8	Very low	23.8	Very low	196 Å²	196	145.2 Å²	145.2	86%	0.86	70%	0.7	S	S	*	*			trans	-72.8	145.8	166.2	-78.8	-124.4	0	0	0	110
1197	L	23.6	Very low	23.8	Very low	154 Å²	154	145.6 Å²	145.6	81%	0.806	70%	0.697	S	S	*	*				-164.4	112.9	127.8	-105.8	160.4	0	0	0	111.9
1198	N	23.1	Very low	23.9	Very low	92 Å²	92	147.3 Å²	147.3	49%	0.492	70%	0.701	S	S	.	*			trans	36	102.6	160.9	-68	-3.4	0	0	0	121	D1200 E1201	N1198-D1200 HydrophobicContact CB-CB 4.38Å; N1198-D1200 PolarHBondContact O-N 3.16Å; N1198-E1201 HydrophobicContact CB-CG 4.2Å; N1198-E1201 PolarHBondContact O-N 3.24Å
1199	F	24.9	Very low	24.2	Very low	211 Å²	211	152.3 Å²	152.3	93%	0.925	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	1.7	155.8	-129.7	-101.1	0	0	0	114.4
1200	D	25.4	Very low	24.5	Very low	91 Å²	91	152.2 Å²	152.2	49%	0.487	71%	0.712	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.2	-22.3	176	-78.4	-58.9	0	0	0	113.9	N1198 K1203 Q1204	N1198-D1200 HydrophobicContact CB-CB 4.38Å; N1198-D1200 PolarHBondContact O-N 3.16Å; D1200-K1203 CarbonylContact O-C 3.43Å; D1200-K1203 WeakPolarHBondContact O-CA 3.26Å; D1200-K1203 WeakPolarHBondContact O-CB 3.36Å; D1200-K1203 PolarHBondContact O-N 2.96Å; D1200-Q1204 WeakPolarHBondContact O-CG 3.45Å; D1200-Q1204 PolarHBondContact O-N 3.01Å
1201	E	24.7	Very low	24.6	Very low	111 Å²	111	147.6 Å²	147.6	52%	0.519	70%	0.703	S	S	.	*	H	α-helix	trans	-76.4	-29.6	-169.1	-65.9	-153.1	128.2	0	0	114.5	N1198 K1203 Q1204 L1205	N1198-E1201 HydrophobicContact CB-CG 4.2Å; N1198-E1201 PolarHBondContact O-N 3.24Å; E1201-K1203 PolarHBondContact O-N 3.16Å; E1201-Q1204 CarbonylContact O-C 3.46Å; E1201-Q1204 WeakPolarHBondContact O-CA 3.44Å; E1201-Q1204 PolarHBondContact O-N 2.91Å; E1201-L1205 PolarHBondContact O-N 2.99Å
1202	M	25.6	Very low	24.7	Very low	172 Å²	172	145.3 Å²	145.3	85%	0.847	71%	0.707	S	S	*	*	H	α-helix	trans	-74.5	-10.2	167.6	-78	-170.1	71.7	0	0	113.7
1203	K	27	Very low	24.8	Very low	159 Å²	159	145.7 Å²	145.7	69%	0.691	71%	0.709	S	S	*	*	H	α-helix	trans	-91	-9.4	162.2	-83.6	-179.2	175.5	174.8	0	113.1	D1200 E1201	D1200-K1203 CarbonylContact O-C 3.43Å; D1200-K1203 WeakPolarHBondContact O-CA 3.26Å; D1200-K1203 WeakPolarHBondContact O-CB 3.36Å; D1200-K1203 PolarHBondContact O-N 2.96Å; E1201-K1203 PolarHBondContact O-N 3.16Å
1204	Q	25	Very low	24.7	Very low	67 Å²	67	147.2 Å²	147.2	31%	0.313	72%	0.715	S	S	.	*	H	α-helix	trans	-101.9	-24.7	173.8	-68.3	-175.6	37.3	0	0	114	D1200 E1201 N1206 R1207 K1208	D1200-Q1204 WeakPolarHBondContact O-CG 3.45Å; D1200-Q1204 PolarHBondContact O-N 3.01Å; E1201-Q1204 CarbonylContact O-C 3.46Å; E1201-Q1204 WeakPolarHBondContact O-CA 3.44Å; E1201-Q1204 PolarHBondContact O-N 2.91Å; Q1204-N1206 PolarHBondContact O-N 3.12Å; Q1204-R1207 CarbonylContact O-C 3.09Å; Q1204-R1207 WeakPolarHBondContact O-CA 3.46Å; Q1204-R1207 PolarHBondContact O-N 2.98Å; Q1204-K1208 WeakPolarHBondContact O-CB 3.21Å; Q1204-K1208 PolarHBondContact O-N 2.69Å
1205	L	25.7	Very low	24.9	Very low	143 Å²	143	147.6 Å²	147.6	75%	0.749	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-13.9	169.3	-96.6	164	0	0	0	113.4	E1201	E1201-L1205 PolarHBondContact O-N 2.99Å
1206	N	28.2	Very low	25	Very low	153 Å²	153	148.1 Å²	148.1	82%	0.818	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	12.5	161.9	-94	-48.8	0	0	0	113	Q1204	Q1204-N1206 PolarHBondContact O-N 3.12Å
1207	R	23.6	Very low	25	Very low	179 Å²	179	145.8 Å²	145.8	68%	0.675	71%	0.709	S	S	*	*	S	Bend	trans	-145.3	26.6	175.1	-72.6	-166.7	166	-176.8	-5.8	114.8	Q1204 H1210	Q1204-R1207 CarbonylContact O-C 3.09Å; Q1204-R1207 WeakPolarHBondContact O-CA 3.46Å; Q1204-R1207 PolarHBondContact O-N 2.98Å; R1207-H1210 WeakPolarHBondContact O-CB 3.45Å
1208	K	23.9	Very low	25	Very low	132 Å²	132	146.3 Å²	146.3	57%	0.574	71%	0.712	S	S	*	*			trans	-157.7	94.7	171.5	-80.6	176.8	176.2	159.1	0	105	Q1204	Q1204-K1208 WeakPolarHBondContact O-CB 3.21Å; Q1204-K1208 PolarHBondContact O-N 2.69Å
1209	Y	27.5	Very low	25.1	Very low	233 Å²	233	146.1 Å²	146.1	91%	0.914	72%	0.717	S	S	*	*	S	Bend	cis	-45	109.7	15.1	-54.8	-88.2	0	0	0	118.1
1210	H	28	Very low	25	Very low	135 Å²	135	142.1 Å²	142.1	63%	0.625	71%	0.706	S	S	*	*			trans	-160.6	159.3	156.3	-104.6	-70.3	0	0	0	106.4	R1207	R1207-H1210 WeakPolarHBondContact O-CB 3.45Å
1211	S	24	Very low	24.9	Very low	91 Å²	91	146.4 Å²	146.4	64%	0.636	72%	0.723	S	S	*	*			trans	45.5	88	170.9	61.6	0	0	0	0	116.5
1212	L	23.5	Very low	24.9	Very low	179 Å²	179	148.3 Å²	148.3	94%	0.937	74%	0.736	S	S	*	*				-104.1	128.6	119.3	-109.8	79.4	0	0	0	106.7
1213	D	24.5	Very low	24.7	Very low	146 Å²	146	149 Å²	149	78%	0.781	73%	0.731	S	S	*	*			trans	-80.5	134.3	175.6	-66.5	-67.9	0	0	0	111.1
1214	V	23.2	Very low	24.5	Very low	118 Å²	118	147 Å²	147	72%	0.715	73%	0.732	S	S	*	*			trans	-141.3	83.6	149.9	-172.4	0	0	0	0	108.5	Q1216	V1214-Q1216 VanDerWaalsContact CG1-O 3.25Å; V1214-Q1216 WeakPolarHBondContact CG1-O 3.35Å
1215	Q	25.8	Very low	24.4	Very low	184 Å²	184	150.6 Å²	150.6	86%	0.86	75%	0.753	S	S	*	*	S	Bend	trans	-84.9	122.8	144.8	-86.1	-165.2	-15.6	0	0	107.4
1216	Q	25.6	Very low	24.3	Very low	165 Å²	165	148.2 Å²	148.2	77%	0.771	75%	0.748	S	S	*	*	S	Bend	trans	67.2	162.2	175.2	-52.1	178	-7.3	0	0	115.1	V1214	V1214-Q1216 VanDerWaalsContact CG1-O 3.25Å; V1214-Q1216 WeakPolarHBondContact CG1-O 3.35Å
1217	I	22.3	Very low	24	Very low	147 Å²	147	148.9 Å²	148.9	75%	0.754	75%	0.747	S	S	*	*			trans	62.4	82.7	-177.2	-42.8	172.1	0	0	0	111.7
1218	L	24	Very low	23.8	Very low	164 Å²	164	144.5 Å²	144.5	86%	0.859	74%	0.742	S	S	*	*				-140.3	121.2	59	-104.1	155.8	0	0	0	113.1
1219	S	25.2	Very low	23.7	Very low	88 Å²	88	145.2 Å²	145.2	62%	0.615	75%	0.748	S	S	*	*			trans	-82.4	154.8	166	-47.8	0	0	0	0	110.6
1220	N	22.3	Very low	23.4	Very low	128 Å²	128	140 Å²	140	68%	0.684	73%	0.732	S	S	*	*			trans	68.3	121.7	177.8	-38.3	-39.8	0	0	0	110.9
1221	E	23.9	Very low	23.2	Very low	181 Å²	181	141.2 Å²	141.2	85%	0.846	74%	0.735	S	S	*	*	S	Bend	cis	-132	149.6	49	-76.1	168.2	-179.7	0	0	111.8
1222	L	23.6	Very low	23.1	Very low	151 Å²	151	142.1 Å²	142.1	79%	0.791	74%	0.737	S	S	*	*			cis	-141.8	135.6	3.6	-111.9	158.2	0	0	0	110.2
1223	Y	21.3	Very low	23.2	Very low	187 Å²	187	139.4 Å²	139.4	73%	0.733	72%	0.724	S	S	*	*			trans	-56.4	134.4	155.7	-87.4	-120.1	0	0	0	108.3
1224	T	22.6	Very low	23.2	Very low	117 Å²	117	137.8 Å²	137.8	72%	0.718	72%	0.715	S	S	*	*				168.7	159.5	94.7	36.9	0	0	0	0	107.3
1225	N	23.1	Very low	23.4	Very low	141 Å²	141	139.8 Å²	139.8	75%	0.754	71%	0.714	S	S	*	*			cis	-136.1	135.8	3.5	-118.5	-19.6	0	0	0	110.2
1226	S	23.3	Very low	23.3	Very low	94 Å²	94	138.1 Å²	138.1	66%	0.657	71%	0.71	S	S	*	*			trans	-65.7	147.3	149.2	55.1	0	0	0	0	109.2
1227	Q	22	Very low	23.2	Very low	167 Å²	167	135.7 Å²	135.7	78%	0.78	71%	0.706	S	S	*	*				170.2	142.9	121.4	-97.3	-177.8	31.3	0	0	112
1228	C	20.7	Very low	23.3	Very low	87 Å²	87	133.8 Å²	133.8	59%	0.588	70%	0.702	S	S	*	*			trans	63	145.4	138.8	-62.2	0	0	0	0	119.8
1229	Q	21.6	Very low	23.3	Very low	146 Å²	146	134.8 Å²	134.8	68%	0.682	70%	0.699	S	S	*	*			cis	-160	149.9	-6	-121.5	164.6	11.5	0	0	110.7
1230	Q	21.8	Very low	23.2	Very low	123 Å²	123	134.5 Å²	134.5	58%	0.575	70%	0.697	S	S	*	*			trans	41.7	136.7	135.8	-74	173.7	36.1	0	0	121.7
1231	K	22.2	Very low	23.2	Very low	161 Å²	161	134.6 Å²	134.6	70%	0.7	70%	0.698	S	S	*	*			trans	70.6	158.9	140.5	-68.4	166.2	-173.8	161.4	0	116
1232	T	22.8	Very low	23.2	Very low	111 Å²	111	132.2 Å²	132.2	68%	0.681	69%	0.691	S	S	*	*			cis	-145.1	129.6	-8.6	10.8	0	0	0	0	104.1
1233	D	25.1	Very low	23.2	Very low	122 Å²	122	132 Å²	132	65%	0.652	69%	0.685	S	S	*	*				67.2	151.3	87.9	-74.9	-65.6	0	0	0	115
1234	D	25.8	Very low	23.3	Very low	112 Å²	112	129.2 Å²	129.2	60%	0.599	69%	0.688	S	S	*	*			trans	67.6	108.2	173.4	-60.5	-41	0	0	0	116.8
1235	K	26.7	Very low	23.2	Very low	159 Å²	159	127.8 Å²	127.8	69%	0.691	68%	0.683	S	S	*	*				71.5	157.1	53.3	-60.7	-174.9	-151.6	73.8	0	112.8
1236	L	23.4	Very low	23.2	Very low	150 Å²	150	127.3 Å²	127.3	79%	0.785	68%	0.679	S	S	*	*			trans	94.6	129.1	165.4	-57.9	157.4	0	0	0	115.2
1237	V	24	Very low	23.2	Very low	113 Å²	113	129.6 Å²	129.6	69%	0.685	68%	0.684	S	S	*	*			cis	178.8	135.6	-28.5	127.2	0	0	0	0	104.5
1238	T	24.9	Very low	23.3	Very low	107 Å²	107	130.1 Å²	130.1	66%	0.656	68%	0.684	S	S	*	*			trans	8	135.5	162.4	69.8	0	0	0	0	120.1
1239	K	23.2	Very low	23.4	Very low	185 Å²	185	131.1 Å²	131.1	80%	0.804	69%	0.688	S	S	*	*				-162.5	149.1	99.4	-92	152.6	-176.8	-179.6	0	108.7
1240	S	22.3	Very low	23.6	Very low	83 Å²	83	129.3 Å²	129.3	58%	0.58	69%	0.691	S	S	*	*				67.7	127.7	54.1	124.8	0	0	0	0	110.8
1241	D	23.5	Very low	23.8	Very low	129 Å²	129	131.1 Å²	131.1	69%	0.69	71%	0.705	S	S	*	*			cis	-145.9	-164.2	-2.6	-72.5	-63.2	0	0	0	109.3
1242	N	23.9	Very low	24	Very low	131 Å²	131	126.6 Å²	126.6	70%	0.701	70%	0.704	S	S	*	*			trans	72.5	153.3	156.4	-67.8	18.3	0	0	0	117.4
1243	E	23.2	Very low	24.1	Very low	146 Å²	146	129.2 Å²	129.2	68%	0.682	71%	0.713	S	S	*	*			cis	-160.4	164.5	-14.1	-117.7	166.2	153.9	0	0	109.9
1244	T	22.8	Very low	24.1	Very low	129 Å²	129	127.4 Å²	127.4	79%	0.791	71%	0.708	S	S	*	*			trans	57.1	160.6	153.7	54.1	0	0	0	0	120
1245	S	21.3	Very low	24.1	Very low	87 Å²	87	129.4 Å²	129.4	61%	0.608	72%	0.724	S	S	*	*			cis	-171	169.8	-32.6	57.2	0	0	0	0	109.5
1246	I	23.2	Very low	24	Very low	131 Å²	131	127.3 Å²	127.3	67%	0.672	72%	0.719	S	S	*	*			trans	74.5	118.9	166.7	-55.1	154.4	0	0	0	113.1	F1248	I1246-F1248 HydrophobicContact CG2-CD2 3.79Å; I1246-F1248 HydrophobicContact CG2-CE2 3.87Å
1247	D	22.2	Very low	24	Very low	142 Å²	142	126.6 Å²	126.6	76%	0.759	72%	0.716	S	S	*	*			cis	90.1	164.5	41.8	-82.7	-50	0	0	0	115.7
1248	F	24.9	Very low	24	Very low	178 Å²	178	125.4 Å²	125.4	78%	0.781	71%	0.705	S	S	*	*			trans	78.3	89.4	-175	-55.4	-75	0	0	0	114.9	I1246	I1246-F1248 HydrophobicContact CG2-CD2 3.79Å; I1246-F1248 HydrophobicContact CG2-CE2 3.87Å
1249	T	23.7	Very low	24	Very low	109 Å²	109	125.3 Å²	125.3	67%	0.669	70%	0.7	S	S	*	*				72.8	100.8	55.5	79.1	0	0	0	0	116.3
1250	S	25	Very low	24	Very low	108 Å²	108	118.4 Å²	118.4	76%	0.755	67%	0.671	S	S	*	*			trans	-174.8	110.2	136	46.3	0	0	0	0	108.5
1251	N	25.3	Very low	24.1	Very low	161 Å²	161	119.8 Å²	119.8	86%	0.861	68%	0.675	S	S	*	*				67.8	102	83.7	-67	-19.6	0	0	0	113.1
1252	G	26.4	Very low	24.1	Very low	65 Å²	65	116.5 Å²	116.5	67%	0.67	67%	0.666	S	S	*	*			cis	153	-175.9	-10.9	0	0	0	0	0	114.4
1253	L	25.6	Very low	24.1	Very low	167 Å²	167	112.7 Å²	112.7	87%	0.874	65%	0.646	S	S	*	*			trans	67.1	157.6	167	-90.3	68	0	0	0	116.9
1254	P	24.6	Very low	24.1	Very low	84 Å²	84	107.2 Å²	107.2	55%	0.545	62%	0.624	S	S	.	*				-140.4	138.3	-53.4	30.8	-11.5	0	0	0	114.3	I1256	P1254-I1256 HydrophobicContact CB-CG1 4.27Å; P1254-I1256 HydrophobicContact CG-CD1 3.87Å; P1254-I1256 HydrophobicContact CG-CG1 3.98Å; P1254-I1256 PolarHBondContact O-N 2.91Å
1255	T	25.8	Very low	24.2	Very low	153 Å²	153	103 Å²	103	94%	0.939	60%	0.597	S	S	*	*			trans	-76	74.9	164.9	-40.8	0	0	0	0	111.2	N1257	T1255-N1257 PolarHBondContact O-N 3.25Å
1256	I	26	Very low	24.4	Very low	115 Å²	115	107.3 Å²	107.3	59%	0.59	61%	0.608	S	S	*	*			trans	-50.6	124.3	167.3	-74.2	159.5	0	0	0	108.4	P1254 L1258	P1254-I1256 HydrophobicContact CB-CG1 4.27Å; P1254-I1256 HydrophobicContact CG-CD1 3.87Å; P1254-I1256 HydrophobicContact CG-CG1 3.98Å; P1254-I1256 PolarHBondContact O-N 2.91Å; I1256-L1258 HydrophobicContact CG2-CD1 4.15Å
1257	N	22.7	Very low	24.6	Very low	136 Å²	136	106.5 Å²	106.5	73%	0.727	61%	0.614	S	S	*	*				68.5	166.9	53.1	-149	-5.4	0	0	0	112.5	T1255	T1255-N1257 PolarHBondContact O-N 3.25Å
1258	L	23.7	Very low	24.7	Very low	87 Å²	87	109.8 Å²	109.8	46%	0.455	62%	0.616	S	S	.	*			trans	61.6	91.4	179.3	-66.8	143.4	0	0	0	115.5	I1256	I1256-L1258 HydrophobicContact CG2-CD1 4.15Å
1259	I	24.2	Very low	24.8	Very low	105 Å²	105	111.4 Å²	111.4	54%	0.538	62%	0.617	S	S	.	*				65	151.8	76.5	-49.4	159.2	0	0	0	112.2	K1626	I1259-K1626 PolarHBondContact O-NZ 3.42Å
1260	E	24.3	Very low	24.8	Very low	41 Å²	41	116.6 Å²	116.6	19%	0.192	62%	0.624	C	S	.	*			trans	77.4	127.8	175.7	-52.4	107.4	-145.2	0	0	117.3	K1626 V1627 K1628	E1260-K1626 HydrophobicContact CB-CB 4.29Å; E1260-K1626 HydrophobicContact CB-CD 3.84Å; E1260-K1626 HydrophobicContact CB-CG 3.86Å; E1260-K1626 WeakPolarHBondContact O-CE 3.35Å; E1260-K1626 VanDerWaalsContact OE2-CA 3.28Å; E1260-K1626 WeakPolarHBondContact OE2-CA 3.21Å; E1260-K1626 WeakPolarHBondContact OE2-CD 3.46Å; E1260-V1627 VanDerWaalsContact OE1-CA 3.22Å; E1260-V1627 WeakPolarHBondContact OE1-CA 3.46Å; E1260-V1627 WeakPolarHBondContact OE2-CA 3.47Å; E1260-V1627 PolarHBondContact OE2-N 3.32Å; E1260-K1628 PolarHBondContact OE1-N 3.35Å
1261	T	23.4	Very low	24.9	Very low	111 Å²	111	116 Å²	116	68%	0.681	62%	0.616	S	S	*	*			cis	76.2	91.6	48.4	-51.9	0	0	0	0	112.7	K1626	T1261-K1626 PolarHBondContact O-N 3.2Å
1262	A	23.2	Very low	25	Very low	61 Å²	61	119.8 Å²	119.8	50%	0.504	62%	0.618	S	S	.	*			trans	69.4	165.2	162.5	0	0	0	0	0	116
1263	N	23.6	Very low	25	Very low	50 Å²	50	125.3 Å²	125.3	27%	0.267	62%	0.624	S	S	.	*			cis	-173	160.1	29.2	-134.6	-10.8	0	0	0	112.4	W1622 R1623 K1624	N1263-W1622 CarbonylContact C-O 3.54Å; N1263-W1622 WeakPolarHBondContact CA-O 3.43Å; N1263-W1622 WeakPolarHBondContact CB-O 3.37Å; N1263-W1622 PolarHBondContact ND2-O 3.43Å; N1263-W1622 VanDerWaalsContact OD1-C 3.31Å; N1263-W1622 WeakPolarHBondContact OD1-CB 3.18Å; N1263-W1622 VanDerWaalsContact OD1-CE3 3.31Å; N1263-W1622 PolarHBondContact OD1-O 3.02Å; N1263-R1623 HydrophobicContact CB-CG 4.48Å; N1263-R1623 PolarHBondContact O-NE 2.96Å; N1263-R1623 PolarHBondContact O-NH2 2.77Å; N1263-K1624 PolarHBondContact ND2-N 3Å; N1263-K1624 PolarHBondContact ND2-O 3.34Å
1264	C	24.6	Very low	25.2	Very low	32 Å²	32	120.8 Å²	120.8	22%	0.216	61%	0.605	C	S	.	*			trans	67.3	146.8	167.7	-104.7	0	0	0	0	121.2	W1622 R1623	C1264-W1622 WeakPolarHBondContact CA-O 3.11Å; C1264-W1622 WeakPolarHBondContact CB-O 3.42Å; C1264-W1622 PolarHBondContact N-O 3.3Å; C1264-W1622 VanDerWaalsContact SG-CA 3.59Å; C1264-W1622 PolarHBondContact SG-O 3.1Å; C1264-R1623 HydrophobicContact CB-CB 3.37Å; C1264-R1623 VanDerWaalsContact CB-CD 3.4Å; C1264-R1623 HydrophobicContact CB-CG 3.46Å; C1264-R1623 VanDerWaalsContact CB-CG 3.46Å; C1264-R1623 VanDerWaalsContact CB-NE 3.32Å; C1264-R1623 PolarHBondContact O-NH2 2.79Å; C1264-R1623 PolarHBondContact SG-N 3.38Å
1265	V	24.7	Very low	25.3	Very low	40 Å²	40	124.6 Å²	124.6	24%	0.242	62%	0.615	C	S	.	*				57.8	132.2	67.2	-164.6	0	0	0	0	112.3	R1623	V1265-R1623 PolarHBondContact O-NH1 2.99Å
1266	Q	24.4	Very low	25.4	Very low	177 Å²	177	122.2 Å²	122.2	83%	0.827	60%	0.596	S	S	*	*	S	Bend	cis	-96	144.7	7	-58.9	153.6	-22.4	0	0	109.8
1267	S	28	Very low	25.4	Very low	114 Å²	114	123 Å²	123	80%	0.797	60%	0.6	S	S	*	*			cis	-140.4	135.4	33.6	51.1	0	0	0	0	112.4
1268	R	25.1	Very low	25.5	Very low	212 Å²	212	124.6 Å²	124.6	80%	0.8	60%	0.601	S	S	*	*			trans	-145.6	97.7	179.5	-81.1	-171.8	173.2	-176.9	-1.5	113
1269	R	25.6	Very low	25.5	Very low	211 Å²	211	128.6 Å²	128.6	80%	0.796	62%	0.619	S	S	*	*			trans	-145.2	133.1	157.1	-76.5	-167.2	166.6	160.3	-4.4	111.2
1270	R	25.5	Very low	25.6	Very low	218 Å²	218	129.7 Å²	129.7	82%	0.823	62%	0.62	S	S	*	*			trans	65.8	76.2	169.3	-60.2	-176.6	178.3	172.2	-0.3	118.6
1271	T	26.9	Very low	25.6	Very low	97 Å²	97	135.9 Å²	135.9	60%	0.595	65%	0.649	S	S	*	*			trans	-127.1	128.9	130.1	48.8	0	0	0	0	108.7	F525	F525-T1271 HydrophobicContact CE1-CG2 4.31Å; F525-T1271 HydrophobicContact CE2-CG2 4.15Å; F525-T1271 HydrophobicContact CZ-CG2 3.69Å
1272	R	27.8	Very low	25.7	Very low	240 Å²	240	135.7 Å²	135.7	91%	0.906	65%	0.652	S	S	*	*			trans	-160.1	123.4	179.4	-108	-170.7	177	-172.2	-1	110.6
1273	K	25.9	Very low	26	Very low	181 Å²	181	140.2 Å²	140.2	79%	0.787	67%	0.668	S	S	*	*			trans	62.9	136.3	168.4	-66.5	-164.1	167.7	-161.5	0	117.7
1274	P	28.4	Very low	26.2	Very low	72 Å²	72	144 Å²	144	47%	0.468	68%	0.684	S	S	.	*	S	Bend	trans	-69.1	158.5	148	32.7	-32.8	0	0	0	110.1	L1276	P1274-L1276 PolarHBondContact O-N 3.22Å
1275	E	28.5	Very low	26.4	Very low	164 Å²	164	150 Å²	150	77%	0.766	71%	0.71	S	S	*	*			trans	-82.1	101.7	-160.7	-62.8	-176.8	128.1	0	0	114
1276	L	27.5	Very low	26.5	Very low	102 Å²	102	154 Å²	154	53%	0.534	73%	0.73	S	S	.	*			trans	-89.2	97.8	160	-109.7	163.9	0	0	0	108.9	Y612 P1274 F1278	Y612-L1276 HydrophobicContact CD2-CD1 4.06Å; Y612-L1276 HydrophobicContact CE2-CD1 3.71Å; P1274-L1276 PolarHBondContact O-N 3.22Å; L1276-F1278 PolarHBondContact O-N 3.01Å; L1276-F1278 VanDerWaalsContact O-N 3.16Å
1277	I	25.2	Very low	26.5	Very low	131 Å²	131	150.8 Å²	150.8	67%	0.672	73%	0.727	S	S	*	*			trans	-68.8	110.1	-177.2	-59.7	176.2	0	0	0	110.4	M1279	I1277-M1279 HydrophobicContact CG2-CG 4.48Å
1278	F	24.9	Very low	26.4	Very low	170 Å²	170	150.2 Å²	150.2	75%	0.746	72%	0.723	S	S	*	*			trans	-134.7	92.2	154.9	-110.1	-74.7	0	0	0	109.1	L1276 K1280 L1554	L1276-F1278 PolarHBondContact O-N 3.01Å; L1276-F1278 VanDerWaalsContact O-N 3.16Å; F1278-K1280 PolarHBondContact O-N 3.37Å; F1278-L1554 HydrophobicContact CE1-CD1 4.28Å
1279	M	24.3	Very low	26.4	Very low	171 Å²	171	146 Å²	146	84%	0.842	72%	0.721	S	S	*	*			trans	-74.3	109.9	172.9	-76.4	175.1	61.7	0	0	110.5	I1277	I1277-M1279 HydrophobicContact CG2-CG 4.48Å
1280	K	26.2	Very low	26.5	Very low	128 Å²	128	142 Å²	142	56%	0.557	72%	0.72	S	S	*	*			trans	-127.2	87	154.6	-89.1	-174.3	174.7	173.1	0	110	F1278 N1558	F1278-K1280 PolarHBondContact O-N 3.37Å; K1280-N1558 PolarHBondContact NZ-ND2 3.37Å; K1280-N1558 PolarHBondContact NZ-OD1 2.97Å
1281	Q	24.3	Very low	26.5	Very low	172 Å²	172	136.5 Å²	136.5	80%	0.804	72%	0.715	S	S	*	*			trans	37.6	147.3	138.7	-64.9	172.2	-31.1	0	0	121.4
1282	S	25.6	Very low	26.8	Very low	106 Å²	106	137.5 Å²	137.5	74%	0.741	72%	0.723	S	S	*	*			trans	70.7	140.9	157	65.4	0	0	0	0	118.3
1283	N	28.2	Very low	26.7	Very low	156 Å²	156	131.7 Å²	131.7	83%	0.834	72%	0.717	S	S	*	*			cis	-150	174.1	-5.7	-109.5	-1.6	0	0	0	112.2
1284	H	28.9	Very low	26.8	Very low	131 Å²	131	132.3 Å²	132.3	61%	0.606	72%	0.719	S	S	*	*			trans	-76.9	158.9	-179.6	-67	-133.1	0	0	0	113.8
1285	M	29.2	Very low	26.9	Very low	157 Å²	157	132.9 Å²	132.9	77%	0.773	72%	0.718	S	S	*	*				170.6	115.5	100.2	-84.6	-52.5	-179.9	0	0	114
1286	D	26	Very low	26.8	Very low	124 Å²	124	127.4 Å²	127.4	66%	0.663	69%	0.693	S	S	*	*				42.8	110.2	123.5	-57	5.7	0	0	0	123.2
1287	S	24.9	Very low	26.7	Very low	109 Å²	109	125.3 Å²	125.3	76%	0.762	68%	0.68	S	S	*	*				80.9	144.5	121.4	81.9	0	0	0	0	124.1
1288	S	24.9	Very low	26.8	Very low	102 Å²	102	124.7 Å²	124.7	71%	0.713	68%	0.678	S	S	*	*			trans	91.2	151.3	146.8	83.4	0	0	0	0	121.6
1289	T	26	Very low	26.8	Very low	123 Å²	123	121.8 Å²	121.8	76%	0.755	68%	0.677	S	S	*	*			trans	82.7	114.5	162.9	63.2	0	0	0	0	122.6
1290	V	27.1	Very low	27	Very low	127 Å²	127	121.1 Å²	121.1	77%	0.77	68%	0.677	S	S	*	*				74.3	95.5	125.2	-178.2	0	0	0	0	121
1291	S	25.5	Very low	27.1	Very low	104 Å²	104	121.3 Å²	121.3	73%	0.727	68%	0.683	S	S	*	*			trans	39.9	145.9	138.5	60.2	0	0	0	0	124.9
1292	P	33.3	Very low	27.3	Very low	118 Å²	118	121.1 Å²	121.1	77%	0.766	68%	0.68	S	S	*	*			trans	-97.5	175.3	179.2	41.4	-37.5	0	0	0	114.6
1293	P	26.6	Very low	27.5	Very low	118 Å²	118	123.3 Å²	123.3	77%	0.766	68%	0.679	S	S	*	*			trans	-141.2	149.1	131.7	37.3	-23.9	0	0	0	117.2
1294	K	28.1	Very low	27.6	Very low	194 Å²	194	121.7 Å²	121.7	84%	0.843	67%	0.674	S	S	*	*			trans	19.9	148.4	137.4	-60.1	179.3	-178.2	-178	0	121.8
1295	N	29	Very low	27.4	Very low	83 Å²	83	121.2 Å²	121.2	44%	0.444	68%	0.681	S	S	.	*			cis	-169.3	174.1	-26	-154.8	-11.2	0	0	0	110.5	V1397 K1398 W1399 R1400	N1295-V1397 WeakPolarHBondContact ND2-CA 3.27Å; N1295-K1398 CarbonylContact C-O 3.34Å; N1295-K1398 VanDerWaalsContact CB-O 3.28Å; N1295-K1398 WeakPolarHBondContact CB-O 3.39Å; N1295-K1398 VanDerWaalsContact O-O 3.12Å; N1295-W1399 WeakPolarHBondContact O-CA 3.13Å; N1295-R1400 PolarHBondContact O-N 3.4Å
1296	E	27.8	Very low	27.4	Very low	49 Å²	49	121.7 Å²	121.7	23%	0.229	68%	0.684	C	S	.	*			trans	58	170.6	149.6	-123.5	-152.9	-158.2	0	0	122.6	V1397 K1398 W1399 R1400	E1296-V1397 VanDerWaalsContact CD-C 3.43Å; E1296-V1397 HydrophobicContact CG-CB 3.86Å; E1296-V1397 HydrophobicContact CG-CG1 3.27Å; E1296-V1397 WeakPolarHBondContact OE1-CB 3.5Å; E1296-V1397 VanDerWaalsContact OE1-CG1 3.28Å; E1296-V1397 WeakPolarHBondContact OE1-CG1 3.3Å; E1296-K1398 VanDerWaalsContact CD-N 3.25Å; E1296-K1398 VanDerWaalsContact CD-NZ 3.3Å; E1296-K1398 IonicContact OE1-NZ 2.92Å; E1296-K1398 PolarHBondContact OE1-NZ 3.26Å; E1296-K1398 VanDerWaalsContact OE2-C 3.22Å; E1296-K1398 WeakPolarHBondContact OE2-CA 3.28Å; E1296-K1398 WeakPolarHBondContact OE2-CE 3.25Å; E1296-K1398 IonicContact OE2-NZ 2.8Å; E1296-K1398 PolarHBondContact OE2-NZ 3.17Å; E1296-W1399 HydrophobicContact CB-CB 3.75Å; E1296-W1399 VanDerWaalsContact CB-CD1 3.42Å; E1296-W1399 HydrophobicContact CB-CG 3.57Å; E1296-W1399 VanDerWaalsContact CB-N 3.27Å; E1296-W1399 HydrophobicContact CG-CB 4.44Å; E1296-W1399 HydrophobicContact CG-CG 4.07Å; E1296-W1399 WeakPolarHBondContact O-CA 3.35Å; E1296-W1399 WeakPolarHBondContact OE2-CA 3.3Å; E1296-W1399 WeakPolarHBondContact OE2-CB 3.28Å; E1296-W1399 PolarHBondContact OE2-N 2.95Å; E1296-R1400 PolarHBondContact O-N 3.34Å; E1296-R1400 VanDerWaalsContact O-N 3.12Å
1297	E	25.1	Very low	27.3	Very low	58 Å²	58	124.3 Å²	124.3	27%	0.271	69%	0.685	S	S	.	*			trans	79.5	119.8	132.9	-79.2	168	-139.5	0	0	126.9	K1398 W1399 R1400	E1297-K1398 WeakPolarHBondContact OE1-CE 3.27Å; E1297-K1398 IonicContact OE1-NZ 2.72Å; E1297-K1398 PolarHBondContact OE1-NZ 3.13Å; E1297-W1399 VanDerWaalsContact CA-CB 3.48Å; E1297-W1399 HydrophobicContact CB-CB 3.27Å; E1297-W1399 HydrophobicContact CB-CD2 3.44Å; E1297-W1399 VanDerWaalsContact CB-CD2 3.44Å; E1297-W1399 HydrophobicContact CB-CG 2.68Å; E1297-W1399 HydrophobicContact CG-CB 3.99Å; E1297-W1399 HydrophobicContact CG-CG 3.56Å; E1297-W1399 VanDerWaalsContact N-CE3 3.26Å; E1297-W1399 VanDerWaalsContact N-CZ2 3.34Å; E1297-W1399 WeakPolarHBondContact O-CZ3 3.47Å; E1297-R1400 VanDerWaalsContact CB-NH2 3.26Å; E1297-R1400 IonicContact OE2-CZ 3.31Å; E1297-R1400 VanDerWaalsContact OE2-CZ 3.31Å; E1297-R1400 IonicContact OE2-NH1 3.28Å; E1297-R1400 PolarHBondContact OE2-NH1 2.83Å; E1297-R1400 IonicContact OE2-NH2 2.65Å; E1297-R1400 PolarHBondContact OE2-NH2 3.41Å
1298	L	27.2	Very low	27.5	Very low	118 Å²	118	127.3 Å²	127.3	62%	0.618	69%	0.691	S	S	*	*			cis	-121.3	161.9	7.6	-68.4	97.3	0	0	0	109.9	R1400	L1298-R1400 VanDerWaalsContact CD1-NH2 3.26Å
1299	C	24.8	Very low	27.5	Very low	109 Å²	109	125 Å²	125	74%	0.736	68%	0.675	S	S	*	*			cis	68.4	115.4	45.2	-70.3	0	0	0	0	116
1300	L	27.6	Very low	27.6	Very low	158 Å²	158	125.4 Å²	125.4	83%	0.827	67%	0.672	S	S	*	*			trans	-161.5	111.9	162.3	-103.6	173.6	0	0	0	109.5
1301	N	29.2	Very low	27.6	Very low	131 Å²	131	123.7 Å²	123.7	70%	0.701	67%	0.666	S	S	*	*			trans	34.9	147.4	138.6	-55.8	-6.8	0	0	0	121.3
1302	K	29	Very low	27.7	Very low	168 Å²	168	124.9 Å²	124.9	73%	0.73	66%	0.664	S	S	*	*			cis	-161.1	171.4	-10.8	-101.8	178	-171.9	-174	0	104.9
1303	E	30.2	Very low	27.6	Very low	153 Å²	153	126 Å²	126	72%	0.715	66%	0.659	S	S	*	*			cis	-164.6	169.7	43.9	-141.7	122	-113.1	0	0	111.8
1304	T	28.9	Very low	27.5	Very low	121 Å²	121	127.4 Å²	127.4	74%	0.742	66%	0.655	S	S	*	*			trans	-11.2	138.3	170.9	48.3	0	0	0	0	120.9
1305	V	25.9	Very low	27.4	Very low	122 Å²	122	122.9 Å²	122.9	74%	0.739	64%	0.64	S	S	*	*			cis	87.6	103.5	21.6	-173.3	0	0	0	0	117.6	R1307	V1305-R1307 HydrophobicContact CG1-CB 4.12Å
1306	I	28.3	Very low	27.4	Very low	166 Å²	166	126.6 Å²	126.6	85%	0.851	65%	0.652	S	S	*	*			trans	-147.5	129.8	141.6	-59.4	-176.2	0	0	0	103.9
1307	R	25	Very low	27.4	Very low	179 Å²	179	129.9 Å²	129.9	68%	0.675	67%	0.672	S	S	*	*			cis	77.1	100.4	5.8	-165.2	-169.3	169	-154.4	-2.8	118.6	V1305 S1309	V1305-R1307 HydrophobicContact CG1-CB 4.12Å; R1307-S1309 PolarHBondContact NE-OG 2.91Å; R1307-S1309 PolarHBondContact NH2-OG 2.89Å
1308	I	28.3	Very low	27.6	Very low	172 Å²	172	134.8 Å²	134.8	88%	0.882	69%	0.694	S	S	*	*				-108	144.9	128.4	-66.8	179.2	0	0	0	107.5
1309	S	24.4	Very low	27.4	Very low	55 Å²	55	134.2 Å²	134.2	39%	0.385	70%	0.696	S	S	.	*			trans	-139.1	166.4	174.1	62.3	0	0	0	0	108.8	R1307	R1307-S1309 PolarHBondContact NE-OG 2.91Å; R1307-S1309 PolarHBondContact NH2-OG 2.89Å
1310	N	28.9	Very low	27.4	Very low	130 Å²	130	136.2 Å²	136.2	70%	0.695	70%	0.699	S	S	*	*			trans	156	125.2	140.4	-78.5	2.8	0	0	0	108.1
1311	S	26.1	Very low	27.3	Very low	92 Å²	92	133 Å²	133	64%	0.643	69%	0.691	S	S	*	*				74.9	141.6	88.3	101.4	0	0	0	0	112.1
1312	N	29.1	Very low	27	Very low	129 Å²	129	134.9 Å²	134.9	69%	0.69	70%	0.695	S	S	*	*			cis	-161.9	-176.8	20.7	-126	-8.5	0	0	0	111.8
1313	H	30.6	Very low	26.8	Very low	141 Å²	141	133.3 Å²	133.3	65%	0.653	69%	0.693	S	S	*	*			trans	11.4	130.1	160.6	-63.2	-74.9	0	0	0	121.3
1314	Q	24.3	Very low	26.5	Very low	147 Å²	147	130 Å²	130	69%	0.687	69%	0.687	S	S	*	*				94.5	147.5	58.2	-143.9	-167.3	-51.9	0	0	113
1315	D	26	Very low	26.4	Very low	99 Å²	99	130.4 Å²	130.4	53%	0.529	69%	0.685	S	S	.	*			trans	76	126.1	158.7	-85	30.2	0	0	0	121.5
1316	K	28.5	Very low	26.6	Very low	161 Å²	161	132.6 Å²	132.6	70%	0.7	69%	0.687	S	S	*	*			trans	85.7	124.6	139.9	-69	170.4	-178.9	110.4	0	121.6
1317	N	27.7	Very low	26.5	Very low	118 Å²	118	130.1 Å²	130.1	63%	0.631	68%	0.684	S	S	*	*			trans	71.4	150.5	131.1	-63.8	27.7	0	0	0	118.4
1318	E	28.9	Very low	26.7	Very low	161 Å²	161	124.5 Å²	124.5	75%	0.752	68%	0.682	S	S	*	*			cis	-150.3	176.9	-10.3	-124.6	151.9	174.5	0	0	111.9
1319	T	23.8	Very low	26.8	Very low	107 Å²	107	121.9 Å²	121.9	66%	0.656	67%	0.674	S	S	*	*			trans	-63.4	161.8	178.7	51.6	0	0	0	0	115
1320	N	25.1	Very low	27.1	Very low	150 Å²	150	129.4 Å²	129.4	80%	0.802	70%	0.696	S	S	*	*			trans	72.9	157.8	155.6	-59.5	-15	0	0	0	115.7
1321	S	25.3	Very low	27.1	Very low	92 Å²	92	127.5 Å²	127.5	64%	0.643	70%	0.698	S	S	*	*			cis	-164.1	139.1	-7.8	32	0	0	0	0	111.2
1322	E	22.8	Very low	27.3	Very low	169 Å²	169	134.4 Å²	134.4	79%	0.79	71%	0.71	S	S	*	*			trans	60.2	175.4	139.8	-59.1	-176.4	135.2	0	0	121.8
1323	I	25.6	Very low	27.3	Very low	136 Å²	136	132.4 Å²	132.4	70%	0.697	71%	0.706	S	S	*	*			trans	67.2	73.2	151.6	-67.3	148.5	0	0	0	118.3
1324	S	24.1	Very low	27.4	Very low	84 Å²	84	131.5 Å²	131.5	59%	0.587	71%	0.711	S	S	*	*				85.7	155	110.9	82.8	0	0	0	0	123.4
1325	N	26	Very low	27.8	Very low	129 Å²	129	130.1 Å²	130.1	69%	0.69	71%	0.708	S	S	*	*			trans	85.3	128.1	137.1	-76.5	-29.8	0	0	0	122.8
1326	Q	29	Very low	28.2	Very low	168 Å²	168	131.3 Å²	131.3	79%	0.785	71%	0.714	S	S	*	*			trans	72	145.5	145.2	-66.6	167.9	16.9	0	0	119.5
1327	S	26.5	Very low	28.3	Very low	114 Å²	114	130.6 Å²	130.6	80%	0.797	71%	0.713	S	S	*	*			cis	-174	145	-27.5	47.5	0	0	0	0	110.2
1328	G	30.8	Very low	28.6	Very low	61 Å²	61	130.3 Å²	130.3	63%	0.629	71%	0.712	S	S	*	*			trans	145.4	81	170	0	0	0	0	0	113.9
1329	T	30.4	Very low	28.7	Very low	117 Å²	117	129 Å²	129	72%	0.718	71%	0.71	S	S	*	*				64.1	126.4	88.9	65.2	0	0	0	0	114.1
1330	Y	29.4	Very low	28.8	Very low	212 Å²	212	128.9 Å²	128.9	83%	0.831	71%	0.713	S	S	*	*			cis	-138.2	138	17.6	-82.7	-86.1	0	0	0	111
1331	A	29	Very low	29.3	Very low	91 Å²	91	127.3 Å²	127.3	75%	0.752	71%	0.712	S	S	*	*				64.9	141.9	98.3	0	0	0	0	0	116.3
1332	R	31	Very low	29.4	Very low	237 Å²	237	129.4 Å²	129.4	89%	0.894	72%	0.72	S	S	*	*			cis	-150.6	166.5	21.2	-158.5	170.2	-175.4	169.3	1.4	113.8
1333	S	28.8	Very low	29.5	Very low	87 Å²	87	128.8 Å²	128.8	61%	0.608	72%	0.722	S	S	*	*			trans	-58.6	167.4	-178.4	56.3	0	0	0	0	116.2
1334	V	33.5	Very low	29.7	Very low	122 Å²	122	130.7 Å²	130.7	74%	0.739	73%	0.728	S	S	*	*				-151	124.9	62.3	172.6	0	0	0	0	109.1
1335	N	31.8	Very low	29.8	Very low	117 Å²	117	133.5 Å²	133.5	63%	0.626	74%	0.736	S	S	*	*				62	139.7	87	-90.1	61.6	0	0	0	114.1
1336	D	35.2	Very low	30.1	Very low	124 Å²	124	134.2 Å²	134.2	66%	0.663	74%	0.74	S	S	*	*			cis	-136.9	141.5	24.2	-85.6	-46.1	0	0	0	112.1
1337	Q	30.8	Very low	29.9	Very low	146 Å²	146	135.7 Å²	135.7	68%	0.682	74%	0.744	S	S	*	*				60.2	138.1	94.5	-70.8	-165.7	23.1	0	0	116.5
1338	N	32.3	Very low	30.1	Very low	113 Å²	113	137.5 Å²	137.5	60%	0.604	74%	0.743	S	S	*	*			cis	-152.8	157.4	13.2	-102.5	-33.2	0	0	0	114.3
1339	N	31.3	Very low	29.8	Very low	132 Å²	132	142.8 Å²	142.8	71%	0.706	75%	0.751	S	S	*	*			trans	40.4	129.5	147.9	-53	-24.8	0	0	0	121.8
1340	S	25.6	Very low	29.5	Very low	105 Å²	105	143.2 Å²	143.2	73%	0.734	75%	0.753	S	S	*	*			cis	97	149.4	27.3	84	0	0	0	0	115.7
1341	P	35.4	Very low	29.5	Very low	118 Å²	118	138.8 Å²	138.8	77%	0.766	75%	0.749	S	S	*	*			trans	-128.1	165.3	-148.3	42.9	-29.4	0	0	0	118.2
1342	T	28.6	Very low	29.2	Very low	135 Å²	135	143.5 Å²	143.5	83%	0.828	75%	0.752	S	S	*	*			trans	-165.7	142.7	155.1	20.5	0	0	0	0	106.4
1343	L	25.1	Very low	29.2	Very low	156 Å²	156	139.5 Å²	139.5	82%	0.817	75%	0.747	S	S	*	*			cis	77.8	87.7	31.9	-159.4	167.1	0	0	0	113.6
1344	E	28.7	Very low	29	Very low	177 Å²	177	139.3 Å²	139.3	83%	0.827	75%	0.745	S	S	*	*			trans	-161.5	176.1	137.8	-120.3	-178.5	174.9	0	0	114.2
1345	N	27.1	Very low	28.6	Very low	143 Å²	143	139.3 Å²	139.3	77%	0.765	75%	0.746	S	S	*	*			trans	-73.9	159.1	-170.8	-53.2	-86.4	0	0	0	113.5
1346	D	32	Very low	28.3	Very low	143 Å²	143	140 Å²	140	77%	0.765	75%	0.749	S	S	*	*				-152.8	154.8	118.3	-137.5	-25	0	0	0	114.4
1347	K	25.4	Very low	28.1	Very low	199 Å²	199	140.7 Å²	140.7	87%	0.865	75%	0.752	S	S	*	*			trans	-127.6	100.2	175.4	-79.3	177.7	179.6	169.2	0	109.7
1348	I	30.6	Very low	27.8	Very low	153 Å²	153	140.7 Å²	140.7	79%	0.785	75%	0.752	S	S	*	*			trans	-125.2	125.7	167.4	-63.2	-175.2	0	0	0	110.6
1349	Q	23.9	Very low	27.7	Very low	172 Å²	172	141.7 Å²	141.7	80%	0.804	76%	0.758	S	S	*	*			trans	-92.1	174.8	170.1	-65.9	-179.8	-28	0	0	110.1
1350	V	25.1	Very low	27.6	Very low	125 Å²	125	142.2 Å²	142.2	76%	0.758	76%	0.76	S	S	*	*			trans	73.8	136.1	168.8	-151.1	0	0	0	0	110.4
1351	T	28.8	Very low	27.9	Very low	119 Å²	119	144.1 Å²	144.1	73%	0.73	76%	0.761	S	S	*	*			cis	-150.3	159.7	41.4	-44.4	0	0	0	0	113
1352	K	23.2	Very low	27.6	Very low	191 Å²	191	142.6 Å²	142.6	83%	0.83	75%	0.753	S	S	*	*			trans	-81.8	134.7	168.2	-56.3	166.6	-180	171.4	0	110.9
1353	I	30.6	Very low	27.7	Very low	152 Å²	152	144.4 Å²	144.4	78%	0.779	75%	0.753	S	S	*	*			trans	-153.9	116.7	147.2	-77.9	111.7	0	0	0	103.6
1354	S	23.7	Very low	28.1	Very low	83 Å²	83	142.1 Å²	142.1	58%	0.58	75%	0.75	S	S	*	*			cis	77.9	120.9	27.4	87.4	0	0	0	0	115.7
1355	T	25.5	Very low	28.3	Very low	123 Å²	123	138 Å²	138	76%	0.755	74%	0.741	S	S	*	*			trans	67.4	153.6	164.3	68	0	0	0	0	116.3
1356	I	25.4	Very low	28.5	Very low	132 Å²	132	138.8 Å²	138.8	68%	0.677	74%	0.744	S	S	*	*			cis	-158.8	164.7	-14.5	-113.9	165.6	0	0	0	108.5
1357	N	30.3	Very low	28.3	Very low	137 Å²	137	135.9 Å²	135.9	73%	0.733	73%	0.734	S	S	*	*			trans	110.4	149.3	166.2	-64.7	-34.9	0	0	0	116.2
1358	Q	26	Very low	28.5	Very low	146 Å²	146	132.3 Å²	132.3	68%	0.682	73%	0.73	S	S	*	*			cis	173.6	152.1	-47	-106.9	-174.9	0	0	0	107.7
1359	N	29.5	Very low	28.4	Very low	135 Å²	135	132.8 Å²	132.8	72%	0.722	73%	0.733	S	S	*	*			trans	69.8	139.7	173.3	-42.4	-38.9	0	0	0	113.7
1360	N	29.8	Very low	28.7	Very low	142 Å²	142	131.4 Å²	131.4	76%	0.759	73%	0.731	S	S	*	*			cis	-159.5	176.9	1.3	-115	-3	0	0	0	108.5
1361	L	31.6	Very low	29.1	Very low	146 Å²	146	129.5 Å²	129.5	76%	0.764	72%	0.721	S	S	*	*			cis	-145.6	-67.2	6.6	-145.1	171.4	0	0	0	113.4
1362	S	28.6	Very low	29.2	Very low	85 Å²	85	130.8 Å²	130.8	59%	0.594	72%	0.724	S	S	*	*			trans	-157.5	171.6	-159.5	61.1	0	0	0	0	111.6
1363	E	31.8	Very low	29.4	Very low	174 Å²	174	125.4 Å²	125.4	81%	0.813	71%	0.71	S	S	*	*			cis	-161.1	142.7	13.7	-149.1	156.1	-109	0	0	113.8
1364	S	32.7	Very low	29.4	Very low	108 Å²	108	124.3 Å²	124.3	76%	0.755	71%	0.706	S	S	*	*			trans	65.2	150.8	152.8	124	0	0	0	0	119.7
1365	S	33.4	Very low	29.7	Very low	91 Å²	91	128.2 Å²	128.2	64%	0.636	71%	0.713	S	S	*	*			cis	-153.1	133.4	-2.2	-81.8	0	0	0	0	112.8
1366	L	30.4	Very low	29.8	Very low	159 Å²	159	127.4 Å²	127.4	83%	0.832	71%	0.708	S	S	*	*			trans	45.9	145.6	141.3	-73.9	88.7	0	0	0	122.8
1367	S	28.7	Very low	30	Very low	81 Å²	81	127.1 Å²	127.1	57%	0.566	71%	0.707	S	S	*	*			cis	-174.8	145.8	-10.5	49.4	0	0	0	0	114
1368	T	28.5	Very low	29.9	Very low	125 Å²	125	126.1 Å²	126.1	77%	0.767	70%	0.702	S	S	*	*			trans	65.4	151.4	146.3	54.1	0	0	0	0	120.4
1369	L	29.6	Very low	30.1	Very low	162 Å²	162	125.7 Å²	125.7	85%	0.848	70%	0.703	S	S	*	*			cis	-147.1	170.4	1.6	-126	162.4	0	0	0	111.9
1370	N	28.8	Very low	30	Very low	143 Å²	143	123.3 Å²	123.3	77%	0.765	70%	0.697	S	S	*	*			trans	-112.3	-164.2	-174.4	-137.5	5	0	0	0	108.5
1371	P	34.8	Very low	30	Very low	86 Å²	86	123.2 Å²	123.2	56%	0.558	70%	0.696	S	S	*	*			cis	-137.1	-155.5	-11.4	32.1	-6.5	0	0	0	113.8
1372	D	31	Very low	29.9	Very low	145 Å²	145	121.9 Å²	121.9	78%	0.775	69%	0.689	S	S	*	*			trans	87.7	146.9	148.6	-65.8	-19.6	0	0	0	122.7
1373	S	27.1	Very low	29.9	Very low	79 Å²	79	124.2 Å²	124.2	55%	0.552	70%	0.695	S	S	*	*			cis	-170.2	160.7	-35.8	62.5	0	0	0	0	109.4
1374	N	29.6	Very low	29.6	Very low	129 Å²	129	120.2 Å²	120.2	69%	0.69	69%	0.686	S	S	*	*			trans	65.9	155.7	158.6	-66.7	-62	0	0	0	116.8
1375	K	30.4	Very low	29.4	Very low	165 Å²	165	120 Å²	120	72%	0.717	68%	0.684	S	S	*	*			cis	-155.4	135.3	-4	-129	165.9	-172	-179.8	0	112.5
1376	T	28.2	Very low	29	Very low	106 Å²	106	122.6 Å²	122.6	65%	0.65	69%	0.691	S	S	*	*			trans	57.8	135.7	135.9	49.7	0	0	0	0	124
1377	N	28.9	Very low	28.9	Very low	126 Å²	126	119.2 Å²	119.2	67%	0.674	68%	0.681	S	S	*	*			trans	77.9	145.3	137.8	-67	33.4	0	0	0	118.4
1378	D	28.8	Very low	28.7	Very low	115 Å²	115	123 Å²	123	62%	0.615	70%	0.695	S	S	*	*			cis	-155.6	165.3	-2.4	-119.9	-23.1	0	0	0	114.7
1379	L	30.3	Very low	28.8	Very low	137 Å²	137	121.6 Å²	121.6	72%	0.717	70%	0.696	S	S	*	*			trans	43.6	111.6	151.2	-58.8	166.2	0	0	0	118.7
1380	S	26.7	Very low	28.5	Very low	85 Å²	85	121.3 Å²	121.3	59%	0.594	70%	0.696	S	S	*	*			cis	92.6	168.1	43.4	78.2	0	0	0	0	114.7
1381	I	30.5	Very low	28.5	Very low	141 Å²	141	121 Å²	121	72%	0.723	70%	0.699	S	S	*	*			trans	74.4	129	165.4	-64	162.5	0	0	0	114.9
1382	N	28.5	Very low	27.9	Very low	117 Å²	117	123.2 Å²	123.2	63%	0.626	71%	0.711	S	S	*	*			cis	-166.7	167.2	-19.9	-110.7	-9.3	0	0	0	108.9
1383	N	28.2	Very low	27.6	Very low	135 Å²	135	122.3 Å²	122.3	72%	0.722	71%	0.711	S	S	*	*			trans	37	150.3	136.1	-56.8	-7.1	0	0	0	121.7
1384	S	26.7	Very low	27.5	Very low	90 Å²	90	126.3 Å²	126.3	63%	0.629	72%	0.721	S	S	*	*			cis	175.1	161	-15	54.6	0	0	0	0	107.5
1385	S	28.4	Very low	27.3	Very low	102 Å²	102	127.2 Å²	127.2	71%	0.713	72%	0.724	S	S	*	*			trans	68.1	160.5	156.6	91.2	0	0	0	0	115.4
1386	N	25.5	Very low	27.1	Very low	146 Å²	146	123.5 Å²	123.5	78%	0.781	72%	0.716	S	S	*	*			cis	-159.4	179.7	-23.2	-121.8	-1.7	0	0	0	109.5
1387	S	27.1	Very low	26.9	Very low	89 Å²	89	122.6 Å²	122.6	62%	0.622	71%	0.711	S	S	*	*			trans	61.1	123.1	147.2	58.7	0	0	0	0	120.5
1388	N	25.5	Very low	26.8	Very low	161 Å²	161	122.3 Å²	122.3	86%	0.861	70%	0.704	S	S	*	*				54.7	115.8	126.7	-47.8	2.4	0	0	0	119.2
1389	A	29.7	Very low	26.6	Very low	95 Å²	95	121.4 Å²	121.4	79%	0.785	69%	0.692	S	S	*	*				-169.3	140.9	108.6	0	0	0	0	0	111
1390	D	24	Very low	26.4	Very low	156 Å²	156	121.5 Å²	121.5	83%	0.834	68%	0.682	S	S	*	*			trans	-67.6	145.2	157.6	-57	-83.6	0	0	0	110.1
1391	T	28.5	Very low	26.3	Very low	136 Å²	136	127.3 Å²	127.3	83%	0.834	69%	0.691	S	S	*	*			trans	-168.8	135.2	140	7.5	0	0	0	0	112.3
1392	T	22.4	Very low	26	Very low	132 Å²	132	124.8 Å²	124.8	81%	0.81	69%	0.691	S	S	*	*			trans	-85.8	137.2	164.3	44.3	0	0	0	0	110.2
1393	T	25	Very low	25.9	Very low	127 Å²	127	128 Å²	128	78%	0.779	70%	0.7	S	S	*	*			trans	170.7	120.6	153.8	26.2	0	0	0	0	108.5
1394	H	25.1	Very low	25.8	Very low	163 Å²	163	126.4 Å²	126.4	76%	0.755	70%	0.695	S	S	*	*				72.8	129.8	81.6	-92.9	-86.2	0	0	0	116.9
1395	I	25.1	Very low	25.8	Very low	147 Å²	147	128.6 Å²	128.6	75%	0.754	70%	0.696	S	S	*	*			trans	74.7	142.9	145.3	-65.8	165.2	0	0	0	117.3
1396	P	26.3	Very low	25.6	Very low	87 Å²	87	131.4 Å²	131.4	57%	0.565	70%	0.695	S	S	*	*			cis	-139.4	162.4	-30.7	38.9	-19	0	0	0	116.9
1397	V	24.6	Very low	25.7	Very low	87 Å²	87	130.5 Å²	130.5	53%	0.527	70%	0.695	S	S	.	*				10.7	117.5	114.2	-121.8	0	0	0	0	116.8	N1295 E1296	N1295-V1397 WeakPolarHBondContact ND2-CA 3.27Å; E1296-V1397 VanDerWaalsContact CD-C 3.43Å; E1296-V1397 HydrophobicContact CG-CB 3.86Å; E1296-V1397 HydrophobicContact CG-CG1 3.27Å; E1296-V1397 WeakPolarHBondContact OE1-CB 3.5Å; E1296-V1397 VanDerWaalsContact OE1-CG1 3.28Å; E1296-V1397 WeakPolarHBondContact OE1-CG1 3.3Å
1398	K	26.2	Very low	25.7	Very low	121 Å²	121	133 Å²	133	53%	0.526	70%	0.701	S	S	.	*			trans	-160.7	129.4	158.4	-136.2	64.1	-120	141.8	0	120	N1295 E1296 E1297	N1295-K1398 CarbonylContact C-O 3.34Å; N1295-K1398 VanDerWaalsContact CB-O 3.28Å; N1295-K1398 WeakPolarHBondContact CB-O 3.39Å; N1295-K1398 VanDerWaalsContact O-O 3.12Å; E1296-K1398 VanDerWaalsContact CD-N 3.25Å; E1296-K1398 VanDerWaalsContact CD-NZ 3.3Å; E1296-K1398 IonicContact OE1-NZ 2.92Å; E1296-K1398 PolarHBondContact OE1-NZ 3.26Å; E1296-K1398 VanDerWaalsContact OE2-C 3.22Å; E1296-K1398 WeakPolarHBondContact OE2-CA 3.28Å; E1296-K1398 WeakPolarHBondContact OE2-CE 3.25Å; E1296-K1398 IonicContact OE2-NZ 2.8Å; E1296-K1398 PolarHBondContact OE2-NZ 3.17Å; E1297-K1398 WeakPolarHBondContact OE1-CE 3.27Å; E1297-K1398 IonicContact OE1-NZ 2.72Å; E1297-K1398 PolarHBondContact OE1-NZ 3.13Å
1399	W	24	Very low	25.8	Very low	96 Å²	96	130.2 Å²	130.2	36%	0.364	69%	0.694	S	S	.	*			trans	-87.2	152.3	-149.1	-112.1	97.2	0	0	0	122.3	N1295 E1296 E1297	N1295-W1399 WeakPolarHBondContact O-CA 3.13Å; E1296-W1399 HydrophobicContact CB-CB 3.75Å; E1296-W1399 VanDerWaalsContact CB-CD1 3.42Å; E1296-W1399 HydrophobicContact CB-CG 3.57Å; E1296-W1399 VanDerWaalsContact CB-N 3.27Å; E1296-W1399 HydrophobicContact CG-CB 4.44Å; E1296-W1399 HydrophobicContact CG-CG 4.07Å; E1296-W1399 WeakPolarHBondContact O-CA 3.35Å; E1296-W1399 WeakPolarHBondContact OE2-CA 3.3Å; E1296-W1399 WeakPolarHBondContact OE2-CB 3.28Å; E1296-W1399 PolarHBondContact OE2-N 2.95Å; E1297-W1399 VanDerWaalsContact CA-CB 3.48Å; E1297-W1399 HydrophobicContact CB-CB 3.27Å; E1297-W1399 HydrophobicContact CB-CD2 3.44Å; E1297-W1399 VanDerWaalsContact CB-CD2 3.44Å; E1297-W1399 HydrophobicContact CB-CG 2.68Å; E1297-W1399 HydrophobicContact CG-CB 3.99Å; E1297-W1399 HydrophobicContact CG-CG 3.56Å; E1297-W1399 VanDerWaalsContact N-CE3 3.26Å; E1297-W1399 VanDerWaalsContact N-CZ2 3.34Å; E1297-W1399 WeakPolarHBondContact O-CZ3 3.47Å
1400	R	25.7	Very low	25.7	Very low	138 Å²	138	133.3 Å²	133.3	52%	0.521	69%	0.692	S	S	.	*			trans	94.7	145.6	159.3	-60.3	144.2	-171.2	141.3	1.4	117.7	N1295 E1296 E1297 L1298	N1295-R1400 PolarHBondContact O-N 3.4Å; E1296-R1400 PolarHBondContact O-N 3.34Å; E1296-R1400 VanDerWaalsContact O-N 3.12Å; E1297-R1400 VanDerWaalsContact CB-NH2 3.26Å; E1297-R1400 IonicContact OE2-CZ 3.31Å; E1297-R1400 VanDerWaalsContact OE2-CZ 3.31Å; E1297-R1400 IonicContact OE2-NH1 3.28Å; E1297-R1400 PolarHBondContact OE2-NH1 2.83Å; E1297-R1400 IonicContact OE2-NH2 2.65Å; E1297-R1400 PolarHBondContact OE2-NH2 3.41Å; L1298-R1400 VanDerWaalsContact CD1-NH2 3.26Å
1401	R	24.7	Very low	25.9	Very low	208 Å²	208	135.2 Å²	135.2	79%	0.785	69%	0.689	S	S	*	*			cis	101.8	129.5	14.6	-170.6	-166.4	-168.5	-178.4	4	115
1402	A	25.1	Very low	25.7	Very low	88 Å²	88	135.7 Å²	135.7	73%	0.727	69%	0.687	S	S	*	*			trans	75.7	167.9	171.7	0	0	0	0	0	114.7
1403	K	25.2	Very low	26	Very low	183 Å²	183	136 Å²	136	80%	0.796	69%	0.688	S	S	*	*			cis	-158.9	170.5	14.7	-144.4	177.1	-170.8	179.6	0	109.3
1404	T	26.6	Very low	26	Very low	103 Å²	103	137.1 Å²	137.1	63%	0.632	69%	0.689	S	S	*	*			trans	61.3	147.7	151.5	50.1	0	0	0	0	119.6
1405	E	26.1	Very low	26	Very low	136 Å²	136	133 Å²	133	64%	0.636	68%	0.684	S	S	*	*			cis	-153.2	172	-6.5	-124.6	163.7	159.8	0	0	116.5
1406	K	24.7	Very low	26	Very low	161 Å²	161	136.4 Å²	136.4	70%	0.7	69%	0.687	S	S	*	*			trans	-29.7	142.4	164	-49	140.1	-173.3	164.3	0	114.2
1407	T	28.3	Very low	25.8	Very low	126 Å²	126	139.5 Å²	139.5	77%	0.773	70%	0.698	S	S	*	*				-167.7	152.9	99	20.6	0	0	0	0	112.9
1408	N	26.7	Very low	25.8	Very low	141 Å²	141	142.4 Å²	142.4	75%	0.754	71%	0.709	S	S	*	*			trans	1.8	151.2	135.7	-39.3	-17.5	0	0	0	116.7
1409	S	27.8	Very low	25.7	Very low	104 Å²	104	141.6 Å²	141.6	73%	0.727	71%	0.714	S	S	*	*			cis	-151.3	145.1	26.9	-52.9	0	0	0	0	108.7
1410	H	26.6	Very low	25.9	Very low	160 Å²	160	145 Å²	145	74%	0.741	74%	0.738	S	S	*	*				59.9	141.2	79.8	-94.9	67.3	0	0	0	116.3
1411	Y	28.3	Very low	25.8	Very low	196 Å²	196	148.7 Å²	148.7	77%	0.769	75%	0.752	S	S	*	*			trans	70.5	126.3	-178.4	-52.7	-74.3	0	0	0	115.3
1412	N	25.6	Very low	26	Very low	146 Å²	146	148.9 Å²	148.9	78%	0.781	75%	0.752	S	S	*	*				64.4	92.5	51.3	-71.1	0.2	0	0	0	114
1413	T	29	Very low	26	Very low	137 Å²	137	154.8 Å²	154.8	84%	0.84	76%	0.756	S	S	*	*				-157.9	120.3	116	31.4	0	0	0	0	106.2
1414	D	23.9	Very low	26.1	Very low	151 Å²	151	152 Å²	152	81%	0.807	75%	0.749	S	S	*	*				59.6	106	66.2	-103.3	-26.2	0	0	0	115.9
1415	A	25	Very low	26.1	Very low	78 Å²	78	155.3 Å²	155.3	65%	0.645	76%	0.757	S	S	*	*			trans	65.8	168.6	145.9	0	0	0	0	0	120.7
1416	R	25.1	Very low	26.3	Very low	217 Å²	217	153.6 Å²	153.6	82%	0.819	76%	0.76	S	S	*	*			trans	71.7	126.1	172	-59.2	130.1	-170.1	-145.1	2.1	113.6
1417	I	22.4	Very low	26.6	Very low	153 Å²	153	152.5 Å²	152.5	79%	0.785	77%	0.767	S	S	*	*			cis	67.4	149.2	38.1	-45.8	168.3	0	0	0	110.9
1418	I	24.6	Very low	26.7	Very low	148 Å²	148	149.3 Å²	149.3	76%	0.759	76%	0.759	S	S	*	*			trans	79.6	98.9	-175.1	-47.8	176.7	0	0	0	111.2
1419	T	24.3	Very low	26.9	Very low	104 Å²	104	149 Å²	149	64%	0.638	76%	0.762	S	S	*	*			cis	85.9	93.4	45.4	-54	0	0	0	0	113.9	R1421	T1419-R1421 HydrophobicContact CG2-CB 4.11Å
1420	I	28.7	Very low	27	Very low	168 Å²	168	150.1 Å²	150.1	86%	0.862	76%	0.76	S	S	*	*			trans	-128.6	109.5	154.9	-56.2	178.3	0	0	0	105.5
1421	R	23.9	Very low	27	Very low	214 Å²	214	147.3 Å²	147.3	81%	0.808	76%	0.755	S	S	*	*			cis	87.4	74.2	22.2	-155.3	-172.8	-169.6	176.9	4.9	115.5	T1419	T1419-R1421 HydrophobicContact CG2-CB 4.11Å
1422	R	28.2	Very low	27	Very low	213 Å²	213	148.9 Å²	148.9	80%	0.804	76%	0.759	S	S	*	*			trans	-162.3	120.1	149.6	-97.2	136.3	-162.9	-148.2	5.1	106.9
1423	R	24.4	Very low	27.1	Very low	212 Å²	212	147.9 Å²	147.9	80%	0.8	75%	0.754	S	S	*	*				83.1	131.8	79.9	-89.6	-170.1	-178.9	160.3	-1.7	111
1424	L	28.7	Very low	27	Very low	124 Å²	124	146.4 Å²	146.4	65%	0.649	75%	0.745	S	S	*	*			cis	-131.9	158.8	3	-60.6	95.4	0	0	0	110.7
1425	Q	26.4	Very low	27.2	Very low	173 Å²	173	148.1 Å²	148.1	81%	0.808	75%	0.745	S	S	*	*				54.6	140.8	112.7	-61.6	167.5	-26.6	0	0	116.1
1426	S	30.7	Very low	27.3	Very low	99 Å²	99	151.9 Å²	151.9	69%	0.692	75%	0.754	S	S	*	*			cis	-148.3	156.1	24.7	55.1	0	0	0	0	115
1427	T	29.4	Very low	27.5	Very low	139 Å²	139	148.6 Å²	148.6	85%	0.853	75%	0.748	S	S	*	*			trans	36.4	127.5	144.9	57	0	0	0	0	121
1428	G	31.5	Very low	27.7	Very low	59 Å²	59	148.1 Å²	148.1	61%	0.608	74%	0.742	S	S	*	*			cis	147.7	172.3	-2.3	0	0	0	0	0	112.6
1429	T	29.6	Very low	27.8	Very low	133 Å²	133	146.8 Å²	146.8	82%	0.816	74%	0.736	S	S	*	*			trans	61.5	152	162.8	59.9	0	0	0	0	118.2
1430	N	30.4	Very low	27.8	Very low	128 Å²	128	148.7 Å²	148.7	68%	0.684	74%	0.741	S	S	*	*			cis	-156	127.3	-15.2	-106.9	-0.1	0	0	0	107
1431	T	27.3	Very low	27.6	Very low	102 Å²	102	146.3 Å²	146.3	63%	0.626	74%	0.735	S	S	*	*				60	147.6	96.7	69.8	0	0	0	0	117.5
1432	W	28.4	Very low	27.7	Very low	228 Å²	228	141.5 Å²	141.5	86%	0.864	73%	0.734	S	S	*	*			trans	88.7	151.9	165.6	-63.3	3.7	0	0	0	118.3
1433	N	27.1	Very low	27.8	Very low	125 Å²	125	137 Å²	137	67%	0.668	74%	0.735	S	S	*	*			cis	-167.6	136.3	-42.8	-122.3	-8.7	0	0	0	111.1
1434	T	27.1	Very low	27.8	Very low	106 Å²	106	136.1 Å²	136.1	65%	0.65	74%	0.737	S	S	*	*			trans	48.9	147.2	145.7	64.1	0	0	0	0	123
1435	K	27.4	Very low	27.8	Very low	188 Å²	188	136.9 Å²	136.9	82%	0.817	74%	0.741	S	S	*	*			trans	75.3	151.5	159.3	-66.2	166.9	-177.1	178.8	0	115.6
1436	L	28.6	Very low	27.7	Very low	156 Å²	156	135.7 Å²	135.7	82%	0.817	74%	0.735	S	S	*	*			cis	-141.1	-164.3	-1	-128	163.7	0	0	0	112
1437	H	28.1	Very low	27.4	Very low	149 Å²	149	138.4 Å²	138.4	69%	0.69	74%	0.737	S	S	*	*			trans	-85.2	156.4	-162	-104.3	-134.4	0	0	0	116.1
1438	E	27.3	Very low	27.4	Very low	142 Å²	142	137.1 Å²	137.1	66%	0.664	73%	0.734	S	S	*	*			trans	77.9	120.8	137.7	-79.7	174.8	-134.9	0	0	124.2
1439	N	26.1	Very low	27.1	Very low	121 Å²	121	145.8 Å²	145.8	65%	0.647	75%	0.748	S	S	*	*				91.2	116.7	123.9	-73.1	-22.9	0	0	0	122.8
1440	I	25.2	Very low	27.2	Very low	143 Å²	143	144.2 Å²	144.2	73%	0.733	74%	0.74	S	S	*	*			trans	94.2	118.2	133.5	-68	167.8	0	0	0	119.6
1441	T	24.7	Very low	27	Very low	119 Å²	119	143.8 Å²	143.8	73%	0.73	74%	0.742	S	S	*	*			trans	64.9	116	158.8	48	0	0	0	0	123.8
1442	S	24.8	Very low	27	Very low	112 Å²	112	146.6 Å²	146.6	78%	0.783	75%	0.748	S	S	*	*				58.3	97.6	117.5	-48.9	0	0	0	0	122.7
1443	S	30.3	Very low	26.8	Very low	118 Å²	118	142.6 Å²	142.6	83%	0.825	74%	0.743	S	S	*	*			trans	-168.9	143.1	144.5	19	0	0	0	0	108.1
1444	K	25.4	Very low	26.8	Very low	194 Å²	194	142.3 Å²	142.3	84%	0.843	75%	0.746	S	S	*	*			cis	91.9	141	42.9	-96.4	-163.4	174.3	-169.1	0	114.4
1445	L	27.3	Very low	26.6	Very low	141 Å²	141	143.3 Å²	143.3	74%	0.738	75%	0.751	S	S	*	*			trans	82.4	91.7	160.9	-64.2	153	0	0	0	120.8
1446	E	24.5	Very low	26.6	Very low	147 Å²	147	140.8 Å²	140.8	69%	0.687	75%	0.747	S	S	*	*				59.8	136.3	101.4	-70.8	-161.6	94.2	0	0	126.4
1447	Q	25.8	Very low	26.4	Very low	157 Å²	157	138 Å²	138	73%	0.734	74%	0.736	S	S	*	*			trans	89.5	149.2	134.1	-78.9	179.3	43.9	0	0	124.9
1448	S	28.4	Very low	26.4	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	74%	0.739	S	S	*	*			trans	90.7	95.6	158.2	70.5	0	0	0	0	123.1
1449	R	25.5	Very low	26.2	Very low	241 Å²	241	137.9 Å²	137.9	91%	0.909	74%	0.742	S	S	*	*				32	159.5	114.5	-73.1	-174.5	173.8	-173.6	-0.9	122.2
1450	P	31.7	Very low	26.3	Very low	100 Å²	100	140.5 Å²	140.5	65%	0.649	75%	0.748	S	S	*	*			cis	-149.9	-170.9	-47.5	44.2	-23.8	0	0	0	116.2
1451	T	26.6	Very low	26.3	Very low	119 Å²	119	143 Å²	143	73%	0.73	75%	0.754	S	S	*	*			trans	75.7	151	148.2	52.2	0	0	0	0	126.3
1452	H	27.7	Very low	26.5	Very low	160 Å²	160	146.9 Å²	146.9	74%	0.741	76%	0.761	S	S	*	*			trans	84	89.5	152.9	-75.2	-68.4	0	0	0	124.9
1453	L	23.3	Very low	26.5	Very low	145 Å²	145	148.3 Å²	148.3	76%	0.759	76%	0.76	S	S	*	*				66.6	155.2	114.7	-94.2	153.1	0	0	0	125.9
1454	T	26.8	Very low	26.4	Very low	119 Å²	119	148 Å²	148	73%	0.73	76%	0.757	S	S	*	*			trans	78.3	84.7	154.9	28.5	0	0	0	0	124
1455	V	24.3	Very low	26.6	Very low	126 Å²	126	143.4 Å²	143.4	76%	0.764	75%	0.75	S	S	*	*				20.8	123.9	114.2	-179.5	0	0	0	0	119.6
1456	N	26.1	Very low	26.5	Very low	135 Å²	135	143.6 Å²	143.6	72%	0.722	75%	0.75	S	S	*	*				-178.3	149.1	93.6	-136.6	-2.8	0	0	0	118.5
1457	T	25.5	Very low	26.5	Very low	98 Å²	98	143 Å²	143	60%	0.601	75%	0.751	S	S	*	*			trans	13.8	159.6	154.9	46.6	0	0	0	0	127.9
1458	N	27.1	Very low	26.5	Very low	139 Å²	139	145.5 Å²	145.5	74%	0.743	76%	0.756	S	S	*	*			trans	100	140.2	154.1	-62	-38.3	0	0	0	118.7
1459	M	24.3	Very low	26.3	Very low	149 Å²	149	147.2 Å²	147.2	73%	0.734	75%	0.754	S	S	*	*			cis	-166.3	168.4	-15.7	-131.2	-168	-173.9	0	0	113.7
1460	K	27.8	Very low	26.4	Very low	176 Å²	176	141 Å²	141	77%	0.765	75%	0.745	S	S	*	*			trans	78.2	88.6	149.2	-74.3	165.5	175.6	167.3	0	124.2
1461	F	24.5	Very low	26	Very low	195 Å²	195	140.7 Å²	140.7	86%	0.855	74%	0.743	S	S	*	*				19.3	140.1	125.7	-74.2	-86.6	0	0	0	125.6
1462	K	28.2	Very low	25.9	Very low	202 Å²	202	142.2 Å²	142.2	88%	0.878	75%	0.745	S	S	*	*				174.7	152.8	129.3	-97.2	170.4	-179.7	179.8	0	109.7
1463	N	26.1	Very low	25.8	Very low	142 Å²	142	142.6 Å²	142.6	76%	0.759	75%	0.745	S	S	*	*			cis	-163.2	178.6	-35.5	-137.5	24.4	0	0	0	109.3
1464	S	28.4	Very low	26	Very low	110 Å²	110	142.7 Å²	142.7	77%	0.769	74%	0.741	S	S	*	*			trans	73.5	134.8	175.9	76.1	0	0	0	0	116.7
1465	S	28.2	Very low	25.9	Very low	99 Å²	99	145.3 Å²	145.3	69%	0.692	74%	0.743	S	S	*	*			cis	-153.9	143.6	-3.7	-87.8	0	0	0	0	112.8
1466	I	26.5	Very low	26.3	Very low	145 Å²	145	144.2 Å²	144.2	74%	0.744	74%	0.741	S	S	*	*			trans	53.1	131.9	136.3	-59.9	165.9	0	0	0	118.9
1467	D	24.7	Very low	26.3	Very low	133 Å²	133	148.4 Å²	148.4	71%	0.711	75%	0.746	S	S	*	*			cis	-160.4	151.3	-26.7	-85.2	-33.9	0	0	0	103.9
1468	Y	25.4	Very low	26.4	Very low	211 Å²	211	152.2 Å²	152.2	83%	0.827	76%	0.762	S	S	*	*				-171.5	155.6	59.5	-142.6	-88.4	0	0	0	108.6
1469	I	24.2	Very low	26.2	Very low	147 Å²	147	153.1 Å²	153.1	75%	0.754	76%	0.759	S	S	*	*			trans	-142.5	137.7	173.7	-54	175.2	0	0	0	110.2
1470	P	26.7	Very low	26.3	Very low	110 Å²	110	152.1 Å²	152.1	71%	0.714	76%	0.756	S	S	*	*			trans	-127.7	166.5	138.4	4.7	18.3	0	0	0	113.5
1471	P	24.1	Very low	26.2	Very low	95 Å²	95	147.1 Å²	147.1	62%	0.617	74%	0.74	S	S	*	*			trans	-139.6	172.6	-141.1	43.7	-26.9	0	0	0	118.1
1472	I	25.2	Very low	26.3	Very low	151 Å²	151	149 Å²	149	77%	0.774	74%	0.742	S	S	*	*			trans	71.5	142.1	144	-78.2	163.1	0	0	0	115.7
1473	K	25.6	Very low	26.2	Very low	168 Å²	168	146.5 Å²	146.5	73%	0.73	73%	0.733	S	S	*	*			cis	-159.5	132.4	41.2	-149.8	149.3	-162.7	175.3	0	112.3
1474	Q	25.8	Very low	26.3	Very low	146 Å²	146	144 Å²	144	68%	0.682	72%	0.723	S	S	*	*			trans	55.8	155.4	145.8	-66	-178.3	25.4	0	0	119.1
1475	K	26.3	Very low	26.2	Very low	175 Å²	175	147.3 Å²	147.3	76%	0.761	72%	0.724	S	S	*	*			cis	-156	153.8	2.8	-116.2	155.7	176.2	170.3	0	106.1
1476	S	32.3	Very low	26.1	Very low	103 Å²	103	148 Å²	148	72%	0.72	72%	0.724	S	S	*	*			cis	-165.6	121.5	-21.5	39.4	0	0	0	0	111.3
1477	R	25.2	Very low	26.1	Very low	222 Å²	222	150 Å²	150	84%	0.838	73%	0.73	S	S	*	*			trans	9.8	133.3	151.2	-71.1	172.8	167.4	169	-3	119.6
1478	L	27.1	Very low	26.2	Very low	179 Å²	179	148.1 Å²	148.1	94%	0.937	73%	0.728	S	S	*	*				-117.6	150.4	119.2	-98.6	169.8	0	0	0	109.8
1479	K	23.9	Very low	26.1	Very low	157 Å²	157	146.8 Å²	146.8	68%	0.683	73%	0.729	S	S	*	*			trans	-135.5	94.1	-162.3	179.2	-154.7	173.5	-161.4	0	109.7
1480	I	25.7	Very low	26.2	Very low	129 Å²	129	147.3 Å²	147.3	66%	0.662	73%	0.733	S	S	*	*			trans	-98.5	114.9	-178.3	-65.6	-178.1	0	0	0	109.6	T1484	I1480-T1484 HydrophobicContact CG2-CG2 3.88Å; I1480-T1484 WeakPolarHBondContact CG2-OG1 3.38Å
1481	T	26.5	Very low	26.2	Very low	71 Å²	71	148.6 Å²	148.6	44%	0.436	73%	0.733	S	S	.	*			trans	-82.8	175.5	175.4	45.7	0	0	0	0	111.5	E1483	T1481-E1483 PolarHBondContact O-N 3.3Å; T1481-E1483 PolarHBondContact OG1-OE2 3.48Å
1482	R	26	Very low	26.3	Very low	235 Å²	235	155 Å²	155	89%	0.887	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	20.7	-166.5	-146.1	175	-167.8	154.2	3.4	114.8
1483	E	26.6	Very low	26.4	Very low	148 Å²	148	155.8 Å²	155.8	69%	0.692	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.7	-11.1	-165.2	-67.7	150.3	145.1	0	0	112.8	T1481 F1485	T1481-E1483 PolarHBondContact O-N 3.3Å; T1481-E1483 PolarHBondContact OG1-OE2 3.48Å; E1483-F1485 VanDerWaalsContact C-N 3.31Å; E1483-F1485 PolarHBondContact O-N 3.26Å
1484	T	27.6	Very low	26.6	Very low	91 Å²	91	154.4 Å²	154.4	56%	0.558	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-0.4	177.7	59.4	0	0	0	0	114.2	I1480 T1486	I1480-T1484 HydrophobicContact CG2-CG2 3.88Å; I1480-T1484 WeakPolarHBondContact CG2-OG1 3.38Å; T1484-T1486 VanDerWaalsContact C-N 3.34Å; T1484-T1486 PolarHBondContact O-N 3.16Å
1485	F	27.6	Very low	27	Very low	178 Å²	178	152.5 Å²	152.5	78%	0.781	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	15.4	-173.4	-83.7	-83.4	0	0	0	114.1	E1483	E1483-F1485 VanDerWaalsContact C-N 3.31Å; E1483-F1485 PolarHBondContact O-N 3.26Å
1486	T	24.6	Very low	27.5	Very low	114 Å²	114	150.3 Å²	150.3	70%	0.699	74%	0.738	S	S	*	*			trans	-141.9	70.9	-176.2	51.3	0	0	0	0	113.1	T1484	T1484-T1486 VanDerWaalsContact C-N 3.34Å; T1484-T1486 PolarHBondContact O-N 3.16Å
1487	Q	27.6	Very low	27.9	Very low	186 Å²	186	151.1 Å²	151.1	87%	0.869	73%	0.734	S	S	*	*			trans	-156.4	125.9	155.9	-114	155.6	35.6	0	0	112.8
1488	S	25.4	Very low	28.5	Very low	95 Å²	95	144.1 Å²	144.1	66%	0.664	72%	0.716	S	S	*	*			trans	12.7	122.5	154.7	52.6	0	0	0	0	118.9
1489	Q	24.6	Very low	29.1	Very low	183 Å²	183	140.1 Å²	140.1	86%	0.855	69%	0.694	S	S	*	*				45.1	87.4	72.7	-69.7	-172.7	-53.6	0	0	114.2
1490	N	25.8	Very low	30.3	Very low	157 Å²	157	137.3 Å²	137.3	84%	0.84	69%	0.686	S	S	*	*			trans	179	-178.9	141.2	-95.1	-18.1	0	0	0	110.1
1491	I	27.1	Very low	31.5	Very low	138 Å²	138	138.4 Å²	138.4	71%	0.708	69%	0.686	S	S	*	*			trans	76.2	84	170.4	-49.3	-178.9	0	0	0	114.1	E1493	I1491-E1493 WeakPolarHBondContact CG2-O 3.45Å
1492	Y	25.6	Very low	32	Very low	229 Å²	229	141.2 Å²	141.2	90%	0.898	69%	0.69	S	S	*	*				-63.2	158.5	128.4	-85.8	-111	0	0	0	108.2
1493	E	27.3	Very low	32.8	Very low	168 Å²	168	133 Å²	133	79%	0.785	66%	0.663	S	S	*	*			trans	81.5	92	-170.9	-52.8	174.5	172.6	0	0	113.8	I1491	I1491-E1493 WeakPolarHBondContact CG2-O 3.45Å
1494	L	29.3	Very low	34.1	Very low	139 Å²	139	129 Å²	129	73%	0.728	65%	0.649	S	S	*	*			trans	-89.4	125.1	154.4	-101.5	76.2	0	0	0	107.9
1495	N	34.7	Very low	34.8	Very low	106 Å²	106	130.1 Å²	130.1	57%	0.567	65%	0.648	S	S	*	*			trans	-70.8	155.9	174.2	-78.3	-10.6	0	0	0	111.8	D1497 T1498	N1495-D1497 VanDerWaalsContact C-N 3.27Å; N1495-D1497 PolarHBondContact O-N 3.1Å; N1495-T1498 PolarHBondContact N-OG1 3.23Å; N1495-T1498 PolarHBondContact O-N 3.01Å; N1495-T1498 VanDerWaalsContact O-N 3.11Å; N1495-T1498 PolarHBondContact O-OG1 2.88Å
1496	N	36.6	Very low	35.6	Very low	128 Å²	128	124.6 Å²	124.6	68%	0.684	63%	0.626	S	S	*	*	H	α-helix	trans	-55.7	-40.9	176.5	-66.7	-17.5	0	0	0	112.1	T1498 M1499 D1500	N1496-T1498 PolarHBondContact O-N 3.37Å; N1496-T1498 VanDerWaalsContact O-N 3.1Å; N1496-M1499 CarbonylContact O-C 3.52Å; N1496-M1499 WeakPolarHBondContact O-CA 3.31Å; N1496-M1499 WeakPolarHBondContact O-CB 3.33Å; N1496-M1499 PolarHBondContact O-N 2.97Å; N1496-D1500 PolarHBondContact O-N 2.99Å
1497	D	41.5	Very low	36.7	Very low	121 Å²	121	125.7 Å²	125.7	65%	0.647	62%	0.623	S	S	*	*	H	α-helix	trans	-52.7	-35.7	177.8	-46.2	3.3	0	0	0	113.1	N1495 K1501	N1495-D1497 VanDerWaalsContact C-N 3.27Å; N1495-D1497 PolarHBondContact O-N 3.1Å; D1497-K1501 WeakPolarHBondContact O-CB 3.32Å; D1497-K1501 PolarHBondContact O-N 3.05Å
1498	T	38	Very low	37.7	Very low	74 Å²	74	124.3 Å²	124.3	45%	0.454	62%	0.616	S	S	.	*	H	α-helix	trans	-74.3	-25.5	176.5	14.1	0	0	0	0	113.2	N1495 N1496	N1495-T1498 PolarHBondContact N-OG1 3.23Å; N1495-T1498 PolarHBondContact O-N 3.01Å; N1495-T1498 VanDerWaalsContact O-N 3.11Å; N1495-T1498 PolarHBondContact O-OG1 2.88Å; N1496-T1498 PolarHBondContact O-N 3.37Å; N1496-T1498 VanDerWaalsContact O-N 3.1Å
1499	M	38.3	Very low	38.5	Very low	96 Å²	96	126.2 Å²	126.2	47%	0.473	62%	0.619	S	S	.	*	H	α-helix	trans	-78.5	-46.5	171.8	-105.6	-62	-166.2	0	0	111.6	N1496 K1501 Y1502 N1503	N1496-M1499 CarbonylContact O-C 3.52Å; N1496-M1499 WeakPolarHBondContact O-CA 3.31Å; N1496-M1499 WeakPolarHBondContact O-CB 3.33Å; N1496-M1499 PolarHBondContact O-N 2.97Å; M1499-K1501 PolarHBondContact O-N 3.21Å; M1499-Y1502 CarbonylContact O-C 3.54Å; M1499-Y1502 WeakPolarHBondContact O-CA 3.42Å; M1499-Y1502 WeakPolarHBondContact O-CB 3.47Å; M1499-Y1502 PolarHBondContact O-N 3.19Å; M1499-N1503 VanDerWaalsContact O-CG 3.28Å; M1499-N1503 PolarHBondContact O-N 2.84Å; M1499-N1503 PolarHBondContact O-ND2 3.29Å
1500	D	49.4	Very low	39.3	Very low	97 Å²	97	119.9 Å²	119.9	52%	0.519	59%	0.591	S	S	.	*	H	α-helix	trans	-62.2	-35	-178.6	-67	-28.8	0	0	0	112.3	N1496 Y1502 N1503 T1504	N1496-D1500 PolarHBondContact O-N 2.99Å; D1500-Y1502 VanDerWaalsContact C-N 3.32Å; D1500-N1503 PolarHBondContact O-N 3.27Å; D1500-T1504 PolarHBondContact O-N 3.43Å; D1500-T1504 PolarHBondContact O-OG1 3.1Å
1501	K	51	Low	40.1	Very low	153 Å²	153	116.2 Å²	116.2	67%	0.665	58%	0.575	S	S	*	*	H	α-helix	trans	-68.9	-28.1	172.4	-161.2	168.9	-170.6	170.7	0	113.6	D1497 M1499 T1504 E1505	D1497-K1501 WeakPolarHBondContact O-CB 3.32Å; D1497-K1501 PolarHBondContact O-N 3.05Å; M1499-K1501 PolarHBondContact O-N 3.21Å; K1501-T1504 WeakPolarHBondContact CA-OG1 3.38Å; K1501-T1504 PolarHBondContact O-OG1 3.31Å; K1501-E1505 PolarHBondContact O-N 2.92Å
1502	Y	36.8	Very low	40.5	Very low	130 Å²	130	118.3 Å²	118.3	51%	0.51	58%	0.578	S	S	.	*	H	α-helix	trans	-79.2	-38.2	174	-132.2	-86.9	0	0	0	111.4	M1499 D1500 E1505 I1506	M1499-Y1502 CarbonylContact O-C 3.54Å; M1499-Y1502 WeakPolarHBondContact O-CA 3.42Å; M1499-Y1502 WeakPolarHBondContact O-CB 3.47Å; M1499-Y1502 PolarHBondContact O-N 3.19Å; D1500-Y1502 VanDerWaalsContact C-N 3.32Å; Y1502-E1505 PolarHBondContact O-N 3.1Å; Y1502-I1506 HydrophobicContact CD1-CD1 4.22Å; Y1502-I1506 WeakPolarHBondContact O-CG1 3.35Å; Y1502-I1506 PolarHBondContact O-N 3.23Å
1503	N	44.1	Very low	41.1	Very low	63 Å²	63	113.7 Å²	113.7	34%	0.337	57%	0.57	S	S	.	*	H	α-helix	trans	-60.8	-44.5	174.8	-66.9	-30.8	0	0	0	110.9	M1499 D1500 E1505 I1506 E1507	M1499-N1503 VanDerWaalsContact O-CG 3.28Å; M1499-N1503 PolarHBondContact O-N 2.84Å; M1499-N1503 PolarHBondContact O-ND2 3.29Å; D1500-N1503 PolarHBondContact O-N 3.27Å; N1503-E1505 PolarHBondContact O-N 3.04Å; N1503-I1506 WeakPolarHBondContact O-CB 3.34Å; N1503-I1506 PolarHBondContact O-N 3.39Å; N1503-I1506 VanDerWaalsContact O-N 3.1Å; N1503-E1507 PolarHBondContact O-N 2.83Å
1504	T	53.1	Low	42	Very low	64 Å²	64	110.1 Å²	110.1	39%	0.393	55%	0.553	S	S	.	*	H	α-helix	trans	-66.3	-31.8	175.7	32.7	0	0	0	0	113.8	D1500 K1501 Q1508	D1500-T1504 PolarHBondContact O-N 3.43Å; D1500-T1504 PolarHBondContact O-OG1 3.1Å; K1501-T1504 WeakPolarHBondContact CA-OG1 3.38Å; K1501-T1504 PolarHBondContact O-OG1 3.31Å; T1504-Q1508 VanDerWaalsContact O-CG 3.26Å; T1504-Q1508 WeakPolarHBondContact O-CG 3.36Å; T1504-Q1508 PolarHBondContact O-N 3.41Å
1505	E	42.7	Very low	42.5	Very low	113 Å²	113	107.5 Å²	107.5	53%	0.528	54%	0.539	S	S	.	.	H	α-helix	trans	-70.3	-30.4	169.9	-76.5	-167.7	167.1	0	0	112.5	K1501 Y1502 N1503 N1509	K1501-E1505 PolarHBondContact O-N 2.92Å; Y1502-E1505 PolarHBondContact O-N 3.1Å; N1503-E1505 PolarHBondContact O-N 3.04Å; E1505-N1509 PolarHBondContact O-ND2 3.36Å
1506	I	44.8	Very low	42.7	Very low	62 Å²	62	111.1 Å²	111.1	32%	0.318	55%	0.546	S	S	.	.	H	α-helix	trans	-70.9	-46.7	175.3	-70.1	166	0	0	0	111	Y1502 N1503 Q1508 N1509 L1510	Y1502-I1506 HydrophobicContact CD1-CD1 4.22Å; Y1502-I1506 WeakPolarHBondContact O-CG1 3.35Å; Y1502-I1506 PolarHBondContact O-N 3.23Å; N1503-I1506 WeakPolarHBondContact O-CB 3.34Å; N1503-I1506 PolarHBondContact O-N 3.39Å; N1503-I1506 VanDerWaalsContact O-N 3.1Å; I1506-Q1508 VanDerWaalsContact C-N 3.26Å; I1506-Q1508 PolarHBondContact O-N 2.79Å; I1506-N1509 PolarHBondContact O-N 3.42Å; I1506-L1510 HydrophobicContact CG2-CD1 4.21Å; I1506-L1510 PolarHBondContact O-N 2.84Å
1507	E	47.9	Very low	43.2	Very low	137 Å²	137	111.1 Å²	111.1	64%	0.64	55%	0.546	S	S	*	.	H	α-helix	trans	-58.3	-37.4	176.7	-71.6	-177.3	156.6	0	0	112.4	N1503 N1509	N1503-E1507 PolarHBondContact O-N 2.83Å; E1507-N1509 VanDerWaalsContact C-N 3.26Å; E1507-N1509 PolarHBondContact O-N 3.16Å
1508	Q	48.3	Very low	43.5	Very low	157 Å²	157	106.9 Å²	106.9	73%	0.734	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-13.6	177.7	-72.6	175.7	31.5	0	0	114.6	T1504 I1506	T1504-Q1508 VanDerWaalsContact O-CG 3.26Å; T1504-Q1508 WeakPolarHBondContact O-CG 3.36Å; T1504-Q1508 PolarHBondContact O-N 3.41Å; I1506-Q1508 VanDerWaalsContact C-N 3.26Å; I1506-Q1508 PolarHBondContact O-N 2.79Å
1509	N	41.3	Very low	43.9	Very low	136 Å²	136	108.8 Å²	108.8	73%	0.727	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	-4.2	-178.2	-79.6	-79.1	0	0	0	114.2	E1505 I1506 E1507	E1505-N1509 PolarHBondContact O-ND2 3.36Å; I1506-N1509 PolarHBondContact O-N 3.42Å; E1507-N1509 VanDerWaalsContact C-N 3.26Å; E1507-N1509 PolarHBondContact O-N 3.16Å
1510	L	42.2	Very low	44.5	Very low	49 Å²	49	112.9 Å²	112.9	26%	0.257	55%	0.553	S	S	.	*	S	Bend	trans	-84.8	136.6	174.3	-75.7	159.8	0	0	0	111	I1506 Q1514 L1515 L1518	I1506-L1510 HydrophobicContact CG2-CD1 4.21Å; I1506-L1510 PolarHBondContact O-N 2.84Å; L1510-Q1514 HydrophobicContact CD2-CB 3.98Å; L1510-L1515 HydrophobicContact CB-CD1 3.72Å; L1510-L1518 HydrophobicContact CD1-CD1 4.28Å
1511	T	41.6	Very low	45	Very low	81 Å²	81	110.8 Å²	110.8	50%	0.497	54%	0.541	S	S	.	.			trans	-76.8	152.9	175.4	63.5	0	0	0	0	111.2	N1513 Q1514 L1515	T1511-N1513 PolarHBondContact O-N 3.31Å; T1511-Q1514 WeakPolarHBondContact O-CA 3.43Å; T1511-Q1514 WeakPolarHBondContact O-CB 3.28Å; T1511-Q1514 PolarHBondContact O-N 2.55Å; T1511-Q1514 WeakPolarHBondContact OG1-CG 3.37Å; T1511-Q1514 PolarHBondContact OG1-OE1 3.15Å; T1511-L1515 WeakPolarHBondContact O-CD1 3.4Å; T1511-L1515 PolarHBondContact O-N 2.71Å
1512	K	36	Very low	45.9	Very low	181 Å²	181	107.7 Å²	107.7	79%	0.787	53%	0.532	S	S	*	.	H	α-helix	trans	-52.1	-32.1	-179.5	-97.7	-168.8	172.3	-171.7	0	114.3	L1515	K1512-L1515 PolarHBondContact O-N 2.85Å
1513	N	37.8	Very low	47	Very low	133 Å²	133	107.5 Å²	107.5	71%	0.711	54%	0.536	S	S	*	.	H	α-helix	trans	-72.8	-32	177.7	-64.2	23.6	0	0	0	111.8	T1511 L1515 Y1516	T1511-N1513 PolarHBondContact O-N 3.31Å; N1513-L1515 VanDerWaalsContact C-N 3.32Å; N1513-Y1516 PolarHBondContact O-N 3.46Å
1514	Q	45.9	Very low	47.9	Very low	92 Å²	92	107.9 Å²	107.9	43%	0.43	54%	0.538	S	S	.	.	H	α-helix	trans	-75.2	-18.7	174.2	-65.1	168.2	-72.4	0	0	112.8	L1510 T1511 L1518	L1510-Q1514 HydrophobicContact CD2-CB 3.98Å; T1511-Q1514 WeakPolarHBondContact O-CA 3.43Å; T1511-Q1514 WeakPolarHBondContact O-CB 3.28Å; T1511-Q1514 PolarHBondContact O-N 2.55Å; T1511-Q1514 WeakPolarHBondContact OG1-CG 3.37Å; T1511-Q1514 PolarHBondContact OG1-OE1 3.15Å; Q1514-L1518 WeakPolarHBondContact O-CD1 3.41Å; Q1514-L1518 VanDerWaalsContact O-CG 3.32Å; Q1514-L1518 WeakPolarHBondContact O-CG 3.28Å
1515	L	41.1	Very low	48.3	Very low	85 Å²	85	108.9 Å²	108.9	45%	0.445	54%	0.538	S	S	.	.	H	α-helix	trans	-74.8	-31.5	170	-88.6	85.6	0	0	0	112.6	L1510 T1511 K1512 N1513 L1518 T1519	L1510-L1515 HydrophobicContact CB-CD1 3.72Å; T1511-L1515 WeakPolarHBondContact O-CD1 3.4Å; T1511-L1515 PolarHBondContact O-N 2.71Å; K1512-L1515 PolarHBondContact O-N 2.85Å; N1513-L1515 VanDerWaalsContact C-N 3.32Å; L1515-L1518 PolarHBondContact O-N 3.22Å; L1515-L1518 VanDerWaalsContact O-N 3.12Å; L1515-T1519 PolarHBondContact O-N 3.32Å
1516	Y	39	Very low	49.2	Very low	182 Å²	182	106.3 Å²	106.3	71%	0.714	53%	0.528	S	S	*	.	H	α-helix	trans	-65.3	-39.1	-179.7	-105.1	-85	0	0	0	112.5	N1513 L1518 T1519	N1513-Y1516 PolarHBondContact O-N 3.46Å; Y1516-L1518 PolarHBondContact O-N 3.43Å; Y1516-T1519 PolarHBondContact O-N 3.2Å; Y1516-T1519 PolarHBondContact O-OG1 2.88Å
1517	D	47.3	Very low	50	Low	128 Å²	128	108.9 Å²	108.9	68%	0.684	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-13.1	174.9	-64.5	-21.8	0	0	0	113.3
1518	L	46.4	Very low	50.9	Low	32 Å²	32	104.5 Å²	104.5	17%	0.168	51%	0.514	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-20.7	179.9	-63.4	172.4	0	0	0	113	L1510 Q1514 L1515 Y1516 E1520 L1521 L1526	L1510-L1518 HydrophobicContact CD1-CD1 4.28Å; Q1514-L1518 WeakPolarHBondContact O-CD1 3.41Å; Q1514-L1518 VanDerWaalsContact O-CG 3.32Å; Q1514-L1518 WeakPolarHBondContact O-CG 3.28Å; L1515-L1518 PolarHBondContact O-N 3.22Å; L1515-L1518 VanDerWaalsContact O-N 3.12Å; Y1516-L1518 PolarHBondContact O-N 3.43Å; L1518-E1520 VanDerWaalsContact C-N 3.27Å; L1518-E1520 PolarHBondContact O-N 3.02Å; L1518-L1521 HydrophobicContact CD2-CD1 3.87Å; L1518-L1521 PolarHBondContact O-N 3.43Å; L1518-L1526 HydrophobicContact CD2-CD1 4.03Å
1519	T	48	Very low	51.6	Low	113 Å²	113	101 Å²	101	69%	0.693	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-13.4	-176.4	39.9	0	0	0	0	115.3	L1515 Y1516	L1515-T1519 PolarHBondContact O-N 3.32Å; Y1516-T1519 PolarHBondContact O-N 3.2Å; Y1516-T1519 PolarHBondContact O-OG1 2.88Å
1520	E	50.8	Low	52.7	Low	182 Å²	182	97.6 Å²	97.6	85%	0.85	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-5.7	174.7	-61.2	-166.9	155.2	0	0	113.7	L1518	L1518-E1520 VanDerWaalsContact C-N 3.27Å; L1518-E1520 PolarHBondContact O-N 3.02Å
1521	L	58.8	Low	53.6	Low	53 Å²	53	99.7 Å²	99.7	28%	0.277	48%	0.484	S	S	.	.	S	Bend	trans	-86.9	126.6	-176.8	-60.4	-177.8	0	0	0	111.4	L1518 Q1525 H1529	L1518-L1521 HydrophobicContact CD2-CD1 3.87Å; L1518-L1521 PolarHBondContact O-N 3.43Å; L1521-Q1525 HydrophobicContact CB-CB 3.97Å; L1521-Q1525 HydrophobicContact CD2-CB 4.18Å; L1521-H1529 HydrophobicContact CD1-CB 4.44Å
1522	N	70.2	Confident	54.4	Low	89 Å²	89	103 Å²	103	48%	0.476	49%	0.487	S	S	.	.			trans	-65.7	160.1	170.9	76.5	51.8	0	0	0	111.4	N1524 Q1525 L1526	N1522-N1524 PolarHBondContact O-N 3.5Å; N1522-N1524 PolarHBondContact OD1-N 3.31Å; N1522-N1524 VanDerWaalsContact OD1-N 3.09Å; N1522-Q1525 PolarHBondContact ND2-OE1 3.46Å; N1522-Q1525 CarbonylContact O-C 3.53Å; N1522-Q1525 WeakPolarHBondContact O-CA 3.16Å; N1522-Q1525 WeakPolarHBondContact O-CB 3.49Å; N1522-Q1525 PolarHBondContact O-N 3.28Å; N1522-Q1525 PolarHBondContact OD1-N 2.83Å; N1522-L1526 PolarHBondContact O-N 2.89Å
1523	E	59.5	Low	55.7	Low	126 Å²	126	97.4 Å²	97.4	59%	0.589	47%	0.465	S	S	*	.	H	α-helix	trans	-53	-31.7	-172.3	-149.6	-159	175.5	0	0	114.3	R1527	E1523-R1527 VanDerWaalsContact CD-CZ 3.42Å; E1523-R1527 WeakPolarHBondContact O-CB 3.31Å; E1523-R1527 WeakPolarHBondContact O-CG 3.48Å; E1523-R1527 PolarHBondContact O-N 3.01Å; E1523-R1527 IonicContact OE1-CZ 2.64Å; E1523-R1527 IonicContact OE1-NH1 2.7Å; E1523-R1527 PolarHBondContact OE1-NH1 3.03Å; E1523-R1527 IonicContact OE1-NH2 3.32Å; E1523-R1527 IonicContact OE2-CZ 3.76Å; E1523-R1527 IonicContact OE2-NH1 3.07Å; E1523-R1527 PolarHBondContact OE2-NH1 2.97Å; E1523-R1527 IonicContact OE2-NH2 3.12Å; E1523-R1527 PolarHBondContact OE2-NH2 2.78Å
1524	N	62.8	Low	56.6	Low	70 Å²	70	95.5 Å²	95.5	37%	0.374	46%	0.455	S	S	.	.	H	α-helix	trans	-81.9	-32.7	176.3	-69	-37	0	0	0	113	N1522 R1527 N1528	N1522-N1524 PolarHBondContact O-N 3.5Å; N1522-N1524 PolarHBondContact OD1-N 3.31Å; N1522-N1524 VanDerWaalsContact OD1-N 3.09Å; N1524-R1527 PolarHBondContact OD1-NH2 3.32Å; N1524-N1528 WeakPolarHBondContact O-CB 3.43Å; N1524-N1528 VanDerWaalsContact O-CG 3.31Å; N1524-N1528 PolarHBondContact O-N 3.32Å
1525	Q	62.3	Low	57.3	Low	86 Å²	86	93.4 Å²	93.4	40%	0.402	45%	0.445	S	S	.	.	H	α-helix	trans	-65.3	-44.1	168.8	-69.3	169.2	-59.1	0	0	110.6	L1521 N1522 N1528 H1529	L1521-Q1525 HydrophobicContact CB-CB 3.97Å; L1521-Q1525 HydrophobicContact CD2-CB 4.18Å; N1522-Q1525 PolarHBondContact ND2-OE1 3.46Å; N1522-Q1525 CarbonylContact O-C 3.53Å; N1522-Q1525 WeakPolarHBondContact O-CA 3.16Å; N1522-Q1525 WeakPolarHBondContact O-CB 3.49Å; N1522-Q1525 PolarHBondContact O-N 3.28Å; N1522-Q1525 PolarHBondContact OD1-N 2.83Å; Q1525-N1528 PolarHBondContact O-N 2.91Å; Q1525-H1529 WeakPolarHBondContact O-CB 3.4Å; Q1525-H1529 PolarHBondContact O-N 3.03Å
1526	L	62.2	Low	58	Low	59 Å²	59	95.7 Å²	95.7	31%	0.309	45%	0.453	S	S	.	.	H	α-helix	trans	-61.3	-49	176.2	-177.4	62.4	0	0	0	111.6	L1518 N1522 N1528 H1529 L1530	L1518-L1526 HydrophobicContact CD2-CD1 4.03Å; N1522-L1526 PolarHBondContact O-N 2.89Å; L1526-N1528 VanDerWaalsContact C-N 3.31Å; L1526-N1528 PolarHBondContact O-N 3.18Å; L1526-H1529 WeakPolarHBondContact O-CB 3.33Å; L1526-H1529 PolarHBondContact O-N 3.08Å; L1526-H1529 VanDerWaalsContact O-N 3.12Å; L1526-L1530 HydrophobicContact CD1-CD1 4.27Å; L1526-L1530 HydrophobicContact CD1-CG 4.32Å; L1526-L1530 HydrophobicContact CG-CD1 4.1Å; L1526-L1530 WeakPolarHBondContact O-CG 3.32Å; L1526-L1530 PolarHBondContact O-N 3.02Å
1527	R	61.5	Low	58.9	Low	116 Å²	116	91.3 Å²	91.3	44%	0.438	44%	0.442	S	S	.	.	H	α-helix	trans	-57.3	-41.2	173.9	-82.5	-171.5	-79.1	-99.8	-1.3	112.7	E1523 N1524 R1531	E1523-R1527 VanDerWaalsContact CD-CZ 3.42Å; E1523-R1527 WeakPolarHBondContact O-CB 3.31Å; E1523-R1527 WeakPolarHBondContact O-CG 3.48Å; E1523-R1527 PolarHBondContact O-N 3.01Å; E1523-R1527 IonicContact OE1-CZ 2.64Å; E1523-R1527 IonicContact OE1-NH1 2.7Å; E1523-R1527 PolarHBondContact OE1-NH1 3.03Å; E1523-R1527 IonicContact OE1-NH2 3.32Å; E1523-R1527 IonicContact OE2-CZ 3.76Å; E1523-R1527 IonicContact OE2-NH1 3.07Å; E1523-R1527 PolarHBondContact OE2-NH1 2.97Å; E1523-R1527 IonicContact OE2-NH2 3.12Å; E1523-R1527 PolarHBondContact OE2-NH2 2.78Å; N1524-R1527 PolarHBondContact OD1-NH2 3.32Å; R1527-R1531 VanDerWaalsContact O-CB 3.25Å; R1527-R1531 WeakPolarHBondContact O-CB 3.31Å; R1527-R1531 PolarHBondContact O-N 3.2Å
1528	N	66	Low	59.7	Low	45 Å²	45	90.2 Å²	90.2	24%	0.241	44%	0.435	C	S	.	.	H	α-helix	trans	-71.6	-30.1	176.9	-75.7	-10	0	0	0	113.1	Y64 N1524 Q1525 L1526 R1532	Y64-N1528 WeakPolarHBondContact CE2-ND2 3.38Å; Y64-N1528 VanDerWaalsContact CZ-ND2 3.25Å; Y64-N1528 PolarHBondContact OH-ND2 2.99Å; N1524-N1528 WeakPolarHBondContact O-CB 3.43Å; N1524-N1528 VanDerWaalsContact O-CG 3.31Å; N1524-N1528 PolarHBondContact O-N 3.32Å; Q1525-N1528 PolarHBondContact O-N 2.91Å; L1526-N1528 VanDerWaalsContact C-N 3.31Å; L1526-N1528 PolarHBondContact O-N 3.18Å; N1528-R1532 WeakPolarHBondContact O-CG 3.36Å; N1528-R1532 PolarHBondContact O-N 2.99Å
1529	H	62.8	Low	60.2	Low	83 Å²	83	91.3 Å²	91.3	38%	0.384	44%	0.441	S	S	.	.	H	α-helix	trans	-70.4	-51.5	174.9	-168.7	99.9	0	0	0	111.1	L1521 Q1525 L1526 R1531 R1532 I1533	L1521-H1529 HydrophobicContact CD1-CB 4.44Å; Q1525-H1529 WeakPolarHBondContact O-CB 3.4Å; Q1525-H1529 PolarHBondContact O-N 3.03Å; L1526-H1529 WeakPolarHBondContact O-CB 3.33Å; L1526-H1529 PolarHBondContact O-N 3.08Å; L1526-H1529 VanDerWaalsContact O-N 3.12Å; H1529-R1531 VanDerWaalsContact C-N 3.26Å; H1529-R1531 PolarHBondContact O-N 3.17Å; H1529-R1532 PolarHBondContact O-N 3.21Å; H1529-R1532 VanDerWaalsContact O-N 3.14Å; H1529-I1533 PolarHBondContact O-N 2.67Å; H1529-I1533 VanDerWaalsContact O-N 3.14Å
1530	L	63.9	Low	60.6	Low	64 Å²	64	89.3 Å²	89.3	34%	0.335	42%	0.423	S	S	.	.	H	α-helix	trans	-58.3	-38.3	175.4	-69.2	171.4	0	0	0	112.1	L1526 I1533 N1534	L1526-L1530 HydrophobicContact CD1-CD1 4.27Å; L1526-L1530 HydrophobicContact CD1-CG 4.32Å; L1526-L1530 HydrophobicContact CG-CD1 4.1Å; L1526-L1530 WeakPolarHBondContact O-CG 3.32Å; L1526-L1530 PolarHBondContact O-N 3.02Å; L1530-I1533 PolarHBondContact O-N 3.32Å; L1530-N1534 PolarHBondContact O-N 3.37Å; L1530-N1534 VanDerWaalsContact O-N 3.08Å
1531	R	61.7	Low	61	Low	93 Å²	93	84.9 Å²	84.9	35%	0.351	40%	0.403	S	S	.	.	H	α-helix	trans	-59.6	-48	174.2	-179.9	175.4	179.4	139.4	1.1	112.5	S62 N63 R1527 H1529 I1533 N1534 E1535	S62-R1531 PolarHBondContact OG-NH2 2.88Å; N63-R1531 PolarHBondContact ND2-NH1 3.19Å; N63-R1531 VanDerWaalsContact ND2-NH1 3.17Å; R1527-R1531 VanDerWaalsContact O-CB 3.25Å; R1527-R1531 WeakPolarHBondContact O-CB 3.31Å; R1527-R1531 PolarHBondContact O-N 3.2Å; H1529-R1531 VanDerWaalsContact C-N 3.26Å; H1529-R1531 PolarHBondContact O-N 3.17Å; R1531-I1533 PolarHBondContact O-N 2.87Å; R1531-N1534 PolarHBondContact O-N 3.18Å; R1531-E1535 HydrophobicContact CG-CG 4.42Å; R1531-E1535 WeakPolarHBondContact CG-OE1 3.29Å; R1531-E1535 IonicContact CZ-OE1 3.01Å; R1531-E1535 IonicContact NE-OE1 2.83Å; R1531-E1535 PolarHBondContact NE-OE1 2.86Å; R1531-E1535 IonicContact NH2-OE1 3.08Å; R1531-E1535 PolarHBondContact NH2-OE1 2.74Å; R1531-E1535 WeakPolarHBondContact O-CG 3.48Å; R1531-E1535 PolarHBondContact O-N 3.49Å
1532	R	59.2	Low	60.9	Low	151 Å²	151	85.5 Å²	85.5	57%	0.57	41%	0.411	S	S	*	.	H	α-helix	trans	-60.3	-44.2	177.9	-72.6	174.9	-175.7	179.2	2.4	111.8	N1528 H1529 N1534 E1535 E1536	N1528-R1532 WeakPolarHBondContact O-CG 3.36Å; N1528-R1532 PolarHBondContact O-N 2.99Å; H1529-R1532 PolarHBondContact O-N 3.21Å; H1529-R1532 VanDerWaalsContact O-N 3.14Å; R1532-N1534 VanDerWaalsContact C-N 3.29Å; R1532-N1534 PolarHBondContact O-N 3Å; R1532-E1535 PolarHBondContact O-N 3.29Å; R1532-E1536 WeakPolarHBondContact O-CG 3.49Å; R1532-E1536 PolarHBondContact O-N 3.38Å
1533	I	62.4	Low	60.3	Low	64 Å²	64	89.6 Å²	89.6	33%	0.328	42%	0.42	S	S	.	.	H	α-helix	trans	-56.7	-43.9	176	-67.1	171.9	0	0	0	110.9	H1529 L1530 R1531 E1536 L1537	H1529-I1533 PolarHBondContact O-N 2.67Å; H1529-I1533 VanDerWaalsContact O-N 3.14Å; L1530-I1533 PolarHBondContact O-N 3.32Å; R1531-I1533 PolarHBondContact O-N 2.87Å; I1533-E1536 PolarHBondContact O-N 3.3Å; I1533-L1537 VanDerWaalsContact O-CB 3.3Å; I1533-L1537 WeakPolarHBondContact O-CB 3.47Å; I1533-L1537 PolarHBondContact O-N 3.17Å
1534	N	56.6	Low	60.4	Low	92 Å²	92	91.1 Å²	91.1	49%	0.492	42%	0.421	S	S	.	.	H	α-helix	trans	-68.3	-39.8	179.4	-161.6	7.9	0	0	0	112.4	L1530 R1531 R1532 L1537 L1538	L1530-N1534 PolarHBondContact O-N 3.37Å; L1530-N1534 VanDerWaalsContact O-N 3.08Å; R1531-N1534 PolarHBondContact O-N 3.18Å; R1532-N1534 VanDerWaalsContact C-N 3.29Å; R1532-N1534 PolarHBondContact O-N 3Å; N1534-L1537 PolarHBondContact O-N 3.37Å; N1534-L1538 WeakPolarHBondContact O-CB 3.13Å; N1534-L1538 PolarHBondContact O-N 3.35Å
1535	E	60.6	Low	60.3	Low	48 Å²	48	92.7 Å²	92.7	22%	0.224	43%	0.429	C	S	.	.	H	α-helix	trans	-63.5	-40.3	175.4	-68.9	173.9	-179.3	0	0	111.9	L60 R1531 R1532 M1539	L60-E1535 HydrophobicContact CD1-CB 4.13Å; L60-E1535 HydrophobicContact CD1-CG 3.49Å; L60-E1535 VanDerWaalsContact CD1-CG 3.49Å; R1531-E1535 HydrophobicContact CG-CG 4.42Å; R1531-E1535 WeakPolarHBondContact CG-OE1 3.29Å; R1531-E1535 IonicContact CZ-OE1 3.01Å; R1531-E1535 IonicContact NE-OE1 2.83Å; R1531-E1535 PolarHBondContact NE-OE1 2.86Å; R1531-E1535 IonicContact NH2-OE1 3.08Å; R1531-E1535 PolarHBondContact NH2-OE1 2.74Å; R1531-E1535 WeakPolarHBondContact O-CG 3.48Å; R1531-E1535 PolarHBondContact O-N 3.49Å; R1532-E1535 PolarHBondContact O-N 3.29Å; E1535-M1539 WeakPolarHBondContact O-CG 3.49Å; E1535-M1539 PolarHBondContact O-N 3.45Å
1536	E	55.5	Low	60.2	Low	133 Å²	133	93.6 Å²	93.6	62%	0.621	43%	0.433	S	S	*	.	H	α-helix	trans	-65.8	-42.9	172.5	-73.4	178.7	-172.1	0	0	112.8	R1532 I1533 L1538 M1539 E1540	R1532-E1536 WeakPolarHBondContact O-CG 3.49Å; R1532-E1536 PolarHBondContact O-N 3.38Å; I1533-E1536 PolarHBondContact O-N 3.3Å; E1536-L1538 PolarHBondContact O-N 3.06Å; E1536-M1539 WeakPolarHBondContact O-CB 3.44Å; E1536-M1539 PolarHBondContact O-N 3.41Å; E1536-E1540 PolarHBondContact O-N 3.05Å
1537	L	58.8	Low	60	Low	90 Å²	90	96.1 Å²	96.1	47%	0.471	45%	0.446	S	S	.	.	H	α-helix	trans	-67.4	-36.8	-177.5	-158.8	151.7	0	0	0	111.4	I1533 N1534 E1540 Q1541	I1533-L1537 VanDerWaalsContact O-CB 3.3Å; I1533-L1537 WeakPolarHBondContact O-CB 3.47Å; I1533-L1537 PolarHBondContact O-N 3.17Å; N1534-L1537 PolarHBondContact O-N 3.37Å; L1537-E1540 PolarHBondContact O-N 3.4Å; L1537-Q1541 HydrophobicContact CD2-CG 4.29Å; L1537-Q1541 WeakPolarHBondContact O-CG 3.3Å; L1537-Q1541 PolarHBondContact O-N 3.24Å
1538	L	63.4	Low	59.9	Low	105 Å²	105	93.2 Å²	93.2	55%	0.55	45%	0.447	S	S	.	.	H	α-helix	trans	-66.3	-38.6	172.1	-174.4	65.2	0	0	0	112.5	N1534 E1536 S1542	N1534-L1538 WeakPolarHBondContact O-CB 3.13Å; N1534-L1538 PolarHBondContact O-N 3.35Å; E1536-L1538 PolarHBondContact O-N 3.06Å; L1538-S1542 WeakPolarHBondContact O-CB 3.18Å; L1538-S1542 PolarHBondContact O-N 3.19Å; L1538-S1542 PolarHBondContact O-OG 3.12Å
1539	M	56.7	Low	59.7	Low	56 Å²	56	95.9 Å²	95.9	28%	0.276	46%	0.461	S	S	.	.	H	α-helix	trans	-64	-42.1	173.8	-79.4	-111.5	-82.2	0	0	112.2	E1535 E1536 S1542 R1543	E1535-M1539 WeakPolarHBondContact O-CG 3.49Å; E1535-M1539 PolarHBondContact O-N 3.45Å; E1536-M1539 WeakPolarHBondContact O-CB 3.44Å; E1536-M1539 PolarHBondContact O-N 3.41Å; M1539-S1542 WeakPolarHBondContact O-CB 3.41Å; M1539-S1542 PolarHBondContact O-N 2.86Å; M1539-R1543 WeakPolarHBondContact O-CG 3.2Å; M1539-R1543 PolarHBondContact O-N 3.09Å
1540	E	56.4	Low	59.4	Low	70 Å²	70	96 Å²	96	33%	0.327	46%	0.463	S	S	.	.	H	α-helix	trans	-75.2	-32.1	179	178	53.8	-161.5	0	0	112.7	E1536 L1537 S1542 R1543 R1544	E1536-E1540 PolarHBondContact O-N 3.05Å; L1537-E1540 PolarHBondContact O-N 3.4Å; E1540-S1542 VanDerWaalsContact C-N 3.31Å; E1540-S1542 PolarHBondContact O-N 3.22Å; E1540-R1543 PolarHBondContact O-N 3.48Å; E1540-R1543 WeakPolarHBondContact OE2-CD 3.2Å; E1540-R1543 IonicContact OE2-NE 2.75Å; E1540-R1543 PolarHBondContact OE2-NE 3.27Å; E1540-R1544 VanDerWaalsContact O-CG 3.27Å; E1540-R1544 WeakPolarHBondContact O-CG 3.41Å; E1540-R1544 PolarHBondContact O-N 2.98Å; E1540-R1544 IonicContact OE1-CZ 2.68Å; E1540-R1544 IonicContact OE1-NE 3.05Å; E1540-R1544 PolarHBondContact OE1-NE 3.25Å; E1540-R1544 IonicContact OE1-NH2 2.7Å; E1540-R1544 PolarHBondContact OE1-NH2 3.09Å
1541	Q	59.9	Low	59	Low	90 Å²	90	96.1 Å²	96.1	42%	0.421	47%	0.468	S	S	.	.	H	α-helix	trans	-58.7	-43.5	164.6	-75.5	-174.5	13.5	0	0	111.5	L1537 R1543 R1544 N1545	L1537-Q1541 HydrophobicContact CD2-CG 4.29Å; L1537-Q1541 WeakPolarHBondContact O-CG 3.3Å; L1537-Q1541 PolarHBondContact O-N 3.24Å; Q1541-R1543 PolarHBondContact O-N 2.98Å; Q1541-R1544 PolarHBondContact O-N 3.22Å; Q1541-N1545 PolarHBondContact O-N 3.49Å; Q1541-N1545 PolarHBondContact O-ND2 3.05Å
1542	S	57	Low	59.1	Low	66 Å²	66	94.2 Å²	94.2	46%	0.462	47%	0.472	S	S	.	.	H	α-helix	trans	-63.4	-41	178.2	-59.7	0	0	0	0	112.3	L1538 M1539 E1540 N1545 H1546	L1538-S1542 WeakPolarHBondContact O-CB 3.18Å; L1538-S1542 PolarHBondContact O-N 3.19Å; L1538-S1542 PolarHBondContact O-OG 3.12Å; M1539-S1542 WeakPolarHBondContact O-CB 3.41Å; M1539-S1542 PolarHBondContact O-N 2.86Å; E1540-S1542 VanDerWaalsContact C-N 3.31Å; E1540-S1542 PolarHBondContact O-N 3.22Å; S1542-N1545 PolarHBondContact O-N 3.45Å; S1542-H1546 PolarHBondContact O-N 2.93Å
1543	R	56.7	Low	59.2	Low	174 Å²	174	92.4 Å²	92.4	66%	0.657	47%	0.474	S	S	*	.	H	α-helix	trans	-61.8	-43.2	173	-74.2	166.2	55.4	90.5	-0.4	112.3	M1539 E1540 Q1541 H1546 L1547	M1539-R1543 WeakPolarHBondContact O-CG 3.2Å; M1539-R1543 PolarHBondContact O-N 3.09Å; E1540-R1543 PolarHBondContact O-N 3.48Å; E1540-R1543 WeakPolarHBondContact OE2-CD 3.2Å; E1540-R1543 IonicContact OE2-NE 2.75Å; E1540-R1543 PolarHBondContact OE2-NE 3.27Å; Q1541-R1543 PolarHBondContact O-N 2.98Å; R1543-H1546 PolarHBondContact O-N 3.29Å; R1543-L1547 WeakPolarHBondContact O-CB 3.19Å; R1543-L1547 PolarHBondContact O-N 2.96Å
1544	R	62.2	Low	58.9	Low	159 Å²	159	92 Å²	92	60%	0.6	47%	0.472	S	S	*	.	H	α-helix	trans	-63.7	-42.1	176.7	-71.2	170	-171.8	-166	5.5	112.3	E1540 Q1541 L1547 A1548	E1540-R1544 VanDerWaalsContact O-CG 3.27Å; E1540-R1544 WeakPolarHBondContact O-CG 3.41Å; E1540-R1544 PolarHBondContact O-N 2.98Å; E1540-R1544 IonicContact OE1-CZ 2.68Å; E1540-R1544 IonicContact OE1-NE 3.05Å; E1540-R1544 PolarHBondContact OE1-NE 3.25Å; E1540-R1544 IonicContact OE1-NH2 2.7Å; E1540-R1544 PolarHBondContact OE1-NH2 3.09Å; Q1541-R1544 PolarHBondContact O-N 3.22Å; R1544-L1547 PolarHBondContact O-N 2.85Å; R1544-A1548 WeakPolarHBondContact O-CB 3.33Å; R1544-A1548 PolarHBondContact O-N 3.23Å
1545	N	61.1	Low	59.4	Low	103 Å²	103	92.8 Å²	92.8	55%	0.551	48%	0.476	S	S	*	.	H	α-helix	trans	-63.8	-41.8	175.6	-72.1	-21.7	0	0	0	111.9	Q1541 S1542 A1548 N1549	Q1541-N1545 PolarHBondContact O-N 3.49Å; Q1541-N1545 PolarHBondContact O-ND2 3.05Å; S1542-N1545 PolarHBondContact O-N 3.45Å; N1545-A1548 PolarHBondContact O-N 2.81Å; N1545-N1549 PolarHBondContact O-N 2.96Å; N1545-N1549 VanDerWaalsContact O-N 3.09Å
1546	H	59.3	Low	59.7	Low	104 Å²	104	93.8 Å²	93.8	48%	0.481	48%	0.481	S	S	.	.	H	α-helix	trans	-63.1	-44.5	175.2	-171.1	50.6	0	0	0	112.1	S1542 R1543 A1548 N1549 M1550	S1542-H1546 PolarHBondContact O-N 2.93Å; R1543-H1546 PolarHBondContact O-N 3.29Å; H1546-A1548 PolarHBondContact O-N 3.34Å; H1546-N1549 PolarHBondContact O-N 2.79Å; H1546-M1550 WeakPolarHBondContact O-CG 3.46Å; H1546-M1550 PolarHBondContact O-N 3.35Å
1547	L	57.9	Low	59.7	Low	112 Å²	112	92.5 Å²	92.5	59%	0.586	48%	0.475	S	S	*	.	H	α-helix	trans	-61.7	-41.3	176.4	-169.9	72.7	0	0	0	112.1	R1543 R1544 N1549 M1550 C1551	R1543-L1547 WeakPolarHBondContact O-CB 3.19Å; R1543-L1547 PolarHBondContact O-N 2.96Å; R1544-L1547 PolarHBondContact O-N 2.85Å; L1547-N1549 PolarHBondContact O-N 3Å; L1547-M1550 PolarHBondContact O-N 3.45Å; L1547-C1551 PolarHBondContact O-N 3.09Å; L1547-C1551 PolarHBondContact O-SG 3.23Å; L1547-C1551 VanDerWaalsContact O-SG 3.33Å
1548	A	59	Low	59.5	Low	55 Å²	55	90.5 Å²	90.5	46%	0.455	46%	0.464	S	S	.	.	H	α-helix	trans	-61.6	-42.7	176.7	0	0	0	0	0	112	R1544 N1545 H1546 C1551 A1552	R1544-A1548 WeakPolarHBondContact O-CB 3.33Å; R1544-A1548 PolarHBondContact O-N 3.23Å; N1545-A1548 PolarHBondContact O-N 2.81Å; H1546-A1548 PolarHBondContact O-N 3.34Å; A1548-C1551 PolarHBondContact O-N 2.86Å; A1548-A1552 PolarHBondContact O-N 3.39Å
1549	N	63.4	Low	59.4	Low	101 Å²	101	92 Å²	92	54%	0.54	46%	0.463	S	S	.	.	H	α-helix	trans	-64.1	-46.9	175.9	-69.9	-12.4	0	0	0	111.5	N1545 H1546 L1547 C1551 A1552 D1553	N1545-N1549 PolarHBondContact O-N 2.96Å; N1545-N1549 VanDerWaalsContact O-N 3.09Å; H1546-N1549 PolarHBondContact O-N 2.79Å; L1547-N1549 PolarHBondContact O-N 3Å; N1549-C1551 VanDerWaalsContact C-N 3.25Å; N1549-C1551 PolarHBondContact O-N 3.08Å; N1549-A1552 WeakPolarHBondContact O-CA 3.4Å; N1549-A1552 WeakPolarHBondContact O-CB 3.34Å; N1549-A1552 PolarHBondContact O-N 2.78Å; N1549-D1553 PolarHBondContact O-N 3.3Å
1550	M	55.4	Low	59.7	Low	85 Å²	85	95.9 Å²	95.9	42%	0.419	48%	0.478	S	S	.	.	H	α-helix	trans	-57.2	-37.9	174.4	-68.5	-177.3	77.6	0	0	112.6	H1546 L1547 L1554	H1546-M1550 WeakPolarHBondContact O-CG 3.46Å; H1546-M1550 PolarHBondContact O-N 3.35Å; L1547-M1550 PolarHBondContact O-N 3.45Å; M1550-L1554 WeakPolarHBondContact O-CB 3.44Å; M1550-L1554 VanDerWaalsContact O-CG 3.32Å; M1550-L1554 WeakPolarHBondContact O-CG 3.29Å; M1550-L1554 PolarHBondContact O-N 2.81Å
1551	C	56.4	Low	59.5	Low	67 Å²	67	97.3 Å²	97.3	45%	0.453	49%	0.487	S	S	.	.	H	α-helix	trans	-67.8	-36.5	174.4	-70.6	0	0	0	0	112.9	L1547 A1548 N1549 L1555	L1547-C1551 PolarHBondContact O-N 3.09Å; L1547-C1551 PolarHBondContact O-SG 3.23Å; L1547-C1551 VanDerWaalsContact O-SG 3.33Å; A1548-C1551 PolarHBondContact O-N 2.86Å; N1549-C1551 VanDerWaalsContact C-N 3.25Å; N1549-C1551 PolarHBondContact O-N 3.08Å; C1551-L1555 WeakPolarHBondContact O-CB 3.42Å; C1551-L1555 VanDerWaalsContact O-CG 3.27Å; C1551-L1555 WeakPolarHBondContact O-CG 3.48Å; C1551-L1555 PolarHBondContact O-N 2.92Å
1552	A	64	Low	58.8	Low	53 Å²	53	101.2 Å²	101.2	44%	0.438	50%	0.498	S	S	.	.	H	α-helix	trans	-67.1	-45.9	175.3	0	0	0	0	0	111.8	A1548 N1549 L1555 E1556	A1548-A1552 PolarHBondContact O-N 3.39Å; N1549-A1552 WeakPolarHBondContact O-CA 3.4Å; N1549-A1552 WeakPolarHBondContact O-CB 3.34Å; N1549-A1552 PolarHBondContact O-N 2.78Å; A1552-L1555 PolarHBondContact O-N 2.89Å; A1552-E1556 WeakPolarHBondContact O-CB 3.34Å; A1552-E1556 PolarHBondContact O-N 3.35Å
1553	D	61.1	Low	58.7	Low	113 Å²	113	102.9 Å²	102.9	60%	0.604	50%	0.502	S	S	*	.	H	α-helix	trans	-61.1	-45.9	177.1	-71.7	-37.2	0	0	0	111.5	N1549 L1555 E1556 E1557	N1549-D1553 PolarHBondContact O-N 3.3Å; D1553-L1555 VanDerWaalsContact C-N 3.32Å; D1553-L1555 PolarHBondContact O-N 3.36Å; D1553-E1556 PolarHBondContact O-N 3.33Å; D1553-E1557 WeakPolarHBondContact O-CB 3.48Å; D1553-E1557 PolarHBondContact O-N 3.1Å
1554	L	56.1	Low	57.9	Low	56 Å²	56	96.6 Å²	96.6	29%	0.293	49%	0.492	S	S	.	.	H	α-helix	trans	-62.2	-35.9	174.8	-77.1	169.3	0	0	0	112.6	F1278 M1550 N1558	F1278-L1554 HydrophobicContact CE1-CD1 4.28Å; M1550-L1554 WeakPolarHBondContact O-CB 3.44Å; M1550-L1554 VanDerWaalsContact O-CG 3.32Å; M1550-L1554 WeakPolarHBondContact O-CG 3.29Å; M1550-L1554 PolarHBondContact O-N 2.81Å; L1554-N1558 VanDerWaalsContact O-CB 3.25Å; L1554-N1558 WeakPolarHBondContact O-CB 3.5Å; L1554-N1558 PolarHBondContact O-N 3.22Å; L1554-N1558 PolarHBondContact O-ND2 3.4Å
1555	L	66.6	Low	56.9	Low	108 Å²	108	96.1 Å²	96.1	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-68.6	-38	175.4	-80	168.4	0	0	0	112.1	C1551 A1552 D1553 N1558 R1559	C1551-L1555 WeakPolarHBondContact O-CB 3.42Å; C1551-L1555 VanDerWaalsContact O-CG 3.27Å; C1551-L1555 WeakPolarHBondContact O-CG 3.48Å; C1551-L1555 PolarHBondContact O-N 2.92Å; A1552-L1555 PolarHBondContact O-N 2.89Å; D1553-L1555 VanDerWaalsContact C-N 3.32Å; D1553-L1555 PolarHBondContact O-N 3.36Å; L1555-N1558 CarbonylContact O-C 3.58Å; L1555-N1558 PolarHBondContact O-N 3.07Å; L1555-R1559 PolarHBondContact O-N 3.5Å
1556	E	66.2	Low	55.8	Low	70 Å²	70	94.2 Å²	94.2	33%	0.327	49%	0.491	S	S	.	.	H	α-helix	trans	-77.5	-35.3	-179.4	-170	52.4	-142.2	0	0	112.2	A1552 D1553 N1558 R1559 K1560	A1552-E1556 WeakPolarHBondContact O-CB 3.34Å; A1552-E1556 PolarHBondContact O-N 3.35Å; D1553-E1556 PolarHBondContact O-N 3.33Å; E1556-N1558 VanDerWaalsContact C-N 3.35Å; E1556-R1559 WeakPolarHBondContact O-CB 3.44Å; E1556-R1559 PolarHBondContact O-N 2.74Å; E1556-R1559 VanDerWaalsContact O-N 3.08Å; E1556-R1559 VanDerWaalsContact OE2-CD 3.3Å; E1556-R1559 WeakPolarHBondContact OE2-CD 3.46Å; E1556-R1559 IonicContact OE2-NH1 3.32Å; E1556-R1559 PolarHBondContact OE2-NH1 3.02Å; E1556-R1559 VanDerWaalsContact OE2-NH1 3.07Å; E1556-K1560 WeakPolarHBondContact O-CG 3.38Å; E1556-K1560 PolarHBondContact O-N 3.1Å
1557	E	55.6	Low	54.8	Low	105 Å²	105	94.3 Å²	94.3	49%	0.491	50%	0.495	S	S	.	.	H	α-helix	trans	-61.6	-43.9	165.6	-170.9	-170.2	-138.7	0	0	110.9	D1553 R1559 K1560 L1561	D1553-E1557 WeakPolarHBondContact O-CB 3.48Å; D1553-E1557 PolarHBondContact O-N 3.1Å; E1557-R1559 PolarHBondContact O-N 3.06Å; E1557-R1559 VanDerWaalsContact O-N 3.15Å; E1557-K1560 PolarHBondContact O-N 3.26Å; E1557-K1560 VanDerWaalsContact O-N 3.15Å; E1557-L1561 HydrophobicContact CG-CD1 4.12Å; E1557-L1561 HydrophobicContact CG-CG 4.44Å; E1557-L1561 WeakPolarHBondContact O-CB 3.37Å; E1557-L1561 WeakPolarHBondContact O-CG 3.37Å; E1557-L1561 PolarHBondContact O-N 2.98Å
1558	N	55.9	Low	53.8	Low	48 Å²	48	91.9 Å²	91.9	26%	0.257	49%	0.487	S	S	.	.	H	α-helix	trans	-67.4	-8.8	173.5	-82.1	-109.9	0	0	0	113.2	K1280 L1554 L1555 E1556 R1562	K1280-N1558 PolarHBondContact NZ-ND2 3.37Å; K1280-N1558 PolarHBondContact NZ-OD1 2.97Å; L1554-N1558 VanDerWaalsContact O-CB 3.25Å; L1554-N1558 WeakPolarHBondContact O-CB 3.5Å; L1554-N1558 PolarHBondContact O-N 3.22Å; L1554-N1558 PolarHBondContact O-ND2 3.4Å; L1555-N1558 CarbonylContact O-C 3.58Å; L1555-N1558 PolarHBondContact O-N 3.07Å; E1556-N1558 VanDerWaalsContact C-N 3.35Å; N1558-R1562 PolarHBondContact O-NE 3.4Å; N1558-R1562 PolarHBondContact O-NH2 3.45Å
1559	R	61.2	Low	52.6	Low	138 Å²	138	95.7 Å²	95.7	52%	0.521	50%	0.497	S	S	.	.	H	α-helix	trans	-88.2	-49.1	163.7	-85.4	178.7	173.6	147.4	-2.9	111.5	L1555 E1556 E1557 L1561 R1562 N1563	L1555-R1559 PolarHBondContact O-N 3.5Å; E1556-R1559 WeakPolarHBondContact O-CB 3.44Å; E1556-R1559 PolarHBondContact O-N 2.74Å; E1556-R1559 VanDerWaalsContact O-N 3.08Å; E1556-R1559 VanDerWaalsContact OE2-CD 3.3Å; E1556-R1559 WeakPolarHBondContact OE2-CD 3.46Å; E1556-R1559 IonicContact OE2-NH1 3.32Å; E1556-R1559 PolarHBondContact OE2-NH1 3.02Å; E1556-R1559 VanDerWaalsContact OE2-NH1 3.07Å; E1557-R1559 PolarHBondContact O-N 3.06Å; E1557-R1559 VanDerWaalsContact O-N 3.15Å; R1559-L1561 PolarHBondContact O-N 3.46Å; R1559-R1562 WeakPolarHBondContact O-CA 3.29Å; R1559-R1562 PolarHBondContact O-N 3.2Å; R1559-N1563 PolarHBondContact O-N 3.29Å
1560	K	61.8	Low	51.4	Low	136 Å²	136	96.1 Å²	96.1	59%	0.591	50%	0.499	S	S	*	.	H	α-helix	trans	-55.5	-38.3	178.1	-70.5	162.3	-177	165.7	0	111.9	E1556 E1557 G1564	E1556-K1560 WeakPolarHBondContact O-CG 3.38Å; E1556-K1560 PolarHBondContact O-N 3.1Å; E1557-K1560 PolarHBondContact O-N 3.26Å; E1557-K1560 VanDerWaalsContact O-N 3.15Å; K1560-G1564 WeakPolarHBondContact O-CA 3.12Å; K1560-G1564 PolarHBondContact O-N 3.06Å
1561	L	52.7	Low	50.7	Low	100 Å²	100	100.1 Å²	100.1	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-69.2	-30.8	173.7	-71.4	170	0	0	0	114	E1557 R1559	E1557-L1561 HydrophobicContact CG-CD1 4.12Å; E1557-L1561 HydrophobicContact CG-CG 4.44Å; E1557-L1561 WeakPolarHBondContact O-CB 3.37Å; E1557-L1561 WeakPolarHBondContact O-CG 3.37Å; E1557-L1561 PolarHBondContact O-N 2.98Å; R1559-L1561 PolarHBondContact O-N 3.46Å
1562	R	45.9	Very low	49.8	Very low	172 Å²	172	105.2 Å²	105.2	65%	0.649	53%	0.532	S	S	*	.	H	α-helix	trans	-80.8	-34.4	177.4	-86.3	-178.5	-76.8	-164.3	-2.6	112.9	N1558 R1559	N1558-R1562 PolarHBondContact O-NE 3.4Å; N1558-R1562 PolarHBondContact O-NH2 3.45Å; R1559-R1562 WeakPolarHBondContact O-CA 3.29Å; R1559-R1562 PolarHBondContact O-N 3.2Å
1563	N	53.4	Low	48.6	Very low	102 Å²	102	109 Å²	109	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-87.2	-40.2	179.2	-63.3	14.1	0	0	0	111.7	R1559 Q1565 S1566	R1559-N1563 PolarHBondContact O-N 3.29Å; N1563-Q1565 PolarHBondContact O-N 3.35Å; N1563-S1566 PolarHBondContact O-N 2.88Å; N1563-S1566 PolarHBondContact O-OG 2.72Å
1564	G	41.4	Very low	47.3	Very low	42 Å²	42	111.3 Å²	111.3	43%	0.433	55%	0.55	S	S	.	*	H	α-helix	trans	-65	-11.6	-176.4	0	0	0	0	0	115.3	K1560	K1560-G1564 WeakPolarHBondContact O-CA 3.12Å; K1560-G1564 PolarHBondContact O-N 3.06Å
1565	Q	39.6	Very low	46.4	Very low	149 Å²	149	116.9 Å²	116.9	70%	0.696	57%	0.574	S	S	*	*	H	α-helix	trans	-88.6	-13.9	173.4	-69.5	-169.5	-11.8	0	0	114.2	N1563	N1563-Q1565 PolarHBondContact O-N 3.35Å
1566	S	38.7	Very low	44.6	Very low	62 Å²	62	120.4 Å²	120.4	43%	0.434	59%	0.588	S	S	.	*	H	α-helix	trans	-81.3	-44.9	171	56	0	0	0	0	112	N1563 S1568 M1569	N1563-S1566 PolarHBondContact O-N 2.88Å; N1563-S1566 PolarHBondContact O-OG 2.72Å; S1566-S1568 PolarHBondContact O-N 3.03Å; S1566-M1569 PolarHBondContact O-N 3.35Å
1567	D	38	Very low	42.8	Very low	106 Å²	106	123 Å²	123	57%	0.567	61%	0.609	S	S	*	*	H	α-helix	trans	-76.5	-25.5	-164.9	-60.8	-9.8	0	0	0	113.3
1568	S	37.9	Very low	41.6	Very low	62 Å²	62	124.6 Å²	124.6	43%	0.434	63%	0.625	S	S	.	*	H	α-helix	trans	-84.5	-9.3	180	82.7	0	0	0	0	114.8	S1566	S1566-S1568 PolarHBondContact O-N 3.03Å
1569	M	33.6	Very low	40.5	Very low	134 Å²	134	128.7 Å²	128.7	66%	0.66	65%	0.653	S	S	*	*	H	α-helix	trans	-89.5	-34.3	172.7	-84.8	-176.9	61	0	0	112.5	S1566	S1566-M1569 PolarHBondContact O-N 3.35Å
1570	N	38.4	Very low	38.8	Very low	110 Å²	110	127.5 Å²	127.5	59%	0.588	66%	0.661	S	S	*	*	H	α-helix	trans	-74.1	-36.9	-179.1	-68	-7.6	0	0	0	112.3	Q1572 I1573	N1570-Q1572 PolarHBondContact O-N 3.28Å; N1570-Q1572 VanDerWaalsContact O-N 3.16Å; N1570-I1573 PolarHBondContact O-N 2.94Å
1571	K	41.2	Very low	37.2	Very low	170 Å²	170	128.1 Å²	128.1	74%	0.739	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	3.3	-177.7	-76.1	-168.7	172.8	-175.5	0	116.5
1572	Q	37.5	Very low	36.2	Very low	174 Å²	174	129.1 Å²	129.1	81%	0.813	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	2.5	173	-66.8	-163	-72.1	0	0	114	N1570	N1570-Q1572 PolarHBondContact O-N 3.28Å; N1570-Q1572 VanDerWaalsContact O-N 3.16Å
1573	I	38.1	Very low	35.3	Very low	132 Å²	132	125.6 Å²	125.6	68%	0.677	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-22.2	-177.4	-63.6	177.1	0	0	0	112.2	N1570	N1570-I1573 PolarHBondContact O-N 2.94Å
1574	E	34.1	Very low	34.2	Very low	161 Å²	161	127 Å²	127	75%	0.752	70%	0.695	S	S	*	*	S	Bend	trans	-95.5	6.5	-175.9	-63.4	-176.9	133.3	0	0	115.2
1575	H	36.6	Very low	33.6	Very low	173 Å²	173	129.5 Å²	129.5	80%	0.801	71%	0.706	S	S	*	*	S	Bend	trans	-117.6	32.9	-178	-88.5	-46.6	0	0	0	114.7
1576	Q	29.6	Very low	33.1	Very low	183 Å²	183	130.8 Å²	130.8	86%	0.855	72%	0.716	S	S	*	*	S	Bend	trans	-137.7	66.6	165.8	-74.5	-164	-23.7	0	0	112.2
1577	T	28.4	Very low	32.5	Very low	123 Å²	123	135.4 Å²	135.4	76%	0.755	73%	0.733	S	S	*	*			trans	-159.7	133.8	163.6	1.6	0	0	0	0	109.4
1578	V	30.1	Very low	32.1	Very low	139 Å²	139	137.1 Å²	137.1	84%	0.842	74%	0.742	S	S	*	*			trans	64.2	120.4	-175.2	-165.9	0	0	0	0	112.2
1579	T	31.9	Very low	31.8	Very low	135 Å²	135	143.3 Å²	143.3	83%	0.828	77%	0.765	S	S	*	*			cis	-114.9	170.5	23.6	45	0	0	0	0	114.7
1580	T	26.7	Very low	31.5	Very low	112 Å²	112	142 Å²	142	69%	0.687	77%	0.766	S	S	*	*			trans	-120.3	176.5	-178.1	59.3	0	0	0	0	112.3
1581	N	27.9	Very low	30.9	Very low	149 Å²	149	144 Å²	144	80%	0.797	78%	0.777	S	S	*	*			trans	80.3	137.2	172.6	-41.1	-16.7	0	0	0	112.8
1582	T	30.5	Very low	30.3	Very low	121 Å²	121	142.6 Å²	142.6	74%	0.742	77%	0.773	S	S	*	*			cis	-138.5	148	13.1	48.7	0	0	0	0	113
1583	S	28.5	Very low	30	Very low	98 Å²	98	139.8 Å²	139.8	69%	0.685	77%	0.768	S	S	*	*			trans	46.1	135.9	146.1	60.1	0	0	0	0	122.2
1584	T	29.4	Very low	29.8	Very low	131 Å²	131	140.8 Å²	140.8	80%	0.804	77%	0.773	S	S	*	*			cis	-175.7	157.8	-6.7	24.4	0	0	0	0	108.5
1585	S	28.8	Very low	29.6	Very low	95 Å²	95	142.9 Å²	142.9	66%	0.664	78%	0.775	S	S	*	*			cis	-179.2	64.9	-35.2	51.1	0	0	0	0	112.1
1586	L	28.3	Very low	29.4	Very low	176 Å²	176	140.9 Å²	140.9	92%	0.921	76%	0.764	S	S	*	*			trans	-131	89.9	172.2	-89	157.3	0	0	0	108.9
1587	M	26.3	Very low	29.7	Very low	160 Å²	160	137.9 Å²	137.9	79%	0.788	75%	0.754	S	S	*	*				81.5	133.3	70.8	-82	-162.4	156.5	0	0	116
1588	N	30.5	Very low	29.9	Very low	141 Å²	141	141 Å²	141	75%	0.754	75%	0.753	S	S	*	*			trans	72.2	88	158.2	-55.4	-16.5	0	0	0	119.6
1589	Q	31	Very low	30.2	Very low	193 Å²	193	139.8 Å²	139.8	90%	0.902	74%	0.742	S	S	*	*				-169.6	163	97.6	-97.4	-172	14	0	0	112.1
1590	P	27.8	Very low	30.3	Very low	105 Å²	105	135.8 Å²	135.8	68%	0.682	72%	0.719	S	S	*	*			trans	-114.6	150.7	-162.4	40	-31.1	0	0	0	117
1591	N	26.6	Very low	30.8	Very low	154 Å²	154	138.1 Å²	138.1	82%	0.824	72%	0.72	S	S	*	*			trans	60.8	170	145.4	-73.7	-20.5	0	0	0	121.5
1592	E	27.7	Very low	31.3	Very low	140 Å²	140	138.3 Å²	138.3	65%	0.654	71%	0.714	S	S	*	*			trans	59.7	93.2	172.8	-62	-147.1	133.2	0	0	119	K1596	E1592-K1596 WeakPolarHBondContact OE1-CE 3.12Å; E1592-K1596 IonicContact OE1-NZ 3.5Å; E1592-K1596 PolarHBondContact OE1-NZ 3.27Å; E1592-K1596 IonicContact OE2-NZ 3.39Å; E1592-K1596 PolarHBondContact OE2-NZ 3.41Å
1593	T	31.6	Very low	31.6	Very low	115 Å²	115	135 Å²	135	71%	0.706	70%	0.699	S	S	*	*	S	Bend	trans	-157.3	-40.2	150.8	-1.4	0	0	0	0	113.4
1594	I	32.4	Very low	31.9	Very low	152 Å²	152	137.6 Å²	137.6	78%	0.779	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-34.9	-166.5	-60.4	179.8	0	0	0	113.5
1595	Y	30.3	Very low	32.3	Very low	205 Å²	205	136.9 Å²	136.9	80%	0.804	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-21.1	-176.2	-98.5	-94.1	0	0	0	115.6	N1597	Y1595-N1597 VanDerWaalsContact C-N 3.32Å; Y1595-N1597 PolarHBondContact O-N 3.08Å
1596	K	33.7	Very low	32.7	Very low	131 Å²	131	136 Å²	136	57%	0.57	68%	0.683	S	S	*	*	H	α-helix	trans	-73	-22.1	-177.7	-74.5	179.6	176.9	173.1	0	113.3	E1592	E1592-K1596 WeakPolarHBondContact OE1-CE 3.12Å; E1592-K1596 IonicContact OE1-NZ 3.5Å; E1592-K1596 PolarHBondContact OE1-NZ 3.27Å; E1592-K1596 IonicContact OE2-NZ 3.39Å; E1592-K1596 PolarHBondContact OE2-NZ 3.41Å
1597	N	34.9	Very low	33.1	Very low	120 Å²	120	133.9 Å²	133.9	64%	0.642	67%	0.666	S	S	*	*	H	α-helix	trans	-85.8	-14.6	-178	-98	-28.6	0	0	0	115.9	Y1595 S1600	Y1595-N1597 VanDerWaalsContact C-N 3.32Å; Y1595-N1597 PolarHBondContact O-N 3.08Å; N1597-S1600 PolarHBondContact O-OG 2.92Å; N1597-S1600 VanDerWaalsContact O-OG 3.11Å
1598	Y	33.9	Very low	33.7	Very low	190 Å²	190	130.6 Å²	130.6	75%	0.745	65%	0.651	S	S	*	*	H	α-helix	trans	-82.2	-41	179.3	-141.2	-92.2	0	0	0	112	K1602	Y1598-K1602 PolarHBondContact O-N 3.35Å
1599	N	36.3	Very low	34	Very low	113 Å²	113	128.6 Å²	128.6	60%	0.604	64%	0.64	S	S	*	*	H	α-helix	trans	-71.1	-30.4	177.4	-77.6	-20	0	0	0	112.8	K1601 K1602 A1603	N1599-K1601 PolarHBondContact O-N 2.95Å; N1599-K1602 PolarHBondContact O-N 3.46Å; N1599-A1603 VanDerWaalsContact O-CB 3.3Å; N1599-A1603 WeakPolarHBondContact O-CB 3.46Å; N1599-A1603 PolarHBondContact O-N 2.86Å
1600	S	32.6	Very low	34.4	Very low	50 Å²	50	121 Å²	121	35%	0.35	61%	0.614	S	S	.	*	H	α-helix	trans	-64.5	-38.6	177.4	68.5	0	0	0	0	112.7	N1597 K1604	N1597-S1600 PolarHBondContact O-OG 2.92Å; N1597-S1600 VanDerWaalsContact O-OG 3.11Å; S1600-K1604 WeakPolarHBondContact O-CB 3.48Å; S1600-K1604 WeakPolarHBondContact O-CG 3.3Å; S1600-K1604 PolarHBondContact O-N 2.92Å
1601	K	37.5	Very low	34.7	Very low	161 Å²	161	121 Å²	121	70%	0.7	60%	0.603	S	S	*	*	H	α-helix	trans	-68.5	-40.8	172.9	-76.6	-173.8	175.6	-179.4	0	112.3	N1599 K1604 L1605	N1599-K1601 PolarHBondContact O-N 2.95Å; K1601-K1604 PolarHBondContact O-N 3.18Å; K1601-L1605 PolarHBondContact O-N 3.03Å
1602	K	38.7	Very low	35.2	Very low	153 Å²	153	118.4 Å²	118.4	67%	0.665	59%	0.588	S	S	*	*	H	α-helix	trans	-66	-39.3	177.9	-147.7	170.6	-173.3	177.2	0	111.8	Y1598 N1599 L1605 S1606	Y1598-K1602 PolarHBondContact O-N 3.35Å; N1599-K1602 PolarHBondContact O-N 3.46Å; K1602-L1605 PolarHBondContact O-N 3.31Å; K1602-S1606 PolarHBondContact O-N 3.3Å; K1602-S1606 PolarHBondContact O-OG 3.05Å
1603	A	36.7	Very low	35.5	Very low	53 Å²	53	119.6 Å²	119.6	44%	0.438	59%	0.591	S	S	.	*	H	α-helix	trans	-67.2	-41.2	172.3	0	0	0	0	0	112.9	N1599 L1605 S1606 F1607	N1599-A1603 VanDerWaalsContact O-CB 3.3Å; N1599-A1603 WeakPolarHBondContact O-CB 3.46Å; N1599-A1603 PolarHBondContact O-N 2.86Å; A1603-L1605 VanDerWaalsContact C-N 3.35Å; A1603-L1605 PolarHBondContact O-N 3.08Å; A1603-S1606 PolarHBondContact O-N 2.75Å; A1603-S1606 PolarHBondContact O-OG 2.95Å; A1603-F1607 VanDerWaalsContact O-CB 3.23Å; A1603-F1607 WeakPolarHBondContact O-CB 3.45Å; A1603-F1607 PolarHBondContact O-N 3.01Å
1604	K	36	Very low	35.7	Very low	151 Å²	151	120.6 Å²	120.6	66%	0.657	59%	0.588	S	S	*	*	H	α-helix	trans	-61.5	-41.1	173.1	-81.6	-175.9	174.6	-177.4	0	111.6	S1600 K1601 F1607 I1608	S1600-K1604 WeakPolarHBondContact O-CB 3.48Å; S1600-K1604 WeakPolarHBondContact O-CG 3.3Å; S1600-K1604 PolarHBondContact O-N 2.92Å; K1601-K1604 PolarHBondContact O-N 3.18Å; K1604-F1607 PolarHBondContact O-N 3.05Å; K1604-I1608 WeakPolarHBondContact O-CB 3.36Å; K1604-I1608 WeakPolarHBondContact O-CD1 3.25Å; K1604-I1608 WeakPolarHBondContact O-CG1 3.5Å; K1604-I1608 PolarHBondContact O-N 2.96Å
1605	L	37.3	Very low	35.8	Very low	116 Å²	116	119.6 Å²	119.6	61%	0.607	58%	0.583	S	S	*	*	H	α-helix	trans	-66	-41.8	175.4	-109.9	74.1	0	0	0	113.2	K1601 K1602 A1603 I1608 N1609	K1601-L1605 PolarHBondContact O-N 3.03Å; K1602-L1605 PolarHBondContact O-N 3.31Å; A1603-L1605 VanDerWaalsContact C-N 3.35Å; A1603-L1605 PolarHBondContact O-N 3.08Å; L1605-I1608 PolarHBondContact O-N 3.13Å; L1605-N1609 WeakPolarHBondContact O-CB 3.49Å; L1605-N1609 PolarHBondContact O-N 3.48Å
1606	S	36.1	Very low	36	Very low	78 Å²	78	114.4 Å²	114.4	55%	0.545	58%	0.576	S	S	.	*	H	α-helix	trans	-67.8	-37	176.5	66	0	0	0	0	112.1	K1602 A1603 G1610	K1602-S1606 PolarHBondContact O-N 3.3Å; K1602-S1606 PolarHBondContact O-OG 3.05Å; A1603-S1606 PolarHBondContact O-N 2.75Å; A1603-S1606 PolarHBondContact O-OG 2.95Å; S1606-G1610 PolarHBondContact O-N 2.84Å
1607	F	37	Very low	36.1	Very low	131 Å²	131	112.1 Å²	112.1	58%	0.575	58%	0.577	S	S	*	*	H	α-helix	trans	-68.8	-37.9	175.6	-167.6	-106	0	0	0	112.4	A1603 K1604 G1610 K1611	A1603-F1607 VanDerWaalsContact O-CB 3.23Å; A1603-F1607 WeakPolarHBondContact O-CB 3.45Å; A1603-F1607 PolarHBondContact O-N 3.01Å; K1604-F1607 PolarHBondContact O-N 3.05Å; F1607-G1610 PolarHBondContact O-N 3.33Å; F1607-K1611 HydrophobicContact CD1-CD 4.34Å; F1607-K1611 HydrophobicContact CE1-CD 3.91Å; F1607-K1611 HydrophobicContact CZ-CD 4.35Å; F1607-K1611 WeakPolarHBondContact O-CB 3.48Å; F1607-K1611 PolarHBondContact O-N 3.13Å
1608	I	38.3	Very low	35.9	Very low	91 Å²	91	111.2 Å²	111.2	47%	0.467	57%	0.572	S	S	.	*	H	α-helix	trans	-66.9	-46.5	173.4	-72.3	165.6	0	0	0	110.6	K1604 L1605 G1610 K1611 I1612	K1604-I1608 WeakPolarHBondContact O-CB 3.36Å; K1604-I1608 WeakPolarHBondContact O-CD1 3.25Å; K1604-I1608 WeakPolarHBondContact O-CG1 3.5Å; K1604-I1608 PolarHBondContact O-N 2.96Å; L1605-I1608 PolarHBondContact O-N 3.13Å; I1608-G1610 VanDerWaalsContact C-N 3.33Å; I1608-G1610 PolarHBondContact O-N 3.08Å; I1608-K1611 PolarHBondContact O-N 2.99Å; I1608-I1612 HydrophobicContact CG2-CD1 3.69Å; I1608-I1612 HydrophobicContact CG2-CG1 4.45Å; I1608-I1612 WeakPolarHBondContact O-CB 3.37Å; I1608-I1612 VanDerWaalsContact O-CG1 3.26Å; I1608-I1612 WeakPolarHBondContact O-CG1 3.49Å; I1608-I1612 PolarHBondContact O-N 2.93Å
1609	N	37.3	Very low	35.7	Very low	99 Å²	99	105.8 Å²	105.8	53%	0.529	56%	0.56	S	S	.	*	H	α-helix	trans	-64.5	-36	175.1	-80.9	-28.9	0	0	0	112.6	L1605 I1612 K1613	L1605-N1609 WeakPolarHBondContact O-CB 3.49Å; L1605-N1609 PolarHBondContact O-N 3.48Å; N1609-I1612 PolarHBondContact O-N 2.87Å; N1609-K1613 PolarHBondContact O-N 2.75Å
1610	G	39.8	Very low	35.5	Very low	34 Å²	34	105.3 Å²	105.3	35%	0.351	56%	0.557	S	S	.	*	H	α-helix	trans	-62.5	-49.4	172.4	0	0	0	0	0	112.2	S1606 F1607 I1608 I1612 K1613 Q1614	S1606-G1610 PolarHBondContact O-N 2.84Å; F1607-G1610 PolarHBondContact O-N 3.33Å; I1608-G1610 VanDerWaalsContact C-N 3.33Å; I1608-G1610 PolarHBondContact O-N 3.08Å; G1610-I1612 PolarHBondContact O-N 3.22Å; G1610-K1613 PolarHBondContact O-N 3.21Å; G1610-Q1614 PolarHBondContact O-N 3.36Å
1611	K	34.9	Very low	35.5	Very low	104 Å²	104	109.4 Å²	109.4	45%	0.452	57%	0.574	S	S	.	*	H	α-helix	trans	-64.7	-35.9	175	-80	-168.3	170.4	-174.7	0	112.7	F1607 I1608 K1613 Q1614 I1615	F1607-K1611 HydrophobicContact CD1-CD 4.34Å; F1607-K1611 HydrophobicContact CE1-CD 3.91Å; F1607-K1611 HydrophobicContact CZ-CD 4.35Å; F1607-K1611 WeakPolarHBondContact O-CB 3.48Å; F1607-K1611 PolarHBondContact O-N 3.13Å; I1608-K1611 PolarHBondContact O-N 2.99Å; K1611-K1613 VanDerWaalsContact C-N 3.34Å; K1611-K1613 PolarHBondContact O-N 3.02Å; K1611-Q1614 PolarHBondContact O-N 3.05Å; K1611-I1615 HydrophobicContact CB-CD1 4.43Å; K1611-I1615 VanDerWaalsContact O-CB 3.31Å; K1611-I1615 WeakPolarHBondContact O-CB 3.26Å; K1611-I1615 WeakPolarHBondContact O-CD1 3.02Å; K1611-I1615 WeakPolarHBondContact O-CG1 3.39Å; K1611-I1615 PolarHBondContact O-N 2.96Å
1612	I	36.1	Very low	35	Very low	100 Å²	100	110.1 Å²	110.1	51%	0.513	57%	0.572	S	S	.	*	H	α-helix	trans	-64.9	-36.6	175.1	-72.3	167.9	0	0	0	111.3	I1608 N1609 G1610 S1616	I1608-I1612 HydrophobicContact CG2-CD1 3.69Å; I1608-I1612 HydrophobicContact CG2-CG1 4.45Å; I1608-I1612 WeakPolarHBondContact O-CB 3.37Å; I1608-I1612 VanDerWaalsContact O-CG1 3.26Å; I1608-I1612 WeakPolarHBondContact O-CG1 3.49Å; I1608-I1612 PolarHBondContact O-N 2.93Å; N1609-I1612 PolarHBondContact O-N 2.87Å; G1610-I1612 PolarHBondContact O-N 3.22Å; I1612-S1616 PolarHBondContact O-N 2.83Å; I1612-S1616 PolarHBondContact O-OG 2.9Å
1613	K	35	Very low	34.3	Very low	165 Å²	165	110.9 Å²	110.9	72%	0.717	57%	0.571	S	S	*	*	H	α-helix	trans	-70.1	-35.4	170.5	-81	-170.7	171.1	-173.5	0	113.9	N1609 G1610 K1611 S1616 S1617	N1609-K1613 PolarHBondContact O-N 2.75Å; G1610-K1613 PolarHBondContact O-N 3.21Å; K1611-K1613 VanDerWaalsContact C-N 3.34Å; K1611-K1613 PolarHBondContact O-N 3.02Å; K1613-S1616 PolarHBondContact O-OG 3.33Å; K1613-S1617 PolarHBondContact O-OG 3.36Å
1614	Q	35.3	Very low	33.9	Very low	136 Å²	136	116.6 Å²	116.6	64%	0.636	59%	0.586	S	S	*	*	H	α-helix	trans	-71.1	-35.7	174.3	-75.3	-177	-27.7	0	0	112.5	G1610 K1611 S1616 S1617	G1610-Q1614 PolarHBondContact O-N 3.36Å; K1611-Q1614 PolarHBondContact O-N 3.05Å; Q1614-S1616 VanDerWaalsContact C-N 3.32Å; Q1614-S1616 PolarHBondContact O-N 3.43Å; Q1614-S1617 PolarHBondContact O-N 3.13Å; Q1614-S1617 PolarHBondContact O-OG 3.42Å
1615	I	33.9	Very low	33.6	Very low	131 Å²	131	113.7 Å²	113.7	67%	0.672	59%	0.585	S	S	*	*	H	α-helix	trans	-73.9	-23.6	179.3	-69.7	164.2	0	0	0	111.7	K1611 S1617	K1611-I1615 HydrophobicContact CB-CD1 4.43Å; K1611-I1615 VanDerWaalsContact O-CB 3.31Å; K1611-I1615 WeakPolarHBondContact O-CB 3.26Å; K1611-I1615 WeakPolarHBondContact O-CD1 3.02Å; K1611-I1615 WeakPolarHBondContact O-CG1 3.39Å; K1611-I1615 PolarHBondContact O-N 2.96Å; I1615-S1617 VanDerWaalsContact C-N 3.28Å; I1615-S1617 PolarHBondContact O-N 3.05Å
1616	S	35.1	Very low	32.8	Very low	95 Å²	95	113.3 Å²	113.3	66%	0.664	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-9.7	175.9	60.6	0	0	0	0	114.8	I1612 K1613 Q1614	I1612-S1616 PolarHBondContact O-N 2.83Å; I1612-S1616 PolarHBondContact O-OG 2.9Å; K1613-S1616 PolarHBondContact O-OG 3.33Å; Q1614-S1616 VanDerWaalsContact C-N 3.32Å; Q1614-S1616 PolarHBondContact O-N 3.43Å
1617	S	34.9	Very low	32.4	Very low	84 Å²	84	114.4 Å²	114.4	59%	0.587	58%	0.581	S	S	*	*	S	Bend	trans	-116.7	-7.1	-164.3	42.7	0	0	0	0	116.7	K1613 Q1614 I1615	K1613-S1617 PolarHBondContact O-OG 3.36Å; Q1614-S1617 PolarHBondContact O-N 3.13Å; Q1614-S1617 PolarHBondContact O-OG 3.42Å; I1615-S1617 VanDerWaalsContact C-N 3.28Å; I1615-S1617 PolarHBondContact O-N 3.05Å
1618	N	32	Very low	31.9	Very low	101 Å²	101	116 Å²	116	54%	0.54	59%	0.588	S	S	.	*			trans	-141.2	119.9	-174.6	-156.7	-31.3	0	0	0	114.6
1619	P	29.7	Very low	31.2	Very low	75 Å²	75	115.3 Å²	115.3	49%	0.487	59%	0.591	S	S	.	*	S	Bend	trans	-81.8	-13.4	-171.5	-17.6	33.1	0	0	0	119
1620	N	32.3	Very low	30.6	Very low	103 Å²	103	118.7 Å²	118.7	55%	0.551	60%	0.603	S	S	*	*			trans	-108.7	9.2	-153.1	-76.4	-16.5	0	0	0	117.8	W1622	N1620-W1622 VanDerWaalsContact C-N 3.33Å; N1620-W1622 PolarHBondContact O-N 3.45Å
1621	I	32.2	Very low	29.8	Very low	137 Å²	137	120 Å²	120	70%	0.703	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	8.9	-162.3	-71.9	175	0	0	0	115.8
1622	W	26.1	Very low	29.4	Very low	176 Å²	176	122.6 Å²	122.6	67%	0.667	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.5	37.4	-176.7	-97.1	46.6	0	0	0	114.3	N1263 C1264 N1620	N1263-W1622 CarbonylContact C-O 3.54Å; N1263-W1622 WeakPolarHBondContact CA-O 3.43Å; N1263-W1622 WeakPolarHBondContact CB-O 3.37Å; N1263-W1622 PolarHBondContact ND2-O 3.43Å; N1263-W1622 VanDerWaalsContact OD1-C 3.31Å; N1263-W1622 WeakPolarHBondContact OD1-CB 3.18Å; N1263-W1622 VanDerWaalsContact OD1-CE3 3.31Å; N1263-W1622 PolarHBondContact OD1-O 3.02Å; C1264-W1622 WeakPolarHBondContact CA-O 3.11Å; C1264-W1622 WeakPolarHBondContact CB-O 3.42Å; C1264-W1622 PolarHBondContact N-O 3.3Å; C1264-W1622 VanDerWaalsContact SG-CA 3.59Å; C1264-W1622 PolarHBondContact SG-O 3.1Å; N1620-W1622 VanDerWaalsContact C-N 3.33Å; N1620-W1622 PolarHBondContact O-N 3.45Å
1623	R	24.4	Very low	28.8	Very low	168 Å²	168	120.5 Å²	120.5	63%	0.634	61%	0.608	S	S	*	*			trans	-125.8	98	166.7	-136.5	157.6	-129.8	-177.9	2.7	114.8	N1263 C1264 V1265	N1263-R1623 HydrophobicContact CB-CG 4.48Å; N1263-R1623 PolarHBondContact O-NE 2.96Å; N1263-R1623 PolarHBondContact O-NH2 2.77Å; C1264-R1623 HydrophobicContact CB-CB 3.37Å; C1264-R1623 VanDerWaalsContact CB-CD 3.4Å; C1264-R1623 HydrophobicContact CB-CG 3.46Å; C1264-R1623 VanDerWaalsContact CB-CG 3.46Å; C1264-R1623 VanDerWaalsContact CB-NE 3.32Å; C1264-R1623 PolarHBondContact O-NH2 2.79Å; C1264-R1623 PolarHBondContact SG-N 3.38Å; V1265-R1623 PolarHBondContact O-NH1 2.99Å
1624	K	28.4	Very low	28.3	Very low	174 Å²	174	115.6 Å²	115.6	76%	0.757	59%	0.59	S	S	*	*			trans	176.2	172.4	140.4	-98.4	159.4	-176.2	-173.2	0	111.8	N1263	N1263-K1624 PolarHBondContact ND2-N 3Å; N1263-K1624 PolarHBondContact ND2-O 3.34Å
1625	S	29.2	Very low	27.8	Very low	89 Å²	89	113.4 Å²	113.4	62%	0.622	58%	0.58	S	S	*	*			trans	47.7	114.9	171.1	57	0	0	0	0	118
1626	K	21.3	Very low	27.3	Very low	109 Å²	109	112.5 Å²	112.5	47%	0.474	58%	0.575	S	S	.	*			cis	55.2	73.4	5	-75.6	-92.3	164.1	-162.3	0	116.7	I1259 E1260 T1261	I1259-K1626 PolarHBondContact O-NZ 3.42Å; E1260-K1626 HydrophobicContact CB-CB 4.29Å; E1260-K1626 HydrophobicContact CB-CD 3.84Å; E1260-K1626 HydrophobicContact CB-CG 3.86Å; E1260-K1626 WeakPolarHBondContact O-CE 3.35Å; E1260-K1626 VanDerWaalsContact OE2-CA 3.28Å; E1260-K1626 WeakPolarHBondContact OE2-CA 3.21Å; E1260-K1626 WeakPolarHBondContact OE2-CD 3.46Å; T1261-K1626 PolarHBondContact O-N 3.2Å
1627	V	26.7	Very low	26.7	Very low	101 Å²	101	114.8 Å²	114.8	61%	0.612	58%	0.58	S	S	*	*			trans	168.1	130.6	134.8	154.3	0	0	0	0	113.7	E1260	E1260-V1627 VanDerWaalsContact OE1-CA 3.22Å; E1260-V1627 WeakPolarHBondContact OE1-CA 3.46Å; E1260-V1627 WeakPolarHBondContact OE2-CA 3.47Å; E1260-V1627 PolarHBondContact OE2-N 3.32Å
1628	K	26.6	Very low	26.2	Very low	165 Å²	165	122.7 Å²	122.7	72%	0.717	62%	0.615	S	S	*	*			trans	74.7	104	154.7	-85.2	168.7	-174.1	178.6	0	122.4	E1260	E1260-K1628 PolarHBondContact OE1-N 3.35Å
1629	S	23.5	Very low	25.9	Very low	75 Å²	75	123.8 Å²	123.8	52%	0.524	62%	0.618	S	S	.	*				53.6	135.5	116.5	67.9	0	0	0	0	124.4
1630	H	25.2	Very low	25.7	Very low	170 Å²	170	126.4 Å²	126.4	79%	0.787	63%	0.625	S	S	*	*			trans	92.3	119.6	149.2	-73.7	9.8	0	0	0	120.2
1631	S	23.8	Very low	25.4	Very low	62 Å²	62	127.7 Å²	127.7	43%	0.434	63%	0.629	S	S	.	*			trans	-0.3	130	155.2	56.8	0	0	0	0	119.6
1632	F	25.2	Very low	25	Very low	158 Å²	158	127.1 Å²	127.1	69%	0.693	63%	0.625	S	S	*	*				-151.8	143.2	98.2	-110.4	-90.8	0	0	0	108.6
1633	N	23.7	Very low	24.9	Very low	56 Å²	56	124.1 Å²	124.1	30%	0.299	62%	0.622	S	S	.	*			trans	-77.4	147.2	164.9	-40	-26.3	0	0	0	107.1	C691 Q695	C691-N1633 HydrophobicContact CB-CB 4.08Å; C691-N1633 PolarHBondContact O-ND2 3.13Å; C691-N1633 PolarHBondContact SG-ND2 3.08Å; Q695-N1633 VanDerWaalsContact NE2-CG 3.27Å; Q695-N1633 PolarHBondContact NE2-ND2 3.43Å
1634	N	24.5	Very low	24.9	Very low	63 Å²	63	121.1 Å²	121.1	34%	0.337	62%	0.622	S	S	.	*				-172.8	166.7	96.4	-119	-29.2	0	0	0	117.8	D688 C691	D688-N1634 VanDerWaalsContact CA-ND2 3.35Å; D688-N1634 WeakPolarHBondContact CA-ND2 2.82Å; D688-N1634 PolarHBondContact O-ND2 2.94Å; D688-N1634 PolarHBondContact OD1-ND2 2.86Å; C691-N1634 VanDerWaalsContact CB-CG 3.42Å; C691-N1634 WeakPolarHBondContact CB-ND2 3.46Å; C691-N1634 WeakPolarHBondContact CB-OD1 3.39Å; C691-N1634 PolarHBondContact SG-OD1 3.33Å; C691-N1634 VanDerWaalsContact SG-OD1 3.34Å
1635	E	24.9	Very low	24.7	Very low	89 Å²	89	117.4 Å²	117.4	42%	0.416	61%	0.612	S	S	.	*			trans	57.7	122.7	148.2	-69.8	-155.3	150.1	0	0	123.5	F687 D688	F687-E1635 WeakPolarHBondContact CB-OE1 3.25Å; F687-E1635 HydrophobicContact CD1-CG 4.09Å; D688-E1635 WeakPolarHBondContact CA-OE1 3.35Å; D688-E1635 HydrophobicContact CB-CG 4.39Å; D688-E1635 PolarHBondContact N-OE1 3.22Å
1636	I	24.7	Very low	24.3	Very low	112 Å²	112	119.5 Å²	119.5	57%	0.574	61%	0.611	S	S	*	*			trans	80.3	98.4	132.1	-61.3	168.8	0	0	0	119
1637	D	21.7	Very low	24.6	Very low	143 Å²	143	120.4 Å²	120.4	77%	0.765	62%	0.623	S	S	*	*				44.8	110.8	126.3	-47	-15.7	0	0	0	121.1
1638	L	24.2	Very low	24.4	Very low	251 Å²	251	122.2 Å²	122.2	100%	1.314	62%	0.624	S	S	*	*			trans	-163.7	0	130.2	-115	170.8	0	0	0	112.8

Retrieved 1,638 of 1,638 residues in 454 ms (Link to these results)

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