A0A5K4F3L1_SCHMA Loading...

PDZ domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F3L1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,882 aa.

						>A0A5K4F3L1_SCHMA|A0A5K4F3L1
MVRPRSSIGPSDRTSKERPVSSGPDMFGLFKRGSVKDVNHPECLKEEDSPMDGSSRDTTTANNKNSSNGSNSSSNSSSKSLSRMSFPGHSKSNGTSNKKTTGNLKDQSTFSSSTPPLGHVMGRNFDDEGESDLSNANDLAHLSSEFDSATSVLNSPAKCAMFIDYLFSHKRDPTWTLFHIVNQYFQRSMASSKELFKDEKRVCLEIFTTFLHEKSPLRLDVRTPIALKSFDFNECSKLFNFIDQQCLNQIELQVSKLAEAINLGMDTWCLSEPIDFVLFRNKEEELACFESRLSSYLDALHQLSTGSCIDNPIALSICRLPNTSGSVTYDQITQAITTCLVTAHRYYSMSQISSADYPETRDSGHSIRHSLFARSFENLTTSALGLGSVSGSIGSGLSSAGSHLWTKLTPYCAKSKQKSHSLLNRKSKWSHKGHSFYEYTYERIADCGVCGFLLWGLSSQGFNCNNCDLFIHLKCKNGIRDHCSREGRRTTGVASANVLSGILGSIPNLTMDTHVPGNAPNQTNESCNKVPLNSNQIGSNDLIHHCCTTHRRCGSDTRHKQKKANTLKDFHLLPSFLHRNNNANSVDNPHDVVASLDETINSSCQDSSGLNETSSISGSGGGDTSINFPSPGLSKRDSISSMSVGSTCQTPVDSYLQSGIGQTDKIKSNGEEFGIMGNDSRYVKQMKNLYEGSEIIQETIPTSRSDSVVSNISLNLPASSNTTGPCDRPVETTSPPASSSLSSPVSNINETVRELVTTDWSDDPEMIAGASFEAAVELRAQFPNFQMPSKGQKSEEYIRTLVLLEFHQKTQYMVRHLKQYEYLLLRRWPVEHAKLSKILCLDQIPILINLFRSLVTCIDQTKTEQGYRGMAEAVLAWLTDNSSANLKTWARHCQALSCSNMLESVRHSVRDYVRRHPDIVPLLQTRHNKFVLIEGLKQMRILYFNLPLIANNIAKDLEKRTKMYKAEAKIWQQIQLKLASLPQTIDNVCMPLVKRINLGQLCTSLDKKDILSKPLPDLLLPFQHLLLNFPRVLFHHWVVAHAEVTVDKLTANRSNKVNHDYICERTEMLAILLHNALILMVKDGERYILRSFKAVREQGGCSGSSGISSTSASNSSTVERLSSFGSPGTTSEKDRPNSGNISGYSSISSCSSLISLPGSNTQSHTSLVSAAASAAVASMTDRSSTSLGSSKLVPIFPLIDVFTSCGEKFGGDHLLNIVFMKQTVLIRLLFSKEDERQNWSAYIQENSVTTQSIDRQRVLKPSASAAAASSSPSSSTQNRPTIGITSESLISKTSGNTPTADEVSVITPQPSTQDLKTSFGKLPTTSSTTTKNDKTTYPSDINSFDLISSGEESTVFVDKLQTAMNELLGQTRQIICEKYNISKEELANAMNESDDVDDILNPGKILLFQIKYFAKCYNLITRTLAPQPSTSFLNQIQDHLESINDKDHQELEILMRQKKRQSSLSWTEGYLESLSRNPVLNVGRNRVIGSTESERSRFNVIDALPDDSKAIQSSPNLVGSDSERSRIEIQDKRKSKRRSRKSEAGPVSNLDFTFFDNLLNKELITMAPVFAKSVMCLCKLTHQDLSPNNLLKESSNSRKSLSRPSIQIDSQIHWTKAGDIECPVSGSTEEVEDEEVRTLANSIIDLSCSQTTDTLRLDTLSTEQSDAIHSGFDLSADNSDQDLDSVAAQLVSDVLENAKNYFSNHITKSNDAEQKTVNVIRDSGCAPSATDEDEDYYYEEEIDDDVDDDHVNNDETVEEISENHIDILTSSGTISTSDTSTPKFVGVASIFDDASLDQSNQLDKTSSIHDDLLIDNDVIDVVAPCPAIFMSGITTSIDPPTIITTTTTNIITNNNTTITTNIGRNDSQKSTTSSGYVDSSDD
					

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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	Very low	30.6	Very low	171 Å²	171	133.6 Å²	133.6	84%	0.842	75%	0.752	S	S	*	*				0	177.8	0	-69.8	156.1	69.8	0	0	109	N135	M1-N135 PolarHBondContact N-OD1 3.33Å
2	V	29	Very low	30.6	Very low	140 Å²	140	131.8 Å²	131.8	85%	0.848	74%	0.739	S	S	*	*			trans	-133.4	123.6	159.9	-177.7	0	0	0	0	109.7
3	R	25.9	Very low	30.7	Very low	203 Å²	203	136.7 Å²	136.7	77%	0.766	74%	0.739	S	S	*	*			trans	-104.4	130.1	171.8	-81.7	177.9	167.8	162.8	-2.9	109.5
4	P	31.1	Very low	30.7	Very low	130 Å²	130	135.7 Å²	135.7	84%	0.844	74%	0.74	S	S	*	*			trans	-78.9	123.8	154.6	30.8	-29	0	0	0	109.7
5	R	28.2	Very low	30.7	Very low	196 Å²	196	132.7 Å²	132.7	74%	0.74	73%	0.733	S	S	*	*			trans	-104.6	124.5	171.7	-112.2	-178.9	168.7	178.5	-5	109.5	E130	R5-E130 IonicContact NH1-OE1 3.77Å; R5-E130 IonicContact NH1-OE2 3.78Å; R5-E130 PolarHBondContact NH1-OE2 3.14Å; R5-E130 VanDerWaalsContact NH1-OE2 3.14Å
6	S	31.1	Very low	30.8	Very low	111 Å²	111	135.2 Å²	135.2	78%	0.776	73%	0.734	S	S	*	*			trans	-158.3	97.2	157	45.3	0	0	0	0	108
7	S	30	Very low	30.8	Very low	108 Å²	108	131.5 Å²	131.5	76%	0.755	71%	0.711	S	S	*	*				97.6	89.4	71.7	65.2	0	0	0	0	112.1
8	I	30.3	Very low	30.7	Very low	171 Å²	171	134.1 Å²	134.1	88%	0.877	71%	0.709	S	S	*	*			trans	-2.3	137.7	137.6	-57.2	154	0	0	0	113.9
9	G	36.2	Very low	31	Very low	57 Å²	57	133.5 Å²	133.5	59%	0.588	71%	0.713	S	S	*	*			cis	165.7	-142.1	12.9	0	0	0	0	0	108.3
10	P	35.7	Very low	30.9	Very low	86 Å²	86	134 Å²	134	56%	0.558	72%	0.721	S	S	*	*			cis	-138.9	174.6	-4.3	43.4	-26.2	0	0	0	115.2
11	S	32.3	Very low	30.8	Very low	97 Å²	97	132.3 Å²	132.3	68%	0.678	72%	0.719	S	S	*	*			trans	41.5	148.1	135.6	73.2	0	0	0	0	122.4
12	D	30.8	Very low	30.8	Very low	112 Å²	112	130 Å²	130	60%	0.599	72%	0.721	S	S	*	*			cis	-166	154.2	37.6	-140.8	-11.7	0	0	0	117.4
13	R	31.6	Very low	30.8	Very low	195 Å²	195	126.7 Å²	126.7	74%	0.736	71%	0.714	S	S	*	*			trans	63.2	111.8	141.1	-95.4	163.7	-121	-129	2.8	125.6
14	T	31	Very low	31.4	Very low	123 Å²	123	122.5 Å²	122.5	76%	0.755	71%	0.713	S	S	*	*				73.2	147.6	122.6	53.4	0	0	0	0	122
15	S	30.7	Very low	31.1	Very low	90 Å²	90	123 Å²	123	63%	0.629	71%	0.709	S	S	*	*			cis	-173	159	-9.4	48.7	0	0	0	0	113.5
16	K	31.9	Very low	31.1	Very low	173 Å²	173	120.2 Å²	120.2	75%	0.752	71%	0.706	S	S	*	*			trans	67.1	145.4	146	-79.5	171.6	174.5	-96.4	0	118.2
17	E	30.6	Very low	30.8	Very low	73 Å²	73	123.4 Å²	123.4	34%	0.341	71%	0.706	S	S	.	*			cis	-164.1	162.3	-7	-139.5	174.7	-98.2	0	0	112.3	L716	E17-L716 HydrophobicContact CB-CD1 3.49Å; E17-L716 VanDerWaalsContact CB-CD1 3.49Å; E17-L716 HydrophobicContact CG-CD1 4.39Å
18	R	29.7	Very low	30.7	Very low	178 Å²	178	120 Å²	120	67%	0.672	69%	0.688	S	S	*	*			trans	71.6	135.5	158.3	-62.1	-178	-161.1	-126.9	-12.2	122.2
19	P	37.1	Very low	30.6	Very low	123 Å²	123	115.4 Å²	115.4	80%	0.799	67%	0.665	S	S	*	*			trans	-99.1	175.9	160.3	40.7	-34.2	0	0	0	112.4
20	V	28.4	Very low	30.1	Very low	142 Å²	142	117.9 Å²	117.9	86%	0.861	66%	0.66	S	S	*	*			trans	-165.5	158.2	146.3	128.1	0	0	0	0	111.9
21	S	27.6	Very low	29.8	Very low	99 Å²	99	118.6 Å²	118.6	69%	0.692	65%	0.654	S	S	*	*			trans	-49.2	149.9	-173.2	58.1	0	0	0	0	119.4
22	S	28.9	Very low	29.6	Very low	124 Å²	124	125.2 Å²	125.2	87%	0.867	66%	0.664	S	S	*	*				-176.5	150.1	106	37.6	0	0	0	0	113.5
23	G	28.9	Very low	29.5	Very low	69 Å²	69	123.3 Å²	123.3	71%	0.711	67%	0.67	S	S	*	*			trans	-134.6	-160	159.8	0	0	0	0	0	108.1
24	P	36.6	Very low	29.3	Very low	115 Å²	115	119.1 Å²	119.1	75%	0.747	67%	0.671	S	S	*	*			cis	-129.8	-144.5	0.1	36.7	-15.1	0	0	0	111.8
25	D	26.4	Very low	29.1	Very low	140 Å²	140	118.7 Å²	118.7	75%	0.749	67%	0.668	S	S	*	*			trans	93.9	127	142.9	-88	3.6	0	0	0	124.9
26	M	27	Very low	28.9	Very low	139 Å²	139	122.9 Å²	122.9	69%	0.685	68%	0.675	S	S	*	*			trans	95	93.2	135.5	-65.9	-72.5	-68.4	0	0	124.9
27	F	25.4	Very low	28.8	Very low	177 Å²	177	120.4 Å²	120.4	78%	0.776	67%	0.67	S	S	*	*				64.2	159.4	129	-81.8	-109.1	0	0	0	124.6
28	G	28.6	Very low	28.7	Very low	36 Å²	36	122 Å²	122	37%	0.371	69%	0.685	S	S	.	*			trans	97	124.5	170.5	0	0	0	0	0	114.9	K1509	G28-K1509 WeakPolarHBondContact O-CG 3.17Å; G28-K1509 PolarHBondContact O-NZ 3.39Å
29	L	27.3	Very low	28.8	Very low	75 Å²	75	120.2 Å²	120.2	39%	0.393	69%	0.688	S	S	.	*			cis	74.6	132.2	27.2	-42.8	176.8	0	0	0	113.2	A1510 I1511	L29-A1510 HydrophobicContact CD2-CB 4.41Å; L29-I1511 HydrophobicContact CD2-CB 3.99Å; L29-I1511 HydrophobicContact CD2-CD1 3.87Å; L29-I1511 HydrophobicContact CD2-CG2 3.88Å
30	F	26.5	Very low	28.3	Very low	110 Å²	110	122.4 Å²	122.4	48%	0.482	69%	0.687	S	S	.	*			cis	-151.3	133.3	1	-74	-70.4	0	0	0	115	K1509 I1511 Q1512	F30-K1509 CarbonylContact C-O 3.53Å; F30-I1511 HydrophobicContact CD1-CB 4.4Å; F30-I1511 HydrophobicContact CD1-CG2 4.46Å; F30-I1511 HydrophobicContact CE1-CG2 4.22Å; F30-Q1512 HydrophobicContact CD1-CB 4.38Å; F30-Q1512 HydrophobicContact CE1-CB 4.01Å; F30-Q1512 VanDerWaalsContact CE1-CD 3.46Å; F30-Q1512 HydrophobicContact CE1-CG 4.11Å; F30-Q1512 VanDerWaalsContact CE1-OE1 3.3Å
31	K	29.5	Very low	28.6	Very low	101 Å²	101	120.5 Å²	120.5	44%	0.439	68%	0.678	S	S	.	*				39.4	124	129.8	-145.6	-160.7	-151.2	174.1	0	120.7	K1509 A1510 I1511 Q1512	K31-K1509 PolarHBondContact N-O 3.34Å; K31-A1510 WeakPolarHBondContact CA-O 3.27Å; K31-A1510 WeakPolarHBondContact CB-O 3.14Å; K31-A1510 PolarHBondContact N-O 2.86Å; K31-I1511 WeakPolarHBondContact CB-O 3.45Å; K31-I1511 WeakPolarHBondContact CD-O 3.24Å; K31-I1511 WeakPolarHBondContact CE-O 3.3Å; K31-I1511 WeakPolarHBondContact CG-O 3.14Å; K31-Q1512 PolarHBondContact NZ-O 3.24Å
32	R	28.1	Very low	28.7	Very low	236 Å²	236	124 Å²	124	89%	0.891	68%	0.684	S	S	*	*				165.7	150.6	111.5	-95.9	176.7	168.9	153	-2	116.3
33	G	27.8	Very low	28.5	Very low	71 Å²	71	123.8 Å²	123.8	73%	0.732	68%	0.681	S	S	*	*			trans	81.7	166	152.8	0	0	0	0	0	115.8
34	S	27.1	Very low	28.3	Very low	108 Å²	108	127.3 Å²	127.3	76%	0.755	68%	0.683	S	S	*	*			cis	-156.6	126.1	-13.7	-115.7	0	0	0	0	108
35	V	26.9	Very low	27.8	Very low	113 Å²	113	129.8 Å²	129.8	69%	0.685	68%	0.682	S	S	*	*				73.1	120.1	95.3	170.4	0	0	0	0	113.1
36	K	27.7	Very low	27.8	Very low	178 Å²	178	130.6 Å²	130.6	77%	0.774	68%	0.681	S	S	*	*			trans	73.7	158.9	159.8	-74.3	173.5	174.7	-164.1	0	117.2
37	D	28.1	Very low	27.8	Very low	122 Å²	122	132.3 Å²	132.3	65%	0.652	69%	0.687	S	S	*	*			cis	-155.2	163	-2.3	-120.6	-22.8	0	0	0	112.7
38	V	29.2	Very low	28.3	Very low	107 Å²	107	130.6 Å²	130.6	65%	0.648	69%	0.686	S	S	*	*			trans	61.4	123.5	138.9	171.5	0	0	0	0	122.4
39	N	31.2	Very low	28.3	Very low	140 Å²	140	133.9 Å²	133.9	75%	0.749	70%	0.703	S	S	*	*			trans	53.8	143.3	147.9	-56.5	-4.1	0	0	0	120.8
40	H	27.2	Very low	28.7	Very low	168 Å²	168	135.4 Å²	135.4	78%	0.778	72%	0.718	S	S	*	*			cis	76.1	146.4	27.9	-158.1	26.7	0	0	0	113.6
41	P	34.6	Very low	29	Very low	102 Å²	102	137.9 Å²	137.9	66%	0.662	73%	0.733	S	S	*	*			cis	-85.8	-129.1	-25.2	9.6	12.6	0	0	0	111.4
42	E	30	Very low	28.9	Very low	173 Å²	173	140.3 Å²	140.3	81%	0.808	75%	0.751	S	S	*	*			cis	-146.5	-175.6	2.7	-84.5	-167	97.5	0	0	110.8
43	C	23.8	Very low	29.1	Very low	119 Å²	119	131.8 Å²	131.8	80%	0.804	74%	0.736	S	S	*	*			trans	-145.6	110.1	176.3	176.8	0	0	0	0	111.8
44	L	26.1	Very low	29	Very low	144 Å²	144	133.8 Å²	133.8	75%	0.754	74%	0.739	S	S	*	*			trans	-147.1	127.6	168.3	-70.4	179	0	0	0	105.7
45	K	24.5	Very low	28.9	Very low	167 Å²	167	132.8 Å²	132.8	73%	0.726	73%	0.732	S	S	*	*				96.3	150.1	52	-93.2	-161.1	172	-165	0	111.9
46	E	28.5	Very low	28.9	Very low	157 Å²	157	137 Å²	137	73%	0.734	74%	0.735	S	S	*	*			trans	64.8	148.2	171.4	-68.4	132.3	-126.7	0	0	116.3
47	E	26.8	Very low	28.8	Very low	174 Å²	174	134.1 Å²	134.1	81%	0.813	73%	0.728	S	S	*	*			cis	-160	-153.1	-41	-130	171.5	-175.3	0	0	107.7
48	D	34.3	Very low	28.7	Very low	142 Å²	142	134 Å²	134	76%	0.759	73%	0.733	S	S	*	*			trans	62.8	81.1	162.6	-63.3	-25.1	0	0	0	120.6
49	S	28.9	Very low	28.6	Very low	105 Å²	105	134.1 Å²	134.1	73%	0.734	73%	0.733	S	S	*	*				23.9	163.8	93.4	-46.2	0	0	0	0	120.3
50	P	36.5	Very low	28.4	Very low	107 Å²	107	133.4 Å²	133.4	70%	0.695	73%	0.734	S	S	*	*			cis	-133.3	-130.7	-47.1	40.2	-22.8	0	0	0	109.9
51	M	32.4	Very low	28.4	Very low	161 Å²	161	129.1 Å²	129.1	79%	0.793	73%	0.728	S	S	*	*			trans	74.7	158.1	169.5	-53	-57.2	-168.1	0	0	118
52	D	26.5	Very low	28.1	Very low	153 Å²	153	130.5 Å²	130.5	82%	0.818	73%	0.73	S	S	*	*			cis	-170.1	169	-46.2	-144.7	-28	0	0	0	107.3
53	G	32.2	Very low	28	Very low	56 Å²	56	127.5 Å²	127.5	58%	0.577	72%	0.72	S	S	*	*			trans	101.7	124.7	174.2	0	0	0	0	0	113.8
54	S	26.8	Very low	28.4	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	72%	0.717	S	S	*	*			cis	63.2	128.3	30.8	-137.6	0	0	0	0	111.5
55	S	25.6	Very low	28.5	Very low	87 Å²	87	129.6 Å²	129.6	61%	0.608	72%	0.715	S	S	*	*			cis	-168.8	174.6	9.7	-133	0	0	0	0	112.5
56	R	27	Very low	28.6	Very low	200 Å²	200	126 Å²	126	76%	0.755	71%	0.711	S	S	*	*			trans	64.5	122	145.3	-75.3	-169.2	171.2	105.6	3.6	121.3
57	D	25.7	Very low	28.6	Very low	118 Å²	118	122.5 Å²	122.5	63%	0.631	70%	0.704	S	S	*	*				63.5	156.9	116.6	-47.5	-17.7	0	0	0	121.6
58	T	26.2	Very low	28.6	Very low	121 Å²	121	122 Å²	122	74%	0.742	71%	0.707	S	S	*	*			trans	68.8	127.4	144.3	43.2	0	0	0	0	119.1
59	T	26.2	Very low	28.4	Very low	108 Å²	108	118.3 Å²	118.3	66%	0.663	70%	0.703	S	S	*	*			cis	-168.6	174.6	-8.5	-0.8	0	0	0	0	111
60	T	26.5	Very low	28.2	Very low	125 Å²	125	118.2 Å²	118.2	77%	0.767	70%	0.702	S	S	*	*			trans	71.1	145	141.7	45.5	0	0	0	0	121.2
61	A	27.8	Very low	27.6	Very low	78 Å²	78	120.5 Å²	120.5	65%	0.645	71%	0.708	S	S	*	*			trans	82.8	129.4	142.3	0	0	0	0	0	118.2
62	N	28	Very low	27.3	Very low	132 Å²	132	117.4 Å²	117.4	71%	0.706	70%	0.702	S	S	*	*			cis	-162.1	159	-11.3	-119.2	-23.8	0	0	0	112.2
63	N	28.8	Very low	27.2	Very low	110 Å²	110	114.4 Å²	114.4	59%	0.588	69%	0.693	S	S	*	*			trans	24.8	126.6	142	-58.2	-35.2	0	0	0	118
64	K	31.6	Very low	26.9	Very low	175 Å²	175	116.5 Å²	116.5	76%	0.761	70%	0.7	S	S	*	*				-160.1	147.4	57.6	-110.9	114.2	-177.8	-173.5	0	113.6
65	N	28.2	Very low	26.7	Very low	131 Å²	131	117.8 Å²	117.8	70%	0.701	70%	0.697	S	S	*	*				37.2	143.1	116.2	-50	23.6	0	0	0	118.3
66	S	27.3	Very low	26.6	Very low	93 Å²	93	118.6 Å²	118.6	65%	0.65	70%	0.703	S	S	*	*			cis	-167.6	131.6	10.4	-121.9	0	0	0	0	108.3
67	S	27.7	Very low	26.4	Very low	83 Å²	83	113.7 Å²	113.7	58%	0.58	70%	0.699	S	S	*	*				83.2	134.7	76.4	81	0	0	0	0	116.4
68	N	26.6	Very low	26.5	Very low	162 Å²	162	113.3 Å²	113.3	87%	0.866	71%	0.706	S	S	*	*			trans	81.6	152.8	155.7	-51	-19.1	0	0	0	119.3
69	G	29.3	Very low	26.5	Very low	66 Å²	66	116.4 Å²	116.4	68%	0.68	71%	0.709	S	S	*	*			trans	99.7	74.1	174.1	0	0	0	0	0	114.2
70	S	25.5	Very low	26.6	Very low	102 Å²	102	116.3 Å²	116.3	71%	0.713	71%	0.713	S	S	*	*			cis	59.4	121.6	49.5	84.1	0	0	0	0	115
71	N	24.9	Very low	26.6	Very low	155 Å²	155	118.2 Å²	118.2	83%	0.829	72%	0.717	S	S	*	*			trans	68.7	149.6	167.2	-61.1	-11.7	0	0	0	115.8
72	S	25.4	Very low	26.8	Very low	96 Å²	96	119 Å²	119	67%	0.671	72%	0.718	S	S	*	*			cis	-168	179.5	-14.2	48.8	0	0	0	0	110.4
73	S	25.1	Very low	26.8	Very low	90 Å²	90	122.5 Å²	122.5	63%	0.629	72%	0.721	S	S	*	*			trans	55.6	105.3	140.1	61.5	0	0	0	0	120.2
74	S	24.2	Very low	26.8	Very low	101 Å²	101	124.8 Å²	124.8	71%	0.706	73%	0.731	S	S	*	*				76.3	149.2	123.9	76	0	0	0	0	121.5
75	N	23.1	Very low	26.6	Very low	141 Å²	141	120.4 Å²	120.4	75%	0.754	72%	0.722	S	S	*	*			trans	62.1	97.5	142.2	-69.8	-0.1	0	0	0	120.3
76	S	23.3	Very low	26.7	Very low	103 Å²	103	123.4 Å²	123.4	72%	0.72	73%	0.729	S	S	*	*				90.6	161.5	106.3	79.1	0	0	0	0	120.6
77	S	24.2	Very low	27	Very low	97 Å²	97	124.7 Å²	124.7	68%	0.678	74%	0.735	S	S	*	*			trans	62.4	84.9	160.2	55.7	0	0	0	0	118.6
78	S	26.5	Very low	27.2	Very low	110 Å²	110	123.9 Å²	123.9	77%	0.769	74%	0.74	S	S	*	*				49.4	153.6	104	-46.3	0	0	0	0	122
79	K	26.6	Very low	27.6	Very low	187 Å²	187	124.6 Å²	124.6	81%	0.813	74%	0.737	S	S	*	*			trans	101.1	93.7	149.1	-69.8	165.6	-179.1	173.4	0	119
80	S	27.4	Very low	27.7	Very low	106 Å²	106	125.7 Å²	125.7	74%	0.741	74%	0.735	S	S	*	*				75.9	146.4	105.5	-59.1	0	0	0	0	120.8
81	L	27.9	Very low	27.9	Very low	165 Å²	165	130 Å²	130	86%	0.864	74%	0.741	S	S	*	*			trans	152.5	127.6	137.8	-80.9	160.8	0	0	0	105.6
82	S	31.5	Very low	28.1	Very low	94 Å²	94	127.1 Å²	127.1	66%	0.657	73%	0.733	S	S	*	*			cis	-159.6	167.3	5.7	-85.2	0	0	0	0	108.2
83	R	28.5	Very low	28.1	Very low	206 Å²	206	130.4 Å²	130.4	78%	0.777	74%	0.743	S	S	*	*			cis	-164.6	159	0.9	-124.6	178.9	-176.2	-175.1	1.8	109.8
84	M	27.3	Very low	28.3	Very low	158 Å²	158	130 Å²	130	78%	0.778	75%	0.753	S	S	*	*			trans	65.6	138.3	152.8	-64.1	171.9	130.2	0	0	119.6
85	S	29.2	Very low	28.4	Very low	82 Å²	82	131.7 Å²	131.7	57%	0.573	76%	0.759	S	S	*	*			cis	-165.7	120.9	-12	-95.4	0	0	0	0	113.8
86	F	28.6	Very low	28.6	Very low	194 Å²	194	129.8 Å²	129.8	85%	0.851	76%	0.757	S	S	*	*			trans	47.7	159.3	134.6	-61.2	-69.7	0	0	0	124
87	P	35	Very low	28.7	Very low	120 Å²	120	132 Å²	132	78%	0.779	76%	0.761	S	S	*	*			cis	-107.7	-152.3	-3.5	17.8	7.1	0	0	0	111.8
88	G	30.3	Very low	28.8	Very low	66 Å²	66	135.8 Å²	135.8	68%	0.68	77%	0.765	S	S	*	*			cis	118.8	146.4	-1.3	0	0	0	0	0	112.7
89	H	36.2	Very low	28.7	Very low	177 Å²	177	139 Å²	139	82%	0.819	77%	0.765	S	S	*	*			cis	-158	138.7	7.8	-107.1	-78.2	0	0	0	113.9
90	S	30.6	Very low	28.6	Very low	90 Å²	90	135.2 Å²	135.2	63%	0.629	76%	0.758	S	S	*	*			trans	20.4	155	136.9	45.7	0	0	0	0	123.9
91	K	29.7	Very low	28.5	Very low	193 Å²	193	136.8 Å²	136.8	84%	0.839	76%	0.763	S	S	*	*			cis	-173.1	166.2	2.7	-116.1	172.5	-179.3	179.4	0	114.3
92	S	29.2	Very low	28.4	Very low	94 Å²	94	132.4 Å²	132.4	66%	0.657	76%	0.758	S	S	*	*			trans	73	127	140	63.5	0	0	0	0	125.2
93	N	26.4	Very low	28.2	Very low	164 Å²	164	134.8 Å²	134.8	88%	0.877	76%	0.763	S	S	*	*			trans	59.6	129.5	135.9	-58.4	8.1	0	0	0	121.7
94	G	28.6	Very low	28.2	Very low	83 Å²	83	132 Å²	132	86%	0.856	76%	0.763	S	S	*	*			trans	175.4	112.7	161.3	0	0	0	0	0	114.2
95	T	26.8	Very low	28.2	Very low	136 Å²	136	132.2 Å²	132.2	83%	0.834	76%	0.76	S	S	*	*			trans	-80	151.5	-178.6	44.8	0	0	0	0	114.8
96	S	26.3	Very low	28.2	Very low	101 Å²	101	132.9 Å²	132.9	71%	0.706	76%	0.757	S	S	*	*			trans	89.4	129.1	141.6	80.7	0	0	0	0	121.2
97	N	26.1	Very low	28.2	Very low	148 Å²	148	131.6 Å²	131.6	79%	0.791	75%	0.754	S	S	*	*			trans	62.2	128.5	133.4	-81.3	-30.4	0	0	0	123.2
98	K	25.5	Very low	27.9	Very low	178 Å²	178	131 Å²	131	77%	0.774	75%	0.752	S	S	*	*			trans	74.4	110.5	139.6	-88	-178.9	175.8	172	0	119.7
99	K	24.3	Very low	27.7	Very low	177 Å²	177	133.1 Å²	133.1	77%	0.77	75%	0.752	S	S	*	*				82	144.9	123.2	-94.6	-166.4	170.3	-164.6	0	119
100	T	24.8	Very low	27.2	Very low	107 Å²	107	133.7 Å²	133.7	66%	0.656	75%	0.752	S	S	*	*			trans	64.6	109.9	148.4	46.5	0	0	0	0	118.8
101	T	25.4	Very low	27.1	Very low	140 Å²	140	134.7 Å²	134.7	86%	0.859	76%	0.76	S	S	*	*				62.9	131.4	129.9	60.9	0	0	0	0	119.6
102	G	26.7	Very low	26.9	Very low	73 Å²	73	131.3 Å²	131.3	75%	0.753	76%	0.76	S	S	*	*			trans	136.7	78.8	151.9	0	0	0	0	0	115.6
103	N	26.5	Very low	26.8	Very low	144 Å²	144	132 Å²	132	77%	0.77	77%	0.765	S	S	*	*			trans	24.7	127.6	136.7	-79.3	4.4	0	0	0	120.7
104	L	28.5	Very low	27	Very low	148 Å²	148	130.8 Å²	130.8	78%	0.775	76%	0.764	S	S	*	*			trans	70.6	149.2	136	-56.7	167.4	0	0	0	115.9
105	K	27.1	Very low	26.9	Very low	161 Å²	161	131.1 Å²	131.1	70%	0.7	75%	0.751	S	S	*	*			cis	-157.4	174.3	11.5	-144.1	177.8	160.9	-155.8	0	112.5
106	D	28.6	Very low	27.1	Very low	97 Å²	97	130.6 Å²	130.6	52%	0.519	75%	0.75	S	S	.	*			trans	75.7	105	150	-62.8	-38.2	0	0	0	120.9
107	Q	29.6	Very low	27.3	Very low	167 Å²	167	133.7 Å²	133.7	78%	0.78	76%	0.758	S	S	*	*				54.9	125.9	119.3	-59.5	172.3	69.1	0	0	118.3
108	S	28	Very low	27.7	Very low	106 Å²	106	129.9 Å²	129.9	74%	0.741	75%	0.753	S	S	*	*				-172.8	150.3	65.2	33.9	0	0	0	0	114.1
109	T	26.9	Very low	28	Very low	112 Å²	112	130.5 Å²	130.5	69%	0.687	76%	0.758	S	S	*	*			trans	8.8	127.9	154.5	56.9	0	0	0	0	118.7
110	F	26.7	Very low	28.3	Very low	188 Å²	188	127.1 Å²	127.1	83%	0.825	75%	0.752	S	S	*	*				-162.8	156.1	67.6	-106.6	-84.4	0	0	0	113.2
111	S	27.4	Very low	28.6	Very low	112 Å²	112	130.9 Å²	130.9	78%	0.783	76%	0.764	S	S	*	*			trans	44	73.7	169.6	61.2	0	0	0	0	116	S113	S111-S113 PolarHBondContact O-N 3.02Å
112	S	25.7	Very low	28.7	Very low	121 Å²	121	126.2 Å²	126.2	85%	0.846	75%	0.745	S	S	*	*			trans	-70.7	108.3	166.7	51.4	0	0	0	0	110.8
113	S	27.1	Very low	29.3	Very low	109 Å²	109	134.5 Å²	134.5	76%	0.762	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-63.8	134	158.5	36.7	0	0	0	0	109.2	S111	S111-S113 PolarHBondContact O-N 3.02Å
114	T	29.8	Very low	29.9	Very low	139 Å²	139	133.3 Å²	133.3	85%	0.853	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-60.9	123.1	171.9	6.3	0	0	0	0	108.6
115	P	27	Very low	30.2	Very low	89 Å²	89	134.4 Å²	134.4	58%	0.578	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-69.6	149.3	-180	29.3	-34.6	0	0	0	110.2	L117	P115-L117 HydrophobicContact CG-CD1 4.4Å; P115-L117 PolarHBondContact O-N 2.84Å
116	P	32	Very low	30.7	Very low	126 Å²	126	134.4 Å²	134.4	82%	0.818	75%	0.753	S	S	*	*			trans	-66.6	96.4	173.9	27.8	-33.7	0	0	0	109.8
117	L	30.5	Very low	31.6	Very low	166 Å²	166	136 Å²	136	87%	0.869	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	121.6	-174.6	-143.6	79.1	0	0	0	110	P115	P115-L117 HydrophobicContact CG-CD1 4.4Å; P115-L117 PolarHBondContact O-N 2.84Å
118	G	33.9	Very low	32.2	Very low	67 Å²	67	132.9 Å²	132.9	69%	0.691	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	139.1	-7	174	0	0	0	0	0	116.6	V120	G118-V120 VanDerWaalsContact C-N 3.29Å; G118-V120 PolarHBondContact O-N 3.39Å
119	H	31.8	Very low	32.6	Very low	192 Å²	192	129.9 Å²	129.9	89%	0.889	73%	0.733	S	S	*	*			trans	-69.6	79.3	177.1	-103.2	36.8	0	0	0	113.2
120	V	30.8	Very low	33.2	Very low	106 Å²	106	131.7 Å²	131.7	64%	0.642	73%	0.733	S	S	*	*			trans	-114	126.1	150.5	177.1	0	0	0	0	106.2	G118 G122 I1833	G118-V120 VanDerWaalsContact C-N 3.29Å; G118-V120 PolarHBondContact O-N 3.39Å; V120-G122 PolarHBondContact O-N 3.3Å; V120-I1833 HydrophobicContact CG2-CD1 3.79Å
121	M	30.8	Very low	34.1	Very low	185 Å²	185	124.6 Å²	124.6	91%	0.911	71%	0.708	S	S	*	*			trans	-74.3	73	-177	-65.2	-176.5	104.7	0	0	111.9
122	G	27.9	Very low	34.9	Very low	43 Å²	43	124.5 Å²	124.5	44%	0.443	70%	0.698	S	S	.	*			trans	-66.2	129.2	158.6	0	0	0	0	0	109.1	V120 N124	V120-G122 PolarHBondContact O-N 3.3Å; G122-N124 PolarHBondContact O-N 3.47Å
123	R	38.4	Very low	36	Very low	246 Å²	246	124.3 Å²	124.3	93%	0.928	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	7.5	-154.6	-131.4	173.1	-179.5	173.1	-4.2	117
124	N	40.1	Very low	37.3	Very low	119 Å²	119	121.6 Å²	121.6	64%	0.636	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.7	13.7	-156.3	-74.4	42.8	0	0	0	116.1	G122	G122-N124 PolarHBondContact O-N 3.47Å
125	F	35.1	Very low	38.7	Very low	171 Å²	171	117.4 Å²	117.4	75%	0.75	64%	0.64	S	S	*	*			trans	-113.7	9	-161.5	-80.9	-67.2	0	0	0	118.7
126	D	35.9	Very low	40.4	Very low	162 Å²	162	115.7 Å²	115.7	87%	0.866	63%	0.634	S	S	*	*	S	Bend	trans	-93.5	-2	-165.1	-66.2	-41.2	0	0	0	117.6
127	D	47.5	Very low	42.1	Very low	129 Å²	129	115 Å²	115	69%	0.69	62%	0.623	S	S	*	*	S	Bend	trans	-125.3	-31.9	-175.8	-92.6	-49.1	0	0	0	117	Q1435	D127-Q1435 PolarHBondContact OD2-NE2 2.83Å
128	E	42.3	Very low	44	Very low	102 Å²	102	111.1 Å²	111.1	48%	0.477	60%	0.603	S	S	.	*	S	Bend	trans	-95	-19.2	-167.6	-69.7	-69.4	148.8	0	0	115.2	E130 S131	E128-E130 PolarHBondContact O-N 2.94Å; E128-S131 WeakPolarHBondContact O-CB 3.48Å; E128-S131 PolarHBondContact O-N 2.84Å; E128-S131 PolarHBondContact O-OG 2.85Å
129	G	37.4	Very low	45.9	Very low	43 Å²	43	110 Å²	110	44%	0.443	58%	0.581	S	S	.	*	H	α-helix	trans	-64.6	-30.2	-159	0	0	0	0	0	118	S131	G129-S131 PolarHBondContact O-N 2.79Å
130	E	38.8	Very low	48	Very low	150 Å²	150	103 Å²	103	70%	0.701	56%	0.557	S	S	*	*	H	α-helix	trans	-64.2	-27.4	174.1	-79.6	-159	148.4	0	0	111.8	R5 E128 S134	R5-E130 IonicContact NH1-OE1 3.77Å; R5-E130 IonicContact NH1-OE2 3.78Å; R5-E130 PolarHBondContact NH1-OE2 3.14Å; R5-E130 VanDerWaalsContact NH1-OE2 3.14Å; E128-E130 PolarHBondContact O-N 2.94Å; E130-S134 PolarHBondContact O-N 3.2Å
131	S	45.4	Very low	50.3	Low	40 Å²	40	103.6 Å²	103.6	28%	0.28	55%	0.553	S	S	.	*	H	α-helix	trans	-78.5	-46.6	-171	78.7	0	0	0	0	112.6	E128 G129 L133 S134 N135	E128-S131 WeakPolarHBondContact O-CB 3.48Å; E128-S131 PolarHBondContact O-N 2.84Å; E128-S131 PolarHBondContact O-OG 2.85Å; G129-S131 PolarHBondContact O-N 2.79Å; S131-L133 VanDerWaalsContact C-N 3.34Å; S131-L133 PolarHBondContact O-N 3.39Å; S131-S134 PolarHBondContact O-N 2.87Å; S131-S134 VanDerWaalsContact O-N 3.1Å; S131-S134 PolarHBondContact O-OG 2.83Å; S131-N135 PolarHBondContact O-N 2.89Å; S131-N135 PolarHBondContact O-ND2 2.72Å; S131-N135 VanDerWaalsContact O-ND2 3.1Å
132	D	45.1	Very low	52.5	Low	109 Å²	109	97.4 Å²	97.4	58%	0.583	52%	0.523	S	S	*	.	H	α-helix	trans	-65.3	-37.7	177.4	-80.3	-29.9	0	0	0	111.7	S134 N135 A136	D132-S134 VanDerWaalsContact C-N 3.29Å; D132-S134 PolarHBondContact O-N 2.62Å; D132-N135 PolarHBondContact O-N 3.03Å; D132-A136 WeakPolarHBondContact O-CB 2.88Å; D132-A136 PolarHBondContact O-N 2.93Å
133	L	49.3	Very low	55.1	Low	117 Å²	117	95.4 Å²	95.4	61%	0.613	50%	0.502	S	S	*	.	H	α-helix	trans	-59.5	-38	171.5	-88.3	161.8	0	0	0	112.4	S131 N137	S131-L133 VanDerWaalsContact C-N 3.34Å; S131-L133 PolarHBondContact O-N 3.39Å; L133-N137 VanDerWaalsContact O-CG 3.29Å; L133-N137 PolarHBondContact O-N 2.76Å; L133-N137 PolarHBondContact O-ND2 2.88Å
134	S	54.1	Low	57.3	Low	53 Å²	53	86.5 Å²	86.5	37%	0.371	48%	0.478	S	S	.	.	H	α-helix	trans	-70	-44.1	176.2	72.7	0	0	0	0	112.6	E130 S131 D132 A136 N137 D138	E130-S134 PolarHBondContact O-N 3.2Å; S131-S134 PolarHBondContact O-N 2.87Å; S131-S134 VanDerWaalsContact O-N 3.1Å; S131-S134 PolarHBondContact O-OG 2.83Å; D132-S134 VanDerWaalsContact C-N 3.29Å; D132-S134 PolarHBondContact O-N 2.62Å; S134-A136 VanDerWaalsContact C-N 3.29Å; S134-A136 PolarHBondContact O-N 3.28Å; S134-N137 PolarHBondContact O-N 2.7Å; S134-D138 PolarHBondContact O-N 2.86Å
135	N	58	Low	59.3	Low	50 Å²	50	82.5 Å²	82.5	27%	0.267	46%	0.455	S	S	.	.	H	α-helix	trans	-65.3	-33.9	177.6	-64.8	-57.5	0	0	0	111.5	M1 S131 D132 L139	M1-N135 PolarHBondContact N-OD1 3.33Å; S131-N135 PolarHBondContact O-N 2.89Å; S131-N135 PolarHBondContact O-ND2 2.72Å; S131-N135 VanDerWaalsContact O-ND2 3.1Å; D132-N135 PolarHBondContact O-N 3.03Å; N135-L139 WeakPolarHBondContact O-CB 3.3Å; N135-L139 VanDerWaalsContact O-CG 3.28Å; N135-L139 WeakPolarHBondContact O-CG 3.5Å; N135-L139 PolarHBondContact O-N 2.59Å
136	A	63.5	Low	61.8	Low	54 Å²	54	74.5 Å²	74.5	45%	0.446	42%	0.42	S	S	.	.	H	α-helix	trans	-66.3	-41	175.6	0	0	0	0	0	112.3	D132 S134 L139 A140	D132-A136 WeakPolarHBondContact O-CB 2.88Å; D132-A136 PolarHBondContact O-N 2.93Å; S134-A136 VanDerWaalsContact C-N 3.29Å; S134-A136 PolarHBondContact O-N 3.28Å; A136-L139 PolarHBondContact O-N 2.8Å; A136-A140 WeakPolarHBondContact O-CB 3.43Å; A136-A140 PolarHBondContact O-N 3.37Å
137	N	68.3	Low	64	Low	110 Å²	110	71.7 Å²	71.7	59%	0.588	41%	0.405	S	S	*	.	H	α-helix	trans	-66.7	-41.1	175.1	-70	-21.7	0	0	0	112.1	L133 S134 L139 A140 H141	L133-N137 VanDerWaalsContact O-CG 3.29Å; L133-N137 PolarHBondContact O-N 2.76Å; L133-N137 PolarHBondContact O-ND2 2.88Å; S134-N137 PolarHBondContact O-N 2.7Å; N137-L139 VanDerWaalsContact C-N 3.32Å; N137-L139 PolarHBondContact O-N 3.12Å; N137-A140 PolarHBondContact O-N 3.32Å; N137-H141 PolarHBondContact O-N 2.91Å
138	D	69	Low	65.9	Low	85 Å²	85	67.8 Å²	67.8	46%	0.455	39%	0.388	S	S	.	.	H	α-helix	trans	-60.2	-41.6	175	-69.2	-13.3	0	0	0	111.1	S134 L142	S134-D138 PolarHBondContact O-N 2.86Å; D138-L142 WeakPolarHBondContact O-CG 3.26Å; D138-L142 PolarHBondContact O-N 2.76Å
139	L	74.2	Confident	68.1	Low	44 Å²	44	63 Å²	63	23%	0.23	37%	0.366	C	S	.	.	H	α-helix	trans	-68.3	-40.1	176	-72.7	168.7	0	0	0	112.6	N135 A136 N137 L142 S143 I261 W268	N135-L139 WeakPolarHBondContact O-CB 3.3Å; N135-L139 VanDerWaalsContact O-CG 3.28Å; N135-L139 WeakPolarHBondContact O-CG 3.5Å; N135-L139 PolarHBondContact O-N 2.59Å; A136-L139 PolarHBondContact O-N 2.8Å; N137-L139 VanDerWaalsContact C-N 3.32Å; N137-L139 PolarHBondContact O-N 3.12Å; L139-L142 PolarHBondContact O-N 2.85Å; L139-S143 WeakPolarHBondContact O-CB 3.42Å; L139-S143 PolarHBondContact O-N 3.25Å; L139-I261 WeakPolarHBondContact O-CG2 3.45Å; L139-W268 HydrophobicContact CD2-CH2 4.11Å; L139-W268 HydrophobicContact CD2-CZ2 3.73Å
140	A	77	Confident	70.5	Confident	46 Å²	46	64.7 Å²	64.7	38%	0.38	37%	0.367	S	S	.	.	H	α-helix	trans	-63.8	-40.8	175.8	0	0	0	0	0	111.9	A136 N137 S143 S144	A136-A140 WeakPolarHBondContact O-CB 3.43Å; A136-A140 PolarHBondContact O-N 3.37Å; N137-A140 PolarHBondContact O-N 3.32Å; A140-S143 WeakPolarHBondContact O-CB 3.23Å; A140-S143 PolarHBondContact O-N 3.49Å; A140-S144 PolarHBondContact O-N 2.99Å
141	H	78.4	Confident	72.8	Confident	118 Å²	118	60.3 Å²	60.3	55%	0.546	35%	0.354	S	S	.	.	H	α-helix	trans	-64.9	-42.4	173.9	-172.4	-64.3	0	0	0	112	N137 S143 S144 E145	N137-H141 PolarHBondContact O-N 2.91Å; H141-S143 PolarHBondContact O-N 3.07Å; H141-S144 PolarHBondContact O-N 3.35Å; H141-S144 PolarHBondContact O-OG 3.42Å; H141-S144 VanDerWaalsContact O-OG 3.12Å; H141-E145 PolarHBondContact O-N 2.87Å
142	L	76.4	Confident	74.9	Confident	54 Å²	54	58.4 Å²	58.4	28%	0.283	34%	0.34	S	S	.	.	H	α-helix	trans	-66.5	-26.8	174.1	-75.2	169.9	0	0	0	112.6	D138 L139 F146 I261 W268 F276	D138-L142 WeakPolarHBondContact O-CG 3.26Å; D138-L142 PolarHBondContact O-N 2.76Å; L139-L142 PolarHBondContact O-N 2.85Å; L142-F146 WeakPolarHBondContact O-CD2 3.26Å; L142-I261 HydrophobicContact CB-CG2 3.86Å; L142-W268 HydrophobicContact CD1-CH2 4.46Å; L142-F276 HydrophobicContact CD2-CD2 4.45Å; L142-F276 HydrophobicContact CD2-CE2 4.4Å
143	S	83.6	Confident	77.1	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.007	31%	0.314	C	S	.	.	H	α-helix	trans	-73.8	-43.7	174.7	-177.8	0	0	0	0	112.1	L139 A140 H141 E145 F146 A258 N262	L139-S143 WeakPolarHBondContact O-CB 3.42Å; L139-S143 PolarHBondContact O-N 3.25Å; A140-S143 WeakPolarHBondContact O-CB 3.23Å; A140-S143 PolarHBondContact O-N 3.49Å; H141-S143 PolarHBondContact O-N 3.07Å; S143-E145 PolarHBondContact O-N 2.84Å; S143-F146 WeakPolarHBondContact O-CA 3.36Å; S143-F146 PolarHBondContact O-N 2.97Å; S143-A258 WeakPolarHBondContact OG-CB 3.41Å; S143-A258 PolarHBondContact OG-O 3.01Å; S143-N262 WeakPolarHBondContact CB-OD1 3.47Å; S143-N262 PolarHBondContact OG-ND2 3.5Å
144	S	83.8	Confident	78.9	Confident	60 Å²	60	52.8 Å²	52.8	42%	0.42	31%	0.311	S	S	.	.	H	α-helix	trans	-65.8	-25.6	-176.1	63	0	0	0	0	112.7	A140 H141 F146 D147	A140-S144 PolarHBondContact O-N 2.99Å; H141-S144 PolarHBondContact O-N 3.35Å; H141-S144 PolarHBondContact O-OG 3.42Å; H141-S144 VanDerWaalsContact O-OG 3.12Å; S144-F146 PolarHBondContact O-N 3.35Å; S144-D147 VanDerWaalsContact CA-OD2 3.28Å; S144-D147 WeakPolarHBondContact CA-OD2 3.45Å; S144-D147 WeakPolarHBondContact CB-OD2 3.2Å; S144-D147 PolarHBondContact O-N 3.17Å; S144-D147 VanDerWaalsContact O-N 3.11Å
145	E	83.5	Confident	80.5	Confident	35 Å²	35	51 Å²	51	16%	0.164	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-13.5	168	-75.6	-148	-114.4	0	0	115	H141 S143 K158 F276	H141-E145 PolarHBondContact O-N 2.87Å; S143-E145 PolarHBondContact O-N 2.84Å; E145-K158 PolarHBondContact O-NZ 2.92Å; E145-K158 WeakPolarHBondContact OE2-CE 3.4Å; E145-K158 IonicContact OE2-NZ 2.74Å; E145-K158 PolarHBondContact OE2-NZ 2.91Å; E145-F276 VanDerWaalsContact OE1-CD2 3.31Å; E145-F276 WeakPolarHBondContact OE1-CD2 3.45Å
146	F	86.1	Confident	82	Confident	2 Å²	2	49 Å²	49	1%	0.009	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	15.8	176.5	-70.4	-93.6	0	0	0	113.7	L142 S143 S144 S148 V152 K158 M161 V254 L257 A258 I261 F276	L142-F146 WeakPolarHBondContact O-CD2 3.26Å; S143-F146 WeakPolarHBondContact O-CA 3.36Å; S143-F146 PolarHBondContact O-N 2.97Å; S144-F146 PolarHBondContact O-N 3.35Å; F146-S148 VanDerWaalsContact C-N 3.26Å; F146-S148 PolarHBondContact O-N 3.35Å; F146-V152 HydrophobicContact CB-CG2 4.24Å; F146-V152 HydrophobicContact CD1-CG1 4.2Å; F146-V152 HydrophobicContact CD1-CG2 3.51Å; F146-V152 HydrophobicContact CE1-CG1 4.26Å; F146-V152 HydrophobicContact CE1-CG2 4.21Å; F146-V152 HydrophobicContact CG-CG2 4.16Å; F146-K158 HydrophobicContact CE1-CB 4.33Å; F146-M161 HydrophobicContact CZ-CB 4.35Å; F146-M161 HydrophobicContact CZ-CE 4.14Å; F146-V254 WeakPolarHBondContact O-CG1 3.36Å; F146-L257 HydrophobicContact CD1-CD2 3.56Å; F146-L257 HydrophobicContact CD1-CG 4.18Å; F146-L257 HydrophobicContact CE1-CD2 3.62Å; F146-L257 HydrophobicContact CG-CD2 4.33Å; F146-L257 HydrophobicContact CG-CG 4.5Å; F146-L257 HydrophobicContact CZ-CD2 4.41Å; F146-A258 HydrophobicContact CB-CB 4.41Å; F146-I261 HydrophobicContact CB-CD1 4.5Å; F146-I261 HydrophobicContact CD2-CD1 3.62Å; F146-I261 HydrophobicContact CE2-CD1 4.02Å; F146-I261 HydrophobicContact CG-CD1 4.12Å; F146-F276 HydrophobicContact CE2-CE2 4.03Å; F146-F276 AromaticContact CE2-CZ 3.91Å; F146-F276 HydrophobicContact CE2-CZ 3.91Å; F146-F276 HydrophobicContact CZ-CE2 4.48Å; F146-F276 AromaticContact CZ-CZ 3.9Å; F146-F276 HydrophobicContact CZ-CZ 3.9Å
147	D	82.7	Confident	83.1	Confident	104 Å²	104	46.4 Å²	46.4	56%	0.556	27%	0.266	S	S	*	.	S	Bend	trans	-65.6	-22.6	-177.7	-76.5	-20.6	0	0	0	114.5	S144	S144-D147 VanDerWaalsContact CA-OD2 3.28Å; S144-D147 WeakPolarHBondContact CA-OD2 3.45Å; S144-D147 WeakPolarHBondContact CB-OD2 3.2Å; S144-D147 PolarHBondContact O-N 3.17Å; S144-D147 VanDerWaalsContact O-N 3.11Å
148	S	87.9	Confident	84.1	Confident	46 Å²	46	42.2 Å²	42.2	32%	0.322	24%	0.243	S	C	.	.			trans	-131.4	128.9	-176.6	-179.4	0	0	0	0	112.9	F146 T150 S151 V152	F146-S148 VanDerWaalsContact C-N 3.26Å; F146-S148 PolarHBondContact O-N 3.35Å; S148-T150 VanDerWaalsContact C-N 3.26Å; S148-T150 PolarHBondContact O-N 3.38Å; S148-T150 PolarHBondContact OG-N 2.9Å; S148-S151 WeakPolarHBondContact O-CB 3.37Å; S148-S151 PolarHBondContact O-N 3.13Å; S148-S151 VanDerWaalsContact O-N 3.08Å; S148-V152 WeakPolarHBondContact O-CG2 3.46Å; S148-V152 PolarHBondContact O-N 3.08Å; S148-V152 VanDerWaalsContact O-N 3.12Å
149	A	88.8	Confident	85.2	Confident	2 Å²	2	38.1 Å²	38.1	2%	0.017	22%	0.221	C	C	.	.	H	α-helix	trans	-53.9	-41.7	174.7	0	0	0	0	0	112.6	S151 V152 L153 I250 E251 V254	A149-S151 VanDerWaalsContact C-N 3.31Å; A149-S151 PolarHBondContact O-N 2.97Å; A149-V152 PolarHBondContact O-N 2.9Å; A149-L153 WeakPolarHBondContact O-CB 3.43Å; A149-L153 WeakPolarHBondContact O-CD1 3.49Å; A149-L153 WeakPolarHBondContact O-CG 3.39Å; A149-L153 PolarHBondContact O-N 3.45Å; A149-I250 HydrophobicContact CB-CB 4.49Å; A149-I250 HydrophobicContact CB-CG2 3.93Å; A149-E251 HydrophobicContact CB-CB 4.15Å; A149-V254 HydrophobicContact CB-CG2 4.33Å
150	T	87.9	Confident	85.9	Confident	78 Å²	78	36 Å²	36	48%	0.479	21%	0.21	S	C	.	.	H	α-helix	trans	-63	-36.7	179.3	-51.2	0	0	0	0	112.1	S148 N154	S148-T150 VanDerWaalsContact C-N 3.26Å; S148-T150 PolarHBondContact O-N 3.38Å; S148-T150 PolarHBondContact OG-N 2.9Å; T150-N154 WeakPolarHBondContact O-CB 3.1Å; T150-N154 VanDerWaalsContact O-CG 3.24Å; T150-N154 PolarHBondContact O-N 3.34Å; T150-N154 PolarHBondContact O-ND2 2.96Å
151	S	85.8	Confident	86.4	Confident	59 Å²	59	35 Å²	35	41%	0.413	20%	0.198	S	C	.	.	H	α-helix	trans	-66.8	-48.8	174.9	-173.3	0	0	0	0	111.1	S148 A149 L153 N154 S155	S148-S151 WeakPolarHBondContact O-CB 3.37Å; S148-S151 PolarHBondContact O-N 3.13Å; S148-S151 VanDerWaalsContact O-N 3.08Å; A149-S151 VanDerWaalsContact C-N 3.31Å; A149-S151 PolarHBondContact O-N 2.97Å; S151-L153 VanDerWaalsContact C-N 3.32Å; S151-L153 PolarHBondContact O-N 3.36Å; S151-N154 PolarHBondContact O-N 2.9Å; S151-S155 PolarHBondContact O-N 3.33Å
152	V	89.5	Confident	87	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.8	-37.4	179.8	174.9	0	0	0	0	112.4	F146 S148 A149 K158 C159 F162 V254	F146-V152 HydrophobicContact CB-CG2 4.24Å; F146-V152 HydrophobicContact CD1-CG1 4.2Å; F146-V152 HydrophobicContact CD1-CG2 3.51Å; F146-V152 HydrophobicContact CE1-CG1 4.26Å; F146-V152 HydrophobicContact CE1-CG2 4.21Å; F146-V152 HydrophobicContact CG-CG2 4.16Å; S148-V152 WeakPolarHBondContact O-CG2 3.46Å; S148-V152 PolarHBondContact O-N 3.08Å; S148-V152 VanDerWaalsContact O-N 3.12Å; A149-V152 PolarHBondContact O-N 2.9Å; V152-K158 HydrophobicContact CB-CB 4.46Å; V152-K158 HydrophobicContact CG1-CB 4.2Å; V152-C159 WeakPolarHBondContact O-CA 3.43Å; V152-C159 WeakPolarHBondContact O-CB 3.49Å; V152-C159 PolarHBondContact O-N 3.4Å; V152-F162 HydrophobicContact CG1-CB 3.76Å; V152-F162 HydrophobicContact CG1-CD1 4.36Å; V152-F162 HydrophobicContact CG1-CG 4.12Å; V152-V254 HydrophobicContact CG2-CG1 4.04Å
153	L	91.1	Very high	87.7	Confident	5 Å²	5	26.9 Å²	26.9	3%	0.026	16%	0.159	C	C	.	.	H	α-helix	trans	-78.2	-22.5	179.5	-69	165.5	0	0	0	113.5	A149 S151 T176 I180 L247 I250 Y347	A149-L153 WeakPolarHBondContact O-CB 3.43Å; A149-L153 WeakPolarHBondContact O-CD1 3.49Å; A149-L153 WeakPolarHBondContact O-CG 3.39Å; A149-L153 PolarHBondContact O-N 3.45Å; S151-L153 VanDerWaalsContact C-N 3.32Å; S151-L153 PolarHBondContact O-N 3.36Å; L153-T176 HydrophobicContact CD2-CG2 4.07Å; L153-I180 HydrophobicContact CD2-CD1 4.43Å; L153-I180 HydrophobicContact CD2-CG1 4.42Å; L153-L247 HydrophobicContact CD1-CD2 4.15Å; L153-I250 HydrophobicContact CD1-CD1 4.29Å; L153-I250 HydrophobicContact CD1-CG2 4.18Å; L153-Y347 WeakPolarHBondContact O-CE1 3.31Å; L153-Y347 PolarHBondContact O-OH 2.88Å
154	N	88.7	Confident	88	Confident	103 Å²	103	27 Å²	27	55%	0.551	16%	0.159	S	C	*	.	H	α-helix	trans	-81.5	-29.8	179.4	-82.6	-34.3	0	0	0	113.6	T150 S151	T150-N154 WeakPolarHBondContact O-CB 3.1Å; T150-N154 VanDerWaalsContact O-CG 3.24Å; T150-N154 PolarHBondContact O-N 3.34Å; T150-N154 PolarHBondContact O-ND2 2.96Å; S151-N154 PolarHBondContact O-N 2.9Å
155	S	87.4	Confident	88.2	Confident	16 Å²	16	24.6 Å²	24.6	11%	0.112	14%	0.141	C	C	.	.	S	Bend	trans	-88.6	124.8	172.2	165.3	0	0	0	0	110.8	S151 A157 K158 C159 E285	S151-S155 PolarHBondContact O-N 3.33Å; S155-A157 VanDerWaalsContact C-N 3.26Å; S155-A157 PolarHBondContact O-N 3.29Å; S155-A157 PolarHBondContact OG-N 3.27Å; S155-K158 PolarHBondContact O-N 2.71Å; S155-K158 PolarHBondContact OG-N 3.14Å; S155-C159 VanDerWaalsContact O-CB 3.26Å; S155-C159 WeakPolarHBondContact O-CB 3.33Å; S155-C159 PolarHBondContact O-N 3.36Å; S155-E285 VanDerWaalsContact CB-OE1 3.29Å; S155-E285 WeakPolarHBondContact CB-OE1 3.45Å; S155-E285 PolarHBondContact OG-OE1 2.96Å
156	P	89.6	Confident	88.5	Confident	6 Å²	6	23 Å²	23	4%	0.039	13%	0.133	C	C	.	.	H	α-helix	trans	-59.2	-36.8	173.5	-15.2	23.9	0	0	0	112.5	A160 E285 F289 Y347	P156-A160 VanDerWaalsContact O-CB 3.28Å; P156-A160 WeakPolarHBondContact O-CB 3.43Å; P156-A160 PolarHBondContact O-N 3.35Å; P156-E285 HydrophobicContact CB-CB 4.11Å; P156-E285 HydrophobicContact CG-CB 3.87Å; P156-F289 HydrophobicContact CB-CB 4.16Å; P156-Y347 HydrophobicContact CB-CD1 4.12Å; P156-Y347 HydrophobicContact CB-CD2 4.26Å; P156-Y347 HydrophobicContact CB-CG 3.97Å; P156-Y347 HydrophobicContact CG-CD1 3.68Å; P156-Y347 HydrophobicContact CG-CE1 4.34Å; P156-Y347 HydrophobicContact CG-CG 3.86Å
157	A	86.2	Confident	88.6	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.3	-46.8	-179.6	0	0	0	0	0	111.7	S155 A160 M161 F276 F279 E285 C288	S155-A157 VanDerWaalsContact C-N 3.26Å; S155-A157 PolarHBondContact O-N 3.29Å; S155-A157 PolarHBondContact OG-N 3.27Å; A157-A160 PolarHBondContact O-N 2.87Å; A157-M161 PolarHBondContact O-N 2.69Å; A157-M161 VanDerWaalsContact O-N 3.13Å; A157-F276 HydrophobicContact CB-CE1 4.42Å; A157-F279 HydrophobicContact CB-CD2 4.38Å; A157-F279 HydrophobicContact CB-CE2 3.82Å; A157-F279 HydrophobicContact CB-CZ 4.12Å; A157-E285 HydrophobicContact CB-CB 4.24Å; A157-E285 HydrophobicContact CB-CG 4.32Å; A157-C288 HydrophobicContact CB-CB 4.26Å
158	K	88.7	Confident	88.6	Confident	22 Å²	22	21.3 Å²	21.3	10%	0.096	13%	0.129	C	C	.	.	H	α-helix	trans	-66.8	-40.8	177.1	-63.2	-174.6	176.2	-167	0	111.9	E145 F146 V152 S155 A160 M161 F162 F276	E145-K158 PolarHBondContact O-NZ 2.92Å; E145-K158 WeakPolarHBondContact OE2-CE 3.4Å; E145-K158 IonicContact OE2-NZ 2.74Å; E145-K158 PolarHBondContact OE2-NZ 2.91Å; F146-K158 HydrophobicContact CE1-CB 4.33Å; V152-K158 HydrophobicContact CB-CB 4.46Å; V152-K158 HydrophobicContact CG1-CB 4.2Å; S155-K158 PolarHBondContact O-N 2.71Å; S155-K158 PolarHBondContact OG-N 3.14Å; K158-A160 VanDerWaalsContact C-N 3.33Å; K158-A160 PolarHBondContact O-N 3.49Å; K158-M161 PolarHBondContact O-N 3.38Å; K158-F162 WeakPolarHBondContact O-CB 3.43Å; K158-F162 PolarHBondContact O-N 3.14Å; K158-F276 HydrophobicContact CG-CD1 4.17Å; K158-F276 HydrophobicContact CG-CE1 3.63Å; K158-F276 HydrophobicContact CG-CZ 4.07Å
159	C	91.5	Very high	88.3	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.5	-41.9	174.2	-174.6	0	0	0	0	111.8	V152 S155 F162 I163 Y347	V152-C159 WeakPolarHBondContact O-CA 3.43Å; V152-C159 WeakPolarHBondContact O-CB 3.49Å; V152-C159 PolarHBondContact O-N 3.4Å; S155-C159 VanDerWaalsContact O-CB 3.26Å; S155-C159 WeakPolarHBondContact O-CB 3.33Å; S155-C159 PolarHBondContact O-N 3.36Å; C159-F162 PolarHBondContact O-N 2.85Å; C159-I163 WeakPolarHBondContact O-CG1 3.45Å; C159-I163 PolarHBondContact O-N 3.26Å; C159-Y347 HydrophobicContact CB-CE2 4.46Å; C159-Y347 WeakPolarHBondContact CB-OH 3.2Å; C159-Y347 PolarHBondContact SG-OH 2.85Å
160	A	89.9	Confident	88.1	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.1	-42.2	177.4	0	0	0	0	0	112.7	P156 A157 K158 I163 D164 F289 R292	P156-A160 VanDerWaalsContact O-CB 3.28Å; P156-A160 WeakPolarHBondContact O-CB 3.43Å; P156-A160 PolarHBondContact O-N 3.35Å; A157-A160 PolarHBondContact O-N 2.87Å; K158-A160 VanDerWaalsContact C-N 3.33Å; K158-A160 PolarHBondContact O-N 3.49Å; A160-I163 PolarHBondContact O-N 3.18Å; A160-D164 WeakPolarHBondContact O-CB 3.31Å; A160-D164 PolarHBondContact O-N 2.99Å; A160-F289 HydrophobicContact CB-CB 4.14Å; A160-F289 HydrophobicContact CB-CD2 3.86Å; A160-F289 HydrophobicContact CB-CG 4.26Å; A160-R292 HydrophobicContact CB-CB 4.05Å; A160-R292 HydrophobicContact CB-CG 4.13Å
161	M	87.6	Confident	88	Confident	23 Å²	23	27.9 Å²	27.9	11%	0.113	14%	0.144	C	C	.	.	H	α-helix	trans	-64.7	-39	173.6	-75.3	-179.7	59.9	0	0	112.4	F146 A157 K158 D164 Y165 I274 F276	F146-M161 HydrophobicContact CZ-CB 4.35Å; F146-M161 HydrophobicContact CZ-CE 4.14Å; A157-M161 PolarHBondContact O-N 2.69Å; A157-M161 VanDerWaalsContact O-N 3.13Å; K158-M161 PolarHBondContact O-N 3.38Å; M161-D164 PolarHBondContact O-N 3.34Å; M161-Y165 WeakPolarHBondContact O-CB 3.41Å; M161-Y165 PolarHBondContact O-N 2.85Å; M161-I274 HydrophobicContact CG-CD1 4.17Å; M161-I274 HydrophobicContact SD-CB 4.35Å; M161-I274 HydrophobicContact SD-CD1 3.84Å; M161-F276 HydrophobicContact CE-CZ 4.13Å; M161-F276 HydrophobicContact SD-CE1 3.89Å; M161-F276 HydrophobicContact SD-CE2 4.45Å; M161-F276 HydrophobicContact SD-CZ 3.45Å; M161-F276 WeakPolarHBondContact SD-CZ 3.47Å
162	F	91.1	Very high	88	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-67	-39.9	176	178.6	-122.5	0	0	0	112.6	V152 K158 C159 Y165 L166 T176 I250 Q253 V254 L257	V152-F162 HydrophobicContact CG1-CB 3.76Å; V152-F162 HydrophobicContact CG1-CD1 4.36Å; V152-F162 HydrophobicContact CG1-CG 4.12Å; K158-F162 WeakPolarHBondContact O-CB 3.43Å; K158-F162 PolarHBondContact O-N 3.14Å; C159-F162 PolarHBondContact O-N 2.85Å; F162-Y165 HydrophobicContact CD2-CD1 4.4Å; F162-Y165 PolarHBondContact O-N 3.38Å; F162-L166 HydrophobicContact CD1-CD1 4.21Å; F162-L166 HydrophobicContact CD2-CG 4.49Å; F162-L166 HydrophobicContact CE1-CD1 3.81Å; F162-L166 HydrophobicContact CE2-CD1 4.18Å; F162-L166 HydrophobicContact CE2-CD2 4.26Å; F162-L166 HydrophobicContact CE2-CG 4.18Å; F162-L166 HydrophobicContact CZ-CD1 3.79Å; F162-L166 HydrophobicContact CZ-CD2 4.35Å; F162-L166 HydrophobicContact CZ-CG 4.26Å; F162-L166 VanDerWaalsContact O-CG 3.3Å; F162-L166 WeakPolarHBondContact O-CG 3.45Å; F162-L166 PolarHBondContact O-N 3.4Å; F162-T176 HydrophobicContact CD1-CG2 4.07Å; F162-T176 HydrophobicContact CE1-CG2 3.85Å; F162-T176 WeakPolarHBondContact CE1-OG1 3.38Å; F162-I250 HydrophobicContact CE1-CG2 3.71Å; F162-I250 HydrophobicContact CZ-CG2 3.89Å; F162-Q253 HydrophobicContact CE2-CB 3.89Å; F162-Q253 HydrophobicContact CZ-CB 3.83Å; F162-V254 HydrophobicContact CD1-CG2 4.42Å; F162-V254 HydrophobicContact CD2-CG2 3.92Å; F162-V254 HydrophobicContact CE1-CG2 4.07Å; F162-V254 HydrophobicContact CE2-CB 4.48Å; F162-V254 HydrophobicContact CE2-CG2 3.54Å; F162-V254 HydrophobicContact CG-CG2 4.36Å; F162-V254 HydrophobicContact CZ-CG2 3.61Å; F162-L257 HydrophobicContact CB-CD2 4.47Å; F162-L257 HydrophobicContact CD2-CD2 4.1Å
163	I	91.2	Very high	88	Confident	3 Å²	3	26.4 Å²	26.4	2%	0.015	13%	0.132	C	C	.	.	H	α-helix	trans	-67.3	-42.1	174.9	-68.5	170.5	0	0	0	111.3	C159 A160 L166 F167 T176 I180 F289 L293 L340	C159-I163 WeakPolarHBondContact O-CG1 3.45Å; C159-I163 PolarHBondContact O-N 3.26Å; A160-I163 PolarHBondContact O-N 3.18Å; I163-L166 PolarHBondContact O-N 2.86Å; I163-F167 HydrophobicContact CG2-CD2 4.09Å; I163-F167 HydrophobicContact CG2-CE1 4.31Å; I163-F167 HydrophobicContact CG2-CE2 3.63Å; I163-F167 HydrophobicContact CG2-CZ 3.76Å; I163-F167 WeakPolarHBondContact O-CG 3.39Å; I163-F167 PolarHBondContact O-N 3.2Å; I163-T176 HydrophobicContact CG1-CG2 4.31Å; I163-I180 HydrophobicContact CD1-CD1 4.48Å; I163-F289 HydrophobicContact CD1-CE2 4.35Å; I163-L293 HydrophobicContact CB-CD1 4.37Å; I163-L293 HydrophobicContact CB-CD2 4.25Å; I163-L293 HydrophobicContact CD1-CD1 4.29Å; I163-L293 HydrophobicContact CG2-CD1 4.1Å; I163-L293 HydrophobicContact CG2-CD2 3.78Å; I163-L340 HydrophobicContact CG2-CD2 4.36Å
164	D	88.5	Confident	88	Confident	3 Å²	3	26.1 Å²	26.1	2%	0.016	13%	0.131	C	C	.	.	H	α-helix	trans	-59.9	-47.4	173.2	-173.4	-13.7	0	0	0	110.8	A160 M161 L166 F167 S168 R292 Y296	A160-D164 WeakPolarHBondContact O-CB 3.31Å; A160-D164 PolarHBondContact O-N 2.99Å; M161-D164 PolarHBondContact O-N 3.34Å; D164-L166 VanDerWaalsContact C-N 3.34Å; D164-L166 PolarHBondContact O-N 2.69Å; D164-F167 PolarHBondContact O-N 3.19Å; D164-S168 WeakPolarHBondContact O-CB 3.46Å; D164-S168 PolarHBondContact O-N 2.9Å; D164-S168 PolarHBondContact O-OG 3.41Å; D164-S168 PolarHBondContact OD1-OG 3.21Å; D164-R292 HydrophobicContact CB-CG 4.37Å; D164-R292 IonicContact OD2-CZ 3.53Å; D164-R292 IonicContact OD2-NE 3.46Å; D164-R292 PolarHBondContact OD2-NE 2.8Å; D164-R292 IonicContact OD2-NH2 3.08Å; D164-R292 PolarHBondContact OD2-NH2 3.05Å; D164-Y296 PolarHBondContact OD1-OH 3.32Å; D164-Y296 VanDerWaalsContact OD1-OH 3.07Å
165	Y	88.2	Confident	88.1	Confident	9 Å²	9	23.5 Å²	23.5	4%	0.035	11%	0.113	C	C	.	.	H	α-helix	trans	-54.5	-45.7	173.8	170.6	-95.6	0	0	0	112.5	M161 F162 H169 R171 K256 L257 W268	M161-Y165 WeakPolarHBondContact O-CB 3.41Å; M161-Y165 PolarHBondContact O-N 2.85Å; F162-Y165 HydrophobicContact CD2-CD1 4.4Å; F162-Y165 PolarHBondContact O-N 3.38Å; Y165-H169 AromaticContact CD2-CD2 3.25Å; Y165-H169 WeakPolarHBondContact CD2-CD2 3.36Å; Y165-H169 AromaticContact CD2-NE2 3.55Å; Y165-H169 AromaticContact CE2-CD2 3.43Å; Y165-H169 VanDerWaalsContact CE2-CD2 3.43Å; Y165-H169 WeakPolarHBondContact CE2-CD2 3.31Å; Y165-H169 AromaticContact CE2-NE2 3.49Å; Y165-H169 WeakPolarHBondContact CE2-NE2 3.42Å; Y165-H169 AromaticContact CG-CD2 3.94Å; Y165-H169 VanDerWaalsContact O-CB 3.29Å; Y165-H169 WeakPolarHBondContact O-CB 3.45Å; Y165-H169 PolarHBondContact O-CD2 3.24Å; Y165-H169 PolarHBondContact O-N 3.09Å; Y165-R171 PolarHBondContact OH-NH1 2.99Å; Y165-R171 VanDerWaalsContact OH-NH1 3.07Å; Y165-R171 PolarHBondContact OH-NH2 2.94Å; Y165-K256 PolarHBondContact OH-O 3.44Å; Y165-L257 HydrophobicContact CD1-CB 4.33Å; Y165-L257 HydrophobicContact CD2-CD1 3.67Å; Y165-L257 HydrophobicContact CE1-CB 4.02Å; Y165-L257 HydrophobicContact CE2-CB 4.24Å; Y165-L257 HydrophobicContact CE2-CD1 3.85Å; Y165-L257 HydrophobicContact CG-CD1 4.08Å; Y165-L257 HydrophobicContact CG-CD2 4.43Å; Y165-L257 PolarHBondContact OH-N 3.16Å; Y165-W268 HydrophobicContact CD2-CB 4.47Å
166	L	89.5	Confident	88.4	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-62.5	-45.4	177.4	-69.2	170.2	0	0	0	112	F162 I163 D164 K170 R171 Q253	F162-L166 HydrophobicContact CD1-CD1 4.21Å; F162-L166 HydrophobicContact CD2-CG 4.49Å; F162-L166 HydrophobicContact CE1-CD1 3.81Å; F162-L166 HydrophobicContact CE2-CD1 4.18Å; F162-L166 HydrophobicContact CE2-CD2 4.26Å; F162-L166 HydrophobicContact CE2-CG 4.18Å; F162-L166 HydrophobicContact CZ-CD1 3.79Å; F162-L166 HydrophobicContact CZ-CD2 4.35Å; F162-L166 HydrophobicContact CZ-CG 4.26Å; F162-L166 VanDerWaalsContact O-CG 3.3Å; F162-L166 WeakPolarHBondContact O-CG 3.45Å; F162-L166 PolarHBondContact O-N 3.4Å; I163-L166 PolarHBondContact O-N 2.86Å; D164-L166 VanDerWaalsContact C-N 3.34Å; D164-L166 PolarHBondContact O-N 2.69Å; L166-K170 PolarHBondContact O-N 2.92Å; L166-K170 VanDerWaalsContact O-N 3.13Å; L166-R171 HydrophobicContact CD2-CB 3.69Å; L166-R171 PolarHBondContact O-N 3.23Å; L166-Q253 HydrophobicContact CD2-CB 4.4Å
167	F	88.7	Confident	88.6	Confident	7 Å²	7	22.7 Å²	22.7	3%	0.031	11%	0.107	C	C	.	.	H	α-helix	trans	-65.6	-46.7	176.8	-67.4	-17.2	0	0	0	112.3	I163 D164 K170 P173 Y296 I317 L320 I336 L340	I163-F167 HydrophobicContact CG2-CD2 4.09Å; I163-F167 HydrophobicContact CG2-CE1 4.31Å; I163-F167 HydrophobicContact CG2-CE2 3.63Å; I163-F167 HydrophobicContact CG2-CZ 3.76Å; I163-F167 WeakPolarHBondContact O-CG 3.39Å; I163-F167 PolarHBondContact O-N 3.2Å; D164-F167 PolarHBondContact O-N 3.19Å; F167-K170 PolarHBondContact O-N 3.03Å; F167-P173 HydrophobicContact CE1-CB 3.99Å; F167-P173 HydrophobicContact CE1-CG 4.07Å; F167-Y296 HydrophobicContact CB-CE1 4.38Å; F167-Y296 HydrophobicContact CD2-CD1 4.07Å; F167-Y296 AromaticContact CD2-CD2 3.72Å; F167-Y296 HydrophobicContact CD2-CD2 3.72Å; F167-Y296 HydrophobicContact CD2-CE1 4.33Å; F167-Y296 HydrophobicContact CD2-CE2 4.03Å; F167-Y296 AromaticContact CD2-CG 3.75Å; F167-Y296 HydrophobicContact CD2-CG 3.75Å; F167-Y296 HydrophobicContact CE2-CD2 4.16Å; F167-Y296 HydrophobicContact CE2-CG 4.09Å; F167-I317 HydrophobicContact CB-CD1 4.38Å; F167-I317 HydrophobicContact CB-CG1 4.35Å; F167-I317 HydrophobicContact CD1-CD1 4.39Å; F167-I317 HydrophobicContact CD1-CG1 4.19Å; F167-I317 HydrophobicContact CD1-CG2 4.41Å; F167-I317 HydrophobicContact CD2-CD1 3.89Å; F167-I317 HydrophobicContact CE1-CG2 4.12Å; F167-I317 HydrophobicContact CE2-CD1 4.21Å; F167-I317 HydrophobicContact CG-CD1 3.99Å; F167-I317 HydrophobicContact CG-CG1 4.12Å; F167-I317 HydrophobicContact CZ-CG2 4.45Å; F167-L320 HydrophobicContact CD1-CD1 4.22Å; F167-I336 HydrophobicContact CZ-CG2 4.4Å; F167-L340 HydrophobicContact CZ-CD1 4.41Å; F167-L340 HydrophobicContact CZ-CD2 4.45Å
168	S	83.1	Confident	88.9	Confident	64 Å²	64	22.7 Å²	22.7	45%	0.448	11%	0.107	S	C	.	.	H	α-helix	trans	-67.6	-37.2	-177.4	-72.2	0	0	0	0	112.6	D164 K170 Y296	D164-S168 WeakPolarHBondContact O-CB 3.46Å; D164-S168 PolarHBondContact O-N 2.9Å; D164-S168 PolarHBondContact O-OG 3.41Å; D164-S168 PolarHBondContact OD1-OG 3.21Å; S168-K170 VanDerWaalsContact C-N 3.34Å; S168-Y296 PolarHBondContact OG-OH 3.15Å
169	H	82.2	Confident	89.1	Confident	60 Å²	60	22.6 Å²	22.6	28%	0.278	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	3.5	173.1	-75.1	-89.4	0	0	0	114.7	Y165 R171	Y165-H169 AromaticContact CD2-CD2 3.25Å; Y165-H169 WeakPolarHBondContact CD2-CD2 3.36Å; Y165-H169 AromaticContact CD2-NE2 3.55Å; Y165-H169 AromaticContact CE2-CD2 3.43Å; Y165-H169 VanDerWaalsContact CE2-CD2 3.43Å; Y165-H169 WeakPolarHBondContact CE2-CD2 3.31Å; Y165-H169 AromaticContact CE2-NE2 3.49Å; Y165-H169 WeakPolarHBondContact CE2-NE2 3.42Å; Y165-H169 AromaticContact CG-CD2 3.94Å; Y165-H169 VanDerWaalsContact O-CB 3.29Å; Y165-H169 WeakPolarHBondContact O-CB 3.45Å; Y165-H169 PolarHBondContact O-CD2 3.24Å; Y165-H169 PolarHBondContact O-N 3.09Å; H169-R171 HydrophobicContact CB-CG 4.17Å; H169-R171 PolarHBondContact O-N 2.82Å
170	K	83.6	Confident	89.1	Confident	144 Å²	144	22.8 Å²	22.8	63%	0.626	11%	0.108	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	46.3	-178.8	-57.8	178	-176.8	173	0	113.4	L166 F167 S168 S316 L320	L166-K170 PolarHBondContact O-N 2.92Å; L166-K170 VanDerWaalsContact O-N 3.13Å; F167-K170 PolarHBondContact O-N 3.03Å; S168-K170 VanDerWaalsContact C-N 3.34Å; K170-S316 WeakPolarHBondContact CE-OG 3.33Å; K170-L320 VanDerWaalsContact CA-CD2 3.47Å; K170-L320 HydrophobicContact CB-CD2 3.59Å; K170-L320 HydrophobicContact CG-CD2 4.15Å
171	R	85.2	Confident	89.2	Confident	61 Å²	61	22.9 Å²	22.9	23%	0.23	11%	0.108	C	C	.	.			trans	-100.6	150.9	173.6	-59.5	-165.2	-175.3	165	10.9	110.7	Y165 L166 H169 P173 L320	Y165-R171 PolarHBondContact OH-NH1 2.99Å; Y165-R171 VanDerWaalsContact OH-NH1 3.07Å; Y165-R171 PolarHBondContact OH-NH2 2.94Å; L166-R171 HydrophobicContact CD2-CB 3.69Å; L166-R171 PolarHBondContact O-N 3.23Å; H169-R171 HydrophobicContact CB-CG 4.17Å; H169-R171 PolarHBondContact O-N 2.82Å; R171-P173 VanDerWaalsContact O-CD 3.31Å; R171-P173 WeakPolarHBondContact O-CD 3.42Å; R171-L320 WeakPolarHBondContact O-CD1 3.31Å
172	D	86.5	Confident	89.3	Confident	25 Å²	25	21.8 Å²	21.8	13%	0.134	10%	0.103	C	C	.	.			trans	-64.8	115.9	-178.3	-169.8	-11.5	0	0	0	111.3	T174 N322	D172-T174 VanDerWaalsContact C-N 3.27Å; D172-T174 PolarHBondContact O-N 3.46Å; D172-T174 WeakPolarHBondContact OD1-CB 3.27Å; D172-T174 PolarHBondContact OD1-N 2.9Å; D172-T174 PolarHBondContact OD1-OG1 3.12Å; D172-N322 PolarHBondContact OD2-ND2 2.83Å
173	P	90.4	Very high	89.3	Confident	2 Å²	2	24.6 Å²	24.6	1%	0.013	12%	0.116	C	C	.	.			trans	-80.3	-6	-179.8	36	-38.6	0	0	0	113.3	F167 R171 W175 T176 L177	F167-P173 HydrophobicContact CE1-CB 3.99Å; F167-P173 HydrophobicContact CE1-CG 4.07Å; R171-P173 VanDerWaalsContact O-CD 3.31Å; R171-P173 WeakPolarHBondContact O-CD 3.42Å; P173-W175 PolarHBondContact O-N 2.98Å; P173-T176 WeakPolarHBondContact O-CB 3.47Å; P173-T176 PolarHBondContact O-N 2.82Å; P173-T176 VanDerWaalsContact O-N 3.14Å; P173-L177 HydrophobicContact CB-CD1 4.06Å; P173-L177 HydrophobicContact CB-CG 4.26Å; P173-L177 HydrophobicContact CG-CD1 4.1Å; P173-L177 WeakPolarHBondContact O-CG 3.26Å; P173-L177 PolarHBondContact O-N 3.02Å
174	T	91	Very high	89.1	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-55.9	-43.6	-165.3	-64.1	0	0	0	0	113.6	D172 L177 F178 F210 L217 L219	D172-T174 VanDerWaalsContact C-N 3.27Å; D172-T174 PolarHBondContact O-N 3.46Å; D172-T174 WeakPolarHBondContact OD1-CB 3.27Å; D172-T174 PolarHBondContact OD1-N 2.9Å; D172-T174 PolarHBondContact OD1-OG1 3.12Å; T174-L177 PolarHBondContact O-N 2.81Å; T174-F178 PolarHBondContact O-N 3.48Å; T174-F210 HydrophobicContact CG2-CD1 4.01Å; T174-F210 HydrophobicContact CG2-CE1 4.31Å; T174-L217 HydrophobicContact CG2-CB 4.05Å; T174-L217 WeakPolarHBondContact CG2-O 3.47Å; T174-L219 HydrophobicContact CG2-CD2 3.71Å; T174-L219 HydrophobicContact CG2-CG 3.92Å
175	W	91	Very high	89.1	Confident	47 Å²	47	25.3 Å²	25.3	18%	0.178	12%	0.119	C	C	.	.	H	α-helix	trans	-59.4	-48.6	178.1	-56.5	92.7	0	0	0	112.1	P173 F178 H179 L219 C246 Q249 I250	P173-W175 PolarHBondContact O-N 2.98Å; W175-F178 PolarHBondContact O-N 3.3Å; W175-H179 PolarHBondContact O-N 2.97Å; W175-H179 VanDerWaalsContact O-N 3.11Å; W175-L219 HydrophobicContact CD2-CD2 3.69Å; W175-L219 HydrophobicContact CE3-CD2 3.52Å; W175-L219 HydrophobicContact CG-CD2 4.2Å; W175-L219 HydrophobicContact CH2-CD2 4.35Å; W175-L219 HydrophobicContact CZ2-CD2 4.48Å; W175-L219 HydrophobicContact CZ3-CD2 3.89Å; W175-C246 HydrophobicContact CE3-CB 4.11Å; W175-Q249 HydrophobicContact CD2-CB 3.79Å; W175-Q249 HydrophobicContact CD2-CG 3.98Å; W175-Q249 HydrophobicContact CE3-CB 3.92Å; W175-Q249 HydrophobicContact CE3-CG 3.86Å; W175-Q249 HydrophobicContact CG-CB 4.07Å; W175-Q249 HydrophobicContact CH2-CG 4.01Å; W175-Q249 HydrophobicContact CZ2-CG 4.11Å; W175-Q249 HydrophobicContact CZ3-CB 4.44Å; W175-Q249 HydrophobicContact CZ3-CG 3.88Å; W175-I250 HydrophobicContact CB-CG1 4.02Å
176	T	92.6	Very high	89	Confident	3 Å²	3	26.9 Å²	26.9	2%	0.018	13%	0.126	C	C	.	.	H	α-helix	trans	-63	-42.2	177.9	-48	0	0	0	0	111.8	L153 F162 I163 P173 I180	L153-T176 HydrophobicContact CD2-CG2 4.07Å; F162-T176 HydrophobicContact CD1-CG2 4.07Å; F162-T176 HydrophobicContact CE1-CG2 3.85Å; F162-T176 WeakPolarHBondContact CE1-OG1 3.38Å; I163-T176 HydrophobicContact CG1-CG2 4.31Å; P173-T176 WeakPolarHBondContact O-CB 3.47Å; P173-T176 PolarHBondContact O-N 2.82Å; P173-T176 VanDerWaalsContact O-N 3.14Å; T176-I180 HydrophobicContact CG2-CD1 4.16Å; T176-I180 WeakPolarHBondContact O-CG1 3.47Å; T176-I180 PolarHBondContact O-N 3.36Å
177	L	93.3	Very high	88.7	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-69.6	-37.2	179.5	-65.1	178.3	0	0	0	112.2	P173 T174 V181 F210 L217 I336 C339 L340	P173-L177 HydrophobicContact CB-CD1 4.06Å; P173-L177 HydrophobicContact CB-CG 4.26Å; P173-L177 HydrophobicContact CG-CD1 4.1Å; P173-L177 WeakPolarHBondContact O-CG 3.26Å; P173-L177 PolarHBondContact O-N 3.02Å; T174-L177 PolarHBondContact O-N 2.81Å; L177-V181 WeakPolarHBondContact O-CB 3.25Å; L177-V181 VanDerWaalsContact O-CG2 3.24Å; L177-V181 WeakPolarHBondContact O-CG2 3.46Å; L177-V181 PolarHBondContact O-N 3.49Å; L177-V181 VanDerWaalsContact O-N 3.16Å; L177-F210 HydrophobicContact CB-CE1 4.28Å; L177-F210 HydrophobicContact CB-CZ 4.31Å; L177-L217 HydrophobicContact CD1-CD1 4.25Å; L177-I336 HydrophobicContact CD1-CG1 4.46Å; L177-I336 HydrophobicContact CD1-CG2 4.42Å; L177-C339 HydrophobicContact CB-CB 4.11Å; L177-C339 HydrophobicContact CD1-CB 4.16Å; L177-C339 HydrophobicContact CD2-CB 3.97Å; L177-C339 HydrophobicContact CG-CB 4.3Å; L177-L340 HydrophobicContact CD2-CD2 4.34Å
178	F	93.1	Very high	88.3	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.1	-48.5	174	177.1	-96.4	0	0	0	111.5	T174 W175 I180 V181 N182 I206 F210 L219 F239 I242 D243 C246	T174-F178 PolarHBondContact O-N 3.48Å; W175-F178 PolarHBondContact O-N 3.3Å; F178-I180 PolarHBondContact O-N 2.71Å; F178-V181 PolarHBondContact O-N 2.97Å; F178-N182 HydrophobicContact CE1-CB 4.4Å; F178-N182 PolarHBondContact O-N 2.92Å; F178-I206 HydrophobicContact CD2-CG2 4.48Å; F178-I206 HydrophobicContact CE2-CG2 3.94Å; F178-F210 HydrophobicContact CB-CD1 3.9Å; F178-F210 HydrophobicContact CB-CE1 3.81Å; F178-F210 HydrophobicContact CB-CG 4.35Å; F178-F210 HydrophobicContact CB-CZ 4.19Å; F178-F210 HydrophobicContact CD2-CB 3.88Å; F178-F210 HydrophobicContact CD2-CD1 4.12Å; F178-F210 AromaticContact CD2-CD2 3.81Å; F178-F210 HydrophobicContact CD2-CD2 3.81Å; F178-F210 HydrophobicContact CD2-CE2 4.3Å; F178-F210 AromaticContact CD2-CG 3.7Å; F178-F210 HydrophobicContact CD2-CG 3.7Å; F178-F210 HydrophobicContact CE2-CB 4.41Å; F178-L219 HydrophobicContact CB-CD1 3.89Å; F178-L219 HydrophobicContact CD1-CD1 4Å; F178-L219 HydrophobicContact CD2-CD1 3.64Å; F178-L219 HydrophobicContact CE1-CD1 4.47Å; F178-L219 HydrophobicContact CE2-CD1 4.14Å; F178-L219 HydrophobicContact CG-CD1 3.56Å; F178-F239 HydrophobicContact CZ-CB 4.15Å; F178-F239 HydrophobicContact CZ-CD1 4.39Å; F178-I242 HydrophobicContact CD1-CG2 4.35Å; F178-I242 HydrophobicContact CE1-CB 4.12Å; F178-I242 HydrophobicContact CE1-CG2 3.69Å; F178-I242 HydrophobicContact CZ-CB 4.15Å; F178-I242 HydrophobicContact CZ-CG2 3.87Å; F178-D243 HydrophobicContact CE1-CB 4.27Å; F178-C246 VanDerWaalsContact CD1-SG 3.57Å
179	H	92.5	Very high	88	Confident	20 Å²	20	27.6 Å²	27.6	9%	0.093	12%	0.12	C	C	.	.	H	α-helix	trans	-53.4	-54	180	176.9	74.6	0	0	0	111.6	W175 V181 N182 Q183 D243 I250	W175-H179 PolarHBondContact O-N 2.97Å; W175-H179 VanDerWaalsContact O-N 3.11Å; H179-V181 VanDerWaalsContact C-N 3.3Å; H179-V181 PolarHBondContact O-N 3.47Å; H179-N182 PolarHBondContact O-N 2.83Å; H179-N182 VanDerWaalsContact O-N 3.13Å; H179-Q183 WeakPolarHBondContact O-CG 3.38Å; H179-Q183 PolarHBondContact O-N 2.89Å; H179-D243 WeakPolarHBondContact CA-OD1 3.27Å; H179-D243 IonicContact CE1-OD1 2.74Å; H179-D243 IonicContact CE1-OD2 3.47Å; H179-D243 IonicContact CG-OD1 3.49Å; H179-D243 IonicContact ND1-OD1 3.4Å; H179-D243 PolarHBondContact ND1-OD1 2.9Å; H179-D243 IonicContact ND1-OD2 3.56Å; H179-D243 PolarHBondContact ND1-OD2 3.42Å; H179-I250 HydrophobicContact CB-CD1 3.87Å
180	I	92.2	Very high	87.8	Confident	3 Å²	3	29.1 Å²	29.1	2%	0.015	14%	0.143	C	C	.	.	H	α-helix	trans	-65.5	-34.1	-177.2	-57.1	164.2	0	0	0	111.4	L153 I163 T176 F178 Y184 A343 Y346	L153-I180 HydrophobicContact CD2-CD1 4.43Å; L153-I180 HydrophobicContact CD2-CG1 4.42Å; I163-I180 HydrophobicContact CD1-CD1 4.48Å; T176-I180 HydrophobicContact CG2-CD1 4.16Å; T176-I180 WeakPolarHBondContact O-CG1 3.47Å; T176-I180 PolarHBondContact O-N 3.36Å; F178-I180 PolarHBondContact O-N 2.71Å; I180-Y184 WeakPolarHBondContact O-CB 3.48Å; I180-Y184 PolarHBondContact O-N 2.79Å; I180-A343 HydrophobicContact CD1-CB 4.4Å; I180-A343 HydrophobicContact CG2-CB 3.62Å; I180-Y346 HydrophobicContact CG2-CD1 4.11Å; I180-Y346 HydrophobicContact CG2-CG 4.34Å
181	V	91.6	Very high	87.2	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.012	14%	0.14	C	C	.	.	H	α-helix	trans	-69.4	-38	174	171.2	0	0	0	0	111.9	L177 F178 H179 Y184 F185 I206 F210 C339 T342 Y411	L177-V181 WeakPolarHBondContact O-CB 3.25Å; L177-V181 VanDerWaalsContact O-CG2 3.24Å; L177-V181 WeakPolarHBondContact O-CG2 3.46Å; L177-V181 PolarHBondContact O-N 3.49Å; L177-V181 VanDerWaalsContact O-N 3.16Å; F178-V181 PolarHBondContact O-N 2.97Å; H179-V181 VanDerWaalsContact C-N 3.3Å; H179-V181 PolarHBondContact O-N 3.47Å; V181-Y184 PolarHBondContact O-N 2.82Å; V181-F185 VanDerWaalsContact O-CB 3.3Å; V181-F185 WeakPolarHBondContact O-CB 3.08Å; V181-F185 PolarHBondContact O-N 2.87Å; V181-I206 HydrophobicContact CG1-CD1 4.13Å; V181-I206 HydrophobicContact CG1-CG1 3.97Å; V181-F210 HydrophobicContact CB-CE2 4.38Å; V181-F210 HydrophobicContact CG1-CE2 4.31Å; V181-C339 HydrophobicContact CG2-CB 4.3Å; V181-T342 HydrophobicContact CG2-CG2 4.28Å; V181-Y411 HydrophobicContact CB-CD2 4.45Å; V181-Y411 HydrophobicContact CG1-CD2 3.69Å; V181-Y411 HydrophobicContact CG1-CE2 3.93Å; V181-Y411 HydrophobicContact CG1-CG 4.24Å; V181-Y411 HydrophobicContact CG2-CD2 3.83Å; V181-Y411 HydrophobicContact CG2-CE2 3.78Å
182	N	91.1	Very high	86.2	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.6	-48.1	172.9	-177.2	50.5	0	0	0	111.2	F178 H179 Y184 F185 Q186 F239 N240 D243	F178-N182 HydrophobicContact CE1-CB 4.4Å; F178-N182 PolarHBondContact O-N 2.92Å; H179-N182 PolarHBondContact O-N 2.83Å; H179-N182 VanDerWaalsContact O-N 3.13Å; N182-Y184 VanDerWaalsContact C-N 3.29Å; N182-Y184 PolarHBondContact O-N 3.14Å; N182-F185 WeakPolarHBondContact O-CA 3.44Å; N182-F185 WeakPolarHBondContact O-CB 3.2Å; N182-F185 PolarHBondContact O-N 2.64Å; N182-Q186 WeakPolarHBondContact O-CG 3.48Å; N182-Q186 PolarHBondContact O-N 2.94Å; N182-Q186 PolarHBondContact OD1-NE2 3.37Å; N182-F239 WeakPolarHBondContact OD1-CB 3.3Å; N182-N240 PolarHBondContact ND2-OD1 3.09Å; N182-D243 PolarHBondContact ND2-OD2 3.38Å
183	Q	89.4	Confident	84.9	Confident	60 Å²	60	32.8 Å²	32.8	28%	0.28	17%	0.174	S	C	.	.	H	α-helix	trans	-59.8	-39.4	177.7	-65.2	-58.7	-37.8	0	0	112	H179 R187 D243 Y346	H179-Q183 WeakPolarHBondContact O-CG 3.38Å; H179-Q183 PolarHBondContact O-N 2.89Å; Q183-R187 VanDerWaalsContact O-CB 3.29Å; Q183-R187 WeakPolarHBondContact O-CB 3.46Å; Q183-R187 PolarHBondContact O-N 2.94Å; Q183-R187 VanDerWaalsContact O-N 3.11Å; Q183-D243 PolarHBondContact NE2-OD2 3.41Å; Q183-Y346 HydrophobicContact CB-CD2 4.33Å; Q183-Y346 HydrophobicContact CB-CE2 3.66Å
184	Y	88.7	Confident	83.2	Confident	18 Å²	18	37.9 Å²	37.9	7%	0.071	20%	0.197	C	C	.	.	H	α-helix	trans	-65.2	-42.2	170.9	-179.2	-97	0	0	0	113.1	I180 V181 N182 S188 T342 R345 M349 Y411 C412	I180-Y184 WeakPolarHBondContact O-CB 3.48Å; I180-Y184 PolarHBondContact O-N 2.79Å; V181-Y184 PolarHBondContact O-N 2.82Å; N182-Y184 VanDerWaalsContact C-N 3.29Å; N182-Y184 PolarHBondContact O-N 3.14Å; Y184-S188 WeakPolarHBondContact O-CB 3.06Å; Y184-S188 PolarHBondContact O-N 3.48Å; Y184-S188 PolarHBondContact O-OG 3.1Å; Y184-T342 HydrophobicContact CD1-CG2 3.31Å; Y184-T342 HydrophobicContact CD2-CG2 4.12Å; Y184-T342 HydrophobicContact CE1-CG2 3.76Å; Y184-T342 HydrophobicContact CG-CG2 3.49Å; Y184-T342 VanDerWaalsContact CG-CG2 3.49Å; Y184-R345 HydrophobicContact CD2-CB 4.44Å; Y184-R345 HydrophobicContact CE2-CB 3.74Å; Y184-M349 HydrophobicContact CD2-SD 4.35Å; Y184-M349 HydrophobicContact CE2-SD 3.67Å; Y184-Y411 VanDerWaalsContact CE1-O 3.3Å; Y184-Y411 WeakPolarHBondContact CE1-O 3.01Å; Y184-Y411 PolarHBondContact OH-O 3.32Å; Y184-C412 HydrophobicContact CE1-CB 3.87Å
185	F	88	Confident	81.8	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.009	20%	0.2	C	C	.	.	H	α-helix	trans	-60.2	-52.6	177.1	170.3	-95.1	0	0	0	111.6	V181 N182 R187 S188 M189 V202 C203 I206 F239	V181-F185 VanDerWaalsContact O-CB 3.3Å; V181-F185 WeakPolarHBondContact O-CB 3.08Å; V181-F185 PolarHBondContact O-N 2.87Å; N182-F185 WeakPolarHBondContact O-CA 3.44Å; N182-F185 WeakPolarHBondContact O-CB 3.2Å; N182-F185 PolarHBondContact O-N 2.64Å; F185-R187 PolarHBondContact O-N 3.29Å; F185-S188 WeakPolarHBondContact O-CB 3.19Å; F185-S188 PolarHBondContact O-N 3.04Å; F185-S188 VanDerWaalsContact O-N 3.12Å; F185-M189 HydrophobicContact CD2-CE 3.96Å; F185-M189 HydrophobicContact CD2-CG 4.48Å; F185-M189 HydrophobicContact CE1-CG 4.32Å; F185-M189 HydrophobicContact CE2-CE 3.42Å; F185-M189 VanDerWaalsContact CE2-CE 3.42Å; F185-M189 HydrophobicContact CE2-CG 4.12Å; F185-M189 HydrophobicContact CZ-CE 4.06Å; F185-M189 HydrophobicContact CZ-CG 4Å; F185-M189 WeakPolarHBondContact O-CG 3.37Å; F185-M189 PolarHBondContact O-N 3.45Å; F185-V202 HydrophobicContact CD2-CB 4.38Å; F185-V202 HydrophobicContact CD2-CG1 3.71Å; F185-V202 HydrophobicContact CE2-CB 4.29Å; F185-V202 HydrophobicContact CE2-CG1 4.1Å; F185-C203 WeakPolarHBondContact CZ-SG 3.43Å; F185-I206 HydrophobicContact CB-CD1 3.88Å; F185-I206 HydrophobicContact CD2-CD1 3.66Å; F185-I206 HydrophobicContact CE2-CD1 4.39Å; F185-I206 HydrophobicContact CG-CD1 3.82Å; F185-F239 HydrophobicContact CD1-CD2 4.25Å; F185-F239 HydrophobicContact CE1-CD2 4.13Å; F185-F239 HydrophobicContact CE1-CE2 4.44Å; F185-F239 HydrophobicContact CZ-CE2 4.45Å
186	Q	85.2	Confident	80.3	Confident	42 Å²	42	41.8 Å²	41.8	20%	0.196	22%	0.216	C	C	.	.	H	α-helix	trans	-61	-44.4	179.7	-58.9	-63.3	-5.9	0	0	111.3	N182 S188 M189 A190 S236 N240	N182-Q186 WeakPolarHBondContact O-CG 3.48Å; N182-Q186 PolarHBondContact O-N 2.94Å; N182-Q186 PolarHBondContact OD1-NE2 3.37Å; Q186-S188 VanDerWaalsContact C-N 3.3Å; Q186-S188 PolarHBondContact O-N 3.17Å; Q186-M189 PolarHBondContact O-N 3.03Å; Q186-A190 WeakPolarHBondContact O-CB 3.44Å; Q186-A190 PolarHBondContact O-N 3.03Å; Q186-S236 VanDerWaalsContact CD-OG 3.31Å; Q186-S236 PolarHBondContact NE2-O 3.39Å; Q186-S236 PolarHBondContact NE2-OG 2.96Å; Q186-S236 PolarHBondContact OE1-OG 2.78Å; Q186-N240 VanDerWaalsContact NE2-CG 3.3Å; Q186-N240 PolarHBondContact NE2-ND2 2.83Å; Q186-N240 VanDerWaalsContact NE2-ND2 3.18Å; Q186-N240 PolarHBondContact NE2-OD1 2.96Å
187	R	83.9	Confident	78.8	Confident	71 Å²	71	50.2 Å²	50.2	27%	0.268	25%	0.253	S	S	.	.	H	α-helix	trans	-63.8	-34.1	175.6	-168.3	174.7	-168.6	145.6	6.9	112.9	Q183 F185 S191 M349 S350	Q183-R187 VanDerWaalsContact O-CB 3.29Å; Q183-R187 WeakPolarHBondContact O-CB 3.46Å; Q183-R187 PolarHBondContact O-N 2.94Å; Q183-R187 VanDerWaalsContact O-N 3.11Å; F185-R187 PolarHBondContact O-N 3.29Å; R187-S191 WeakPolarHBondContact O-CB 3.38Å; R187-S191 PolarHBondContact O-N 2.92Å; R187-S191 PolarHBondContact O-OG 2.94Å; R187-M349 PolarHBondContact NH2-O 2.68Å; R187-S350 PolarHBondContact NH1-OG 2.96Å
188	S	80.1	Confident	77.6	Confident	3 Å²	3	52 Å²	52	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-69.6	-42.2	176.4	-63.9	0	0	0	0	112.1	Y184 F185 Q186 S191 S192	Y184-S188 WeakPolarHBondContact O-CB 3.06Å; Y184-S188 PolarHBondContact O-N 3.48Å; Y184-S188 PolarHBondContact O-OG 3.1Å; F185-S188 WeakPolarHBondContact O-CB 3.19Å; F185-S188 PolarHBondContact O-N 3.04Å; F185-S188 VanDerWaalsContact O-N 3.12Å; Q186-S188 VanDerWaalsContact C-N 3.3Å; Q186-S188 PolarHBondContact O-N 3.17Å; S188-S191 PolarHBondContact O-N 2.93Å; S188-S191 PolarHBondContact O-OG 2.8Å; S188-S192 PolarHBondContact O-N 2.65Å
189	M	77.3	Confident	76.5	Confident	14 Å²	14	54.3 Å²	54.3	7%	0.069	27%	0.273	C	S	.	.	H	α-helix	trans	-70.2	-36.9	176.9	-64.6	-53	168.2	0	0	112.2	F185 Q186 S191 L195 F196 E199 V202	F185-M189 HydrophobicContact CD2-CE 3.96Å; F185-M189 HydrophobicContact CD2-CG 4.48Å; F185-M189 HydrophobicContact CE1-CG 4.32Å; F185-M189 HydrophobicContact CE2-CE 3.42Å; F185-M189 VanDerWaalsContact CE2-CE 3.42Å; F185-M189 HydrophobicContact CE2-CG 4.12Å; F185-M189 HydrophobicContact CZ-CE 4.06Å; F185-M189 HydrophobicContact CZ-CG 4Å; F185-M189 WeakPolarHBondContact O-CG 3.37Å; F185-M189 PolarHBondContact O-N 3.45Å; Q186-M189 PolarHBondContact O-N 3.03Å; M189-S191 VanDerWaalsContact C-N 3.28Å; M189-S191 PolarHBondContact O-N 3.02Å; M189-L195 HydrophobicContact CE-CB 4.2Å; M189-L195 HydrophobicContact SD-CB 3.79Å; M189-F196 WeakPolarHBondContact O-CE2 3.33Å; M189-E199 HydrophobicContact CE-CB 3.91Å; M189-E199 HydrophobicContact CE-CG 4.06Å; M189-E199 HydrophobicContact SD-CB 4.29Å; M189-E199 HydrophobicContact SD-CG 4.42Å; M189-V202 HydrophobicContact CE-CB 4.5Å
190	A	77.3	Confident	75.4	Confident	92 Å²	92	58.9 Å²	58.9	76%	0.76	29%	0.292	S	S	*	.	H	α-helix	trans	-64.1	-29.3	173.6	0	0	0	0	0	113.7	Q186	Q186-A190 WeakPolarHBondContact O-CB 3.44Å; Q186-A190 PolarHBondContact O-N 3.03Å
191	S	70.4	Confident	74.6	Confident	80 Å²	80	61.2 Å²	61.2	56%	0.559	30%	0.301	S	S	*	.	H	α-helix	trans	-101.1	-22.6	-173	55.2	0	0	0	0	115.2	R187 S188 M189	R187-S191 WeakPolarHBondContact O-CB 3.38Å; R187-S191 PolarHBondContact O-N 2.92Å; R187-S191 PolarHBondContact O-OG 2.94Å; S188-S191 PolarHBondContact O-N 2.93Å; S188-S191 PolarHBondContact O-OG 2.8Å; M189-S191 VanDerWaalsContact C-N 3.28Å; M189-S191 PolarHBondContact O-N 3.02Å
192	S	65.8	Low	73.9	Confident	30 Å²	30	61.1 Å²	61.1	21%	0.21	30%	0.301	C	S	.	.			trans	-122.9	104.6	-173.1	-175.5	0	0	0	0	114	S188 E194 L195	S188-S192 PolarHBondContact O-N 2.65Å; S192-E194 PolarHBondContact O-N 2.85Å; S192-E194 VanDerWaalsContact O-N 3.08Å; S192-E194 PolarHBondContact OG-N 3.03Å; S192-L195 PolarHBondContact O-N 2.8Å; S192-L195 PolarHBondContact OG-N 2.99Å
193	K	58.9	Low	73.4	Confident	197 Å²	197	61.1 Å²	61.1	86%	0.857	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-20.5	169.6	-68.9	-174.2	178.2	-179.2	0	113.8
194	E	55	Low	72.8	Confident	108 Å²	108	58.9 Å²	58.9	51%	0.505	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-28.8	176.3	-65	-172.1	114.4	0	0	112.8	S192 F196 K197 K414	S192-E194 PolarHBondContact O-N 2.85Å; S192-E194 VanDerWaalsContact O-N 3.08Å; S192-E194 PolarHBondContact OG-N 3.03Å; E194-F196 VanDerWaalsContact C-N 3.25Å; E194-F196 PolarHBondContact O-N 2.8Å; E194-K197 WeakPolarHBondContact O-CB 3.23Å; E194-K197 PolarHBondContact O-N 3.39Å; E194-K414 IonicContact OE1-NZ 2.66Å; E194-K414 IonicContact OE2-NZ 3.7Å; E194-K414 PolarHBondContact OE2-NZ 3.2Å
195	L	60	Low	72.4	Confident	14 Å²	14	59.5 Å²	59.5	7%	0.073	29%	0.294	C	S	.	.	H	α-helix	trans	-69.9	-20.3	-179.6	-77.7	177.2	0	0	0	113.2	M189 S192 K197 D198 E199 C412	M189-L195 HydrophobicContact CE-CB 4.2Å; M189-L195 HydrophobicContact SD-CB 3.79Å; S192-L195 PolarHBondContact O-N 2.8Å; S192-L195 PolarHBondContact OG-N 2.99Å; L195-K197 PolarHBondContact O-N 3.41Å; L195-K197 VanDerWaalsContact O-N 3.11Å; L195-D198 HydrophobicContact CD2-CB 4.18Å; L195-D198 CarbonylContact O-C 2.93Å; L195-D198 WeakPolarHBondContact O-CA 3.21Å; L195-D198 PolarHBondContact O-N 3.02Å; L195-E199 WeakPolarHBondContact O-CA 3.49Å; L195-E199 PolarHBondContact O-N 2.84Å; L195-C412 HydrophobicContact CD1-CB 3.91Å; L195-C412 HydrophobicContact CD2-CB 4.13Å
196	F	60.1	Low	72.3	Confident	115 Å²	115	59.4 Å²	59.4	50%	0.504	29%	0.294	S	S	.	.	H	α-helix	trans	-56.4	-22.4	166.8	-75.7	-85.2	0	0	0	113.8	M189 E194	M189-F196 WeakPolarHBondContact O-CE2 3.33Å; E194-F196 VanDerWaalsContact C-N 3.25Å; E194-F196 PolarHBondContact O-N 2.8Å
197	K	60.8	Low	72.2	Confident	181 Å²	181	58 Å²	58	79%	0.787	29%	0.287	S	S	*	.	H	α-helix	trans	-78.8	-31.6	172.5	-60.7	-179.1	-179.8	177.9	0	112.5	E194 L195	E194-K197 WeakPolarHBondContact O-CB 3.23Å; E194-K197 PolarHBondContact O-N 3.39Å; L195-K197 PolarHBondContact O-N 3.41Å; L195-K197 VanDerWaalsContact O-N 3.11Å
198	D	67.4	Low	72	Confident	41 Å²	41	54.7 Å²	54.7	22%	0.219	27%	0.274	C	S	.	.	H	α-helix	trans	-93.7	-6.5	178	-84.2	-10.1	0	0	0	112.5	L195 K200 R201 V202	L195-D198 HydrophobicContact CD2-CB 4.18Å; L195-D198 CarbonylContact O-C 2.93Å; L195-D198 WeakPolarHBondContact O-CA 3.21Å; L195-D198 PolarHBondContact O-N 3.02Å; D198-K200 VanDerWaalsContact C-N 3.35Å; D198-K200 PolarHBondContact O-N 2.72Å; D198-R201 HydrophobicContact CB-CG 4.12Å; D198-R201 WeakPolarHBondContact O-CA 3.42Å; D198-R201 WeakPolarHBondContact O-CB 3.36Å; D198-R201 VanDerWaalsContact O-CG 3.23Å; D198-R201 WeakPolarHBondContact O-CG 3.42Å; D198-R201 PolarHBondContact O-N 3.08Å; D198-R201 WeakPolarHBondContact OD1-CD 3.31Å; D198-R201 IonicContact OD1-NE 2.59Å; D198-R201 PolarHBondContact OD1-NE 2.91Å; D198-R201 IonicContact OD2-NE 2.69Å; D198-R201 PolarHBondContact OD2-NE 3.23Å; D198-V202 PolarHBondContact O-N 2.79Å
199	E	71.8	Confident	72.3	Confident	48 Å²	48	54.6 Å²	54.6	22%	0.224	27%	0.274	C	S	.	.	H	α-helix	trans	-51	-50.9	-170.3	175.9	176.8	-160.5	0	0	112.2	M189 L195 R201 V202 C203	M189-E199 HydrophobicContact CE-CB 3.91Å; M189-E199 HydrophobicContact CE-CG 4.06Å; M189-E199 HydrophobicContact SD-CB 4.29Å; M189-E199 HydrophobicContact SD-CG 4.42Å; L195-E199 WeakPolarHBondContact O-CA 3.49Å; L195-E199 PolarHBondContact O-N 2.84Å; E199-R201 PolarHBondContact O-N 3.45Å; E199-V202 PolarHBondContact O-N 3.35Å; E199-V202 VanDerWaalsContact O-N 3.12Å; E199-C203 WeakPolarHBondContact O-CB 3.48Å; E199-C203 PolarHBondContact O-N 3.12Å; E199-C203 PolarHBondContact O-SG 2.99Å
200	K	69.2	Low	72.8	Confident	115 Å²	115	54 Å²	54	50%	0.5	27%	0.271	S	S	.	.	H	α-helix	trans	-59.9	-31.6	178.5	-57.6	-166.7	177.1	-172.3	0	112.7	D198 L204 F232	D198-K200 VanDerWaalsContact C-N 3.35Å; D198-K200 PolarHBondContact O-N 2.72Å; K200-L204 VanDerWaalsContact O-CB 3.28Å; K200-L204 WeakPolarHBondContact O-CB 3.31Å; K200-L204 PolarHBondContact O-N 3.2Å; K200-F232 HydrophobicContact CB-CD1 3.71Å; K200-F232 HydrophobicContact CB-CE1 4.08Å; K200-F232 HydrophobicContact CB-CG 4.34Å; K200-F232 HydrophobicContact CD-CB 3.96Å; K200-F232 HydrophobicContact CD-CD1 4.33Å; K200-F232 HydrophobicContact CD-CG 4.09Å; K200-F232 HydrophobicContact CG-CB 4.07Å; K200-F232 HydrophobicContact CG-CD1 3.95Å; K200-F232 HydrophobicContact CG-CG 4.17Å; K200-F232 WeakPolarHBondContact O-CE1 3.33Å
201	R	73.7	Confident	73.1	Confident	52 Å²	52	50.2 Å²	50.2	20%	0.196	24%	0.238	C	C	.	.	H	α-helix	trans	-73.6	-40.9	177.8	106.1	-173.4	-167.1	114.6	13.8	111.2	D198 E199 L204 E205 A413 S415 L457	D198-R201 HydrophobicContact CB-CG 4.12Å; D198-R201 WeakPolarHBondContact O-CA 3.42Å; D198-R201 WeakPolarHBondContact O-CB 3.36Å; D198-R201 VanDerWaalsContact O-CG 3.23Å; D198-R201 WeakPolarHBondContact O-CG 3.42Å; D198-R201 PolarHBondContact O-N 3.08Å; D198-R201 WeakPolarHBondContact OD1-CD 3.31Å; D198-R201 IonicContact OD1-NE 2.59Å; D198-R201 PolarHBondContact OD1-NE 2.91Å; D198-R201 IonicContact OD2-NE 2.69Å; D198-R201 PolarHBondContact OD2-NE 3.23Å; E199-R201 PolarHBondContact O-N 3.45Å; R201-L204 PolarHBondContact O-N 3.44Å; R201-E205 WeakPolarHBondContact O-CG 3.1Å; R201-E205 PolarHBondContact O-N 3.46Å; R201-E205 VanDerWaalsContact O-N 3.08Å; R201-A413 PolarHBondContact NH2-O 3.04Å; R201-S415 VanDerWaalsContact NH2-N 3.11Å; R201-L457 HydrophobicContact CB-CD2 3.74Å; R201-L457 HydrophobicContact CG-CD1 3.86Å; R201-L457 HydrophobicContact CG-CD2 3.5Å; R201-L457 HydrophobicContact CG-CG 4.34Å
202	V	76.9	Confident	73.4	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-71.8	-42	175.7	-172.5	0	0	0	0	111.7	F185 M189 D198 E199 L204 E205 I206	F185-V202 HydrophobicContact CD2-CB 4.38Å; F185-V202 HydrophobicContact CD2-CG1 3.71Å; F185-V202 HydrophobicContact CE2-CB 4.29Å; F185-V202 HydrophobicContact CE2-CG1 4.1Å; M189-V202 HydrophobicContact CE-CB 4.5Å; D198-V202 PolarHBondContact O-N 2.79Å; E199-V202 PolarHBondContact O-N 3.35Å; E199-V202 VanDerWaalsContact O-N 3.12Å; V202-L204 VanDerWaalsContact C-N 3.28Å; V202-L204 PolarHBondContact O-N 3.32Å; V202-E205 PolarHBondContact O-N 3.14Å; V202-E205 VanDerWaalsContact O-N 3.13Å; V202-I206 HydrophobicContact CG1-CD1 4.07Å; V202-I206 HydrophobicContact CG1-CG1 4.48Å; V202-I206 WeakPolarHBondContact O-CG1 3.14Å; V202-I206 PolarHBondContact O-N 3.2Å
203	C	81.4	Confident	73.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.4	-40.9	173.3	-69.1	0	0	0	0	111.8	F185 E199 F207 F230 F232 C235 F239	F185-C203 WeakPolarHBondContact CZ-SG 3.43Å; E199-C203 WeakPolarHBondContact O-CB 3.48Å; E199-C203 PolarHBondContact O-N 3.12Å; E199-C203 PolarHBondContact O-SG 2.99Å; C203-F207 VanDerWaalsContact O-CB 3.29Å; C203-F207 WeakPolarHBondContact O-CB 3.43Å; C203-F207 PolarHBondContact O-N 3.1Å; C203-F230 HydrophobicContact CB-CE1 4.41Å; C203-F230 HydrophobicContact CB-CZ 4.23Å; C203-F232 HydrophobicContact CB-CD1 4.47Å; C203-C235 HydrophobicContact CB-CB 3.94Å; C203-C235 WeakPolarHBondContact SG-CB 3.48Å; C203-F239 HydrophobicContact CB-CE2 4.33Å; C203-F239 HydrophobicContact CB-CZ 4.33Å
204	L	76	Confident	74.3	Confident	13 Å²	13	47 Å²	47	7%	0.068	21%	0.212	C	C	.	.	H	α-helix	trans	-63.7	-42.5	174	-176.2	63.8	0	0	0	111.9	K200 R201 V202 F207 T208 F232 I444	K200-L204 VanDerWaalsContact O-CB 3.28Å; K200-L204 WeakPolarHBondContact O-CB 3.31Å; K200-L204 PolarHBondContact O-N 3.2Å; R201-L204 PolarHBondContact O-N 3.44Å; V202-L204 VanDerWaalsContact C-N 3.28Å; V202-L204 PolarHBondContact O-N 3.32Å; L204-F207 PolarHBondContact O-N 3.4Å; L204-T208 HydrophobicContact CD1-CG2 4.11Å; L204-T208 HydrophobicContact CG-CG2 4.47Å; L204-T208 WeakPolarHBondContact O-CB 3.22Å; L204-T208 WeakPolarHBondContact O-CG2 3.28Å; L204-T208 PolarHBondContact O-N 2.82Å; L204-T208 PolarHBondContact O-OG1 3.48Å; L204-F232 HydrophobicContact CB-CE1 4.29Å; L204-I444 HydrophobicContact CD1-CD1 4.49Å; L204-I444 HydrophobicContact CD1-CG1 4.26Å
205	E	80.2	Confident	75.5	Confident	30 Å²	30	41.8 Å²	41.8	14%	0.14	19%	0.188	C	C	.	.	H	α-helix	trans	-62.4	-44.9	176.1	-72.6	-162.2	128.3	0	0	112.8	R201 V202 T208 T209 Y411 W455 L457	R201-E205 WeakPolarHBondContact O-CG 3.1Å; R201-E205 PolarHBondContact O-N 3.46Å; R201-E205 VanDerWaalsContact O-N 3.08Å; V202-E205 PolarHBondContact O-N 3.14Å; V202-E205 VanDerWaalsContact O-N 3.13Å; E205-T208 WeakPolarHBondContact CA-OG1 3.34Å; E205-T208 PolarHBondContact O-N 2.71Å; E205-T208 PolarHBondContact O-OG1 2.74Å; E205-T209 VanDerWaalsContact O-CB 3.24Å; E205-T209 WeakPolarHBondContact O-CB 3.11Å; E205-T209 PolarHBondContact O-N 2.77Å; E205-T209 PolarHBondContact O-OG1 3.36Å; E205-Y411 HydrophobicContact CB-CD1 4.12Å; E205-Y411 HydrophobicContact CB-CE1 3.95Å; E205-Y411 WeakPolarHBondContact OE2-CD1 3.45Å; E205-W455 HydrophobicContact CB-CZ3 4.25Å; E205-W455 HydrophobicContact CG-CZ3 4.07Å; E205-L457 VanDerWaalsContact CD-CG 3.5Å; E205-L457 HydrophobicContact CG-CD1 3.87Å; E205-L457 HydrophobicContact CG-CD2 4.37Å; E205-L457 HydrophobicContact CG-CG 3.9Å; E205-L457 WeakPolarHBondContact OE1-CD1 3.47Å; E205-L457 VanDerWaalsContact OE1-CG 3.25Å; E205-L457 WeakPolarHBondContact OE1-CG 3.35Å; E205-L457 WeakPolarHBondContact OE2-CD1 3.31Å
206	I	86.5	Confident	76.6	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-45.7	178	-65.7	170.6	0	0	0	109.8	F178 V181 F185 V202 T208 T209 F210 F239	F178-I206 HydrophobicContact CD2-CG2 4.48Å; F178-I206 HydrophobicContact CE2-CG2 3.94Å; V181-I206 HydrophobicContact CG1-CD1 4.13Å; V181-I206 HydrophobicContact CG1-CG1 3.97Å; F185-I206 HydrophobicContact CB-CD1 3.88Å; F185-I206 HydrophobicContact CD2-CD1 3.66Å; F185-I206 HydrophobicContact CE2-CD1 4.39Å; F185-I206 HydrophobicContact CG-CD1 3.82Å; V202-I206 HydrophobicContact CG1-CD1 4.07Å; V202-I206 HydrophobicContact CG1-CG1 4.48Å; V202-I206 WeakPolarHBondContact O-CG1 3.14Å; V202-I206 PolarHBondContact O-N 3.2Å; I206-T208 PolarHBondContact O-N 3.09Å; I206-T209 PolarHBondContact O-N 2.97Å; I206-F210 HydrophobicContact CG2-CD2 4.27Å; I206-F210 PolarHBondContact O-N 2.75Å; I206-F239 HydrophobicContact CB-CE1 4.47Å; I206-F239 HydrophobicContact CB-CE2 4.02Å; I206-F239 HydrophobicContact CB-CZ 3.82Å; I206-F239 HydrophobicContact CD1-CD2 4.4Å; I206-F239 HydrophobicContact CD1-CE2 3.97Å; I206-F239 HydrophobicContact CG2-CD1 4.26Å; I206-F239 HydrophobicContact CG2-CD2 4.27Å; I206-F239 HydrophobicContact CG2-CE1 3.87Å; I206-F239 HydrophobicContact CG2-CE2 3.88Å; I206-F239 HydrophobicContact CG2-CG 4.46Å; I206-F239 HydrophobicContact CG2-CZ 3.66Å
207	F	83.4	Confident	77.9	Confident	12 Å²	12	36.1 Å²	36.1	5%	0.053	16%	0.164	C	C	.	.	I	π-helix	trans	-59.8	-46.9	176	174.4	-88.5	0	0	0	112.8	C203 L204 T209 L211 H212 L227 F230 I444	C203-F207 VanDerWaalsContact O-CB 3.29Å; C203-F207 WeakPolarHBondContact O-CB 3.43Å; C203-F207 PolarHBondContact O-N 3.1Å; L204-F207 PolarHBondContact O-N 3.4Å; F207-T209 VanDerWaalsContact C-N 3.34Å; F207-L211 HydrophobicContact CD2-CB 4.01Å; F207-L211 HydrophobicContact CD2-CD1 4.37Å; F207-L211 HydrophobicContact CE2-CB 4.5Å; F207-L211 HydrophobicContact CG-CB 4.49Å; F207-L211 CarbonylContact O-C 3.03Å; F207-L211 WeakPolarHBondContact O-CA 3.46Å; F207-L211 PolarHBondContact O-N 3.42Å; F207-H212 HydrophobicContact CD1-CB 4.29Å; F207-H212 HydrophobicContact CE1-CB 3.98Å; F207-H212 PolarHBondContact O-N 3.29Å; F207-L227 HydrophobicContact CE2-CB 4.41Å; F207-L227 HydrophobicContact CE2-CD2 3.83Å; F207-F230 HydrophobicContact CB-CE1 4.14Å; F207-F230 HydrophobicContact CB-CE2 3.9Å; F207-F230 HydrophobicContact CB-CZ 3.64Å; F207-F230 HydrophobicContact CD2-CB 4.36Å; F207-F230 HydrophobicContact CD2-CD1 4.3Å; F207-F230 AromaticContact CD2-CD2 3.28Å; F207-F230 HydrophobicContact CD2-CD2 3.28Å; F207-F230 HydrophobicContact CD2-CE1 4.38Å; F207-F230 AromaticContact CD2-CE2 3.39Å; F207-F230 HydrophobicContact CD2-CE2 3.39Å; F207-F230 AromaticContact CD2-CG 3.76Å; F207-F230 HydrophobicContact CD2-CG 3.76Å; F207-F230 AromaticContact CD2-CZ 3.95Å; F207-F230 HydrophobicContact CD2-CZ 3.95Å; F207-F230 HydrophobicContact CE2-CB 3.91Å; F207-F230 AromaticContact CE2-CD2 3.6Å; F207-F230 HydrophobicContact CE2-CD2 3.6Å; F207-F230 HydrophobicContact CE2-CE2 4.2Å; F207-F230 AromaticContact CE2-CG 3.83Å; F207-F230 HydrophobicContact CE2-CG 3.83Å; F207-F230 HydrophobicContact CG-CD1 4.46Å; F207-F230 HydrophobicContact CG-CD2 4.12Å; F207-F230 HydrophobicContact CG-CE1 4.31Å; F207-F230 AromaticContact CG-CE2 3.95Å; F207-F230 HydrophobicContact CG-CE2 3.95Å; F207-F230 HydrophobicContact CG-CG 4.35Å; F207-F230 HydrophobicContact CG-CZ 4.03Å; F207-F230 HydrophobicContact CZ-CB 4.34Å; F207-I444 HydrophobicContact CD1-CD1 4.45Å; F207-I444 HydrophobicContact CE1-CD1 3.92Å
208	T	80.8	Confident	79	Confident	1 Å²	1	31 Å²	31	1%	0.006	14%	0.14	C	C	.	.	I	π-helix	trans	-75.4	-21.3	-179.2	47.6	0	0	0	0	113.5	L204 E205 I206 S215 P216 I444 L453 W455	L204-T208 HydrophobicContact CD1-CG2 4.11Å; L204-T208 HydrophobicContact CG-CG2 4.47Å; L204-T208 WeakPolarHBondContact O-CB 3.22Å; L204-T208 WeakPolarHBondContact O-CG2 3.28Å; L204-T208 PolarHBondContact O-N 2.82Å; L204-T208 PolarHBondContact O-OG1 3.48Å; E205-T208 WeakPolarHBondContact CA-OG1 3.34Å; E205-T208 PolarHBondContact O-N 2.71Å; E205-T208 PolarHBondContact O-OG1 2.74Å; I206-T208 PolarHBondContact O-N 3.09Å; T208-S215 WeakPolarHBondContact O-CA 3.4Å; T208-S215 WeakPolarHBondContact O-CB 3.4Å; T208-P216 WeakPolarHBondContact O-CD 3.33Å; T208-I444 HydrophobicContact CG2-CD1 4.07Å; T208-I444 HydrophobicContact CG2-CG1 4.11Å; T208-L453 HydrophobicContact CG2-CD2 4.28Å; T208-W455 HydrophobicContact CG2-CB 4.33Å; T208-W455 HydrophobicContact CG2-CD2 4.14Å; T208-W455 HydrophobicContact CG2-CE3 4.46Å; T208-W455 HydrophobicContact CG2-CG 4.13Å; T208-W455 WeakPolarHBondContact OG1-CZ3 3.42Å
209	T	85.5	Confident	79.9	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.012	13%	0.132	C	C	.	.	I	π-helix	trans	-78.7	-40	172.5	-60.4	0	0	0	0	112.7	E205 I206 F207 S215 P216 L217 A335 Y411	E205-T209 VanDerWaalsContact O-CB 3.24Å; E205-T209 WeakPolarHBondContact O-CB 3.11Å; E205-T209 PolarHBondContact O-N 2.77Å; E205-T209 PolarHBondContact O-OG1 3.36Å; I206-T209 PolarHBondContact O-N 2.97Å; F207-T209 VanDerWaalsContact C-N 3.34Å; T209-S215 WeakPolarHBondContact O-CB 3.48Å; T209-P216 HydrophobicContact CG2-CG 4.47Å; T209-P216 WeakPolarHBondContact O-CD 3.39Å; T209-L217 HydrophobicContact CG2-CB 4.29Å; T209-L217 HydrophobicContact CG2-CD1 4.05Å; T209-L217 HydrophobicContact CG2-CG 4.4Å; T209-L217 CarbonylContact O-C 3.59Å; T209-L217 WeakPolarHBondContact O-CA 3.31Å; T209-L217 PolarHBondContact O-N 3.3Å; T209-A335 HydrophobicContact CG2-CB 4.22Å; T209-Y411 WeakPolarHBondContact CG2-OH 3.23Å; T209-Y411 PolarHBondContact OG1-OH 2.96Å
210	F	87.6	Confident	80.2	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.147	C	C	.	.	I	π-helix	trans	-121.3	-31.6	-167.2	-65.6	-80.7	0	0	0	116.7	T174 L177 F178 V181 I206 L217 R218 L219	T174-F210 HydrophobicContact CG2-CD1 4.01Å; T174-F210 HydrophobicContact CG2-CE1 4.31Å; L177-F210 HydrophobicContact CB-CE1 4.28Å; L177-F210 HydrophobicContact CB-CZ 4.31Å; F178-F210 HydrophobicContact CB-CD1 3.9Å; F178-F210 HydrophobicContact CB-CE1 3.81Å; F178-F210 HydrophobicContact CB-CG 4.35Å; F178-F210 HydrophobicContact CB-CZ 4.19Å; F178-F210 HydrophobicContact CD2-CB 3.88Å; F178-F210 HydrophobicContact CD2-CD1 4.12Å; F178-F210 AromaticContact CD2-CD2 3.81Å; F178-F210 HydrophobicContact CD2-CD2 3.81Å; F178-F210 HydrophobicContact CD2-CE2 4.3Å; F178-F210 AromaticContact CD2-CG 3.7Å; F178-F210 HydrophobicContact CD2-CG 3.7Å; F178-F210 HydrophobicContact CE2-CB 4.41Å; V181-F210 HydrophobicContact CB-CE2 4.38Å; V181-F210 HydrophobicContact CG1-CE2 4.31Å; I206-F210 HydrophobicContact CG2-CD2 4.27Å; I206-F210 PolarHBondContact O-N 2.75Å; F210-L217 WeakPolarHBondContact CA-O 3.17Å; F210-L217 HydrophobicContact CD1-CB 3.82Å; F210-L217 WeakPolarHBondContact CD1-O 3.42Å; F210-L217 HydrophobicContact CE1-CB 3.89Å; F210-L217 HydrophobicContact CE1-CD1 3.93Å; F210-L217 HydrophobicContact CZ-CD1 4.21Å; F210-R218 WeakPolarHBondContact O-CA 3.41Å; F210-L219 HydrophobicContact CB-CD1 4.14Å; F210-L219 HydrophobicContact CB-CG 4.42Å; F210-L219 HydrophobicContact CD1-CG 4.5Å; F210-L219 PolarHBondContact O-N 2.83Å
211	L	82.9	Confident	80.3	Confident	13 Å²	13	28.3 Å²	28.3	7%	0.068	13%	0.133	C	C	.	.	I	π-helix	trans	-110.2	-22.5	-166.2	-55.2	-175.8	0	0	0	114.2	F207 L219 L227 F239 I242	F207-L211 HydrophobicContact CD2-CB 4.01Å; F207-L211 HydrophobicContact CD2-CD1 4.37Å; F207-L211 HydrophobicContact CE2-CB 4.5Å; F207-L211 HydrophobicContact CG-CB 4.49Å; F207-L211 CarbonylContact O-C 3.03Å; F207-L211 WeakPolarHBondContact O-CA 3.46Å; F207-L211 PolarHBondContact O-N 3.42Å; L211-L219 HydrophobicContact CD2-CB 4.45Å; L211-L219 HydrophobicContact CD2-CD1 3.93Å; L211-L227 WeakPolarHBondContact O-CD1 3.36Å; L211-F239 HydrophobicContact CD1-CD1 4.05Å; L211-F239 HydrophobicContact CD1-CE1 3.8Å; L211-I242 HydrophobicContact CD1-CD1 3.74Å; L211-I242 HydrophobicContact CD2-CD1 3.78Å; L211-I242 HydrophobicContact CG-CD1 4.44Å
212	H	76.7	Confident	79.7	Confident	36 Å²	36	36.3 Å²	36.3	17%	0.167	16%	0.164	C	C	.	.	S	Bend	trans	-71.9	147.2	178.2	-176.1	-104.5	0	0	0	111.8	F207 K214 S215	F207-H212 HydrophobicContact CD1-CB 4.29Å; F207-H212 HydrophobicContact CE1-CB 3.98Å; F207-H212 PolarHBondContact O-N 3.29Å; H212-K214 VanDerWaalsContact C-N 3.28Å; H212-K214 PolarHBondContact ND1-N 3.04Å; H212-K214 PolarHBondContact O-N 2.88Å; H212-S215 WeakPolarHBondContact O-CB 3.29Å; H212-S215 PolarHBondContact O-N 2.96Å; H212-S215 PolarHBondContact O-OG 3.46Å
213	E	72.6	Confident	78.7	Confident	138 Å²	138	38.8 Å²	38.8	65%	0.645	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-32.2	-176	-169.3	-175.4	-170.9	0	0	113.7	S324	E213-S324 PolarHBondContact O-OG 3.35Å
214	K	72.4	Confident	77	Confident	65 Å²	65	44.8 Å²	44.8	28%	0.283	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	22.9	172.6	-48	-176.9	-165.3	169.7	0	113.1	H212 D446 G451 L453	H212-K214 VanDerWaalsContact C-N 3.28Å; H212-K214 PolarHBondContact ND1-N 3.04Å; H212-K214 PolarHBondContact O-N 2.88Å; K214-D446 IonicContact NZ-OD1 2.73Å; K214-D446 PolarHBondContact NZ-OD1 3.07Å; K214-D446 IonicContact NZ-OD2 2.65Å; K214-G451 PolarHBondContact NZ-O 3.4Å; K214-L453 HydrophobicContact CD-CD1 4.39Å
215	S	79.9	Confident	75.7	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.229	C	C	.	.			trans	-77.9	149.5	-176.7	63.6	0	0	0	0	113	T208 T209 H212 R218	T208-S215 WeakPolarHBondContact O-CA 3.4Å; T208-S215 WeakPolarHBondContact O-CB 3.4Å; T209-S215 WeakPolarHBondContact O-CB 3.48Å; H212-S215 WeakPolarHBondContact O-CB 3.29Å; H212-S215 PolarHBondContact O-N 2.96Å; H212-S215 PolarHBondContact O-OG 3.46Å; S215-R218 VanDerWaalsContact OG-CA 3.28Å; S215-R218 WeakPolarHBondContact OG-CA 3.38Å; S215-R218 WeakPolarHBondContact OG-CB 3.44Å
216	P	83.2	Confident	74	Confident	9 Å²	9	48.7 Å²	48.7	6%	0.058	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-17.4	-176.7	31.3	-37	0	0	0	114.8	T208 T209 T323 V327 Q331 I332 A335	T208-P216 WeakPolarHBondContact O-CD 3.33Å; T209-P216 HydrophobicContact CG2-CG 4.47Å; T209-P216 WeakPolarHBondContact O-CD 3.39Å; P216-T323 WeakPolarHBondContact O-CG2 3.38Å; P216-V327 HydrophobicContact CB-CG1 3.92Å; P216-Q331 HydrophobicContact CB-CB 4.46Å; P216-I332 HydrophobicContact CB-CG1 4.33Å; P216-A335 HydrophobicContact CB-CB 4.07Å; P216-A335 HydrophobicContact CG-CB 3.78Å
217	L	86.5	Confident	72.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.9	56.4	175.9	-63.8	178.5	0	0	0	109.1	T174 L177 T209 F210 L219 P321 A335 I336	T174-L217 HydrophobicContact CG2-CB 4.05Å; T174-L217 WeakPolarHBondContact CG2-O 3.47Å; L177-L217 HydrophobicContact CD1-CD1 4.25Å; T209-L217 HydrophobicContact CG2-CB 4.29Å; T209-L217 HydrophobicContact CG2-CD1 4.05Å; T209-L217 HydrophobicContact CG2-CG 4.4Å; T209-L217 CarbonylContact O-C 3.59Å; T209-L217 WeakPolarHBondContact O-CA 3.31Å; T209-L217 PolarHBondContact O-N 3.3Å; F210-L217 WeakPolarHBondContact CA-O 3.17Å; F210-L217 HydrophobicContact CD1-CB 3.82Å; F210-L217 WeakPolarHBondContact CD1-O 3.42Å; F210-L217 HydrophobicContact CE1-CB 3.89Å; F210-L217 HydrophobicContact CE1-CD1 3.93Å; F210-L217 HydrophobicContact CZ-CD1 4.21Å; L217-L219 PolarHBondContact O-N 3.26Å; L217-P321 HydrophobicContact CD2-CB 3.8Å; L217-P321 HydrophobicContact CD2-CG 3.43Å; L217-P321 VanDerWaalsContact CD2-CG 3.43Å; L217-A335 HydrophobicContact CD1-CB 3.87Å; L217-A335 HydrophobicContact CG-CB 3.98Å; L217-I336 HydrophobicContact CD1-CG1 4.29Å; L217-I336 HydrophobicContact CD2-CD1 4.25Å; L217-I336 HydrophobicContact CD2-CG1 3.78Å
218	R	85.3	Confident	70.4	Confident	74 Å²	74	61.9 Å²	61.9	28%	0.279	31%	0.309	S	S	.	.			trans	-59.3	119.4	-174.4	176.4	-179.7	160.1	157.2	-6	111.9	F210 S215 D220	F210-R218 WeakPolarHBondContact O-CA 3.41Å; S215-R218 VanDerWaalsContact OG-CA 3.28Å; S215-R218 WeakPolarHBondContact OG-CA 3.38Å; S215-R218 WeakPolarHBondContact OG-CB 3.44Å; R218-D220 IonicContact CZ-OD1 3.89Å; R218-D220 IonicContact NE-OD1 3.27Å; R218-D220 PolarHBondContact NE-OD1 3.43Å; R218-D220 IonicContact NH2-OD1 2.64Å; R218-D220 PolarHBondContact NH2-OD1 2.9Å
219	L	85.3	Confident	68.9	Low	10 Å²	10	66.4 Å²	66.4	5%	0.052	34%	0.34	C	S	.	.			trans	-77.6	129.7	161.8	-72.1	169.7	0	0	0	109.9	T174 W175 F178 F210 L211 L217 V221 I242	T174-L219 HydrophobicContact CG2-CD2 3.71Å; T174-L219 HydrophobicContact CG2-CG 3.92Å; W175-L219 HydrophobicContact CD2-CD2 3.69Å; W175-L219 HydrophobicContact CE3-CD2 3.52Å; W175-L219 HydrophobicContact CG-CD2 4.2Å; W175-L219 HydrophobicContact CH2-CD2 4.35Å; W175-L219 HydrophobicContact CZ2-CD2 4.48Å; W175-L219 HydrophobicContact CZ3-CD2 3.89Å; F178-L219 HydrophobicContact CB-CD1 3.89Å; F178-L219 HydrophobicContact CD1-CD1 4Å; F178-L219 HydrophobicContact CD2-CD1 3.64Å; F178-L219 HydrophobicContact CE1-CD1 4.47Å; F178-L219 HydrophobicContact CE2-CD1 4.14Å; F178-L219 HydrophobicContact CG-CD1 3.56Å; F210-L219 HydrophobicContact CB-CD1 4.14Å; F210-L219 HydrophobicContact CB-CG 4.42Å; F210-L219 HydrophobicContact CD1-CG 4.5Å; F210-L219 PolarHBondContact O-N 2.83Å; L211-L219 HydrophobicContact CD2-CB 4.45Å; L211-L219 HydrophobicContact CD2-CD1 3.93Å; L217-L219 PolarHBondContact O-N 3.26Å; L219-V221 HydrophobicContact CB-CG2 3.9Å; L219-V221 PolarHBondContact O-N 2.95Å; L219-I242 HydrophobicContact CD1-CG2 3.96Å
220	D	77.6	Confident	67.5	Low	102 Å²	102	67.8 Å²	67.8	55%	0.545	35%	0.346	S	S	.	.			trans	-94.3	79	173.5	-149.9	54.5	0	0	0	110	R218	R218-D220 IonicContact CZ-OD1 3.89Å; R218-D220 IonicContact NE-OD1 3.27Å; R218-D220 PolarHBondContact NE-OD1 3.43Å; R218-D220 IonicContact NH2-OD1 2.64Å; R218-D220 PolarHBondContact NH2-OD1 2.9Å
221	V	72.1	Confident	66.3	Low	35 Å²	35	71.7 Å²	71.7	21%	0.212	37%	0.367	C	S	.	.			trans	-79.7	120.5	-177.1	-176.2	0	0	0	0	109.5	L219 T223 I242	L219-V221 HydrophobicContact CB-CG2 3.9Å; L219-V221 PolarHBondContact O-N 2.95Å; V221-T223 PolarHBondContact O-N 2.71Å; V221-I242 HydrophobicContact CG2-CG2 4.04Å
222	R	61.5	Low	65.4	Low	221 Å²	221	74.2 Å²	74.2	83%	0.834	38%	0.377	S	S	*	.	S	Bend	trans	-63.7	-21.2	-178	-70.1	-170.8	179.2	114.5	-0.3	114.3	P224	R222-P224 WeakPolarHBondContact O-CD 3.41Å
223	T	54.3	Low	64.7	Low	53 Å²	53	78.4 Å²	78.4	33%	0.325	40%	0.401	S	S	.	.	S	Bend	trans	-78.3	119.5	178.6	-44.5	0	0	0	0	110.1	V221 I225 F241 Q245	V221-T223 PolarHBondContact O-N 2.71Å; T223-I225 HydrophobicContact CG2-CD1 4.43Å; T223-I225 HydrophobicContact CG2-CG1 3.71Å; T223-I225 PolarHBondContact O-N 3.03Å; T223-F241 HydrophobicContact CG2-CE1 4.15Å; T223-F241 HydrophobicContact CG2-CZ 4.43Å; T223-Q245 PolarHBondContact OG1-NE2 3.12Å
224	P	47.7	Very low	64.5	Low	126 Å²	126	75.7 Å²	75.7	82%	0.818	39%	0.388	S	S	*	.			trans	-76.8	61.7	174.8	34.1	-36.3	0	0	0	110.7	R222 A226	R222-P224 WeakPolarHBondContact O-CD 3.41Å; P224-A226 PolarHBondContact O-N 3.49Å
225	I	48.5	Very low	64.6	Low	59 Å²	59	72.6 Å²	72.6	30%	0.303	38%	0.375	S	S	.	.			trans	-58.6	128.8	167.7	-54.3	-179.6	0	0	0	106.5	T223 L227 L238 F241	T223-I225 HydrophobicContact CG2-CD1 4.43Å; T223-I225 HydrophobicContact CG2-CG1 3.71Å; T223-I225 PolarHBondContact O-N 3.03Å; I225-L227 PolarHBondContact O-N 2.83Å; I225-L238 HydrophobicContact CD1-CD1 3.42Å; I225-L238 VanDerWaalsContact CD1-CD1 3.42Å; I225-L238 HydrophobicContact CG2-CD1 3.99Å; I225-F241 HydrophobicContact CD1-CD1 3.94Å; I225-F241 HydrophobicContact CD1-CE1 3.98Å
226	A	43	Very low	64.5	Low	66 Å²	66	74.5 Å²	74.5	55%	0.545	39%	0.388	S	S	.	.			trans	-74.8	74	-173.1	0	0	0	0	0	111.8	P224 K228 S229	P224-A226 PolarHBondContact O-N 3.49Å; A226-K228 PolarHBondContact O-N 2.96Å; A226-S229 PolarHBondContact O-N 2.81Å
227	L	51.3	Low	64.3	Low	73 Å²	73	80.5 Å²	80.5	38%	0.382	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-57.2	-7	-179.7	-60.5	168.3	0	0	0	114	F207 L211 I225 S229	F207-L227 HydrophobicContact CE2-CB 4.41Å; F207-L227 HydrophobicContact CE2-CD2 3.83Å; L211-L227 WeakPolarHBondContact O-CD1 3.36Å; I225-L227 PolarHBondContact O-N 2.83Å; L227-S229 PolarHBondContact O-N 2.92Å
228	K	44.3	Very low	64.1	Low	217 Å²	217	81.9 Å²	81.9	94%	0.943	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-56.7	-22.1	165.1	-67.9	-177.4	177.1	177.6	0	113.3	A226	A226-K228 PolarHBondContact O-N 2.96Å
229	S	47.8	Very low	64.1	Low	95 Å²	95	78.3 Å²	78.3	66%	0.664	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-136.8	78.1	172.9	57.8	0	0	0	0	111.4	A226 L227 D231	A226-S229 PolarHBondContact O-N 2.81Å; L227-S229 PolarHBondContact O-N 2.92Å; S229-D231 PolarHBondContact O-N 2.86Å; S229-D231 VanDerWaalsContact O-N 3.08Å
230	F	57.2	Low	64.1	Low	31 Å²	31	80.7 Å²	80.7	14%	0.136	42%	0.42	C	S	.	.			trans	-69.7	95.7	168.3	-178.5	-107.4	0	0	0	109.8	C203 F207 F232 C235 L238 F239	C203-F230 HydrophobicContact CB-CE1 4.41Å; C203-F230 HydrophobicContact CB-CZ 4.23Å; F207-F230 HydrophobicContact CB-CE1 4.14Å; F207-F230 HydrophobicContact CB-CE2 3.9Å; F207-F230 HydrophobicContact CB-CZ 3.64Å; F207-F230 HydrophobicContact CD2-CB 4.36Å; F207-F230 HydrophobicContact CD2-CD1 4.3Å; F207-F230 AromaticContact CD2-CD2 3.28Å; F207-F230 HydrophobicContact CD2-CD2 3.28Å; F207-F230 HydrophobicContact CD2-CE1 4.38Å; F207-F230 AromaticContact CD2-CE2 3.39Å; F207-F230 HydrophobicContact CD2-CE2 3.39Å; F207-F230 AromaticContact CD2-CG 3.76Å; F207-F230 HydrophobicContact CD2-CG 3.76Å; F207-F230 AromaticContact CD2-CZ 3.95Å; F207-F230 HydrophobicContact CD2-CZ 3.95Å; F207-F230 HydrophobicContact CE2-CB 3.91Å; F207-F230 AromaticContact CE2-CD2 3.6Å; F207-F230 HydrophobicContact CE2-CD2 3.6Å; F207-F230 HydrophobicContact CE2-CE2 4.2Å; F207-F230 AromaticContact CE2-CG 3.83Å; F207-F230 HydrophobicContact CE2-CG 3.83Å; F207-F230 HydrophobicContact CG-CD1 4.46Å; F207-F230 HydrophobicContact CG-CD2 4.12Å; F207-F230 HydrophobicContact CG-CE1 4.31Å; F207-F230 AromaticContact CG-CE2 3.95Å; F207-F230 HydrophobicContact CG-CE2 3.95Å; F207-F230 HydrophobicContact CG-CG 4.35Å; F207-F230 HydrophobicContact CG-CZ 4.03Å; F207-F230 HydrophobicContact CZ-CB 4.34Å; F230-F232 HydrophobicContact CD1-CD1 4.42Å; F230-F232 HydrophobicContact CD1-CE1 4.15Å; F230-F232 HydrophobicContact CD1-CZ 4.2Å; F230-F232 HydrophobicContact CE1-CD1 4.02Å; F230-F232 AromaticContact CE1-CE1 3.8Å; F230-F232 HydrophobicContact CE1-CE1 3.8Å; F230-F232 HydrophobicContact CE1-CZ 4.28Å; F230-F232 PolarHBondContact O-N 3.21Å; F230-C235 VanDerWaalsContact CE1-SG 3.53Å; F230-C235 HydrophobicContact CZ-CB 4.25Å; F230-C235 WeakPolarHBondContact CZ-SG 3.11Å; F230-L238 HydrophobicContact CD2-CD2 3.85Å; F230-L238 HydrophobicContact CE2-CD2 3.83Å; F230-F239 HydrophobicContact CE2-CE1 4.13Å; F230-F239 HydrophobicContact CE2-CZ 4.33Å; F230-F239 HydrophobicContact CZ-CE1 4.34Å; F230-F239 HydrophobicContact CZ-CZ 4.08Å
231	D	62.6	Low	64.4	Low	82 Å²	82	80 Å²	80	44%	0.439	41%	0.412	S	S	.	.			trans	-76.4	118.2	172.8	-169.6	-7.9	0	0	0	110.3	S229 N233 E234 C235	S229-D231 PolarHBondContact O-N 2.86Å; S229-D231 VanDerWaalsContact O-N 3.08Å; D231-N233 PolarHBondContact O-N 3.09Å; D231-N233 VanDerWaalsContact O-N 3.13Å; D231-N233 VanDerWaalsContact OD1-CG 3.3Å; D231-N233 PolarHBondContact OD1-N 2.91Å; D231-N233 PolarHBondContact OD1-ND2 3.36Å; D231-N233 PolarHBondContact OD2-ND2 2.96Å; D231-E234 PolarHBondContact O-N 2.87Å; D231-E234 VanDerWaalsContact O-N 3.11Å; D231-C235 PolarHBondContact O-SG 3.43Å
232	F	63.6	Low	65	Low	66 Å²	66	78.6 Å²	78.6	29%	0.289	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-22.9	174.9	-73	-78.5	0	0	0	114.2	K200 C203 L204 F230 E234 C235	K200-F232 HydrophobicContact CB-CD1 3.71Å; K200-F232 HydrophobicContact CB-CE1 4.08Å; K200-F232 HydrophobicContact CB-CG 4.34Å; K200-F232 HydrophobicContact CD-CB 3.96Å; K200-F232 HydrophobicContact CD-CD1 4.33Å; K200-F232 HydrophobicContact CD-CG 4.09Å; K200-F232 HydrophobicContact CG-CB 4.07Å; K200-F232 HydrophobicContact CG-CD1 3.95Å; K200-F232 HydrophobicContact CG-CG 4.17Å; K200-F232 WeakPolarHBondContact O-CE1 3.33Å; C203-F232 HydrophobicContact CB-CD1 4.47Å; L204-F232 HydrophobicContact CB-CE1 4.29Å; F230-F232 HydrophobicContact CD1-CD1 4.42Å; F230-F232 HydrophobicContact CD1-CE1 4.15Å; F230-F232 HydrophobicContact CD1-CZ 4.2Å; F230-F232 HydrophobicContact CE1-CD1 4.02Å; F230-F232 AromaticContact CE1-CE1 3.8Å; F230-F232 HydrophobicContact CE1-CE1 3.8Å; F230-F232 HydrophobicContact CE1-CZ 4.28Å; F230-F232 PolarHBondContact O-N 3.21Å; F232-E234 VanDerWaalsContact C-N 3.34Å; F232-C235 VanDerWaalsContact CA-SG 3.51Å
233	N	61.5	Low	66.2	Low	124 Å²	124	68.4 Å²	68.4	66%	0.663	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-16	179.9	-51.6	-49.6	0	0	0	113.2	D231	D231-N233 PolarHBondContact O-N 3.09Å; D231-N233 VanDerWaalsContact O-N 3.13Å; D231-N233 VanDerWaalsContact OD1-CG 3.3Å; D231-N233 PolarHBondContact OD1-N 2.91Å; D231-N233 PolarHBondContact OD1-ND2 3.36Å; D231-N233 PolarHBondContact OD2-ND2 2.96Å
234	E	69.7	Low	67.5	Low	81 Å²	81	72.1 Å²	72.1	38%	0.379	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	1.3	-175.9	-59.9	-129	114.3	0	0	113.7	D231 F232 S236 K237 L238	D231-E234 PolarHBondContact O-N 2.87Å; D231-E234 VanDerWaalsContact O-N 3.11Å; F232-E234 VanDerWaalsContact C-N 3.34Å; E234-S236 VanDerWaalsContact C-N 3.31Å; E234-S236 PolarHBondContact O-N 2.87Å; E234-K237 WeakPolarHBondContact O-CB 3.23Å; E234-K237 PolarHBondContact O-N 2.68Å; E234-K237 WeakPolarHBondContact OE1-CD 3.32Å; E234-K237 WeakPolarHBondContact OE1-CE 3.16Å; E234-K237 IonicContact OE1-NZ 3.28Å; E234-K237 PolarHBondContact OE1-NZ 3.42Å; E234-L238 PolarHBondContact O-N 3.38Å
235	C	74.4	Confident	69.2	Low	1 Å²	1	68.5 Å²	68.5	1%	0.007	35%	0.351	C	S	.	.	H	α-helix	trans	-51.9	-42.7	-175.6	-61.7	0	0	0	0	114.1	C203 F230 D231 F232 K237 L238 F239	C203-C235 HydrophobicContact CB-CB 3.94Å; C203-C235 WeakPolarHBondContact SG-CB 3.48Å; F230-C235 VanDerWaalsContact CE1-SG 3.53Å; F230-C235 HydrophobicContact CZ-CB 4.25Å; F230-C235 WeakPolarHBondContact CZ-SG 3.11Å; D231-C235 PolarHBondContact O-SG 3.43Å; F232-C235 VanDerWaalsContact CA-SG 3.51Å; C235-K237 VanDerWaalsContact C-N 3.35Å; C235-K237 PolarHBondContact O-N 2.84Å; C235-L238 PolarHBondContact O-N 3.29Å; C235-F239 HydrophobicContact CB-CE2 4.01Å; C235-F239 HydrophobicContact CB-CZ 4.11Å; C235-F239 WeakPolarHBondContact O-CB 3.35Å; C235-F239 WeakPolarHBondContact O-CD2 3.23Å; C235-F239 WeakPolarHBondContact O-CG 3.43Å; C235-F239 PolarHBondContact O-N 3.48Å
236	S	76.3	Confident	70.9	Confident	39 Å²	39	65.7 Å²	65.7	27%	0.273	34%	0.337	S	S	.	.	H	α-helix	trans	-63.3	-38.7	178.5	174	0	0	0	0	112.3	Q186 E234 N240	Q186-S236 VanDerWaalsContact CD-OG 3.31Å; Q186-S236 PolarHBondContact NE2-O 3.39Å; Q186-S236 PolarHBondContact NE2-OG 2.96Å; Q186-S236 PolarHBondContact OE1-OG 2.78Å; E234-S236 VanDerWaalsContact C-N 3.31Å; E234-S236 PolarHBondContact O-N 2.87Å; S236-N240 WeakPolarHBondContact O-CB 3.33Å; S236-N240 PolarHBondContact O-N 2.91Å; S236-N240 VanDerWaalsContact O-N 3.11Å; S236-N240 PolarHBondContact O-ND2 3.12Å
237	K	79.7	Confident	73	Confident	136 Å²	136	64.8 Å²	64.8	59%	0.591	32%	0.323	S	S	*	.	H	α-helix	trans	-65.2	-47.6	173.8	-57.6	179.7	-176.6	176.3	0	110.8	E234 C235 N240 F241	E234-K237 WeakPolarHBondContact O-CB 3.23Å; E234-K237 PolarHBondContact O-N 2.68Å; E234-K237 WeakPolarHBondContact OE1-CD 3.32Å; E234-K237 WeakPolarHBondContact OE1-CE 3.16Å; E234-K237 IonicContact OE1-NZ 3.28Å; E234-K237 PolarHBondContact OE1-NZ 3.42Å; C235-K237 VanDerWaalsContact C-N 3.35Å; C235-K237 PolarHBondContact O-N 2.84Å; K237-N240 PolarHBondContact O-N 2.84Å; K237-F241 WeakPolarHBondContact O-CB 3.36Å; K237-F241 PolarHBondContact O-N 2.8Å
238	L	81.9	Confident	74.6	Confident	28 Å²	28	66.2 Å²	66.2	15%	0.147	33%	0.33	C	S	.	.	H	α-helix	trans	-59.1	-47.7	179.8	174	60.2	0	0	0	111.7	I225 F230 E234 C235 F241 I242	I225-L238 HydrophobicContact CD1-CD1 3.42Å; I225-L238 VanDerWaalsContact CD1-CD1 3.42Å; I225-L238 HydrophobicContact CG2-CD1 3.99Å; F230-L238 HydrophobicContact CD2-CD2 3.85Å; F230-L238 HydrophobicContact CE2-CD2 3.83Å; E234-L238 PolarHBondContact O-N 3.38Å; C235-L238 PolarHBondContact O-N 3.29Å; L238-F241 PolarHBondContact O-N 2.98Å; L238-I242 HydrophobicContact CD1-CD1 3.79Å; L238-I242 HydrophobicContact CD1-CG1 4.41Å; L238-I242 HydrophobicContact CG-CD1 4.08Å; L238-I242 VanDerWaalsContact O-CG1 3.31Å; L238-I242 WeakPolarHBondContact O-CG1 3.3Å; L238-I242 PolarHBondContact O-N 3.49Å
239	F	86.7	Confident	76.6	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.9	-42.9	178.7	-60.4	-23.2	0	0	0	111.3	F178 N182 F185 C203 I206 L211 F230 C235 F241 I242 D243	F178-F239 HydrophobicContact CZ-CB 4.15Å; F178-F239 HydrophobicContact CZ-CD1 4.39Å; N182-F239 WeakPolarHBondContact OD1-CB 3.3Å; F185-F239 HydrophobicContact CD1-CD2 4.25Å; F185-F239 HydrophobicContact CE1-CD2 4.13Å; F185-F239 HydrophobicContact CE1-CE2 4.44Å; F185-F239 HydrophobicContact CZ-CE2 4.45Å; C203-F239 HydrophobicContact CB-CE2 4.33Å; C203-F239 HydrophobicContact CB-CZ 4.33Å; I206-F239 HydrophobicContact CB-CE1 4.47Å; I206-F239 HydrophobicContact CB-CE2 4.02Å; I206-F239 HydrophobicContact CB-CZ 3.82Å; I206-F239 HydrophobicContact CD1-CD2 4.4Å; I206-F239 HydrophobicContact CD1-CE2 3.97Å; I206-F239 HydrophobicContact CG2-CD1 4.26Å; I206-F239 HydrophobicContact CG2-CD2 4.27Å; I206-F239 HydrophobicContact CG2-CE1 3.87Å; I206-F239 HydrophobicContact CG2-CE2 3.88Å; I206-F239 HydrophobicContact CG2-CG 4.46Å; I206-F239 HydrophobicContact CG2-CZ 3.66Å; L211-F239 HydrophobicContact CD1-CD1 4.05Å; L211-F239 HydrophobicContact CD1-CE1 3.8Å; F230-F239 HydrophobicContact CE2-CE1 4.13Å; F230-F239 HydrophobicContact CE2-CZ 4.33Å; F230-F239 HydrophobicContact CZ-CE1 4.34Å; F230-F239 HydrophobicContact CZ-CZ 4.08Å; C235-F239 HydrophobicContact CB-CE2 4.01Å; C235-F239 HydrophobicContact CB-CZ 4.11Å; C235-F239 WeakPolarHBondContact O-CB 3.35Å; C235-F239 WeakPolarHBondContact O-CD2 3.23Å; C235-F239 WeakPolarHBondContact O-CG 3.43Å; C235-F239 PolarHBondContact O-N 3.48Å; F239-F241 PolarHBondContact O-N 3.33Å; F239-I242 PolarHBondContact O-N 2.96Å; F239-D243 WeakPolarHBondContact O-CB 3.27Å; F239-D243 PolarHBondContact O-N 3.1Å
240	N	84.3	Confident	78.6	Confident	59 Å²	59	54.1 Å²	54.1	32%	0.316	27%	0.267	S	S	.	.	H	α-helix	trans	-65.5	-35.9	177	-70.7	-19.2	0	0	0	113.4	N182 Q186 S236 K237 D243 Q244	N182-N240 PolarHBondContact ND2-OD1 3.09Å; Q186-N240 VanDerWaalsContact NE2-CG 3.3Å; Q186-N240 PolarHBondContact NE2-ND2 2.83Å; Q186-N240 VanDerWaalsContact NE2-ND2 3.18Å; Q186-N240 PolarHBondContact NE2-OD1 2.96Å; S236-N240 WeakPolarHBondContact O-CB 3.33Å; S236-N240 PolarHBondContact O-N 2.91Å; S236-N240 VanDerWaalsContact O-N 3.11Å; S236-N240 PolarHBondContact O-ND2 3.12Å; K237-N240 PolarHBondContact O-N 2.84Å; N240-D243 WeakPolarHBondContact O-CB 3.38Å; N240-D243 PolarHBondContact O-N 2.9Å; N240-Q244 PolarHBondContact O-N 3.24Å; N240-Q244 VanDerWaalsContact O-N 3.1Å
241	F	83	Confident	80.3	Confident	89 Å²	89	56.7 Å²	56.7	39%	0.39	28%	0.279	S	S	.	.	H	α-helix	trans	-64.8	-40.3	173.3	175.3	-100.1	0	0	0	111.9	T223 I225 K237 L238 F239	T223-F241 HydrophobicContact CG2-CE1 4.15Å; T223-F241 HydrophobicContact CG2-CZ 4.43Å; I225-F241 HydrophobicContact CD1-CD1 3.94Å; I225-F241 HydrophobicContact CD1-CE1 3.98Å; K237-F241 WeakPolarHBondContact O-CB 3.36Å; K237-F241 PolarHBondContact O-N 2.8Å; L238-F241 PolarHBondContact O-N 2.98Å; F239-F241 PolarHBondContact O-N 3.33Å
242	I	85.4	Confident	81.6	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-69.1	-36.8	174.3	-65.6	167	0	0	0	110.5	F178 L211 L219 V221 L238 F239 Q244 Q245 C246	F178-I242 HydrophobicContact CD1-CG2 4.35Å; F178-I242 HydrophobicContact CE1-CB 4.12Å; F178-I242 HydrophobicContact CE1-CG2 3.69Å; F178-I242 HydrophobicContact CZ-CB 4.15Å; F178-I242 HydrophobicContact CZ-CG2 3.87Å; L211-I242 HydrophobicContact CD1-CD1 3.74Å; L211-I242 HydrophobicContact CD2-CD1 3.78Å; L211-I242 HydrophobicContact CG-CD1 4.44Å; L219-I242 HydrophobicContact CD1-CG2 3.96Å; V221-I242 HydrophobicContact CG2-CG2 4.04Å; L238-I242 HydrophobicContact CD1-CD1 3.79Å; L238-I242 HydrophobicContact CD1-CG1 4.41Å; L238-I242 HydrophobicContact CG-CD1 4.08Å; L238-I242 VanDerWaalsContact O-CG1 3.31Å; L238-I242 WeakPolarHBondContact O-CG1 3.3Å; L238-I242 PolarHBondContact O-N 3.49Å; F239-I242 PolarHBondContact O-N 2.96Å; I242-Q244 VanDerWaalsContact C-N 3.35Å; I242-Q244 PolarHBondContact O-N 3.34Å; I242-Q245 CarbonylContact O-C 3.56Å; I242-Q245 WeakPolarHBondContact O-CA 3.33Å; I242-Q245 WeakPolarHBondContact O-CB 3.26Å; I242-Q245 PolarHBondContact O-N 2.89Å; I242-C246 PolarHBondContact O-N 3.32Å; I242-C246 PolarHBondContact O-SG 2.84Å
243	D	86.8	Confident	82.8	Confident	8 Å²	8	55.8 Å²	55.8	4%	0.043	28%	0.276	C	S	.	.	H	α-helix	trans	-62.5	-39.4	179.5	-157.5	20	0	0	0	112.2	F178 H179 N182 Q183 F239 N240 Q245 C246 L247	F178-D243 HydrophobicContact CE1-CB 4.27Å; H179-D243 WeakPolarHBondContact CA-OD1 3.27Å; H179-D243 IonicContact CE1-OD1 2.74Å; H179-D243 IonicContact CE1-OD2 3.47Å; H179-D243 IonicContact CG-OD1 3.49Å; H179-D243 IonicContact ND1-OD1 3.4Å; H179-D243 PolarHBondContact ND1-OD1 2.9Å; H179-D243 IonicContact ND1-OD2 3.56Å; H179-D243 PolarHBondContact ND1-OD2 3.42Å; N182-D243 PolarHBondContact ND2-OD2 3.38Å; Q183-D243 PolarHBondContact NE2-OD2 3.41Å; F239-D243 WeakPolarHBondContact O-CB 3.27Å; F239-D243 PolarHBondContact O-N 3.1Å; N240-D243 WeakPolarHBondContact O-CB 3.38Å; N240-D243 PolarHBondContact O-N 2.9Å; D243-Q245 VanDerWaalsContact C-N 3.29Å; D243-Q245 PolarHBondContact O-N 2.93Å; D243-C246 WeakPolarHBondContact O-CB 3.38Å; D243-C246 PolarHBondContact O-N 3.4Å; D243-L247 PolarHBondContact O-N 2.94Å
244	Q	82.6	Confident	84.2	Confident	131 Å²	131	50 Å²	50	61%	0.612	24%	0.244	S	C	*	.	H	α-helix	trans	-60	-36.3	171.1	-72.7	178.6	-14.9	0	0	112.8	N240 I242	N240-Q244 PolarHBondContact O-N 3.24Å; N240-Q244 VanDerWaalsContact O-N 3.1Å; I242-Q244 VanDerWaalsContact C-N 3.35Å; I242-Q244 PolarHBondContact O-N 3.34Å
245	Q	81.8	Confident	85.2	Confident	49 Å²	49	48.9 Å²	48.9	23%	0.229	25%	0.246	C	C	.	.	H	α-helix	trans	-74.1	-31	173	-58.6	-171.8	28.8	0	0	112.2	T223 I242 D243	T223-Q245 PolarHBondContact OG1-NE2 3.12Å; I242-Q245 CarbonylContact O-C 3.56Å; I242-Q245 WeakPolarHBondContact O-CA 3.33Å; I242-Q245 WeakPolarHBondContact O-CB 3.26Å; I242-Q245 PolarHBondContact O-N 2.89Å; D243-Q245 VanDerWaalsContact C-N 3.29Å; D243-Q245 PolarHBondContact O-N 2.93Å
246	C	85.1	Confident	85.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.4	-41.4	177.3	-64.3	0	0	0	0	111.9	W175 F178 I242 D243 N248 Q249 I250	W175-C246 HydrophobicContact CE3-CB 4.11Å; F178-C246 VanDerWaalsContact CD1-SG 3.57Å; I242-C246 PolarHBondContact O-N 3.32Å; I242-C246 PolarHBondContact O-SG 2.84Å; D243-C246 WeakPolarHBondContact O-CB 3.38Å; D243-C246 PolarHBondContact O-N 3.4Å; C246-N248 VanDerWaalsContact C-N 3.33Å; C246-N248 PolarHBondContact O-N 3.02Å; C246-Q249 PolarHBondContact O-N 2.74Å; C246-I250 HydrophobicContact CB-CD1 4.43Å; C246-I250 VanDerWaalsContact O-CG1 3.31Å; C246-I250 WeakPolarHBondContact O-CG1 3.47Å; C246-I250 PolarHBondContact O-N 2.74Å
247	L	86.9	Confident	86.4	Confident	48 Å²	48	50.4 Å²	50.4	25%	0.251	25%	0.248	S	C	.	.	H	α-helix	trans	-54	-47.2	177.6	-73.9	171.4	0	0	0	112	L153 D243 Q249 I250 E251	L153-L247 HydrophobicContact CD1-CD2 4.15Å; D243-L247 PolarHBondContact O-N 2.94Å; L247-Q249 VanDerWaalsContact C-N 3.27Å; L247-Q249 PolarHBondContact O-N 3.08Å; L247-I250 PolarHBondContact O-N 3.28Å; L247-I250 VanDerWaalsContact O-N 3.11Å; L247-E251 WeakPolarHBondContact O-CB 3.23Å; L247-E251 PolarHBondContact O-N 3.25Å
248	N	85.7	Confident	86.7	Confident	102 Å²	102	44.2 Å²	44.2	55%	0.545	22%	0.222	S	C	.	.	H	α-helix	trans	-61.3	-32	177.5	-60.9	-10.5	0	0	0	113.1	C246 L252	C246-N248 VanDerWaalsContact C-N 3.33Å; C246-N248 PolarHBondContact O-N 3.02Å; N248-L252 PolarHBondContact O-N 2.85Å
249	Q	86	Confident	86.9	Confident	57 Å²	57	48.2 Å²	48.2	27%	0.266	24%	0.24	S	C	.	.	H	α-helix	trans	-77.9	-35.5	174.9	-66.5	-53.5	-62.3	0	0	112.3	W175 C246 L247 Q253	W175-Q249 HydrophobicContact CD2-CB 3.79Å; W175-Q249 HydrophobicContact CD2-CG 3.98Å; W175-Q249 HydrophobicContact CE3-CB 3.92Å; W175-Q249 HydrophobicContact CE3-CG 3.86Å; W175-Q249 HydrophobicContact CG-CB 4.07Å; W175-Q249 HydrophobicContact CH2-CG 4.01Å; W175-Q249 HydrophobicContact CZ2-CG 4.11Å; W175-Q249 HydrophobicContact CZ3-CB 4.44Å; W175-Q249 HydrophobicContact CZ3-CG 3.88Å; C246-Q249 PolarHBondContact O-N 2.74Å; L247-Q249 VanDerWaalsContact C-N 3.27Å; L247-Q249 PolarHBondContact O-N 3.08Å; Q249-Q253 WeakPolarHBondContact O-CG 3.49Å; Q249-Q253 PolarHBondContact O-N 3.16Å
250	I	90.4	Very high	86.7	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-68.1	-43.4	175.9	-64.9	162.2	0	0	0	110	A149 L153 F162 W175 H179 C246 L247 L252 Q253 V254	A149-I250 HydrophobicContact CB-CB 4.49Å; A149-I250 HydrophobicContact CB-CG2 3.93Å; L153-I250 HydrophobicContact CD1-CD1 4.29Å; L153-I250 HydrophobicContact CD1-CG2 4.18Å; F162-I250 HydrophobicContact CE1-CG2 3.71Å; F162-I250 HydrophobicContact CZ-CG2 3.89Å; W175-I250 HydrophobicContact CB-CG1 4.02Å; H179-I250 HydrophobicContact CB-CD1 3.87Å; C246-I250 HydrophobicContact CB-CD1 4.43Å; C246-I250 VanDerWaalsContact O-CG1 3.31Å; C246-I250 WeakPolarHBondContact O-CG1 3.47Å; C246-I250 PolarHBondContact O-N 2.74Å; L247-I250 PolarHBondContact O-N 3.28Å; L247-I250 VanDerWaalsContact O-N 3.11Å; I250-L252 PolarHBondContact O-N 3.1Å; I250-Q253 CarbonylContact O-C 3.37Å; I250-Q253 WeakPolarHBondContact O-CA 3.3Å; I250-Q253 WeakPolarHBondContact O-CB 3.24Å; I250-Q253 PolarHBondContact O-N 2.82Å; I250-V254 HydrophobicContact CG2-CG2 4.06Å; I250-V254 WeakPolarHBondContact O-CG2 3.4Å; I250-V254 PolarHBondContact O-N 3Å
251	E	91.5	Very high	86.6	Confident	86 Å²	86	45.8 Å²	45.8	40%	0.402	23%	0.228	S	C	.	.	H	α-helix	trans	-55.6	-48.5	175.7	-170.3	162.9	-119.3	0	0	111.4	A149 L247 Q253 V254 S255	A149-E251 HydrophobicContact CB-CB 4.15Å; L247-E251 WeakPolarHBondContact O-CB 3.23Å; L247-E251 PolarHBondContact O-N 3.25Å; E251-Q253 PolarHBondContact O-N 2.86Å; E251-Q253 VanDerWaalsContact O-N 3.07Å; E251-V254 PolarHBondContact O-N 3.24Å; E251-S255 PolarHBondContact O-N 3.21Å; E251-S255 PolarHBondContact O-OG 3.42Å; E251-S255 VanDerWaalsContact O-OG 3.07Å
252	L	89.7	Confident	86.5	Confident	84 Å²	84	45.9 Å²	45.9	44%	0.44	23%	0.232	S	C	.	.	H	α-helix	trans	-61	-18.1	173.7	-178.8	59.7	0	0	0	114.6	N248 I250 K256	N248-L252 PolarHBondContact O-N 2.85Å; I250-L252 PolarHBondContact O-N 3.1Å; L252-K256 WeakPolarHBondContact O-CD 3.44Å; L252-K256 WeakPolarHBondContact O-CE 3.46Å; L252-K256 WeakPolarHBondContact O-CG 3.25Å; L252-K256 PolarHBondContact O-NZ 2.86Å
253	Q	89.1	Confident	86.1	Confident	45 Å²	45	51 Å²	51	21%	0.21	26%	0.259	C	S	.	.	H	α-helix	trans	-91.3	-33.4	171.5	-62.1	-64.8	-10.3	0	0	112.4	F162 L166 Q249 I250 E251 K256 L257	F162-Q253 HydrophobicContact CE2-CB 3.89Å; F162-Q253 HydrophobicContact CZ-CB 3.83Å; L166-Q253 HydrophobicContact CD2-CB 4.4Å; Q249-Q253 WeakPolarHBondContact O-CG 3.49Å; Q249-Q253 PolarHBondContact O-N 3.16Å; I250-Q253 CarbonylContact O-C 3.37Å; I250-Q253 WeakPolarHBondContact O-CA 3.3Å; I250-Q253 WeakPolarHBondContact O-CB 3.24Å; I250-Q253 PolarHBondContact O-N 2.82Å; E251-Q253 PolarHBondContact O-N 2.86Å; E251-Q253 VanDerWaalsContact O-N 3.07Å; Q253-K256 PolarHBondContact O-N 2.89Å; Q253-L257 PolarHBondContact O-N 3.46Å
254	V	91.3	Very high	85.2	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-70.7	-43.8	177	166.7	0	0	0	0	111	F146 A149 V152 F162 I250 E251 K256 L257 A258	F146-V254 WeakPolarHBondContact O-CG1 3.36Å; A149-V254 HydrophobicContact CB-CG2 4.33Å; V152-V254 HydrophobicContact CG2-CG1 4.04Å; F162-V254 HydrophobicContact CD1-CG2 4.42Å; F162-V254 HydrophobicContact CD2-CG2 3.92Å; F162-V254 HydrophobicContact CE1-CG2 4.07Å; F162-V254 HydrophobicContact CE2-CB 4.48Å; F162-V254 HydrophobicContact CE2-CG2 3.54Å; F162-V254 HydrophobicContact CG-CG2 4.36Å; F162-V254 HydrophobicContact CZ-CG2 3.61Å; I250-V254 HydrophobicContact CG2-CG2 4.06Å; I250-V254 WeakPolarHBondContact O-CG2 3.4Å; I250-V254 PolarHBondContact O-N 3Å; E251-V254 PolarHBondContact O-N 3.24Å; V254-K256 PolarHBondContact O-N 2.93Å; V254-L257 WeakPolarHBondContact O-CA 3.49Å; V254-L257 WeakPolarHBondContact O-CB 3.44Å; V254-L257 PolarHBondContact O-N 3.47Å; V254-A258 PolarHBondContact O-N 3.49Å
255	S	89.9	Confident	84.4	Confident	59 Å²	59	48.9 Å²	48.9	41%	0.413	25%	0.253	S	S	.	.	H	α-helix	trans	-59.4	-31	173.1	-47.6	0	0	0	0	112.5	E251 L257 A258 E259	E251-S255 PolarHBondContact O-N 3.21Å; E251-S255 PolarHBondContact O-OG 3.42Å; E251-S255 VanDerWaalsContact O-OG 3.07Å; S255-L257 VanDerWaalsContact C-N 3.33Å; S255-A258 PolarHBondContact O-N 2.89Å; S255-E259 VanDerWaalsContact O-CB 3.27Å; S255-E259 WeakPolarHBondContact O-CB 3.09Å; S255-E259 PolarHBondContact O-N 3.41Å
256	K	88	Confident	83.4	Confident	68 Å²	68	48.4 Å²	48.4	30%	0.296	25%	0.252	S	S	.	.	H	α-helix	trans	-77.1	-16.5	174.5	-68.6	170.9	-170.4	157.2	0	113.6	Y165 L252 Q253 V254 A260	Y165-K256 PolarHBondContact OH-O 3.44Å; L252-K256 WeakPolarHBondContact O-CD 3.44Å; L252-K256 WeakPolarHBondContact O-CE 3.46Å; L252-K256 WeakPolarHBondContact O-CG 3.25Å; L252-K256 PolarHBondContact O-NZ 2.86Å; Q253-K256 PolarHBondContact O-N 2.89Å; V254-K256 PolarHBondContact O-N 2.93Å; K256-A260 WeakPolarHBondContact O-CB 3.3Å; K256-A260 PolarHBondContact O-N 3.41Å
257	L	87.8	Confident	82	Confident	4 Å²	4	51 Å²	51	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-81.2	-48.1	167.7	171.4	55.7	0	0	0	109.2	F146 F162 Y165 Q253 V254 S255 E259 A260 I261 W268	F146-L257 HydrophobicContact CD1-CD2 3.56Å; F146-L257 HydrophobicContact CD1-CG 4.18Å; F146-L257 HydrophobicContact CE1-CD2 3.62Å; F146-L257 HydrophobicContact CG-CD2 4.33Å; F146-L257 HydrophobicContact CG-CG 4.5Å; F146-L257 HydrophobicContact CZ-CD2 4.41Å; F162-L257 HydrophobicContact CB-CD2 4.47Å; F162-L257 HydrophobicContact CD2-CD2 4.1Å; Y165-L257 HydrophobicContact CD1-CB 4.33Å; Y165-L257 HydrophobicContact CD2-CD1 3.67Å; Y165-L257 HydrophobicContact CE1-CB 4.02Å; Y165-L257 HydrophobicContact CE2-CB 4.24Å; Y165-L257 HydrophobicContact CE2-CD1 3.85Å; Y165-L257 HydrophobicContact CG-CD1 4.08Å; Y165-L257 HydrophobicContact CG-CD2 4.43Å; Y165-L257 PolarHBondContact OH-N 3.16Å; Q253-L257 PolarHBondContact O-N 3.46Å; V254-L257 WeakPolarHBondContact O-CA 3.49Å; V254-L257 WeakPolarHBondContact O-CB 3.44Å; V254-L257 PolarHBondContact O-N 3.47Å; S255-L257 VanDerWaalsContact C-N 3.33Å; L257-E259 PolarHBondContact O-N 2.99Å; L257-A260 CarbonylContact O-C 2.77Å; L257-A260 WeakPolarHBondContact O-CA 3.46Å; L257-A260 WeakPolarHBondContact O-CB 3.39Å; L257-A260 PolarHBondContact O-N 2.78Å; L257-I261 HydrophobicContact CD1-CD1 3.94Å; L257-I261 HydrophobicContact CD1-CG1 4.17Å; L257-I261 HydrophobicContact CG-CD1 3.99Å; L257-I261 WeakPolarHBondContact O-CG1 3.49Å; L257-I261 PolarHBondContact O-N 2.82Å; L257-W268 HydrophobicContact CD1-CB 3.78Å; L257-W268 HydrophobicContact CD1-CG 4.38Å
258	A	87.4	Confident	80.6	Confident	6 Å²	6	50.5 Å²	50.5	5%	0.05	26%	0.263	C	S	.	.	H	α-helix	trans	-54.8	-47.3	172.5	0	0	0	0	0	112.4	S143 F146 V254 S255 A260 I261 N262	S143-A258 WeakPolarHBondContact OG-CB 3.41Å; S143-A258 PolarHBondContact OG-O 3.01Å; F146-A258 HydrophobicContact CB-CB 4.41Å; V254-A258 PolarHBondContact O-N 3.49Å; S255-A258 PolarHBondContact O-N 2.89Å; A258-A260 VanDerWaalsContact C-N 3.33Å; A258-A260 PolarHBondContact O-N 3.37Å; A258-I261 WeakPolarHBondContact O-CA 3.35Å; A258-I261 PolarHBondContact O-N 2.95Å; A258-N262 PolarHBondContact O-N 2.88Å
259	E	85.4	Confident	79	Confident	112 Å²	112	48.5 Å²	48.5	52%	0.523	26%	0.256	S	S	.	.	H	α-helix	trans	-55.4	-44.7	172.4	-174.7	-170.7	-177.2	0	0	111.9	S255 L257 I261 N262 L263	S255-E259 VanDerWaalsContact O-CB 3.27Å; S255-E259 WeakPolarHBondContact O-CB 3.09Å; S255-E259 PolarHBondContact O-N 3.41Å; L257-E259 PolarHBondContact O-N 2.99Å; E259-I261 VanDerWaalsContact C-N 3.31Å; E259-I261 PolarHBondContact O-N 3.39Å; E259-N262 PolarHBondContact O-N 2.7Å; E259-L263 HydrophobicContact CG-CD1 3.95Å; E259-L263 VanDerWaalsContact O-CB 3.31Å; E259-L263 WeakPolarHBondContact O-CB 3.42Å; E259-L263 VanDerWaalsContact O-CG 3.24Å; E259-L263 WeakPolarHBondContact O-CG 3.37Å; E259-L263 PolarHBondContact O-N 3.06Å
260	A	82.4	Confident	77.1	Confident	6 Å²	6	48 Å²	48	5%	0.05	26%	0.255	C	S	.	.	H	α-helix	trans	-68.6	-28.6	177.4	0	0	0	0	0	112.9	K256 L257 A258 G264 M265 W268	K256-A260 WeakPolarHBondContact O-CB 3.3Å; K256-A260 PolarHBondContact O-N 3.41Å; L257-A260 CarbonylContact O-C 2.77Å; L257-A260 WeakPolarHBondContact O-CA 3.46Å; L257-A260 WeakPolarHBondContact O-CB 3.39Å; L257-A260 PolarHBondContact O-N 2.78Å; A258-A260 VanDerWaalsContact C-N 3.33Å; A258-A260 PolarHBondContact O-N 3.37Å; A260-G264 PolarHBondContact O-N 2.87Å; A260-M265 HydrophobicContact CB-CB 4.25Å; A260-M265 HydrophobicContact CB-SD 4.45Å; A260-M265 WeakPolarHBondContact O-CB 3.3Å; A260-M265 PolarHBondContact O-N 2.78Å; A260-W268 PolarHBondContact O-NE1 3.1Å
261	I	82.5	Confident	75	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-71	-51.9	172.9	-63.5	162.2	0	0	0	110.2	L139 L142 F146 L257 A258 E259 L263 G264 W268	L139-I261 WeakPolarHBondContact O-CG2 3.45Å; L142-I261 HydrophobicContact CB-CG2 3.86Å; F146-I261 HydrophobicContact CB-CD1 4.5Å; F146-I261 HydrophobicContact CD2-CD1 3.62Å; F146-I261 HydrophobicContact CE2-CD1 4.02Å; F146-I261 HydrophobicContact CG-CD1 4.12Å; L257-I261 HydrophobicContact CD1-CD1 3.94Å; L257-I261 HydrophobicContact CD1-CG1 4.17Å; L257-I261 HydrophobicContact CG-CD1 3.99Å; L257-I261 WeakPolarHBondContact O-CG1 3.49Å; L257-I261 PolarHBondContact O-N 2.82Å; A258-I261 WeakPolarHBondContact O-CA 3.35Å; A258-I261 PolarHBondContact O-N 2.95Å; E259-I261 VanDerWaalsContact C-N 3.31Å; E259-I261 PolarHBondContact O-N 3.39Å; I261-L263 VanDerWaalsContact C-N 3.33Å; I261-L263 PolarHBondContact O-N 3.12Å; I261-G264 WeakPolarHBondContact O-CA 3.17Å; I261-G264 PolarHBondContact O-N 2.79Å; I261-W268 VanDerWaalsContact CA-NE1 3.35Å; I261-W268 HydrophobicContact CB-CZ2 4.45Å; I261-W268 HydrophobicContact CG1-CD2 3.83Å; I261-W268 HydrophobicContact CG1-CE3 4.41Å; I261-W268 HydrophobicContact CG1-CG 3.96Å; I261-W268 HydrophobicContact CG1-CZ2 4.32Å; I261-W268 HydrophobicContact CG2-CZ2 4.11Å
262	N	80.7	Confident	72.9	Confident	90 Å²	90	54.3 Å²	54.3	48%	0.481	30%	0.295	S	S	.	.	H	α-helix	trans	-58.2	-39.9	175.6	-80.2	-35.4	0	0	0	113.4	S143 A258 E259 G264	S143-N262 WeakPolarHBondContact CB-OD1 3.47Å; S143-N262 PolarHBondContact OG-ND2 3.5Å; A258-N262 PolarHBondContact O-N 2.88Å; E259-N262 PolarHBondContact O-N 2.7Å; N262-G264 PolarHBondContact O-N 2.93Å
263	L	78.2	Confident	71.2	Confident	113 Å²	113	56.1 Å²	56.1	59%	0.592	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	0.9	174.5	-69	173.9	0	0	0	113.5	E259 I261 M265	E259-L263 HydrophobicContact CG-CD1 3.95Å; E259-L263 VanDerWaalsContact O-CB 3.31Å; E259-L263 WeakPolarHBondContact O-CB 3.42Å; E259-L263 VanDerWaalsContact O-CG 3.24Å; E259-L263 WeakPolarHBondContact O-CG 3.37Å; E259-L263 PolarHBondContact O-N 3.06Å; I261-L263 VanDerWaalsContact C-N 3.33Å; I261-L263 PolarHBondContact O-N 3.12Å; L263-M265 HydrophobicContact CB-CG 3.83Å; L263-M265 HydrophobicContact CB-SD 4.25Å; L263-M265 HydrophobicContact CD1-SD 4.07Å; L263-M265 PolarHBondContact O-N 3.17Å
264	G	67.3	Low	69.7	Low	12 Å²	12	56.1 Å²	56.1	12%	0.124	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	27.5	-177.7	0	0	0	0	0	113.3	A260 I261 N262 D266 R1422	A260-G264 PolarHBondContact O-N 2.87Å; I261-G264 WeakPolarHBondContact O-CA 3.17Å; I261-G264 PolarHBondContact O-N 2.79Å; N262-G264 PolarHBondContact O-N 2.93Å; G264-D266 PolarHBondContact O-N 3.22Å; G264-R1422 PolarHBondContact O-NH2 3.28Å
265	M	65.4	Low	68.3	Low	82 Å²	82	59.9 Å²	59.9	40%	0.404	33%	0.333	S	S	.	.			trans	-76.6	93.5	-175.3	-70	-177.8	57.9	0	0	111.1	A260 L263 T267 W268	A260-M265 HydrophobicContact CB-CB 4.25Å; A260-M265 HydrophobicContact CB-SD 4.45Å; A260-M265 WeakPolarHBondContact O-CB 3.3Å; A260-M265 PolarHBondContact O-N 2.78Å; L263-M265 HydrophobicContact CB-CG 3.83Å; L263-M265 HydrophobicContact CB-SD 4.25Å; L263-M265 HydrophobicContact CD1-SD 4.07Å; L263-M265 PolarHBondContact O-N 3.17Å; M265-T267 PolarHBondContact O-N 3.21Å; M265-T267 PolarHBondContact O-OG1 3.01Å; M265-W268 PolarHBondContact O-N 2.7Å; M265-W268 PolarHBondContact O-NE1 3.38Å
266	D	61.2	Low	67.1	Low	38 Å²	38	58.2 Å²	58.2	20%	0.203	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	6.4	-175.5	42.5	-55	0	0	0	116.5	G264 C269 N1418 R1422	G264-D266 PolarHBondContact O-N 3.22Å; D266-C269 HydrophobicContact CB-CB 4.17Å; D266-C269 PolarHBondContact O-N 3.29Å; D266-N1418 PolarHBondContact OD1-ND2 2.81Å; D266-N1418 WeakPolarHBondContact OD2-CB 3.46Å; D266-N1418 PolarHBondContact OD2-ND2 2.99Å; D266-R1422 IonicContact OD1-CZ 2.7Å; D266-R1422 IonicContact OD1-NE 3.45Å; D266-R1422 PolarHBondContact OD1-NE 3.4Å; D266-R1422 IonicContact OD1-NH2 2.86Å; D266-R1422 PolarHBondContact OD1-NH2 3.02Å; D266-R1422 IonicContact OD2-NE 3.37Å
267	T	54.9	Low	65.8	Low	56 Å²	56	60.6 Å²	60.6	34%	0.344	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-25.8	163.5	41.2	0	0	0	0	115.6	M265 C269	M265-T267 PolarHBondContact O-N 3.21Å; M265-T267 PolarHBondContact O-OG1 3.01Å; T267-C269 VanDerWaalsContact C-N 3.34Å
268	W	57.8	Low	64.4	Low	37 Å²	37	65.7 Å²	65.7	14%	0.14	37%	0.365	C	S	.	.	S	Bend	trans	-85	-12.2	167.9	58.7	-100.2	0	0	0	112.4	L139 L142 Y165 L257 A260 I261 M265	L139-W268 HydrophobicContact CD2-CH2 4.11Å; L139-W268 HydrophobicContact CD2-CZ2 3.73Å; L142-W268 HydrophobicContact CD1-CH2 4.46Å; Y165-W268 HydrophobicContact CD2-CB 4.47Å; L257-W268 HydrophobicContact CD1-CB 3.78Å; L257-W268 HydrophobicContact CD1-CG 4.38Å; A260-W268 PolarHBondContact O-NE1 3.1Å; I261-W268 VanDerWaalsContact CA-NE1 3.35Å; I261-W268 HydrophobicContact CB-CZ2 4.45Å; I261-W268 HydrophobicContact CG1-CD2 3.83Å; I261-W268 HydrophobicContact CG1-CE3 4.41Å; I261-W268 HydrophobicContact CG1-CG 3.96Å; I261-W268 HydrophobicContact CG1-CZ2 4.32Å; I261-W268 HydrophobicContact CG2-CZ2 4.11Å; M265-W268 PolarHBondContact O-N 2.7Å; M265-W268 PolarHBondContact O-NE1 3.38Å
269	C	52.2	Low	63.3	Low	60 Å²	60	68.1 Å²	68.1	41%	0.405	37%	0.374	S	S	.	.			trans	-90.8	133.1	-172.5	-164.5	0	0	0	0	110.5	D266 T267	D266-C269 HydrophobicContact CB-CB 4.17Å; D266-C269 PolarHBondContact O-N 3.29Å; T267-C269 VanDerWaalsContact C-N 3.34Å
270	L	46.2	Very low	62.1	Low	46 Å²	46	73.5 Å²	73.5	24%	0.241	39%	0.39	C	S	.	.			trans	-118.1	171.9	-164.5	-60.9	161.3	0	0	0	108.8	E272	L270-E272 PolarHBondContact O-N 3Å
271	S	46.6	Very low	61.7	Low	93 Å²	93	76.1 Å²	76.1	65%	0.65	40%	0.403	S	S	*	.	S	Bend	trans	-63.8	-12.3	-167	-76.6	0	0	0	0	115.7	R926	S271-R926 PolarHBondContact OG-NH2 3.06Å
272	E	48	Very low	61.5	Low	126 Å²	126	81.4 Å²	81.4	59%	0.589	43%	0.426	S	S	*	.	S	Bend	trans	-132.3	130.6	173.2	-69.5	162.5	-164	0	0	107.1	L270 I274	L270-E272 PolarHBondContact O-N 3Å; E272-I274 PolarHBondContact O-N 2.9Å
273	P	52.4	Low	61.4	Low	123 Å²	123	81.5 Å²	81.5	80%	0.799	42%	0.424	S	S	*	.			trans	-73.7	120.6	173.2	29.8	-32	0	0	0	109.7	D275	P273-D275 PolarHBondContact O-N 3.29Å
274	I	57.5	Low	61.4	Low	44 Å²	44	79.7 Å²	79.7	23%	0.226	41%	0.412	C	S	.	.			trans	-83.9	111.2	176.7	-63.4	168.7	0	0	0	108.4	M161 E272 F276 F279	M161-I274 HydrophobicContact CG-CD1 4.17Å; M161-I274 HydrophobicContact SD-CB 4.35Å; M161-I274 HydrophobicContact SD-CD1 3.84Å; E272-I274 PolarHBondContact O-N 2.9Å; I274-F276 HydrophobicContact CG2-CD1 4.31Å; I274-F276 HydrophobicContact CG2-CE1 4.31Å; I274-F279 HydrophobicContact CG2-CE2 3.7Å; I274-F279 HydrophobicContact CG2-CZ 3.8Å
275	D	62.5	Low	62.2	Low	80 Å²	80	80.7 Å²	80.7	43%	0.428	41%	0.413	S	S	.	.			trans	-85.6	107.6	167.7	177.6	-1.2	0	0	0	108.9	P273 V277 L278	P273-D275 PolarHBondContact O-N 3.29Å; D275-V277 PolarHBondContact O-N 3.1Å; D275-V277 VanDerWaalsContact OD1-CB 3.24Å; D275-V277 WeakPolarHBondContact OD1-CB 3.44Å; D275-V277 WeakPolarHBondContact OD1-CG2 3.27Å; D275-V277 PolarHBondContact OD1-N 3.19Å; D275-L278 HydrophobicContact CB-CD1 3.92Å; D275-L278 HydrophobicContact CB-CG 3.93Å; D275-L278 PolarHBondContact O-N 3.5Å
276	F	65	Low	63.2	Low	24 Å²	24	77.5 Å²	77.5	11%	0.105	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-63.3	-21.6	-179.6	-63.4	-74.1	0	0	0	113.1	L142 E145 F146 A157 K158 M161 I274 L278 F279	L142-F276 HydrophobicContact CD2-CD2 4.45Å; L142-F276 HydrophobicContact CD2-CE2 4.4Å; E145-F276 VanDerWaalsContact OE1-CD2 3.31Å; E145-F276 WeakPolarHBondContact OE1-CD2 3.45Å; F146-F276 HydrophobicContact CE2-CE2 4.03Å; F146-F276 AromaticContact CE2-CZ 3.91Å; F146-F276 HydrophobicContact CE2-CZ 3.91Å; F146-F276 HydrophobicContact CZ-CE2 4.48Å; F146-F276 AromaticContact CZ-CZ 3.9Å; F146-F276 HydrophobicContact CZ-CZ 3.9Å; A157-F276 HydrophobicContact CB-CE1 4.42Å; K158-F276 HydrophobicContact CG-CD1 4.17Å; K158-F276 HydrophobicContact CG-CE1 3.63Å; K158-F276 HydrophobicContact CG-CZ 4.07Å; M161-F276 HydrophobicContact CE-CZ 4.13Å; M161-F276 HydrophobicContact SD-CE1 3.89Å; M161-F276 HydrophobicContact SD-CE2 4.45Å; M161-F276 HydrophobicContact SD-CZ 3.45Å; M161-F276 WeakPolarHBondContact SD-CZ 3.47Å; I274-F276 HydrophobicContact CG2-CD1 4.31Å; I274-F276 HydrophobicContact CG2-CE1 4.31Å; F276-L278 PolarHBondContact O-N 3.07Å; F276-F279 HydrophobicContact CD1-CD2 4.45Å; F276-F279 HydrophobicContact CD1-CE2 4.07Å; F276-F279 PolarHBondContact O-N 3.23Å
277	V	59.7	Low	64.2	Low	119 Å²	119	78.2 Å²	78.2	72%	0.721	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-74.1	-14.3	-179.9	-167.5	0	0	0	0	111.8	D275	D275-V277 PolarHBondContact O-N 3.1Å; D275-V277 VanDerWaalsContact OD1-CB 3.24Å; D275-V277 WeakPolarHBondContact OD1-CB 3.44Å; D275-V277 WeakPolarHBondContact OD1-CG2 3.27Å; D275-V277 PolarHBondContact OD1-N 3.19Å
278	L	59.5	Low	65.5	Low	110 Å²	110	76.1 Å²	76.1	58%	0.576	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-78.9	-20.8	177.7	-65.2	-180	0	0	0	114.3	D275 F276 R280	D275-L278 HydrophobicContact CB-CD1 3.92Å; D275-L278 HydrophobicContact CB-CG 3.93Å; D275-L278 PolarHBondContact O-N 3.5Å; F276-L278 PolarHBondContact O-N 3.07Å; L278-R280 PolarHBondContact O-N 2.91Å
279	F	64.4	Low	67	Low	57 Å²	57	74.4 Å²	74.4	25%	0.25	39%	0.39	C	S	.	.			trans	-71.9	114	-177.5	-64.2	-61.2	0	0	0	111.3	A157 I274 F276 E284 E285 C288	A157-F279 HydrophobicContact CB-CD2 4.38Å; A157-F279 HydrophobicContact CB-CE2 3.82Å; A157-F279 HydrophobicContact CB-CZ 4.12Å; I274-F279 HydrophobicContact CG2-CE2 3.7Å; I274-F279 HydrophobicContact CG2-CZ 3.8Å; F276-F279 HydrophobicContact CD1-CD2 4.45Å; F276-F279 HydrophobicContact CD1-CE2 4.07Å; F276-F279 PolarHBondContact O-N 3.23Å; F279-E284 HydrophobicContact CD1-CB 3.88Å; F279-E285 HydrophobicContact CB-CG 4.1Å; F279-E285 HydrophobicContact CD1-CG 4.48Å; F279-E285 HydrophobicContact CD2-CG 4.45Å; F279-E285 HydrophobicContact CG-CG 4.11Å; F279-C288 HydrophobicContact CE1-CB 3.96Å; F279-C288 HydrophobicContact CZ-CB 3.89Å
280	R	59.5	Low	68.7	Low	226 Å²	226	74 Å²	74	85%	0.853	38%	0.383	S	S	*	.			trans	-90.7	-16.1	-175.9	-60.3	-176.4	174.3	-135.4	-6.8	113.7	L278 E284	L278-R280 PolarHBondContact O-N 2.91Å; R280-E284 WeakPolarHBondContact CB-OE2 3.47Å; R280-E284 PolarHBondContact N-OE2 2.87Å
281	N	75.3	Confident	70.3	Confident	61 Å²	61	76 Å²	76	33%	0.326	40%	0.401	S	S	.	.	S	Bend	trans	-161	168.3	-172.7	58.6	55.4	0	0	0	110.7	E283 E284 E285	N281-E283 VanDerWaalsContact C-N 3.26Å; N281-E283 VanDerWaalsContact CB-OE2 3.28Å; N281-E283 WeakPolarHBondContact CB-OE2 3.41Å; N281-E283 PolarHBondContact O-N 2.8Å; N281-E283 WeakPolarHBondContact OD1-CB 3.27Å; N281-E283 PolarHBondContact OD1-N 3.47Å; N281-E283 PolarHBondContact OD1-OE2 3.04Å; N281-E284 VanDerWaalsContact ND2-CD 3.3Å; N281-E284 PolarHBondContact ND2-OE1 3.15Å; N281-E284 PolarHBondContact O-N 3.37Å; N281-E284 WeakPolarHBondContact OD1-CB 3.49Å; N281-E284 VanDerWaalsContact OD1-CG 3.26Å; N281-E284 WeakPolarHBondContact OD1-CG 3.42Å; N281-E284 PolarHBondContact OD1-N 3.19Å; N281-E285 PolarHBondContact O-N 3.35Å
282	K	78.1	Confident	72.1	Confident	113 Å²	113	74.6 Å²	74.6	49%	0.491	38%	0.381	S	S	.	.	H	α-helix	trans	-74.4	-18.2	-177.7	-67.8	-171.6	175.8	-175.2	0	112.7	L286	K282-L286 VanDerWaalsContact O-CB 3.24Å; K282-L286 WeakPolarHBondContact O-CB 3.39Å; K282-L286 PolarHBondContact O-N 3.13Å
283	E	77.4	Confident	74.1	Confident	92 Å²	92	68.6 Å²	68.6	43%	0.43	35%	0.353	S	S	.	.	H	α-helix	trans	-70.1	-36.8	176.7	-62.9	58.6	-129.1	0	0	110.7	N281 L286 A287 Q351	N281-E283 VanDerWaalsContact C-N 3.26Å; N281-E283 VanDerWaalsContact CB-OE2 3.28Å; N281-E283 WeakPolarHBondContact CB-OE2 3.41Å; N281-E283 PolarHBondContact O-N 2.8Å; N281-E283 WeakPolarHBondContact OD1-CB 3.27Å; N281-E283 PolarHBondContact OD1-N 3.47Å; N281-E283 PolarHBondContact OD1-OE2 3.04Å; E283-L286 PolarHBondContact O-N 3.39Å; E283-A287 WeakPolarHBondContact O-CB 3.38Å; E283-A287 PolarHBondContact O-N 2.92Å; E283-Q351 VanDerWaalsContact OE1-CD 3.24Å; E283-Q351 WeakPolarHBondContact OE1-CG 3.33Å; E283-Q351 PolarHBondContact OE1-NE2 2.96Å
284	E	79.1	Confident	75.8	Confident	74 Å²	74	63.6 Å²	63.6	35%	0.346	32%	0.321	S	S	.	.	H	α-helix	trans	-72.5	-39.4	174	-69.7	160.4	-159.1	0	0	111.6	F279 R280 N281 L286 A287 C288	F279-E284 HydrophobicContact CD1-CB 3.88Å; R280-E284 WeakPolarHBondContact CB-OE2 3.47Å; R280-E284 PolarHBondContact N-OE2 2.87Å; N281-E284 VanDerWaalsContact ND2-CD 3.3Å; N281-E284 PolarHBondContact ND2-OE1 3.15Å; N281-E284 PolarHBondContact O-N 3.37Å; N281-E284 WeakPolarHBondContact OD1-CB 3.49Å; N281-E284 VanDerWaalsContact OD1-CG 3.26Å; N281-E284 WeakPolarHBondContact OD1-CG 3.42Å; N281-E284 PolarHBondContact OD1-N 3.19Å; E284-L286 VanDerWaalsContact C-N 3.34Å; E284-L286 PolarHBondContact O-N 2.9Å; E284-A287 PolarHBondContact O-N 3.13Å; E284-C288 PolarHBondContact O-N 3.42Å
285	E	82.4	Confident	77	Confident	33 Å²	33	64.7 Å²	64.7	15%	0.154	33%	0.332	C	S	.	.	H	α-helix	trans	-61.3	-41.5	169.8	-65.5	-171.4	99.8	0	0	111.9	S155 P156 A157 F279 N281 C288 F289	S155-E285 VanDerWaalsContact CB-OE1 3.29Å; S155-E285 WeakPolarHBondContact CB-OE1 3.45Å; S155-E285 PolarHBondContact OG-OE1 2.96Å; P156-E285 HydrophobicContact CB-CB 4.11Å; P156-E285 HydrophobicContact CG-CB 3.87Å; A157-E285 HydrophobicContact CB-CB 4.24Å; A157-E285 HydrophobicContact CB-CG 4.32Å; F279-E285 HydrophobicContact CB-CG 4.1Å; F279-E285 HydrophobicContact CD1-CG 4.48Å; F279-E285 HydrophobicContact CD2-CG 4.45Å; F279-E285 HydrophobicContact CG-CG 4.11Å; N281-E285 PolarHBondContact O-N 3.35Å; E285-C288 VanDerWaalsContact O-CB 3.28Å; E285-C288 WeakPolarHBondContact O-CB 3.29Å; E285-C288 PolarHBondContact O-N 2.94Å; E285-F289 PolarHBondContact O-N 3.42Å
286	L	86.4	Confident	78.2	Confident	15 Å²	15	62.2 Å²	62.2	8%	0.079	32%	0.317	C	S	.	.	H	α-helix	trans	-69.5	-35	177.4	-175.7	63.1	0	0	0	111.8	K282 E283 E284 C288 F289 E290	K282-L286 VanDerWaalsContact O-CB 3.24Å; K282-L286 WeakPolarHBondContact O-CB 3.39Å; K282-L286 PolarHBondContact O-N 3.13Å; E283-L286 PolarHBondContact O-N 3.39Å; E284-L286 VanDerWaalsContact C-N 3.34Å; E284-L286 PolarHBondContact O-N 2.9Å; L286-C288 VanDerWaalsContact C-N 3.3Å; L286-F289 WeakPolarHBondContact O-CB 3.37Å; L286-F289 PolarHBondContact O-N 2.97Å; L286-E290 PolarHBondContact O-N 3.48Å
287	A	82.7	Confident	79.3	Confident	53 Å²	53	61 Å²	61	44%	0.438	31%	0.312	S	S	.	.	H	α-helix	trans	-66.7	-32.1	171.3	0	0	0	0	0	112.1	E283 E284 S291	E283-A287 WeakPolarHBondContact O-CB 3.38Å; E283-A287 PolarHBondContact O-N 2.92Å; E284-A287 PolarHBondContact O-N 3.13Å; A287-S291 WeakPolarHBondContact O-CB 3.49Å; A287-S291 PolarHBondContact O-N 3.49Å; A287-S291 PolarHBondContact O-OG 3.01Å
288	C	82.9	Confident	80.5	Confident	13 Å²	13	57.2 Å²	57.2	9%	0.088	29%	0.288	C	S	.	.	H	α-helix	trans	-63.3	-48.2	167.4	-171.9	0	0	0	0	110.8	A157 F279 E284 E285 L286 E290 S291 R292	A157-C288 HydrophobicContact CB-CB 4.26Å; F279-C288 HydrophobicContact CE1-CB 3.96Å; F279-C288 HydrophobicContact CZ-CB 3.89Å; E284-C288 PolarHBondContact O-N 3.42Å; E285-C288 VanDerWaalsContact O-CB 3.28Å; E285-C288 WeakPolarHBondContact O-CB 3.29Å; E285-C288 PolarHBondContact O-N 2.94Å; L286-C288 VanDerWaalsContact C-N 3.3Å; C288-E290 PolarHBondContact O-N 2.81Å; C288-S291 PolarHBondContact O-N 2.87Å; C288-S291 PolarHBondContact O-OG 2.81Å; C288-S291 VanDerWaalsContact O-OG 3.13Å; C288-R292 WeakPolarHBondContact O-CB 3.33Å; C288-R292 PolarHBondContact O-N 2.96Å
289	F	88.6	Confident	81.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-57	-46	175.7	-176	-78.7	0	0	0	112.8	P156 A160 I163 E285 L286 L293 A343 H344 Y347 W405	P156-F289 HydrophobicContact CB-CB 4.16Å; A160-F289 HydrophobicContact CB-CB 4.14Å; A160-F289 HydrophobicContact CB-CD2 3.86Å; A160-F289 HydrophobicContact CB-CG 4.26Å; I163-F289 HydrophobicContact CD1-CE2 4.35Å; E285-F289 PolarHBondContact O-N 3.42Å; L286-F289 WeakPolarHBondContact O-CB 3.37Å; L286-F289 PolarHBondContact O-N 2.97Å; F289-L293 HydrophobicContact CD1-CD1 4.32Å; F289-L293 HydrophobicContact CD2-CD1 4.15Å; F289-L293 HydrophobicContact CE1-CD1 3.94Å; F289-L293 HydrophobicContact CE2-CD1 3.75Å; F289-L293 HydrophobicContact CG-CD1 4.41Å; F289-L293 HydrophobicContact CZ-CD1 3.63Å; F289-L293 PolarHBondContact O-N 2.9Å; F289-A343 HydrophobicContact CE2-CB 4.49Å; F289-A343 HydrophobicContact CZ-CB 3.84Å; F289-H344 HydrophobicContact CE1-CB 4.05Å; F289-Y347 HydrophobicContact CD2-CD2 4.3Å; F289-Y347 HydrophobicContact CD2-CE2 4.29Å; F289-Y347 HydrophobicContact CE2-CD2 4.15Å; F289-Y347 AromaticContact CE2-CE2 3.93Å; F289-Y347 HydrophobicContact CE2-CE2 3.93Å; F289-W405 HydrophobicContact CD1-CH2 4.38Å; F289-W405 AromaticContact CE1-CH2 3.89Å; F289-W405 HydrophobicContact CE1-CH2 3.89Å; F289-W405 AromaticContact CE1-CZ3 3.9Å; F289-W405 HydrophobicContact CE1-CZ3 3.9Å
290	E	87.7	Confident	82.7	Confident	53 Å²	53	49.5 Å²	49.5	25%	0.248	25%	0.25	C	C	.	.	H	α-helix	trans	-61.3	-50.3	174.9	-76.6	-171	-154.1	0	0	112.1	L286 C288 R292 S294 H344 W405	L286-E290 PolarHBondContact O-N 3.48Å; C288-E290 PolarHBondContact O-N 2.81Å; E290-R292 PolarHBondContact O-N 2.96Å; E290-S294 VanDerWaalsContact O-CB 3.25Å; E290-S294 WeakPolarHBondContact O-CB 3.42Å; E290-S294 PolarHBondContact O-N 2.9Å; E290-S294 PolarHBondContact O-OG 3.32Å; E290-H344 WeakPolarHBondContact CG-NE2 3.44Å; E290-H344 IonicContact OE1-CD2 3.37Å; E290-H344 IonicContact OE1-CE1 2.74Å; E290-H344 IonicContact OE1-NE2 3.38Å; E290-H344 PolarHBondContact OE1-NE2 2.87Å; E290-W405 HydrophobicContact CG-CG 4.41Å
291	S	81.3	Confident	83.8	Confident	88 Å²	88	41.4 Å²	41.4	62%	0.615	22%	0.222	S	C	*	.	H	α-helix	trans	-66.4	-38	-175.2	71.7	0	0	0	0	112.4	A287 C288	A287-S291 WeakPolarHBondContact O-CB 3.49Å; A287-S291 PolarHBondContact O-N 3.49Å; A287-S291 PolarHBondContact O-OG 3.01Å; C288-S291 PolarHBondContact O-N 2.87Å; C288-S291 PolarHBondContact O-OG 2.81Å; C288-S291 VanDerWaalsContact O-OG 3.13Å
292	R	83.3	Confident	84.1	Confident	62 Å²	62	41.9 Å²	41.9	23%	0.234	22%	0.222	C	C	.	.	H	α-helix	trans	-66.5	-43.1	179.5	-159.5	73	-123.7	139.9	6.2	112.6	A160 D164 C288 E290	A160-R292 HydrophobicContact CB-CB 4.05Å; A160-R292 HydrophobicContact CB-CG 4.13Å; D164-R292 HydrophobicContact CB-CG 4.37Å; D164-R292 IonicContact OD2-CZ 3.53Å; D164-R292 IonicContact OD2-NE 3.46Å; D164-R292 PolarHBondContact OD2-NE 2.8Å; D164-R292 IonicContact OD2-NH2 3.08Å; D164-R292 PolarHBondContact OD2-NH2 3.05Å; C288-R292 WeakPolarHBondContact O-CB 3.33Å; C288-R292 PolarHBondContact O-N 2.96Å; E290-R292 PolarHBondContact O-N 2.96Å
293	L	89.3	Confident	84.1	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-102.6	-9.3	-170.1	-60	179.9	0	0	0	115	I163 F289 S295 Y296 L297 L340 W405	I163-L293 HydrophobicContact CB-CD1 4.37Å; I163-L293 HydrophobicContact CB-CD2 4.25Å; I163-L293 HydrophobicContact CD1-CD1 4.29Å; I163-L293 HydrophobicContact CG2-CD1 4.1Å; I163-L293 HydrophobicContact CG2-CD2 3.78Å; F289-L293 HydrophobicContact CD1-CD1 4.32Å; F289-L293 HydrophobicContact CD2-CD1 4.15Å; F289-L293 HydrophobicContact CE1-CD1 3.94Å; F289-L293 HydrophobicContact CE2-CD1 3.75Å; F289-L293 HydrophobicContact CG-CD1 4.41Å; F289-L293 HydrophobicContact CZ-CD1 3.63Å; F289-L293 PolarHBondContact O-N 2.9Å; L293-S295 VanDerWaalsContact C-N 3.29Å; L293-S295 PolarHBondContact O-N 2.89Å; L293-Y296 HydrophobicContact CD2-CD2 4.01Å; L293-Y296 HydrophobicContact CD2-CE2 4.43Å; L293-Y296 PolarHBondContact O-N 3.04Å; L293-Y296 VanDerWaalsContact O-N 3.16Å; L293-L297 PolarHBondContact O-N 2.89Å; L293-L340 HydrophobicContact CD1-CD2 4.28Å; L293-W405 HydrophobicContact CB-CH2 3.9Å; L293-W405 HydrophobicContact CB-CZ2 4.07Å
294	S	88.7	Confident	83.9	Confident	18 Å²	18	35.6 Å²	35.6	13%	0.126	20%	0.201	C	C	.	.	H	α-helix	trans	-58.9	-35.5	-178.8	-73.5	0	0	0	0	113.7	E290 Y296 L297 D298 W405	E290-S294 VanDerWaalsContact O-CB 3.25Å; E290-S294 WeakPolarHBondContact O-CB 3.42Å; E290-S294 PolarHBondContact O-N 2.9Å; E290-S294 PolarHBondContact O-OG 3.32Å; S294-Y296 VanDerWaalsContact C-N 3.34Å; S294-Y296 PolarHBondContact O-N 3.47Å; S294-L297 PolarHBondContact O-N 3.14Å; S294-D298 WeakPolarHBondContact O-CB 3.46Å; S294-D298 PolarHBondContact O-N 2.66Å; S294-W405 PolarHBondContact OG-NE1 2.74Å
295	S	82.6	Confident	83.7	Confident	67 Å²	67	36 Å²	36	47%	0.469	21%	0.208	S	C	.	.	H	α-helix	trans	-63.2	-38.2	177.8	55.1	0	0	0	0	112.7	L293 A299	L293-S295 VanDerWaalsContact C-N 3.29Å; L293-S295 PolarHBondContact O-N 2.89Å; S295-A299 WeakPolarHBondContact O-CB 3.36Å; S295-A299 PolarHBondContact O-N 3.34Å; S295-A299 VanDerWaalsContact O-N 3.14Å
296	Y	87.8	Confident	82.9	Confident	28 Å²	28	36.7 Å²	36.7	11%	0.11	22%	0.224	C	C	.	.	H	α-helix	trans	-72.4	-40.2	174.5	-59.1	-61.7	0	0	0	111.5	D164 F167 S168 L293 S294 A299 L300 I313 I317	D164-Y296 PolarHBondContact OD1-OH 3.32Å; D164-Y296 VanDerWaalsContact OD1-OH 3.07Å; F167-Y296 HydrophobicContact CB-CE1 4.38Å; F167-Y296 HydrophobicContact CD2-CD1 4.07Å; F167-Y296 AromaticContact CD2-CD2 3.72Å; F167-Y296 HydrophobicContact CD2-CD2 3.72Å; F167-Y296 HydrophobicContact CD2-CE1 4.33Å; F167-Y296 HydrophobicContact CD2-CE2 4.03Å; F167-Y296 AromaticContact CD2-CG 3.75Å; F167-Y296 HydrophobicContact CD2-CG 3.75Å; F167-Y296 HydrophobicContact CE2-CD2 4.16Å; F167-Y296 HydrophobicContact CE2-CG 4.09Å; S168-Y296 PolarHBondContact OG-OH 3.15Å; L293-Y296 HydrophobicContact CD2-CD2 4.01Å; L293-Y296 HydrophobicContact CD2-CE2 4.43Å; L293-Y296 PolarHBondContact O-N 3.04Å; L293-Y296 VanDerWaalsContact O-N 3.16Å; S294-Y296 VanDerWaalsContact C-N 3.34Å; S294-Y296 PolarHBondContact O-N 3.47Å; Y296-A299 PolarHBondContact O-N 3.22Å; Y296-L300 VanDerWaalsContact O-CG 3.3Å; Y296-L300 WeakPolarHBondContact O-CG 3.2Å; Y296-L300 PolarHBondContact O-N 3.45Å; Y296-I313 HydrophobicContact CD1-CG2 3.54Å; Y296-I313 HydrophobicContact CE1-CG2 3.74Å; Y296-I317 HydrophobicContact CD1-CD1 3.44Å; Y296-I317 VanDerWaalsContact CD1-CD1 3.44Å; Y296-I317 HydrophobicContact CE1-CD1 4.14Å; Y296-I317 HydrophobicContact CG-CD1 4.05Å
297	L	89	Confident	81.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-45	176.3	-171.1	69.4	0	0	0	112	L293 S294 A299 L300 H301 T337 V341 L404 W405 L408	L293-L297 PolarHBondContact O-N 2.89Å; S294-L297 PolarHBondContact O-N 3.14Å; L297-A299 VanDerWaalsContact C-N 3.34Å; L297-A299 PolarHBondContact O-N 2.89Å; L297-L300 PolarHBondContact O-N 3.41Å; L297-H301 VanDerWaalsContact O-CB 3.24Å; L297-H301 WeakPolarHBondContact O-CB 3.49Å; L297-H301 PolarHBondContact O-N 2.9Å; L297-T337 HydrophobicContact CD1-CG2 3.98Å; L297-V341 HydrophobicContact CD1-CG2 4.11Å; L297-L404 HydrophobicContact CD2-CB 3.91Å; L297-L404 HydrophobicContact CG-CD1 4.48Å; L297-W405 HydrophobicContact CB-CZ2 4.4Å; L297-W405 HydrophobicContact CD2-CD2 3.55Å; L297-W405 HydrophobicContact CD2-CE3 3.77Å; L297-W405 HydrophobicContact CD2-CG 4.09Å; L297-W405 HydrophobicContact CD2-CH2 4.07Å; L297-W405 HydrophobicContact CD2-CZ2 3.87Å; L297-W405 HydrophobicContact CD2-CZ3 4.02Å; L297-L408 HydrophobicContact CD1-CD1 4.12Å; L297-L408 HydrophobicContact CD2-CD1 4.37Å; L297-L408 HydrophobicContact CG-CD1 4.39Å
298	D	85.3	Confident	80.7	Confident	39 Å²	39	40.3 Å²	40.3	21%	0.209	25%	0.247	C	C	.	.	H	α-helix	trans	-59.3	-44	173.9	-86.8	-39.6	0	0	0	111	S294 H301 Q302 L404	S294-D298 WeakPolarHBondContact O-CB 3.46Å; S294-D298 PolarHBondContact O-N 2.66Å; D298-H301 PolarHBondContact O-N 2.97Å; D298-Q302 WeakPolarHBondContact O-CB 2.98Å; D298-Q302 VanDerWaalsContact O-CG 3.23Å; D298-Q302 WeakPolarHBondContact O-CG 3.47Å; D298-Q302 PolarHBondContact O-N 2.78Å; D298-L404 WeakPolarHBondContact OD1-CD1 3.37Å
299	A	84.2	Confident	79.6	Confident	4 Å²	4	45.5 Å²	45.5	3%	0.033	27%	0.272	C	S	.	.	H	α-helix	trans	-64.1	-45.1	179.1	0	0	0	0	0	112.7	S295 Y296 L297 Q302 L303 I313 A314	S295-A299 WeakPolarHBondContact O-CB 3.36Å; S295-A299 PolarHBondContact O-N 3.34Å; S295-A299 VanDerWaalsContact O-N 3.14Å; Y296-A299 PolarHBondContact O-N 3.22Å; L297-A299 VanDerWaalsContact C-N 3.34Å; L297-A299 PolarHBondContact O-N 2.89Å; A299-Q302 PolarHBondContact O-N 2.77Å; A299-L303 PolarHBondContact O-N 3.3Å; A299-I313 HydrophobicContact CB-CB 4.41Å; A299-I313 HydrophobicContact CB-CG2 4.43Å; A299-A314 HydrophobicContact CB-CB 4.22Å; A299-A314 WeakPolarHBondContact O-CB 3.18Å
300	L	85.2	Confident	78.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.3	-44	175.9	-68.6	167.6	0	0	0	111.1	Y296 L297 Q302 L303 S304 A314 I317 T333 I336 L340	Y296-L300 VanDerWaalsContact O-CG 3.3Å; Y296-L300 WeakPolarHBondContact O-CG 3.2Å; Y296-L300 PolarHBondContact O-N 3.45Å; L297-L300 PolarHBondContact O-N 3.41Å; L300-Q302 VanDerWaalsContact C-N 3.34Å; L300-Q302 PolarHBondContact O-N 3.34Å; L300-L303 PolarHBondContact O-N 2.92Å; L300-L303 VanDerWaalsContact O-N 3.1Å; L300-S304 PolarHBondContact O-N 2.98Å; L300-A314 HydrophobicContact CD2-CB 4.29Å; L300-I317 HydrophobicContact CD2-CG2 4.14Å; L300-T333 HydrophobicContact CB-CG2 3.94Å; L300-T333 HydrophobicContact CD2-CG2 3.99Å; L300-T333 WeakPolarHBondContact O-CG2 3.45Å; L300-I336 HydrophobicContact CD1-CB 4.26Å; L300-I336 HydrophobicContact CD1-CG2 3.67Å; L300-L340 HydrophobicContact CD1-CD1 4.13Å
301	H	83	Confident	77.8	Confident	57 Å²	57	50.2 Å²	50.2	26%	0.264	30%	0.3	S	S	.	.	H	α-helix	trans	-62.8	-37.8	177.9	-176.3	-103.6	0	0	0	112.5	L297 D298 L303 T305 L404	L297-H301 VanDerWaalsContact O-CB 3.24Å; L297-H301 WeakPolarHBondContact O-CB 3.49Å; L297-H301 PolarHBondContact O-N 2.9Å; D298-H301 PolarHBondContact O-N 2.97Å; H301-L303 VanDerWaalsContact C-N 3.31Å; H301-L303 PolarHBondContact O-N 3.47Å; H301-T305 WeakPolarHBondContact O-CB 3.3Å; H301-T305 WeakPolarHBondContact O-CG2 3.44Å; H301-T305 PolarHBondContact O-N 3.43Å; H301-T305 PolarHBondContact O-OG1 3.39Å; H301-L404 HydrophobicContact CB-CD1 3.95Å
302	Q	80.1	Confident	77.5	Confident	70 Å²	70	49 Å²	49	33%	0.327	29%	0.289	S	S	.	.	H	α-helix	trans	-62.6	-34.4	172.9	-75.4	170.5	33.9	0	0	113.3	D298 A299 L300 T305 G306 S307 C308 N311	D298-Q302 WeakPolarHBondContact O-CB 2.98Å; D298-Q302 VanDerWaalsContact O-CG 3.23Å; D298-Q302 WeakPolarHBondContact O-CG 3.47Å; D298-Q302 PolarHBondContact O-N 2.78Å; A299-Q302 PolarHBondContact O-N 2.77Å; L300-Q302 VanDerWaalsContact C-N 3.34Å; L300-Q302 PolarHBondContact O-N 3.34Å; Q302-T305 PolarHBondContact O-OG1 3.31Å; Q302-G306 PolarHBondContact O-N 3.37Å; Q302-S307 PolarHBondContact O-N 3.33Å; Q302-C308 HydrophobicContact CB-CB 4.2Å; Q302-C308 PolarHBondContact O-N 2.84Å; Q302-N311 PolarHBondContact OE1-ND2 3.16Å
303	L	78.6	Confident	77.3	Confident	25 Å²	25	49.4 Å²	49.4	13%	0.131	30%	0.295	C	S	.	.	H	α-helix	trans	-74.1	-47.6	179.1	-175.4	58.9	0	0	0	111.1	A299 L300 H301 T305 G306 A314 L315 T333	A299-L303 PolarHBondContact O-N 3.3Å; L300-L303 PolarHBondContact O-N 2.92Å; L300-L303 VanDerWaalsContact O-N 3.1Å; H301-L303 VanDerWaalsContact C-N 3.31Å; H301-L303 PolarHBondContact O-N 3.47Å; L303-T305 PolarHBondContact O-N 3.33Å; L303-G306 PolarHBondContact O-N 2.96Å; L303-A314 HydrophobicContact CB-CB 4.13Å; L303-A314 HydrophobicContact CD2-CB 3.77Å; L303-L315 HydrophobicContact CD2-CD2 4.22Å; L303-T333 HydrophobicContact CB-CG2 4.15Å; L303-T333 HydrophobicContact CD2-CG2 4.47Å; L303-T333 HydrophobicContact CG-CG2 4.46Å
304	S	74	Confident	76.7	Confident	49 Å²	49	49.4 Å²	49.4	34%	0.343	30%	0.295	S	S	.	.	H	α-helix	trans	-69.2	-31.2	178.6	-173.1	0	0	0	0	113.3	L300 G306 D330	L300-S304 PolarHBondContact O-N 2.98Å; S304-G306 PolarHBondContact O-N 3.05Å; S304-D330 PolarHBondContact OG-OD1 3.31Å
305	T	74.2	Confident	76.3	Confident	82 Å²	82	50.3 Å²	50.3	50%	0.503	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-4.3	170.9	55.1	0	0	0	0	113.9	H301 Q302 L303 S307	H301-T305 WeakPolarHBondContact O-CB 3.3Å; H301-T305 WeakPolarHBondContact O-CG2 3.44Å; H301-T305 PolarHBondContact O-N 3.43Å; H301-T305 PolarHBondContact O-OG1 3.39Å; Q302-T305 PolarHBondContact O-OG1 3.31Å; L303-T305 PolarHBondContact O-N 3.33Å; T305-S307 PolarHBondContact O-N 3.39Å
306	G	67.1	Low	76.3	Confident	48 Å²	48	48.6 Å²	48.6	50%	0.495	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	14.5	-176.7	0	0	0	0	0	114.4	Q302 L303 S304	Q302-G306 PolarHBondContact O-N 3.37Å; L303-G306 PolarHBondContact O-N 2.96Å; S304-G306 PolarHBondContact O-N 3.05Å
307	S	63.5	Low	75.9	Confident	97 Å²	97	47.4 Å²	47.4	68%	0.678	28%	0.282	S	S	*	.	S	Bend	trans	-77	-24.1	-177.7	-170.7	0	0	0	0	113.1	Q302 T305	Q302-S307 PolarHBondContact O-N 3.33Å; T305-S307 PolarHBondContact O-N 3.39Å
308	C	59.3	Low	75.5	Confident	47 Å²	47	47.6 Å²	47.6	32%	0.318	28%	0.283	S	S	.	.			trans	-146.4	102.6	172.4	-169.5	0	0	0	0	109.5	Q302 D310	Q302-C308 HydrophobicContact CB-CB 4.2Å; Q302-C308 PolarHBondContact O-N 2.84Å; C308-D310 VanDerWaalsContact C-N 3.32Å; C308-D310 PolarHBondContact O-N 3.12Å
309	I	59.4	Low	75.3	Confident	121 Å²	121	53.6 Å²	53.6	62%	0.621	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-28.4	-174.2	-61.6	170.9	0	0	0	111.6
310	D	64.7	Low	75.1	Confident	132 Å²	132	54.3 Å²	54.3	71%	0.706	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	23.9	-169.5	-56.3	-61.1	0	0	0	113.7	C308 P312	C308-D310 VanDerWaalsContact C-N 3.32Å; C308-D310 PolarHBondContact O-N 3.12Å; D310-P312 VanDerWaalsContact O-CD 3.28Å; D310-P312 WeakPolarHBondContact O-CD 3.26Å; D310-P312 VanDerWaalsContact O-N 3.16Å
311	N	73.7	Confident	74.7	Confident	21 Å²	21	54.7 Å²	54.7	11%	0.112	31%	0.309	C	S	.	.			trans	-65.7	113	179.9	-174.6	-44.6	0	0	0	110.5	Q302 I313 A314 L315	Q302-N311 PolarHBondContact OE1-ND2 3.16Å; N311-I313 VanDerWaalsContact C-N 3.31Å; N311-I313 PolarHBondContact O-N 3.48Å; N311-I313 PolarHBondContact OD1-N 2.9Å; N311-I313 VanDerWaalsContact OD1-N 3.11Å; N311-A314 HydrophobicContact CB-CB 4.21Å; N311-A314 PolarHBondContact O-N 3.32Å; N311-A314 PolarHBondContact OD1-N 2.81Å; N311-L315 WeakPolarHBondContact O-CB 3.28Å; N311-L315 VanDerWaalsContact O-CG 3.31Å; N311-L315 WeakPolarHBondContact O-CG 3.41Å; N311-L315 PolarHBondContact O-N 3.35Å
312	P	75.5	Confident	74	Confident	62 Å²	62	57.5 Å²	57.5	40%	0.403	33%	0.326	S	S	.	.	H	α-helix	trans	-71.5	-25.6	-169.6	29.4	-35.5	0	0	0	113	D310 S316	D310-P312 VanDerWaalsContact O-CD 3.28Å; D310-P312 WeakPolarHBondContact O-CD 3.26Å; D310-P312 VanDerWaalsContact O-N 3.16Å; P312-S316 WeakPolarHBondContact O-CB 3.48Å; P312-S316 PolarHBondContact O-N 3.38Å
313	I	77.7	Confident	73.4	Confident	70 Å²	70	56.4 Å²	56.4	36%	0.359	32%	0.324	S	S	.	.	H	α-helix	trans	-72.1	-51.5	178.7	-60.5	174.7	0	0	0	109	Y296 A299 N311 L315 S316 I317	Y296-I313 HydrophobicContact CD1-CG2 3.54Å; Y296-I313 HydrophobicContact CE1-CG2 3.74Å; A299-I313 HydrophobicContact CB-CB 4.41Å; A299-I313 HydrophobicContact CB-CG2 4.43Å; N311-I313 VanDerWaalsContact C-N 3.31Å; N311-I313 PolarHBondContact O-N 3.48Å; N311-I313 PolarHBondContact OD1-N 2.9Å; N311-I313 VanDerWaalsContact OD1-N 3.11Å; I313-L315 PolarHBondContact O-N 3.16Å; I313-S316 PolarHBondContact O-N 2.9Å; I313-S316 VanDerWaalsContact O-N 3.13Å; I313-I317 HydrophobicContact CG2-CD1 4.07Å; I313-I317 WeakPolarHBondContact O-CG1 3.41Å; I313-I317 PolarHBondContact O-N 2.73Å
314	A	77.7	Confident	72.6	Confident	0 Å²	0	57 Å²	57	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.1	-44.8	176.2	0	0	0	0	0	111.7	A299 L300 L303 N311 S316 I317 C318	A299-A314 HydrophobicContact CB-CB 4.22Å; A299-A314 WeakPolarHBondContact O-CB 3.18Å; L300-A314 HydrophobicContact CD2-CB 4.29Å; L303-A314 HydrophobicContact CB-CB 4.13Å; L303-A314 HydrophobicContact CD2-CB 3.77Å; N311-A314 HydrophobicContact CB-CB 4.21Å; N311-A314 PolarHBondContact O-N 3.32Å; N311-A314 PolarHBondContact OD1-N 2.81Å; A314-S316 VanDerWaalsContact C-N 3.27Å; A314-S316 PolarHBondContact O-N 2.97Å; A314-I317 PolarHBondContact O-N 3.49Å; A314-C318 WeakPolarHBondContact O-CB 3.5Å; A314-C318 PolarHBondContact O-N 3.37Å; A314-C318 PolarHBondContact O-SG 3.46Å; A314-C318 VanDerWaalsContact O-SG 3.36Å
315	L	80.5	Confident	71.9	Confident	37 Å²	37	59.1 Å²	59.1	19%	0.194	36%	0.36	C	S	.	.	H	α-helix	trans	-66.3	-24.6	176.4	-70.2	173.4	0	0	0	113.7	L303 N311 I313 R319 Y329	L303-L315 HydrophobicContact CD2-CD2 4.22Å; N311-L315 WeakPolarHBondContact O-CB 3.28Å; N311-L315 VanDerWaalsContact O-CG 3.31Å; N311-L315 WeakPolarHBondContact O-CG 3.41Å; N311-L315 PolarHBondContact O-N 3.35Å; I313-L315 PolarHBondContact O-N 3.16Å; L315-R319 VanDerWaalsContact O-CD 3.29Å; L315-R319 WeakPolarHBondContact O-CD 3.41Å; L315-R319 VanDerWaalsContact O-CG 3.27Å; L315-R319 WeakPolarHBondContact O-CG 3.33Å; L315-Y329 HydrophobicContact CD2-CD1 4.1Å; L315-Y329 HydrophobicContact CD2-CE1 4.17Å
316	S	81.1	Confident	71.4	Confident	31 Å²	31	56.6 Å²	56.6	22%	0.217	35%	0.346	C	S	.	.	H	α-helix	trans	-75.5	-44.5	170.9	-168.2	0	0	0	0	111.1	K170 P312 I313 A314 R319 L320	K170-S316 WeakPolarHBondContact CE-OG 3.33Å; P312-S316 WeakPolarHBondContact O-CB 3.48Å; P312-S316 PolarHBondContact O-N 3.38Å; I313-S316 PolarHBondContact O-N 2.9Å; I313-S316 VanDerWaalsContact O-N 3.13Å; A314-S316 VanDerWaalsContact C-N 3.27Å; A314-S316 PolarHBondContact O-N 2.97Å; S316-R319 PolarHBondContact O-N 3.43Å; S316-L320 WeakPolarHBondContact O-CD2 3.38Å; S316-L320 WeakPolarHBondContact O-CG 3.44Å
317	I	81.2	Confident	71.5	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.015	33%	0.329	C	S	.	.	H	α-helix	trans	-64.5	-42	179.8	-71	170.6	0	0	0	111.5	F167 Y296 L300 I313 A314 R319 L320 I336	F167-I317 HydrophobicContact CB-CD1 4.38Å; F167-I317 HydrophobicContact CB-CG1 4.35Å; F167-I317 HydrophobicContact CD1-CD1 4.39Å; F167-I317 HydrophobicContact CD1-CG1 4.19Å; F167-I317 HydrophobicContact CD1-CG2 4.41Å; F167-I317 HydrophobicContact CD2-CD1 3.89Å; F167-I317 HydrophobicContact CE1-CG2 4.12Å; F167-I317 HydrophobicContact CE2-CD1 4.21Å; F167-I317 HydrophobicContact CG-CD1 3.99Å; F167-I317 HydrophobicContact CG-CG1 4.12Å; F167-I317 HydrophobicContact CZ-CG2 4.45Å; Y296-I317 HydrophobicContact CD1-CD1 3.44Å; Y296-I317 VanDerWaalsContact CD1-CD1 3.44Å; Y296-I317 HydrophobicContact CE1-CD1 4.14Å; Y296-I317 HydrophobicContact CG-CD1 4.05Å; L300-I317 HydrophobicContact CD2-CG2 4.14Å; I313-I317 HydrophobicContact CG2-CD1 4.07Å; I313-I317 WeakPolarHBondContact O-CG1 3.41Å; I313-I317 PolarHBondContact O-N 2.73Å; A314-I317 PolarHBondContact O-N 3.49Å; I317-R319 PolarHBondContact O-N 3.17Å; I317-R319 VanDerWaalsContact O-N 3.09Å; I317-L320 WeakPolarHBondContact O-CG 3.21Å; I317-L320 PolarHBondContact O-N 2.74Å; I317-I336 HydrophobicContact CG2-CD1 3.67Å; I317-I336 HydrophobicContact CG2-CG2 4.35Å
318	C	80.5	Confident	72.2	Confident	4 Å²	4	52.9 Å²	52.9	3%	0.027	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	4.8	177.1	-62.4	0	0	0	0	114.6	A314 Y329 I332 T333	A314-C318 WeakPolarHBondContact O-CB 3.5Å; A314-C318 PolarHBondContact O-N 3.37Å; A314-C318 PolarHBondContact O-SG 3.46Å; A314-C318 VanDerWaalsContact O-SG 3.36Å; C318-Y329 HydrophobicContact CB-CD1 3.71Å; C318-Y329 HydrophobicContact CB-CE1 4.21Å; C318-I332 HydrophobicContact CB-CB 4.31Å; C318-I332 HydrophobicContact CB-CG2 4.03Å; C318-T333 PolarHBondContact SG-OG1 3.19Å
319	R	81.5	Confident	73.1	Confident	165 Å²	165	55.4 Å²	55.4	62%	0.623	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	1	171.8	-71.5	174.6	-177	163.6	5.2	113.7	L315 S316 I317 Y329	L315-R319 VanDerWaalsContact O-CD 3.29Å; L315-R319 WeakPolarHBondContact O-CD 3.41Å; L315-R319 VanDerWaalsContact O-CG 3.27Å; L315-R319 WeakPolarHBondContact O-CG 3.33Å; S316-R319 PolarHBondContact O-N 3.43Å; I317-R319 PolarHBondContact O-N 3.17Å; I317-R319 VanDerWaalsContact O-N 3.09Å; R319-Y329 HydrophobicContact CG-CE1 3.97Å; R319-Y329 PolarHBondContact NE-OH 3.31Å
320	L	79.5	Confident	73.9	Confident	19 Å²	19	53.3 Å²	53.3	10%	0.099	30%	0.303	C	S	.	.	S	Bend	trans	-81.8	-36.9	-179.2	-48.9	-175.9	0	0	0	113.9	F167 K170 R171 S316 I317	F167-L320 HydrophobicContact CD1-CD1 4.22Å; K170-L320 VanDerWaalsContact CA-CD2 3.47Å; K170-L320 HydrophobicContact CB-CD2 3.59Å; K170-L320 HydrophobicContact CG-CD2 4.15Å; R171-L320 WeakPolarHBondContact O-CD1 3.31Å; S316-L320 WeakPolarHBondContact O-CD2 3.38Å; S316-L320 WeakPolarHBondContact O-CG 3.44Å; I317-L320 WeakPolarHBondContact O-CG 3.21Å; I317-L320 PolarHBondContact O-N 2.74Å
321	P	76.4	Confident	74.5	Confident	9 Å²	9	49 Å²	49	6%	0.058	28%	0.279	C	S	.	.	S	Bend	trans	-74.5	139.8	179.8	-18.2	33.3	0	0	0	113	L217 T323 I332 I336	L217-P321 HydrophobicContact CD2-CB 3.8Å; L217-P321 HydrophobicContact CD2-CG 3.43Å; L217-P321 VanDerWaalsContact CD2-CG 3.43Å; P321-T323 VanDerWaalsContact C-N 3.26Å; P321-T323 HydrophobicContact CB-CG2 4.36Å; P321-T323 PolarHBondContact O-N 2.87Å; P321-I332 HydrophobicContact CG-CG2 4.09Å; P321-I336 HydrophobicContact CG-CD1 4.33Å
322	N	68.2	Low	75.1	Confident	115 Å²	115	48.3 Å²	48.3	62%	0.615	28%	0.275	S	S	*	.			trans	-75.4	68.6	178	-70.5	-66.6	0	0	0	112.8	D172	D172-N322 PolarHBondContact OD2-ND2 2.83Å
323	T	68.4	Low	75.5	Confident	47 Å²	47	45.4 Å²	45.4	29%	0.288	26%	0.256	S	S	.	.			trans	-81.8	145.1	179.8	54.6	0	0	0	0	113.7	P216 P321 V327 I332	P216-T323 WeakPolarHBondContact O-CG2 3.38Å; P321-T323 VanDerWaalsContact C-N 3.26Å; P321-T323 HydrophobicContact CB-CG2 4.36Å; P321-T323 PolarHBondContact O-N 2.87Å; T323-V327 HydrophobicContact CG2-CB 4.27Å; T323-V327 HydrophobicContact CG2-CG1 4.37Å; T323-V327 HydrophobicContact CG2-CG2 4.14Å; T323-I332 HydrophobicContact CG2-CD1 3.91Å; T323-I332 HydrophobicContact CG2-CG1 4.29Å
324	S	61	Low	75.8	Confident	38 Å²	38	46.4 Å²	46.4	27%	0.266	26%	0.259	S	S	.	.			trans	-67.1	147.4	163.3	58.8	0	0	0	0	110.7	E213 S326 V327	E213-S324 PolarHBondContact O-OG 3.35Å; S324-S326 PolarHBondContact O-N 2.99Å; S324-V327 PolarHBondContact O-N 3.29Å
325	G	58.5	Low	76.2	Confident	94 Å²	94	46.8 Å²	46.8	97%	0.969	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	17.6	-171.7	0	0	0	0	0	117.4
326	S	64.7	Low	76.7	Confident	28 Å²	28	45 Å²	45	20%	0.196	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-14.1	175	66.9	0	0	0	0	113.7	S324 F452	S324-S326 PolarHBondContact O-N 2.99Å; S326-F452 WeakPolarHBondContact O-CD1 3.45Å; S326-F452 WeakPolarHBondContact O-CE1 3.46Å
327	V	69.6	Low	77.1	Confident	25 Å²	25	44.1 Å²	44.1	15%	0.152	25%	0.246	C	C	.	.			trans	-81.4	139	-177.2	-173.7	0	0	0	0	111.1	P216 T323 S324 Q331 I332	P216-V327 HydrophobicContact CB-CG1 3.92Å; T323-V327 HydrophobicContact CG2-CB 4.27Å; T323-V327 HydrophobicContact CG2-CG1 4.37Å; T323-V327 HydrophobicContact CG2-CG2 4.14Å; S324-V327 PolarHBondContact O-N 3.29Å; V327-Q331 HydrophobicContact CG1-CB 4.14Å; V327-I332 HydrophobicContact CG1-CD1 4.07Å; V327-I332 HydrophobicContact CG1-CG1 3.57Å
328	T	76.9	Confident	77.5	Confident	42 Å²	42	45.1 Å²	45.1	26%	0.258	25%	0.252	S	S	.	.			trans	-95.3	145.4	173.7	61.2	0	0	0	0	112.4	D330 Q331 I332	T328-D330 PolarHBondContact O-N 2.97Å; T328-D330 VanDerWaalsContact O-N 3.08Å; T328-Q331 WeakPolarHBondContact O-CB 3.24Å; T328-Q331 PolarHBondContact O-N 3.06Å; T328-Q331 PolarHBondContact OG1-OE1 2.88Å; T328-I332 PolarHBondContact O-N 2.85Å
329	Y	78.3	Confident	78	Confident	100 Å²	100	45 Å²	45	39%	0.392	25%	0.251	S	S	.	.	H	α-helix	trans	-48.8	-37.7	179.3	-81.6	-89.8	0	0	0	113.7	L315 C318 R319 Q331 I332 T333	L315-Y329 HydrophobicContact CD2-CD1 4.1Å; L315-Y329 HydrophobicContact CD2-CE1 4.17Å; C318-Y329 HydrophobicContact CB-CD1 3.71Å; C318-Y329 HydrophobicContact CB-CE1 4.21Å; R319-Y329 HydrophobicContact CG-CE1 3.97Å; R319-Y329 PolarHBondContact NE-OH 3.31Å; Y329-Q331 PolarHBondContact O-N 2.77Å; Y329-I332 PolarHBondContact O-N 2.85Å; Y329-T333 WeakPolarHBondContact O-CB 3.04Å; Y329-T333 PolarHBondContact O-N 3.11Å; Y329-T333 PolarHBondContact O-OG1 3.27Å
330	D	75.7	Confident	78.5	Confident	77 Å²	77	37.1 Å²	37.1	41%	0.412	22%	0.222	S	C	.	.	H	α-helix	trans	-59.3	-41.7	175.8	-177.1	36.4	0	0	0	112.4	S304 T328 T333 Q334	S304-D330 PolarHBondContact OG-OD1 3.31Å; T328-D330 PolarHBondContact O-N 2.97Å; T328-D330 VanDerWaalsContact O-N 3.08Å; D330-T333 WeakPolarHBondContact O-CB 3.18Å; D330-T333 PolarHBondContact O-N 3.45Å; D330-Q334 WeakPolarHBondContact O-CB 3.47Å; D330-Q334 PolarHBondContact O-N 2.83Å
331	Q	78.1	Confident	79.1	Confident	42 Å²	42	36.2 Å²	36.2	20%	0.196	22%	0.217	C	C	.	.	H	α-helix	trans	-69	-37.5	176.9	-65.5	165	-70.1	0	0	112.3	P216 V327 T328 Y329 A335	P216-Q331 HydrophobicContact CB-CB 4.46Å; V327-Q331 HydrophobicContact CG1-CB 4.14Å; T328-Q331 WeakPolarHBondContact O-CB 3.24Å; T328-Q331 PolarHBondContact O-N 3.06Å; T328-Q331 PolarHBondContact OG1-OE1 2.88Å; Y329-Q331 PolarHBondContact O-N 2.77Å; Q331-A335 VanDerWaalsContact O-CB 3.31Å; Q331-A335 WeakPolarHBondContact O-CB 3.1Å; Q331-A335 PolarHBondContact O-N 2.95Å
332	I	85.5	Confident	79.7	Confident	7 Å²	7	35.8 Å²	35.8	4%	0.036	21%	0.214	C	C	.	.	H	α-helix	trans	-66.8	-43.5	174.3	-53.6	176.5	0	0	0	109.8	P216 C318 P321 T323 V327 T328 Y329 Q334 A335 I336	P216-I332 HydrophobicContact CB-CG1 4.33Å; C318-I332 HydrophobicContact CB-CB 4.31Å; C318-I332 HydrophobicContact CB-CG2 4.03Å; P321-I332 HydrophobicContact CG-CG2 4.09Å; T323-I332 HydrophobicContact CG2-CD1 3.91Å; T323-I332 HydrophobicContact CG2-CG1 4.29Å; V327-I332 HydrophobicContact CG1-CD1 4.07Å; V327-I332 HydrophobicContact CG1-CG1 3.57Å; T328-I332 PolarHBondContact O-N 2.85Å; Y329-I332 PolarHBondContact O-N 2.85Å; I332-Q334 PolarHBondContact O-N 3.13Å; I332-A335 PolarHBondContact O-N 3.02Å; I332-I336 HydrophobicContact CG2-CD1 3.85Å; I332-I336 HydrophobicContact CG2-CG1 4.4Å; I332-I336 WeakPolarHBondContact O-CG1 3.34Å; I332-I336 PolarHBondContact O-N 3.03Å
333	T	85.4	Confident	80.8	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-58.1	-49	176.6	-53.9	0	0	0	0	110.8	L300 L303 C318 Y329 D330 T337	L300-T333 HydrophobicContact CB-CG2 3.94Å; L300-T333 HydrophobicContact CD2-CG2 3.99Å; L300-T333 WeakPolarHBondContact O-CG2 3.45Å; L303-T333 HydrophobicContact CB-CG2 4.15Å; L303-T333 HydrophobicContact CD2-CG2 4.47Å; L303-T333 HydrophobicContact CG-CG2 4.46Å; C318-T333 PolarHBondContact SG-OG1 3.19Å; Y329-T333 WeakPolarHBondContact O-CB 3.04Å; Y329-T333 PolarHBondContact O-N 3.11Å; Y329-T333 PolarHBondContact O-OG1 3.27Å; D330-T333 WeakPolarHBondContact O-CB 3.18Å; D330-T333 PolarHBondContact O-N 3.45Å; T333-T337 VanDerWaalsContact O-CB 3.28Å; T333-T337 WeakPolarHBondContact O-CB 3.26Å; T333-T337 PolarHBondContact O-N 2.77Å; T333-T337 PolarHBondContact O-OG1 3.28Å
334	Q	83.5	Confident	81.9	Confident	92 Å²	92	28.6 Å²	28.6	43%	0.43	17%	0.174	S	C	.	.	H	α-helix	trans	-62.6	-46.8	177.9	-172.2	178.9	3.5	0	0	111.4	D330 I332 T337 T338	D330-Q334 WeakPolarHBondContact O-CB 3.47Å; D330-Q334 PolarHBondContact O-N 2.83Å; I332-Q334 PolarHBondContact O-N 3.13Å; Q334-T337 WeakPolarHBondContact O-CB 3.3Å; Q334-T337 PolarHBondContact O-N 3.44Å; Q334-T338 PolarHBondContact O-N 3.28Å; Q334-T338 PolarHBondContact O-OG1 2.81Å
335	A	86.9	Confident	83.2	Confident	8 Å²	8	31.3 Å²	31.3	7%	0.066	18%	0.178	C	C	.	.	H	α-helix	trans	-59	-51.6	179.9	0	0	0	0	0	112.2	T209 P216 L217 Q331 I332 T337 T338 C339	T209-A335 HydrophobicContact CG2-CB 4.22Å; P216-A335 HydrophobicContact CB-CB 4.07Å; P216-A335 HydrophobicContact CG-CB 3.78Å; L217-A335 HydrophobicContact CD1-CB 3.87Å; L217-A335 HydrophobicContact CG-CB 3.98Å; Q331-A335 VanDerWaalsContact O-CB 3.31Å; Q331-A335 WeakPolarHBondContact O-CB 3.1Å; Q331-A335 PolarHBondContact O-N 2.95Å; I332-A335 PolarHBondContact O-N 3.02Å; A335-T337 VanDerWaalsContact C-N 3.31Å; A335-T337 PolarHBondContact O-N 3.25Å; A335-T338 PolarHBondContact O-N 2.94Å; A335-C339 PolarHBondContact O-N 3.46Å; A335-C339 PolarHBondContact O-SG 3.16Å
336	I	90.4	Very high	84.7	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62	-41.1	178.8	-61.9	174.5	0	0	0	110.6	F167 L177 L217 L300 I317 P321 I332 C339 L340	F167-I336 HydrophobicContact CZ-CG2 4.4Å; L177-I336 HydrophobicContact CD1-CG1 4.46Å; L177-I336 HydrophobicContact CD1-CG2 4.42Å; L217-I336 HydrophobicContact CD1-CG1 4.29Å; L217-I336 HydrophobicContact CD2-CD1 4.25Å; L217-I336 HydrophobicContact CD2-CG1 3.78Å; L300-I336 HydrophobicContact CD1-CB 4.26Å; L300-I336 HydrophobicContact CD1-CG2 3.67Å; I317-I336 HydrophobicContact CG2-CD1 3.67Å; I317-I336 HydrophobicContact CG2-CG2 4.35Å; P321-I336 HydrophobicContact CG-CD1 4.33Å; I332-I336 HydrophobicContact CG2-CD1 3.85Å; I332-I336 HydrophobicContact CG2-CG1 4.4Å; I332-I336 WeakPolarHBondContact O-CG1 3.34Å; I332-I336 PolarHBondContact O-N 3.03Å; I336-C339 PolarHBondContact O-N 3.36Å; I336-L340 HydrophobicContact CG2-CD1 4.04Å; I336-L340 HydrophobicContact CG2-CG 4.31Å; I336-L340 WeakPolarHBondContact O-CG 3.38Å; I336-L340 PolarHBondContact O-N 2.95Å
337	T	89.7	Confident	85.8	Confident	12 Å²	12	27.4 Å²	27.4	7%	0.074	13%	0.13	C	C	.	.	H	α-helix	trans	-59.3	-47.8	176.4	-59.4	0	0	0	0	111.6	L297 T333 Q334 A335 L340 V341 L408	L297-T337 HydrophobicContact CD1-CG2 3.98Å; T333-T337 VanDerWaalsContact O-CB 3.28Å; T333-T337 WeakPolarHBondContact O-CB 3.26Å; T333-T337 PolarHBondContact O-N 2.77Å; T333-T337 PolarHBondContact O-OG1 3.28Å; Q334-T337 WeakPolarHBondContact O-CB 3.3Å; Q334-T337 PolarHBondContact O-N 3.44Å; A335-T337 VanDerWaalsContact C-N 3.31Å; A335-T337 PolarHBondContact O-N 3.25Å; T337-L340 PolarHBondContact O-N 2.66Å; T337-V341 VanDerWaalsContact O-CG2 3.28Å; T337-V341 WeakPolarHBondContact O-CG2 3.27Å; T337-V341 PolarHBondContact O-N 3.41Å; T337-V341 VanDerWaalsContact O-N 3.09Å; T337-L408 HydrophobicContact CG2-CD1 3.8Å
338	T	88.4	Confident	86.6	Confident	23 Å²	23	27.6 Å²	27.6	14%	0.141	13%	0.133	C	C	.	.	H	α-helix	trans	-65.5	-38.6	178	-62.6	0	0	0	0	111.8	Q334 A335 T342 Y411	Q334-T338 PolarHBondContact O-N 3.28Å; Q334-T338 PolarHBondContact O-OG1 2.81Å; A335-T338 PolarHBondContact O-N 2.94Å; T338-T342 WeakPolarHBondContact O-CB 3.37Å; T338-T342 PolarHBondContact O-N 2.97Å; T338-T342 PolarHBondContact O-OG1 3.47Å; T338-Y411 HydrophobicContact CG2-CD1 4.35Å; T338-Y411 HydrophobicContact CG2-CD2 3.88Å; T338-Y411 HydrophobicContact CG2-CE1 4.13Å; T338-Y411 HydrophobicContact CG2-CE2 3.64Å; T338-Y411 HydrophobicContact CG2-CG 4.21Å
339	C	92.2	Very high	86.4	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.007	13%	0.133	C	C	.	.	H	α-helix	trans	-63.8	-47.2	175.3	-64.9	0	0	0	0	112.3	L177 V181 A335 I336 V341 T342 A343	L177-C339 HydrophobicContact CB-CB 4.11Å; L177-C339 HydrophobicContact CD1-CB 4.16Å; L177-C339 HydrophobicContact CD2-CB 3.97Å; L177-C339 HydrophobicContact CG-CB 4.3Å; V181-C339 HydrophobicContact CG2-CB 4.3Å; A335-C339 PolarHBondContact O-N 3.46Å; A335-C339 PolarHBondContact O-SG 3.16Å; I336-C339 PolarHBondContact O-N 3.36Å; C339-V341 PolarHBondContact O-N 3.01Å; C339-T342 WeakPolarHBondContact O-CB 3.5Å; C339-T342 PolarHBondContact O-N 3.42Å; C339-T342 VanDerWaalsContact O-N 3.14Å; C339-A343 PolarHBondContact O-N 3.06Å
340	L	92.3	Very high	85.7	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.4	-44.1	178.1	-71.6	174.6	0	0	0	112.4	I163 F167 L177 L293 L300 I336 T337 T342 A343 H344 W405	I163-L340 HydrophobicContact CG2-CD2 4.36Å; F167-L340 HydrophobicContact CZ-CD1 4.41Å; F167-L340 HydrophobicContact CZ-CD2 4.45Å; L177-L340 HydrophobicContact CD2-CD2 4.34Å; L293-L340 HydrophobicContact CD1-CD2 4.28Å; L300-L340 HydrophobicContact CD1-CD1 4.13Å; I336-L340 HydrophobicContact CG2-CD1 4.04Å; I336-L340 HydrophobicContact CG2-CG 4.31Å; I336-L340 WeakPolarHBondContact O-CG 3.38Å; I336-L340 PolarHBondContact O-N 2.95Å; T337-L340 PolarHBondContact O-N 2.66Å; L340-T342 VanDerWaalsContact C-N 3.25Å; L340-T342 PolarHBondContact O-N 3.46Å; L340-A343 WeakPolarHBondContact O-CB 3.36Å; L340-A343 PolarHBondContact O-N 3.4Å; L340-H344 PolarHBondContact O-N 2.83Å; L340-W405 HydrophobicContact CB-CZ3 4.33Å
341	V	91.1	Very high	84.7	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.7	-29.4	176.6	174.6	0	0	0	0	111.5	L297 T337 C339 R345 W405 L408 P410	L297-V341 HydrophobicContact CD1-CG2 4.11Å; T337-V341 VanDerWaalsContact O-CG2 3.28Å; T337-V341 WeakPolarHBondContact O-CG2 3.27Å; T337-V341 PolarHBondContact O-N 3.41Å; T337-V341 VanDerWaalsContact O-N 3.09Å; C339-V341 PolarHBondContact O-N 3.01Å; V341-R345 WeakPolarHBondContact O-CG 3.43Å; V341-R345 PolarHBondContact O-N 2.98Å; V341-W405 HydrophobicContact CG2-CE3 4.46Å; V341-L408 HydrophobicContact CB-CB 4.46Å; V341-L408 HydrophobicContact CG1-CB 4.08Å; V341-L408 HydrophobicContact CG2-CB 3.74Å; V341-L408 HydrophobicContact CG2-CD1 3.86Å; V341-L408 HydrophobicContact CG2-CG 4.46Å; V341-P410 HydrophobicContact CG1-CB 4.28Å
342	T	89.9	Confident	82.9	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-73.7	-37.7	173.5	-55.8	0	0	0	0	112	V181 Y184 T338 C339 L340 R345 Y346 P410 Y411	V181-T342 HydrophobicContact CG2-CG2 4.28Å; Y184-T342 HydrophobicContact CD1-CG2 3.31Å; Y184-T342 HydrophobicContact CD2-CG2 4.12Å; Y184-T342 HydrophobicContact CE1-CG2 3.76Å; Y184-T342 HydrophobicContact CG-CG2 3.49Å; Y184-T342 VanDerWaalsContact CG-CG2 3.49Å; T338-T342 WeakPolarHBondContact O-CB 3.37Å; T338-T342 PolarHBondContact O-N 2.97Å; T338-T342 PolarHBondContact O-OG1 3.47Å; C339-T342 WeakPolarHBondContact O-CB 3.5Å; C339-T342 PolarHBondContact O-N 3.42Å; C339-T342 VanDerWaalsContact O-N 3.14Å; L340-T342 VanDerWaalsContact C-N 3.25Å; L340-T342 PolarHBondContact O-N 3.46Å; T342-R345 WeakPolarHBondContact O-CB 3.47Å; T342-R345 PolarHBondContact O-N 3.29Å; T342-Y346 PolarHBondContact O-N 3.5Å; T342-P410 WeakPolarHBondContact OG1-CA 3.21Å; T342-P410 WeakPolarHBondContact OG1-CB 3.5Å; T342-Y411 HydrophobicContact CG2-CD2 4.04Å; T342-Y411 VanDerWaalsContact OG1-CD2 3.31Å; T342-Y411 WeakPolarHBondContact OG1-CD2 3.41Å; T342-Y411 PolarHBondContact OG1-N 3.39Å
343	A	91.5	Very high	80.4	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-61.5	-46.5	173.1	0	0	0	0	0	112	I180 F289 C339 L340 R345 Y346 Y347	I180-A343 HydrophobicContact CD1-CB 4.4Å; I180-A343 HydrophobicContact CG2-CB 3.62Å; F289-A343 HydrophobicContact CE2-CB 4.49Å; F289-A343 HydrophobicContact CZ-CB 3.84Å; C339-A343 PolarHBondContact O-N 3.06Å; L340-A343 WeakPolarHBondContact O-CB 3.36Å; L340-A343 PolarHBondContact O-N 3.4Å; A343-R345 VanDerWaalsContact C-N 3.27Å; A343-R345 PolarHBondContact O-N 3.37Å; A343-Y346 WeakPolarHBondContact O-CB 3.25Å; A343-Y346 PolarHBondContact O-N 3.42Å; A343-Y346 VanDerWaalsContact O-N 3.12Å; A343-Y347 WeakPolarHBondContact O-CD2 3.15Å; A343-Y347 PolarHBondContact O-N 3.09Å; A343-Y347 VanDerWaalsContact O-N 3.1Å
344	H	90.6	Very high	77.6	Confident	11 Å²	11	38.3 Å²	38.3	5%	0.051	21%	0.209	C	C	.	.	H	α-helix	trans	-54.8	-42.6	172.7	179	-87.7	0	0	0	112.4	F289 E290 L340 S348 W405	F289-H344 HydrophobicContact CE1-CB 4.05Å; E290-H344 WeakPolarHBondContact CG-NE2 3.44Å; E290-H344 IonicContact OE1-CD2 3.37Å; E290-H344 IonicContact OE1-CE1 2.74Å; E290-H344 IonicContact OE1-NE2 3.38Å; E290-H344 PolarHBondContact OE1-NE2 2.87Å; L340-H344 PolarHBondContact O-N 2.83Å; H344-S348 WeakPolarHBondContact O-CB 3.21Å; H344-S348 PolarHBondContact O-N 2.88Å; H344-S348 PolarHBondContact O-OG 2.84Å; H344-W405 HydrophobicContact CB-CE3 3.61Å; H344-W405 HydrophobicContact CB-CZ3 3.91Å; H344-W405 AromaticContact CD2-CE3 3.99Å; H344-W405 AromaticContact CG-CE3 3.82Å
345	R	87.6	Confident	75	Confident	94 Å²	94	38.7 Å²	38.7	36%	0.355	23%	0.227	S	C	.	.	H	α-helix	trans	-67.2	-36.5	176.6	-70	-80.7	-176.9	149.2	2.9	113.2	Y184 V341 T342 A343 S348 M349 P410	Y184-R345 HydrophobicContact CD2-CB 4.44Å; Y184-R345 HydrophobicContact CE2-CB 3.74Å; V341-R345 WeakPolarHBondContact O-CG 3.43Å; V341-R345 PolarHBondContact O-N 2.98Å; T342-R345 WeakPolarHBondContact O-CB 3.47Å; T342-R345 PolarHBondContact O-N 3.29Å; A343-R345 VanDerWaalsContact C-N 3.27Å; A343-R345 PolarHBondContact O-N 3.37Å; R345-S348 PolarHBondContact O-N 3.27Å; R345-M349 WeakPolarHBondContact O-CB 3.48Å; R345-M349 WeakPolarHBondContact O-CG 3.27Å; R345-M349 PolarHBondContact O-N 3.38Å; R345-P410 HydrophobicContact CG-CB 4.07Å; R345-P410 HydrophobicContact CG-CG 4.04Å
346	Y	89.6	Confident	72.1	Confident	29 Å²	29	45.4 Å²	45.4	11%	0.114	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-48.5	175.7	174.3	-105.4	0	0	0	112.2	I180 Q183 T342 A343 M349 S350	I180-Y346 HydrophobicContact CG2-CD1 4.11Å; I180-Y346 HydrophobicContact CG2-CG 4.34Å; Q183-Y346 HydrophobicContact CB-CD2 4.33Å; Q183-Y346 HydrophobicContact CB-CE2 3.66Å; T342-Y346 PolarHBondContact O-N 3.5Å; A343-Y346 WeakPolarHBondContact O-CB 3.25Å; A343-Y346 PolarHBondContact O-N 3.42Å; A343-Y346 VanDerWaalsContact O-N 3.12Å; Y346-M349 PolarHBondContact O-N 2.83Å; Y346-S350 PolarHBondContact O-N 3.11Å; Y346-S350 PolarHBondContact O-OG 2.89Å
347	Y	89.6	Confident	69.1	Low	12 Å²	12	56.5 Å²	56.5	5%	0.047	31%	0.306	C	S	.	.	H	α-helix	trans	-66.3	-40.5	175.8	-65	-61.4	0	0	0	111.5	L153 P156 C159 F289 A343 M349 S350	L153-Y347 WeakPolarHBondContact O-CE1 3.31Å; L153-Y347 PolarHBondContact O-OH 2.88Å; P156-Y347 HydrophobicContact CB-CD1 4.12Å; P156-Y347 HydrophobicContact CB-CD2 4.26Å; P156-Y347 HydrophobicContact CB-CG 3.97Å; P156-Y347 HydrophobicContact CG-CD1 3.68Å; P156-Y347 HydrophobicContact CG-CE1 4.34Å; P156-Y347 HydrophobicContact CG-CG 3.86Å; C159-Y347 HydrophobicContact CB-CE2 4.46Å; C159-Y347 WeakPolarHBondContact CB-OH 3.2Å; C159-Y347 PolarHBondContact SG-OH 2.85Å; F289-Y347 HydrophobicContact CD2-CD2 4.3Å; F289-Y347 HydrophobicContact CD2-CE2 4.29Å; F289-Y347 HydrophobicContact CE2-CD2 4.15Å; F289-Y347 AromaticContact CE2-CE2 3.93Å; F289-Y347 HydrophobicContact CE2-CE2 3.93Å; A343-Y347 WeakPolarHBondContact O-CD2 3.15Å; A343-Y347 PolarHBondContact O-N 3.09Å; A343-Y347 VanDerWaalsContact O-N 3.1Å; Y347-M349 PolarHBondContact O-N 3.38Å; Y347-S350 VanDerWaalsContact O-CB 3.26Å; Y347-S350 WeakPolarHBondContact O-CB 3.12Å; Y347-S350 PolarHBondContact O-N 2.99Å
348	S	85.1	Confident	66.2	Low	29 Å²	29	61.4 Å²	61.4	20%	0.203	34%	0.338	C	S	.	.	H	α-helix	trans	-57.4	-43.7	172	-58.5	0	0	0	0	113	H344 R345 S350 Q351	H344-S348 WeakPolarHBondContact O-CB 3.21Å; H344-S348 PolarHBondContact O-N 2.88Å; H344-S348 PolarHBondContact O-OG 2.84Å; R345-S348 PolarHBondContact O-N 3.27Å; S348-S350 PolarHBondContact O-N 3.32Å; S348-Q351 PolarHBondContact O-N 2.95Å; S348-Q351 PolarHBondContact O-OE1 2.97Å
349	M	72.8	Confident	63.2	Low	54 Å²	54	67.8 Å²	67.8	27%	0.266	37%	0.366	S	S	.	.	H	α-helix	trans	-69.1	-11.8	177.5	-76.3	-179.6	66.8	0	0	113.7	Y184 R187 R345 Y346 Y347 Q351	Y184-M349 HydrophobicContact CD2-SD 4.35Å; Y184-M349 HydrophobicContact CE2-SD 3.67Å; R187-M349 PolarHBondContact NH2-O 2.68Å; R345-M349 WeakPolarHBondContact O-CB 3.48Å; R345-M349 WeakPolarHBondContact O-CG 3.27Å; R345-M349 PolarHBondContact O-N 3.38Å; Y346-M349 PolarHBondContact O-N 2.83Å; Y347-M349 PolarHBondContact O-N 3.38Å; M349-Q351 PolarHBondContact O-N 3.26Å
350	S	63.9	Low	60.2	Low	22 Å²	22	74.6 Å²	74.6	15%	0.154	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-2.9	179	-60.7	0	0	0	0	114.3	R187 Y346 Y347 S348	R187-S350 PolarHBondContact NH1-OG 2.96Å; Y346-S350 PolarHBondContact O-N 3.11Å; Y346-S350 PolarHBondContact O-OG 2.89Å; Y347-S350 VanDerWaalsContact O-CB 3.26Å; Y347-S350 WeakPolarHBondContact O-CB 3.12Å; Y347-S350 PolarHBondContact O-N 2.99Å; S348-S350 PolarHBondContact O-N 3.32Å
351	Q	54.7	Low	57	Low	78 Å²	78	84.1 Å²	84.1	36%	0.364	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-13.5	176.4	-65	168.4	-25.7	0	0	113.8	E283 S348 M349	E283-Q351 VanDerWaalsContact OE1-CD 3.24Å; E283-Q351 WeakPolarHBondContact OE1-CG 3.33Å; E283-Q351 PolarHBondContact OE1-NE2 2.96Å; S348-Q351 PolarHBondContact O-N 2.95Å; S348-Q351 PolarHBondContact O-OE1 2.97Å; M349-Q351 PolarHBondContact O-N 3.26Å
352	I	39.6	Very low	53.9	Low	140 Å²	140	91.3 Å²	91.3	72%	0.718	48%	0.482	S	S	*	.	S	Bend	trans	-100.3	8.6	-163.2	-53.2	170	0	0	0	112.6
353	S	32.9	Very low	50.9	Low	89 Å²	89	97.1 Å²	97.1	62%	0.622	52%	0.523	S	S	*	.	S	Bend	trans	-117.1	23.6	-172.9	59.6	0	0	0	0	115.6
354	S	28.5	Very low	47.8	Very low	110 Å²	110	100.9 Å²	100.9	77%	0.769	56%	0.562	S	S	*	*			trans	-123	83	170.6	55.9	0	0	0	0	109.7
355	A	27.9	Very low	44.8	Very low	99 Å²	99	108 Å²	108	82%	0.818	60%	0.595	S	S	*	*			trans	-108	100.3	-174.9	0	0	0	0	0	110.8
356	D	26.6	Very low	42	Very low	150 Å²	150	106.6 Å²	106.6	80%	0.802	60%	0.599	S	S	*	*			trans	-152.5	55.8	171.7	-147.5	2.2	0	0	0	112.4
357	Y	27.3	Very low	39.1	Very low	232 Å²	232	113.4 Å²	113.4	91%	0.91	64%	0.636	S	S	*	*	S	Bend	trans	-151.9	149.7	158	-89.7	-71.7	0	0	0	109.8
358	P	28.5	Very low	36.2	Very low	116 Å²	116	122 Å²	122	75%	0.753	67%	0.668	S	S	*	*			trans	-79.4	154	-160.7	-17.7	33	0	0	0	116.7	T360	P358-T360 PolarHBondContact O-N 2.74Å
359	E	24.8	Very low	33.6	Very low	157 Å²	157	126.7 Å²	126.7	73%	0.734	69%	0.687	S	S	*	*			trans	-61.6	129.9	169.6	-61.1	-171.7	139.6	0	0	112.2	R361	E359-R361 IonicContact OE2-NH1 3.33Å
360	T	29	Very low	31.8	Very low	144 Å²	144	128 Å²	128	88%	0.883	70%	0.702	S	S	*	*			trans	-121.8	144.6	146.3	42.5	0	0	0	0	108	P358	P358-T360 PolarHBondContact O-N 2.74Å
361	R	26.3	Very low	30.3	Very low	200 Å²	200	132.8 Å²	132.8	76%	0.755	73%	0.725	S	S	*	*			trans	-109.3	161.8	-166.1	-66.5	159.9	81.4	131.7	-3.9	110.7	E359	E359-R361 IonicContact OE2-NH1 3.33Å
362	D	25.2	Very low	29.2	Very low	150 Å²	150	135.8 Å²	135.8	80%	0.802	74%	0.737	S	S	*	*	S	Bend	trans	78.7	142.2	177.3	-52.6	-32.4	0	0	0	117.3
363	S	27.8	Very low	28.8	Very low	122 Å²	122	131.6 Å²	131.6	85%	0.853	72%	0.723	S	S	*	*	S	Bend	trans	66.4	128.9	-167.3	77.1	0	0	0	0	116.1	H365	S363-H365 PolarHBondContact O-N 3.49Å
364	G	26.5	Very low	28.8	Very low	80 Å²	80	132.4 Å²	132.4	83%	0.825	71%	0.712	S	S	*	*			trans	-95.5	89.6	-168.9	0	0	0	0	0	114.8
365	H	27.5	Very low	29	Very low	160 Å²	160	130.9 Å²	130.9	74%	0.741	70%	0.702	S	S	*	*			trans	-152.3	153.9	172.3	-106.6	50.6	0	0	0	111.2	S363	S363-H365 PolarHBondContact O-N 3.49Å
366	S	26.9	Very low	29.1	Very low	65 Å²	65	130 Å²	130	46%	0.455	68%	0.68	S	S	.	*			cis	-168.6	134.8	-25.7	178.9	0	0	0	0	109.4
367	I	30.5	Very low	29.4	Very low	173 Å²	173	128 Å²	128	89%	0.887	67%	0.666	S	S	*	*			trans	-132.8	65.1	175.4	-44.5	179.7	0	0	0	110.4
368	R	28.4	Very low	29.6	Very low	191 Å²	191	121.2 Å²	121.2	72%	0.721	65%	0.645	S	S	*	*			trans	-144.4	85.7	164.4	-76.6	-167.7	177.1	-172	-2.6	109.4
369	H	30.5	Very low	29.8	Very low	128 Å²	128	121.3 Å²	121.3	59%	0.593	64%	0.638	S	S	*	*			trans	-132	46.6	-171.7	-111.8	-100	0	0	0	114.5	R374	H369-R374 PolarHBondContact NE2-NH1 2.81Å
370	S	35.1	Very low	30.2	Very low	82 Å²	82	116.8 Å²	116.8	57%	0.573	62%	0.622	S	S	*	*			trans	-85.3	111.2	149.9	177.7	0	0	0	0	108.4	F372 A373	S370-F372 PolarHBondContact O-N 2.77Å; S370-F372 VanDerWaalsContact O-N 3.17Å; S370-A373 PolarHBondContact O-N 2.74Å
371	L	32.5	Very low	30.4	Very low	122 Å²	122	114.3 Å²	114.3	64%	0.639	61%	0.606	S	S	*	*	H	α-helix	trans	-61.2	-24.6	-177.5	-66.6	171.2	0	0	0	112.4	A373 R374	L371-A373 VanDerWaalsContact C-N 3.32Å; L371-A373 PolarHBondContact O-N 2.55Å; L371-R374 PolarHBondContact O-N 3.44Å
372	F	30.1	Very low	30.6	Very low	142 Å²	142	109.7 Å²	109.7	62%	0.623	61%	0.605	S	S	*	*	H	α-helix	trans	-64.9	-32.2	179.5	-139.3	-86.4	0	0	0	113.4	S370 R753	S370-F372 PolarHBondContact O-N 2.77Å; S370-F372 VanDerWaalsContact O-N 3.17Å; F372-R753 VanDerWaalsContact CZ-NH1 3.26Å
373	A	32.8	Very low	31	Very low	52 Å²	52	106.3 Å²	106.3	43%	0.43	60%	0.598	S	S	.	*	H	α-helix	trans	-75.6	-39.3	177.9	0	0	0	0	0	112.1	S370 L371 S375 F376 E377	S370-A373 PolarHBondContact O-N 2.74Å; L371-A373 VanDerWaalsContact C-N 3.32Å; L371-A373 PolarHBondContact O-N 2.55Å; A373-S375 PolarHBondContact O-N 3.32Å; A373-F376 WeakPolarHBondContact O-CB 3.2Å; A373-F376 PolarHBondContact O-N 3.04Å; A373-F376 VanDerWaalsContact O-N 3.15Å; A373-E377 PolarHBondContact O-N 3.2Å
374	R	31.2	Very low	31	Very low	105 Å²	105	107.3 Å²	107.3	40%	0.396	59%	0.593	S	S	.	*	H	α-helix	trans	-72.5	-32.9	-168.6	-151.9	168.8	-175.2	173.5	-1.4	113	H369 L371 F376 N378	H369-R374 PolarHBondContact NE2-NH1 2.81Å; L371-R374 PolarHBondContact O-N 3.44Å; R374-F376 VanDerWaalsContact C-N 3.32Å; R374-N378 WeakPolarHBondContact O-CB 3.3Å; R374-N378 PolarHBondContact O-N 2.83Å; R374-N378 PolarHBondContact O-ND2 3.31Å
375	S	32.8	Very low	31.1	Very low	78 Å²	78	106.9 Å²	106.9	55%	0.545	59%	0.589	S	S	.	*	H	α-helix	trans	-64.1	-37.4	170.6	-61	0	0	0	0	112.2	A373 N378 L379	A373-S375 PolarHBondContact O-N 3.32Å; S375-N378 PolarHBondContact O-N 3.37Å; S375-L379 WeakPolarHBondContact O-CG 3.46Å; S375-L379 PolarHBondContact O-N 2.95Å
376	F	31.3	Very low	31.1	Very low	82 Å²	82	107.7 Å²	107.7	36%	0.36	60%	0.598	S	S	.	*	H	α-helix	trans	-72.6	-39.9	179.4	-165.9	-99.2	0	0	0	112.7	A373 R374 L379 T380 L397 S399	A373-F376 WeakPolarHBondContact O-CB 3.2Å; A373-F376 PolarHBondContact O-N 3.04Å; A373-F376 VanDerWaalsContact O-N 3.15Å; R374-F376 VanDerWaalsContact C-N 3.32Å; F376-L379 PolarHBondContact O-N 3.38Å; F376-T380 HydrophobicContact CE1-CG2 4.44Å; F376-T380 PolarHBondContact O-N 3.3Å; F376-T380 VanDerWaalsContact O-N 3.14Å; F376-T380 PolarHBondContact O-OG1 3.26Å; F376-L397 HydrophobicContact CZ-CD2 4.47Å; F376-S399 WeakPolarHBondContact CZ-OG 3.09Å
377	E	31.6	Very low	31.1	Very low	107 Å²	107	108 Å²	108	50%	0.5	61%	0.611	S	S	.	*	H	α-helix	trans	-65.9	-37	172.1	-69.9	-174.4	141.6	0	0	112.1	A373 T380 T381	A373-E377 PolarHBondContact O-N 3.2Å; E377-T380 WeakPolarHBondContact CA-OG1 3.47Å; E377-T380 PolarHBondContact O-N 3.23Å; E377-T380 PolarHBondContact O-OG1 3.31Å; E377-T381 WeakPolarHBondContact O-CB 3.34Å; E377-T381 WeakPolarHBondContact O-CG2 3.27Å; E377-T381 PolarHBondContact O-N 2.99Å; E377-T381 PolarHBondContact O-OG1 2.71Å
378	N	32.4	Very low	31	Very low	89 Å²	89	105.8 Å²	105.8	48%	0.476	61%	0.611	S	S	.	*	H	α-helix	trans	-69.4	-37.2	176.3	-74.9	-11.3	0	0	0	112.8	R374 S375 T381 S382	R374-N378 WeakPolarHBondContact O-CB 3.3Å; R374-N378 PolarHBondContact O-N 2.83Å; R374-N378 PolarHBondContact O-ND2 3.31Å; S375-N378 PolarHBondContact O-N 3.37Å; N378-T381 WeakPolarHBondContact CA-OG1 3.38Å; N378-T381 PolarHBondContact O-OG1 3.29Å; N378-S382 VanDerWaalsContact O-CB 3.26Å; N378-S382 WeakPolarHBondContact O-CB 3.25Å; N378-S382 PolarHBondContact O-N 3.14Å; N378-S382 PolarHBondContact O-OG 3.08Å
379	L	32	Very low	30.9	Very low	118 Å²	118	103.7 Å²	103.7	62%	0.618	62%	0.619	S	S	*	*	H	α-helix	trans	-65.5	-38.8	173.8	-78.6	165.2	0	0	0	112.3	S375 F376	S375-L379 WeakPolarHBondContact O-CG 3.46Å; S375-L379 PolarHBondContact O-N 2.95Å; F376-L379 PolarHBondContact O-N 3.38Å
380	T	33.4	Very low	30.8	Very low	62 Å²	62	103.4 Å²	103.4	38%	0.38	63%	0.631	S	S	.	*	H	α-helix	trans	-78.9	-28.7	179.2	43.7	0	0	0	0	113.8	F376 E377	F376-T380 HydrophobicContact CE1-CG2 4.44Å; F376-T380 PolarHBondContact O-N 3.3Å; F376-T380 VanDerWaalsContact O-N 3.14Å; F376-T380 PolarHBondContact O-OG1 3.26Å; E377-T380 WeakPolarHBondContact CA-OG1 3.47Å; E377-T380 PolarHBondContact O-N 3.23Å; E377-T380 PolarHBondContact O-OG1 3.31Å
381	T	32.7	Very low	30.4	Very low	92 Å²	92	102.5 Å²	102.5	56%	0.564	64%	0.635	S	S	*	*	H	α-helix	trans	-79.6	-36.6	174.2	48	0	0	0	0	113.1	E377 N378 A383 L384	E377-T381 WeakPolarHBondContact O-CB 3.34Å; E377-T381 WeakPolarHBondContact O-CG2 3.27Å; E377-T381 PolarHBondContact O-N 2.99Å; E377-T381 PolarHBondContact O-OG1 2.71Å; N378-T381 WeakPolarHBondContact CA-OG1 3.38Å; N378-T381 PolarHBondContact O-OG1 3.29Å; T381-A383 PolarHBondContact O-N 3.04Å; T381-L384 PolarHBondContact O-N 3.11Å; T381-L384 VanDerWaalsContact O-N 3.16Å
382	S	32.4	Very low	30.2	Very low	104 Å²	104	103 Å²	103	73%	0.727	65%	0.649	S	S	*	*	H	α-helix	trans	-65	-23.6	177.5	-57.9	0	0	0	0	113.4	N378	N378-S382 VanDerWaalsContact O-CB 3.26Å; N378-S382 WeakPolarHBondContact O-CB 3.25Å; N378-S382 PolarHBondContact O-N 3.14Å; N378-S382 PolarHBondContact O-OG 3.08Å
383	A	33	Very low	30	Very low	79 Å²	79	104.3 Å²	104.3	65%	0.653	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-4.1	177.1	0	0	0	0	0	114.7	T381	T381-A383 PolarHBondContact O-N 3.04Å
384	L	28.1	Very low	29.7	Very low	142 Å²	142	104.2 Å²	104.2	74%	0.743	67%	0.665	S	S	*	*			trans	-125.1	41.2	-169	-69.5	177.6	0	0	0	114.4	T381 L386	T381-L384 PolarHBondContact O-N 3.11Å; T381-L384 VanDerWaalsContact O-N 3.16Å; L384-L386 PolarHBondContact O-N 3.42Å
385	G	27.7	Very low	29.5	Very low	72 Å²	72	103.6 Å²	103.6	74%	0.742	68%	0.677	S	S	*	*			trans	-70	86.1	169.6	0	0	0	0	0	114.1
386	L	27.4	Very low	29.2	Very low	177 Å²	177	102.4 Å²	102.4	93%	0.927	68%	0.677	S	S	*	*	S	Bend	trans	43.1	103.5	151.7	-63.8	166.9	0	0	0	118.3	L384	L384-L386 PolarHBondContact O-N 3.42Å
387	G	27.6	Very low	29	Very low	72 Å²	72	104.6 Å²	104.6	74%	0.742	69%	0.691	S	S	*	*			trans	-169.1	6.3	176.5	0	0	0	0	0	122.7	V389	G387-V389 PolarHBondContact O-N 3.23Å
388	S	27.5	Very low	28.8	Very low	125 Å²	125	104.3 Å²	104.3	87%	0.874	70%	0.702	S	S	*	*			trans	24.3	86.4	169	-163.7	0	0	0	0	119.7
389	V	27.4	Very low	29.1	Very low	147 Å²	147	102.4 Å²	102.4	89%	0.891	70%	0.695	S	S	*	*			trans	-145.9	141.8	154.5	-102.6	0	0	0	0	111.2	G387	G387-V389 PolarHBondContact O-N 3.23Å
390	S	27.9	Very low	29.1	Very low	122 Å²	122	99.1 Å²	99.1	85%	0.853	69%	0.685	S	S	*	*			trans	-97.2	108.8	-174.4	-174.8	0	0	0	0	112.3
391	G	26	Very low	29.3	Very low	64 Å²	64	96.6 Å²	96.6	66%	0.66	67%	0.671	S	S	*	*			trans	-163.2	142.2	175.5	0	0	0	0	0	112	I393	G391-I393 PolarHBondContact O-N 2.83Å
392	S	28	Very low	30.1	Very low	133 Å²	133	95.2 Å²	95.2	93%	0.93	67%	0.665	S	S	*	*			trans	-82.1	114.9	-167.7	-58.2	0	0	0	0	114.3
393	I	27.3	Very low	31.4	Very low	169 Å²	169	95 Å²	95	87%	0.867	65%	0.653	S	S	*	*			trans	-147.5	139.7	161.4	-42.7	175.2	0	0	0	103.4	G391	G391-I393 PolarHBondContact O-N 2.83Å
394	G	26.5	Very low	33.5	Very low	50 Å²	50	92.2 Å²	92.2	52%	0.515	63%	0.626	S	S	.	*			cis	130.6	140.8	9.6	0	0	0	0	0	108.8
395	S	26.5	Very low	36	Very low	92 Å²	92	85.5 Å²	85.5	64%	0.643	59%	0.591	S	S	*	*			trans	67.5	101.7	168.8	-51	0	0	0	0	120.6	S1548 N1549	S395-S1548 PolarHBondContact N-OG 2.91Å; S395-S1548 WeakPolarHBondContact OG-CB 3.44Å; S395-S1548 PolarHBondContact OG-OG 3.2Å; S395-N1549 WeakPolarHBondContact CA-OD1 3.36Å
396	G	25.8	Very low	38.2	Very low	53 Å²	53	85.4 Å²	85.4	55%	0.546	58%	0.577	S	S	.	*				109.9	75.3	113.6	0	0	0	0	0	119.4	N1549	G396-N1549 WeakPolarHBondContact CA-OD1 3.36Å; G396-N1549 PolarHBondContact N-OD1 3.18Å
397	L	27.2	Very low	40.5	Very low	127 Å²	127	83.3 Å²	83.3	67%	0.665	56%	0.56	S	S	*	*			trans	-141.7	100.7	176	-71.6	173.9	0	0	0	114.4	F376 S399	F376-L397 HydrophobicContact CZ-CD2 4.47Å; L397-S399 PolarHBondContact O-N 3.43Å
398	S	29	Very low	43	Very low	102 Å²	102	81.5 Å²	81.5	71%	0.713	53%	0.533	S	S	*	.	S	Bend	trans	-88.9	48	165.2	-54.8	0	0	0	0	111.3
399	S	37.1	Very low	45.4	Very low	49 Å²	49	80.1 Å²	80.1	34%	0.343	52%	0.52	S	S	.	.			trans	-155.6	35.6	-171.4	-155.7	0	0	0	0	112.7	F376 L397	F376-S399 WeakPolarHBondContact CZ-OG 3.09Å; L397-S399 PolarHBondContact O-N 3.43Å
400	A	33.5	Very low	47.9	Very low	49 Å²	49	73.9 Å²	73.9	41%	0.405	48%	0.482	S	S	.	.			trans	-78.6	-37.9	-175	0	0	0	0	0	113.8	S402 H403	A400-S402 PolarHBondContact O-N 2.92Å; A400-H403 PolarHBondContact O-N 3.09Å; A400-H403 VanDerWaalsContact O-N 3.16Å
401	G	36.3	Very low	49.9	Very low	9 Å²	9	68.4 Å²	68.4	9%	0.093	44%	0.443	C	S	.	.	H	α-helix	trans	-54.1	-48.7	-166.7	0	0	0	0	0	116	H403 L404	G401-H403 PolarHBondContact O-N 2.75Å; G401-H403 VanDerWaalsContact O-N 3.09Å; G401-L404 PolarHBondContact O-N 3.2Å
402	S	49.8	Very low	51.8	Low	63 Å²	63	66 Å²	66	44%	0.441	42%	0.416	S	S	.	.	H	α-helix	trans	-57.9	-29.7	-178	60.9	0	0	0	0	113.1	A400	A400-S402 PolarHBondContact O-N 2.92Å
403	H	59.1	Low	53.5	Low	100 Å²	100	61.2 Å²	61.2	46%	0.463	38%	0.384	S	S	.	.	H	α-helix	trans	-84.2	-14.2	179.9	-153.7	-13.5	0	0	0	113.4	A400 G401 T406 K407	A400-H403 PolarHBondContact O-N 3.09Å; A400-H403 VanDerWaalsContact O-N 3.16Å; G401-H403 PolarHBondContact O-N 2.75Å; G401-H403 VanDerWaalsContact O-N 3.09Å; H403-T406 PolarHBondContact O-OG1 2.85Å; H403-K407 PolarHBondContact CD2-NZ 3.22Å; H403-K407 WeakPolarHBondContact CE1-CE 3.15Å; H403-K407 PolarHBondContact CE1-NZ 3.45Å; H403-K407 VanDerWaalsContact CG-NZ 3.26Å; H403-K407 PolarHBondContact ND1-NZ 2.84Å; H403-K407 PolarHBondContact NE2-NZ 3.02Å; H403-K407 WeakPolarHBondContact O-CB 3.37Å; H403-K407 WeakPolarHBondContact O-CD 3.32Å; H403-K407 WeakPolarHBondContact O-CG 3.29Å; H403-K407 PolarHBondContact O-N 3.08Å
404	L	76.7	Confident	54.8	Low	19 Å²	19	58.9 Å²	58.9	10%	0.099	37%	0.368	C	S	.	.	H	α-helix	trans	-76.4	-45.8	176.2	-68.1	-170.8	0	0	0	112.4	L297 D298 H301 G401 T406 K407 L408	L297-L404 HydrophobicContact CD2-CB 3.91Å; L297-L404 HydrophobicContact CG-CD1 4.48Å; D298-L404 WeakPolarHBondContact OD1-CD1 3.37Å; H301-L404 HydrophobicContact CB-CD1 3.95Å; G401-L404 PolarHBondContact O-N 3.2Å; L404-T406 PolarHBondContact O-N 2.8Å; L404-K407 PolarHBondContact O-N 3.09Å; L404-L408 HydrophobicContact CB-CD1 4.08Å; L404-L408 WeakPolarHBondContact O-CG 3.06Å; L404-L408 PolarHBondContact O-N 3.44Å
405	W	81.3	Confident	55.6	Low	1 Å²	1	59.3 Å²	59.3	0%	0.004	36%	0.363	C	S	.	.	H	α-helix	trans	-52	-33.1	179	-59.3	105.4	0	0	0	113.3	F289 E290 L293 S294 L297 L340 V341 H344	F289-W405 HydrophobicContact CD1-CH2 4.38Å; F289-W405 AromaticContact CE1-CH2 3.89Å; F289-W405 HydrophobicContact CE1-CH2 3.89Å; F289-W405 AromaticContact CE1-CZ3 3.9Å; F289-W405 HydrophobicContact CE1-CZ3 3.9Å; E290-W405 HydrophobicContact CG-CG 4.41Å; L293-W405 HydrophobicContact CB-CH2 3.9Å; L293-W405 HydrophobicContact CB-CZ2 4.07Å; S294-W405 PolarHBondContact OG-NE1 2.74Å; L297-W405 HydrophobicContact CB-CZ2 4.4Å; L297-W405 HydrophobicContact CD2-CD2 3.55Å; L297-W405 HydrophobicContact CD2-CE3 3.77Å; L297-W405 HydrophobicContact CD2-CG 4.09Å; L297-W405 HydrophobicContact CD2-CH2 4.07Å; L297-W405 HydrophobicContact CD2-CZ2 3.87Å; L297-W405 HydrophobicContact CD2-CZ3 4.02Å; L340-W405 HydrophobicContact CB-CZ3 4.33Å; V341-W405 HydrophobicContact CG2-CE3 4.46Å; H344-W405 HydrophobicContact CB-CE3 3.61Å; H344-W405 HydrophobicContact CB-CZ3 3.91Å; H344-W405 AromaticContact CD2-CE3 3.99Å; H344-W405 AromaticContact CG-CE3 3.82Å
406	T	74.9	Confident	55.9	Low	71 Å²	71	64.1 Å²	64.1	44%	0.436	37%	0.372	S	S	.	.	H	α-helix	trans	-90.2	-23.9	179.5	52	0	0	0	0	114.6	H403 L404	H403-T406 PolarHBondContact O-OG1 2.85Å; L404-T406 PolarHBondContact O-N 2.8Å
407	K	75.9	Confident	56.3	Low	132 Å²	132	69.4 Å²	69.4	57%	0.574	38%	0.382	S	S	*	.	H	α-helix	trans	-85.7	-34.1	179.8	-85.8	174.4	170.8	137.6	0	113.7	H403 L404	H403-K407 PolarHBondContact CD2-NZ 3.22Å; H403-K407 WeakPolarHBondContact CE1-CE 3.15Å; H403-K407 PolarHBondContact CE1-NZ 3.45Å; H403-K407 VanDerWaalsContact CG-NZ 3.26Å; H403-K407 PolarHBondContact ND1-NZ 2.84Å; H403-K407 PolarHBondContact NE2-NZ 3.02Å; H403-K407 WeakPolarHBondContact O-CB 3.37Å; H403-K407 WeakPolarHBondContact O-CD 3.32Å; H403-K407 WeakPolarHBondContact O-CG 3.29Å; H403-K407 PolarHBondContact O-N 3.08Å; L404-K407 PolarHBondContact O-N 3.09Å
408	L	79.3	Confident	56.3	Low	35 Å²	35	71.6 Å²	71.6	18%	0.183	39%	0.386	C	S	.	.	S	Bend	trans	-77.8	151.5	-174.8	-65.3	169.2	0	0	0	111.5	L297 T337 V341 L404 P410	L297-L408 HydrophobicContact CD1-CD1 4.12Å; L297-L408 HydrophobicContact CD2-CD1 4.37Å; L297-L408 HydrophobicContact CG-CD1 4.39Å; T337-L408 HydrophobicContact CG2-CD1 3.8Å; V341-L408 HydrophobicContact CB-CB 4.46Å; V341-L408 HydrophobicContact CG1-CB 4.08Å; V341-L408 HydrophobicContact CG2-CB 3.74Å; V341-L408 HydrophobicContact CG2-CD1 3.86Å; V341-L408 HydrophobicContact CG2-CG 4.46Å; L404-L408 HydrophobicContact CB-CD1 4.08Å; L404-L408 WeakPolarHBondContact O-CG 3.06Å; L404-L408 PolarHBondContact O-N 3.44Å; L408-P410 WeakPolarHBondContact O-CD 3.44Å
409	T	77.9	Confident	56.1	Low	96 Å²	96	72.1 Å²	72.1	59%	0.589	39%	0.39	S	S	*	.			trans	-90.8	118.3	-177.6	48.6	0	0	0	0	111.2	A413	T409-A413 HydrophobicContact CG2-CB 4.48Å
410	P	79.4	Confident	55.8	Low	15 Å²	15	77.4 Å²	77.4	10%	0.097	41%	0.409	C	S	.	.			trans	-74.1	175.5	168.2	34.7	-38.4	0	0	0	111.3	V341 T342 R345 L408 A413	V341-P410 HydrophobicContact CG1-CB 4.28Å; T342-P410 WeakPolarHBondContact OG1-CA 3.21Å; T342-P410 WeakPolarHBondContact OG1-CB 3.5Å; R345-P410 HydrophobicContact CG-CB 4.07Å; R345-P410 HydrophobicContact CG-CG 4.04Å; L408-P410 WeakPolarHBondContact O-CD 3.44Å; P410-A413 VanDerWaalsContact O-CB 3.23Å; P410-A413 WeakPolarHBondContact O-CB 3.26Å; P410-A413 PolarHBondContact O-N 2.83Å
411	Y	70.6	Confident	55.6	Low	8 Å²	8	80 Å²	80	3%	0.031	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	162.2	159.7	-66.7	-73.8	0	0	0	111.1	V181 Y184 E205 T209 T338 T342 A413	V181-Y411 HydrophobicContact CB-CD2 4.45Å; V181-Y411 HydrophobicContact CG1-CD2 3.69Å; V181-Y411 HydrophobicContact CG1-CE2 3.93Å; V181-Y411 HydrophobicContact CG1-CG 4.24Å; V181-Y411 HydrophobicContact CG2-CD2 3.83Å; V181-Y411 HydrophobicContact CG2-CE2 3.78Å; Y184-Y411 VanDerWaalsContact CE1-O 3.3Å; Y184-Y411 WeakPolarHBondContact CE1-O 3.01Å; Y184-Y411 PolarHBondContact OH-O 3.32Å; E205-Y411 HydrophobicContact CB-CD1 4.12Å; E205-Y411 HydrophobicContact CB-CE1 3.95Å; E205-Y411 WeakPolarHBondContact OE2-CD1 3.45Å; T209-Y411 WeakPolarHBondContact CG2-OH 3.23Å; T209-Y411 PolarHBondContact OG1-OH 2.96Å; T338-Y411 HydrophobicContact CG2-CD1 4.35Å; T338-Y411 HydrophobicContact CG2-CD2 3.88Å; T338-Y411 HydrophobicContact CG2-CE1 4.13Å; T338-Y411 HydrophobicContact CG2-CE2 3.64Å; T338-Y411 HydrophobicContact CG2-CG 4.21Å; T342-Y411 HydrophobicContact CG2-CD2 4.04Å; T342-Y411 VanDerWaalsContact OG1-CD2 3.31Å; T342-Y411 WeakPolarHBondContact OG1-CD2 3.41Å; T342-Y411 PolarHBondContact OG1-N 3.39Å; Y411-A413 PolarHBondContact O-N 3.48Å
412	C	65.7	Low	55.5	Low	13 Å²	13	87.3 Å²	87.3	9%	0.088	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	8.7	-173	-50.7	0	0	0	0	115.1	Y184 L195 K414	Y184-C412 HydrophobicContact CE1-CB 3.87Å; L195-C412 HydrophobicContact CD1-CB 3.91Å; L195-C412 HydrophobicContact CD2-CB 4.13Å; C412-K414 PolarHBondContact O-N 2.94Å
413	A	62.8	Low	54.7	Low	32 Å²	32	92.7 Å²	92.7	26%	0.264	48%	0.483	S	S	.	.			trans	-66.6	120.4	176.9	0	0	0	0	0	111	R201 T409 P410 Y411 S415	R201-A413 PolarHBondContact NH2-O 3.04Å; T409-A413 HydrophobicContact CG2-CB 4.48Å; P410-A413 VanDerWaalsContact O-CB 3.23Å; P410-A413 WeakPolarHBondContact O-CB 3.26Å; P410-A413 PolarHBondContact O-N 2.83Å; Y411-A413 PolarHBondContact O-N 3.48Å; A413-S415 PolarHBondContact O-N 2.89Å
414	K	54.9	Low	53.3	Low	121 Å²	121	94 Å²	94	53%	0.526	49%	0.494	S	S	.	.			trans	-54.6	124.6	173	-71.2	-169.9	177.6	-173.2	0	109.9	E194 C412 K416	E194-K414 IonicContact OE1-NZ 2.66Å; E194-K414 IonicContact OE2-NZ 3.7Å; E194-K414 PolarHBondContact OE2-NZ 3.2Å; C412-K414 PolarHBondContact O-N 2.94Å; K414-K416 PolarHBondContact O-N 3.32Å
415	S	44.2	Very low	51.4	Low	59 Å²	59	104.9 Å²	104.9	41%	0.413	53%	0.534	S	S	.	.			trans	-65.1	108.8	164.3	-178	0	0	0	0	108	R201 A413 Q417	R201-S415 VanDerWaalsContact NH2-N 3.11Å; A413-S415 PolarHBondContact O-N 2.89Å; S415-Q417 PolarHBondContact O-N 3Å
416	K	32.4	Very low	49.5	Very low	192 Å²	192	114.6 Å²	114.6	84%	0.835	58%	0.576	S	S	*	*			trans	-73.8	75.2	165.7	-73.1	-175.2	178.9	177.6	0	108.2	K414 K418	K414-K416 PolarHBondContact O-N 3.32Å; K416-K418 PolarHBondContact O-N 2.81Å
417	Q	35	Very low	48.6	Very low	164 Å²	164	113.6 Å²	113.6	77%	0.766	57%	0.572	S	S	*	*			trans	-61.3	79.4	156.4	-79.1	-167.1	-19.9	0	0	107.9	S415 S419	S415-Q417 PolarHBondContact O-N 3Å; Q417-S419 PolarHBondContact O-N 3Å
418	K	26.4	Very low	48.1	Very low	173 Å²	173	115.3 Å²	115.3	75%	0.752	58%	0.579	S	S	*	*			trans	-80.3	77.7	179.7	-157.3	179.1	-173.4	-170.6	0	108.2	K416 H420	K416-K418 PolarHBondContact O-N 2.81Å; K418-H420 PolarHBondContact O-N 3.43Å
419	S	25.7	Very low	48	Very low	113 Å²	113	116 Å²	116	79%	0.79	58%	0.579	S	S	*	*			trans	-68.7	58	178	49.1	0	0	0	0	112.6	Q417	Q417-S419 PolarHBondContact O-N 3Å
420	H	30.8	Very low	48.1	Very low	161 Å²	161	115.1 Å²	115.1	75%	0.745	58%	0.577	S	S	*	*			trans	-104.2	111.8	163	-78.4	-88.2	0	0	0	109.2	K418	K418-H420 PolarHBondContact O-N 3.43Å
421	S	28.8	Very low	48.3	Very low	104 Å²	104	117.1 Å²	117.1	73%	0.727	59%	0.585	S	S	*	*			trans	-57.4	148.7	169.9	-171.3	0	0	0	0	111.1
422	L	33.3	Very low	48.8	Very low	161 Å²	161	120.1 Å²	120.1	84%	0.843	60%	0.598	S	S	*	*	S	Bend	trans	160.7	-10.3	145	-87.6	166.6	0	0	0	113.3
423	L	34	Very low	49.6	Very low	176 Å²	176	120.8 Å²	120.8	92%	0.921	61%	0.607	S	S	*	*			trans	-130.4	40.7	174.4	-73.7	177.3	0	0	0	114.1	R425	L423-R425 PolarHBondContact O-N 3.42Å
424	N	30.1	Very low	50.8	Low	129 Å²	129	119.6 Å²	119.6	69%	0.69	60%	0.596	S	S	*	*			trans	-81.5	97.2	178.3	-177	9.8	0	0	0	112.6
425	R	35.6	Very low	52.4	Low	246 Å²	246	115.4 Å²	115.4	93%	0.928	58%	0.582	S	S	*	*			trans	-157.6	34.8	172.1	-118.1	178	-146.7	-152.3	8	116.3	L423	L423-R425 PolarHBondContact O-N 3.42Å
426	K	42.2	Very low	54.5	Low	205 Å²	205	112.6 Å²	112.6	89%	0.891	56%	0.563	S	S	*	*	S	Bend	trans	-135.8	-12.8	-178	-76.5	-171.8	179.5	175.7	0	118.8
427	S	56.5	Low	57.1	Low	50 Å²	50	106.3 Å²	106.3	35%	0.35	53%	0.534	S	S	.	.	S	Bend	trans	-86.7	-7.9	-170.5	53.8	0	0	0	0	116.1	Y437 E438	S427-Y437 WeakPolarHBondContact O-CA 3.27Å; S427-E438 PolarHBondContact O-N 2.86Å
428	K	64.1	Low	59.5	Low	168 Å²	168	102.4 Å²	102.4	73%	0.73	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	132.6	174.6	-71.4	-173.1	179.5	-178.7	0	111.3	F436	K428-F436 WeakPolarHBondContact CA-O 3.31Å
429	W	77.1	Confident	62.1	Low	50 Å²	50	98 Å²	98	19%	0.189	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	153.2	172.2	174	61.5	0	0	0	109.7	H431 F436 F462 I471 K476 I479	W429-H431 HydrophobicContact CH2-CB 3.34Å; W429-H431 AromaticContact CH2-CG 3.79Å; W429-H431 HydrophobicContact CZ2-CB 3.26Å; W429-H431 AromaticContact CZ2-CG 3.65Å; W429-H431 AromaticContact CZ2-ND1 3.87Å; W429-H431 HydrophobicContact CZ3-CB 4.13Å; W429-F436 HydrophobicContact CB-CB 4.4Å; W429-F436 HydrophobicContact CD2-CB 4.49Å; W429-F436 HydrophobicContact CD2-CD2 4.41Å; W429-F436 HydrophobicContact CE3-CB 3.61Å; W429-F436 AromaticContact CE3-CD2 3.37Å; W429-F436 HydrophobicContact CE3-CD2 3.37Å; W429-F436 HydrophobicContact CE3-CE2 4.18Å; W429-F436 AromaticContact CE3-CG 3.67Å; W429-F436 HydrophobicContact CE3-CG 3.67Å; W429-F436 HydrophobicContact CH2-CD2 4.21Å; W429-F436 HydrophobicContact CH2-CE2 4.28Å; W429-F436 HydrophobicContact CZ3-CB 4.28Å; W429-F436 AromaticContact CZ3-CD2 3.2Å; W429-F436 HydrophobicContact CZ3-CD2 3.2Å; W429-F436 AromaticContact CZ3-CE2 3.54Å; W429-F436 HydrophobicContact CZ3-CE2 3.54Å; W429-F436 AromaticContact CZ3-CG 3.81Å; W429-F436 HydrophobicContact CZ3-CG 3.81Å; W429-F436 HydrophobicContact CZ3-CZ 4.39Å; W429-F436 PolarHBondContact N-O 3.1Å; W429-F436 WeakPolarHBondContact O-CA 3.47Å; W429-F436 WeakPolarHBondContact O-CB 3.37Å; W429-F436 PolarHBondContact O-N 2.7Å; W429-F436 VanDerWaalsContact O-O 3.1Å; W429-F462 HydrophobicContact CB-CE1 4.49Å; W429-F462 HydrophobicContact CE3-CD2 4.44Å; W429-I471 HydrophobicContact CZ3-CD1 3.97Å; W429-K476 HydrophobicContact CD2-CD 4.31Å; W429-K476 HydrophobicContact CD2-CG 4.06Å; W429-K476 HydrophobicContact CE3-CD 4.47Å; W429-K476 HydrophobicContact CE3-CG 3.91Å; W429-K476 HydrophobicContact CH2-CB 4.24Å; W429-K476 HydrophobicContact CH2-CG 3.34Å; W429-K476 WeakPolarHBondContact CH2-O 3.47Å; W429-K476 HydrophobicContact CZ2-CD 4.22Å; W429-K476 HydrophobicContact CZ2-CG 3.39Å; W429-K476 HydrophobicContact CZ3-CB 4.42Å; W429-K476 HydrophobicContact CZ3-CG 3.6Å; W429-I479 HydrophobicContact CH2-CD1 3.74Å; W429-I479 HydrophobicContact CZ3-CD1 3.93Å
430	S	81.4	Confident	64.5	Low	77 Å²	77	95.2 Å²	95.2	54%	0.538	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	144.7	174.3	-174.8	0	0	0	0	111.9	H434	S430-H434 WeakPolarHBondContact CA-O 3.37Å; S430-H434 VanDerWaalsContact CB-O 3.31Å; S430-H434 WeakPolarHBondContact CB-O 3.16Å; S430-H434 PolarHBondContact OG-O 2.79Å
431	H	82.6	Confident	66.5	Low	57 Å²	57	87.8 Å²	87.8	26%	0.264	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	131.7	-179.5	-170.1	84.2	0	0	0	109.3	W429 G433 H434	W429-H431 HydrophobicContact CH2-CB 3.34Å; W429-H431 AromaticContact CH2-CG 3.79Å; W429-H431 HydrophobicContact CZ2-CB 3.26Å; W429-H431 AromaticContact CZ2-CG 3.65Å; W429-H431 AromaticContact CZ2-ND1 3.87Å; W429-H431 HydrophobicContact CZ3-CB 4.13Å; H431-G433 PolarHBondContact O-N 2.93Å; H431-G433 VanDerWaalsContact O-N 3.11Å; H431-H434 PolarHBondContact N-O 3.33Å; H431-H434 WeakPolarHBondContact O-CB 3.33Å; H431-H434 PolarHBondContact O-CD2 2.78Å; H431-H434 PolarHBondContact O-N 2.83Å
432	K	81.2	Confident	68.3	Low	71 Å²	71	90.3 Å²	90.3	31%	0.309	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	36.8	178.9	-62.2	-179.8	177.9	-179	0	114.5	H434 I479 R480 D481 H482 C483	K432-H434 VanDerWaalsContact C-N 3.3Å; K432-H434 PolarHBondContact O-N 3.04Å; K432-I479 PolarHBondContact NZ-O 2.96Å; K432-R480 PolarHBondContact NZ-O 3.03Å; K432-D481 WeakPolarHBondContact CB-O 3.17Å; K432-D481 WeakPolarHBondContact CD-O 3.39Å; K432-H482 CarbonylContact O-C 3.5Å; K432-H482 VanDerWaalsContact O-CA 3.29Å; K432-H482 WeakPolarHBondContact O-CA 3.43Å; K432-C483 PolarHBondContact O-N 3.29Å
433	G	82.4	Confident	70	Confident	27 Å²	27	90.6 Å²	90.6	28%	0.278	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	-11.9	-179.2	0	0	0	0	0	115.2	H431	H431-G433 PolarHBondContact O-N 2.93Å; H431-G433 VanDerWaalsContact O-N 3.11Å
434	H	87.8	Confident	71.7	Confident	7 Å²	7	85.6 Å²	85.6	3%	0.032	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	135.5	174.2	-65.3	-90.3	0	0	0	110.6	S430 H431 K432 F436 C464 C467 L469 C483	S430-H434 WeakPolarHBondContact CA-O 3.37Å; S430-H434 VanDerWaalsContact CB-O 3.31Å; S430-H434 WeakPolarHBondContact CB-O 3.16Å; S430-H434 PolarHBondContact OG-O 2.79Å; H431-H434 PolarHBondContact N-O 3.33Å; H431-H434 WeakPolarHBondContact O-CB 3.33Å; H431-H434 PolarHBondContact O-CD2 2.78Å; H431-H434 PolarHBondContact O-N 2.83Å; K432-H434 VanDerWaalsContact C-N 3.3Å; K432-H434 PolarHBondContact O-N 3.04Å; H434-F436 HydrophobicContact CB-CD2 3.61Å; H434-F436 HydrophobicContact CB-CE2 3.17Å; H434-F436 HydrophobicContact CB-CZ 3.74Å; H434-F436 AromaticContact CG-CE2 3.76Å; H434-F436 AromaticContact CG-CZ 3.93Å; H434-C464 VanDerWaalsContact CA-SG 3.6Å; H434-C464 HydrophobicContact CB-CB 4.25Å; H434-C464 VanDerWaalsContact CB-SG 3.51Å; H434-C464 PolarHBondContact ND1-SG 3.46Å; H434-C464 VanDerWaalsContact ND1-SG 3.38Å; H434-C467 PolarHBondContact CE1-SG 3.06Å; H434-C467 PolarHBondContact ND1-SG 3.07Å; H434-L469 VanDerWaalsContact CE1-CD2 3.45Å; H434-L469 WeakPolarHBondContact CE1-CD2 3.48Å; H434-C483 HydrophobicContact CB-CB 4.29Å; H434-C483 PolarHBondContact NE2-N 3.04Å
435	S	88.5	Confident	73.9	Confident	34 Å²	34	80.1 Å²	80.1	24%	0.238	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	89	172	171.5	0	0	0	0	109.7	C464 N465 N466	S435-C464 PolarHBondContact N-SG 2.9Å; S435-C464 WeakPolarHBondContact O-CA 3.42Å; S435-N465 PolarHBondContact O-N 3.07Å; S435-N466 WeakPolarHBondContact CB-OD1 3.09Å
436	F	89.4	Confident	76.1	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	141.7	-177.3	-75.3	-73.5	0	0	0	113.3	K428 W429 H434 F462 N463 C464 L469 I471 I479	K428-F436 WeakPolarHBondContact CA-O 3.31Å; W429-F436 HydrophobicContact CB-CB 4.4Å; W429-F436 HydrophobicContact CD2-CB 4.49Å; W429-F436 HydrophobicContact CD2-CD2 4.41Å; W429-F436 HydrophobicContact CE3-CB 3.61Å; W429-F436 AromaticContact CE3-CD2 3.37Å; W429-F436 HydrophobicContact CE3-CD2 3.37Å; W429-F436 HydrophobicContact CE3-CE2 4.18Å; W429-F436 AromaticContact CE3-CG 3.67Å; W429-F436 HydrophobicContact CE3-CG 3.67Å; W429-F436 HydrophobicContact CH2-CD2 4.21Å; W429-F436 HydrophobicContact CH2-CE2 4.28Å; W429-F436 HydrophobicContact CZ3-CB 4.28Å; W429-F436 AromaticContact CZ3-CD2 3.2Å; W429-F436 HydrophobicContact CZ3-CD2 3.2Å; W429-F436 AromaticContact CZ3-CE2 3.54Å; W429-F436 HydrophobicContact CZ3-CE2 3.54Å; W429-F436 AromaticContact CZ3-CG 3.81Å; W429-F436 HydrophobicContact CZ3-CG 3.81Å; W429-F436 HydrophobicContact CZ3-CZ 4.39Å; W429-F436 PolarHBondContact N-O 3.1Å; W429-F436 WeakPolarHBondContact O-CA 3.47Å; W429-F436 WeakPolarHBondContact O-CB 3.37Å; W429-F436 PolarHBondContact O-N 2.7Å; W429-F436 VanDerWaalsContact O-O 3.1Å; H434-F436 HydrophobicContact CB-CD2 3.61Å; H434-F436 HydrophobicContact CB-CE2 3.17Å; H434-F436 HydrophobicContact CB-CZ 3.74Å; H434-F436 AromaticContact CG-CE2 3.76Å; H434-F436 AromaticContact CG-CZ 3.93Å; F436-F462 HydrophobicContact CB-CB 3.89Å; F436-F462 HydrophobicContact CB-CD1 4.2Å; F436-F462 HydrophobicContact CB-CG 4.19Å; F436-F462 HydrophobicContact CD1-CB 3.53Å; F436-F462 HydrophobicContact CE1-CB 4.4Å; F436-F462 HydrophobicContact CG-CB 4.02Å; F436-N463 CarbonylContact C-O 3.43Å; F436-N463 VanDerWaalsContact CA-O 3.23Å; F436-N463 WeakPolarHBondContact CA-O 3.23Å; F436-N463 WeakPolarHBondContact CD1-O 3.23Å; F436-C464 HydrophobicContact CD1-CB 3.87Å; F436-C464 HydrophobicContact CE1-CB 3.69Å; F436-C464 HydrophobicContact CG-CB 4.49Å; F436-C464 HydrophobicContact CZ-CB 4.17Å; F436-L469 WeakPolarHBondContact CE1-O 3.33Å; F436-L469 HydrophobicContact CZ-CD2 4.14Å; F436-L469 HydrophobicContact CZ-CG 4.43Å; F436-I471 HydrophobicContact CD1-CD1 4.07Å; F436-I471 HydrophobicContact CD1-CG1 4.31Å; F436-I471 HydrophobicContact CE1-CD1 3.55Å; F436-I471 HydrophobicContact CE1-CG1 3.83Å; F436-I471 HydrophobicContact CE2-CD1 4.15Å; F436-I471 HydrophobicContact CZ-CD1 3.6Å; F436-I471 HydrophobicContact CZ-CG1 4.34Å; F436-I479 HydrophobicContact CD2-CD1 4.44Å; F436-I479 HydrophobicContact CE2-CD1 3.34Å; F436-I479 HydrophobicContact CZ-CD1 3.5Å; F436-I479 VanDerWaalsContact CZ-CD1 3.5Å
437	Y	86.7	Confident	78.3	Confident	60 Å²	60	62.6 Å²	62.6	24%	0.235	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	144.5	170.9	66.3	-72.5	0	0	0	109.9	S427 Y439 F462 N463 N465	S427-Y437 WeakPolarHBondContact O-CA 3.27Å; Y437-Y439 HydrophobicContact CD2-CD2 4.39Å; Y437-Y439 AromaticContact CE2-CD2 3.49Å; Y437-Y439 HydrophobicContact CE2-CD2 3.49Å; Y437-Y439 VanDerWaalsContact CE2-CD2 3.49Å; Y437-Y439 HydrophobicContact CE2-CE2 4.14Å; Y437-Y439 HydrophobicContact CE2-CG 4.32Å; Y437-Y439 AromaticContact CZ-CD2 3.93Å; Y437-Y439 PolarHBondContact O-N 3.11Å; Y437-F462 CarbonylContact O-C 3.05Å; Y437-F462 WeakPolarHBondContact O-CA 3.15Å; Y437-N463 HydrophobicContact CD1-CB 4.35Å; Y437-N463 WeakPolarHBondContact CD1-O 3.17Å; Y437-N463 HydrophobicContact CE1-CB 3.64Å; Y437-N463 WeakPolarHBondContact CE1-O 3.36Å; Y437-N463 PolarHBondContact N-O 3.48Å; Y437-N463 PolarHBondContact O-N 2.87Å; Y437-N463 PolarHBondContact OH-ND2 3.28Å; Y437-N465 WeakPolarHBondContact CD1-OD1 3.45Å; Y437-N465 WeakPolarHBondContact CE1-OD1 3.47Å
438	E	85.4	Confident	79.7	Confident	82 Å²	82	63 Å²	63	38%	0.383	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	132.4	172.3	-87.2	-179.3	92.2	0	0	110	S427 S459 F462 L473	S427-E438 PolarHBondContact O-N 2.86Å; E438-S459 VanDerWaalsContact OE1-CB 3.22Å; E438-S459 WeakPolarHBondContact OE1-CB 3.48Å; E438-S459 PolarHBondContact OE1-OG 2.71Å; E438-F462 HydrophobicContact CG-CD1 4.2Å; E438-F462 HydrophobicContact CG-CE1 3.86Å; E438-L473 HydrophobicContact CG-CD1 4.26Å
439	Y	80.3	Confident	80.8	Confident	81 Å²	81	57.4 Å²	57.4	32%	0.318	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	137.6	-175.5	-164.3	-117.1	0	0	0	111.4	Y437 Y441 S459 G461 N463	Y437-Y439 HydrophobicContact CD2-CD2 4.39Å; Y437-Y439 AromaticContact CE2-CD2 3.49Å; Y437-Y439 HydrophobicContact CE2-CD2 3.49Å; Y437-Y439 VanDerWaalsContact CE2-CD2 3.49Å; Y437-Y439 HydrophobicContact CE2-CE2 4.14Å; Y437-Y439 HydrophobicContact CE2-CG 4.32Å; Y437-Y439 AromaticContact CZ-CD2 3.93Å; Y437-Y439 PolarHBondContact O-N 3.11Å; Y439-Y441 HydrophobicContact CD1-CD1 4.05Å; Y439-Y441 HydrophobicContact CD1-CD2 4.1Å; Y439-Y441 AromaticContact CD1-CE1 3.95Å; Y439-Y441 HydrophobicContact CD1-CE1 3.95Å; Y439-Y441 AromaticContact CD1-CE2 3.98Å; Y439-Y441 HydrophobicContact CD1-CE2 3.98Å; Y439-Y441 HydrophobicContact CD1-CG 4.12Å; Y439-Y441 AromaticContact CD1-CZ 3.91Å; Y439-Y441 HydrophobicContact CE1-CD1 4.45Å; Y439-Y441 HydrophobicContact CG-CE2 4.46Å; Y439-Y441 WeakPolarHBondContact O-CD2 3.24Å; Y439-Y441 VanDerWaalsContact O-CE2 3.24Å; Y439-Y441 WeakPolarHBondContact O-CE2 3.22Å; Y439-S459 WeakPolarHBondContact O-CA 3.44Å; Y439-G461 PolarHBondContact N-O 2.71Å; Y439-N463 HydrophobicContact CD1-CB 4.29Å; Y439-N463 HydrophobicContact CG-CB 4.04Å
440	T	77.2	Confident	81.2	Confident	54 Å²	54	57 Å²	57	33%	0.331	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.2	173	-56.4	0	0	0	0	107.9	E442 G456	T440-E442 PolarHBondContact O-N 3.39Å; T440-G456 WeakPolarHBondContact CG2-O 3.49Å
441	Y	72.9	Confident	81.1	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.016	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	87.1	-163.5	-76	-99.3	0	0	0	111.8	Y439 R443 A445 L454 W455 G456 F462 F470	Y439-Y441 HydrophobicContact CD1-CD1 4.05Å; Y439-Y441 HydrophobicContact CD1-CD2 4.1Å; Y439-Y441 AromaticContact CD1-CE1 3.95Å; Y439-Y441 HydrophobicContact CD1-CE1 3.95Å; Y439-Y441 AromaticContact CD1-CE2 3.98Å; Y439-Y441 HydrophobicContact CD1-CE2 3.98Å; Y439-Y441 HydrophobicContact CD1-CG 4.12Å; Y439-Y441 AromaticContact CD1-CZ 3.91Å; Y439-Y441 HydrophobicContact CE1-CD1 4.45Å; Y439-Y441 HydrophobicContact CG-CE2 4.46Å; Y439-Y441 WeakPolarHBondContact O-CD2 3.24Å; Y439-Y441 VanDerWaalsContact O-CE2 3.24Å; Y439-Y441 WeakPolarHBondContact O-CE2 3.22Å; Y441-R443 PolarHBondContact O-N 2.9Å; Y441-R443 VanDerWaalsContact O-N 3.13Å; Y441-A445 HydrophobicContact CD1-CB 3.94Å; Y441-A445 HydrophobicContact CE1-CB 3.97Å; Y441-L454 HydrophobicContact CD1-CB 3.77Å; Y441-L454 HydrophobicContact CD2-CB 4.26Å; Y441-L454 HydrophobicContact CD2-CD2 4.46Å; Y441-L454 HydrophobicContact CE1-CB 3.79Å; Y441-L454 HydrophobicContact CE1-CD1 4.05Å; Y441-L454 HydrophobicContact CE1-CG 4.41Å; Y441-L454 HydrophobicContact CE2-CB 4.3Å; Y441-L454 HydrophobicContact CE2-CD2 4.05Å; Y441-L454 HydrophobicContact CG-CB 4.01Å; Y441-W455 VanDerWaalsContact CB-CA 3.45Å; Y441-W455 CarbonylContact O-C 3.55Å; Y441-G456 PolarHBondContact N-O 2.9Å; Y441-G456 PolarHBondContact O-N 3.33Å; Y441-F462 PolarHBondContact OH-O 3.48Å; Y441-F470 HydrophobicContact CE1-CB 3.88Å; Y441-F470 AromaticContact CE1-CD1 3.49Å; Y441-F470 HydrophobicContact CE1-CD1 3.49Å; Y441-F470 VanDerWaalsContact CE1-CD1 3.49Å; Y441-F470 HydrophobicContact CE1-CE1 4.23Å; Y441-F470 AromaticContact CE1-CG 3.82Å; Y441-F470 HydrophobicContact CE1-CG 3.82Å; Y441-F470 AromaticContact CZ-CD1 3.95Å
442	E	65.3	Low	80.8	Confident	158 Å²	158	55.7 Å²	55.7	74%	0.738	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	-5.1	175.8	-60.4	-179.1	174.4	0	0	114.3	T440	T440-E442 PolarHBondContact O-N 3.39Å
443	R	68.7	Low	80.6	Confident	166 Å²	166	52.7 Å²	52.7	63%	0.626	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.2	156.3	174.9	-58.6	-177	-167.4	163.8	6.7	108.9	Y441 A445	Y441-R443 PolarHBondContact O-N 2.9Å; Y441-R443 VanDerWaalsContact O-N 3.13Å; R443-A445 PolarHBondContact O-N 3.16Å
444	I	70	Confident	80.2	Confident	71 Å²	71	51.4 Å²	51.4	36%	0.364	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	127.5	170.8	-66.7	173.3	0	0	0	109.5	L204 F207 T208 L453	L204-I444 HydrophobicContact CD1-CD1 4.49Å; L204-I444 HydrophobicContact CD1-CG1 4.26Å; F207-I444 HydrophobicContact CD1-CD1 4.45Å; F207-I444 HydrophobicContact CE1-CD1 3.92Å; T208-I444 HydrophobicContact CG2-CD1 4.07Å; T208-I444 HydrophobicContact CG2-CG1 4.11Å; I444-L453 HydrophobicContact CG1-CD2 4.4Å; I444-L453 HydrophobicContact CG2-CD1 3.59Å; I444-L453 HydrophobicContact CG2-CD2 4.18Å; I444-L453 HydrophobicContact CG2-CG 3.88Å
445	A	76.1	Confident	79.3	Confident	15 Å²	15	52.5 Å²	52.5	12%	0.124	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	152.3	166.5	0	0	0	0	0	109.6	Y441 R443 L453 L454 F470	Y441-A445 HydrophobicContact CD1-CB 3.94Å; Y441-A445 HydrophobicContact CE1-CB 3.97Å; R443-A445 PolarHBondContact O-N 3.16Å; A445-L453 CarbonylContact O-C 3.48Å; A445-L454 HydrophobicContact CB-CB 4.35Å; A445-L454 PolarHBondContact N-O 2.77Å; A445-L454 PolarHBondContact O-N 2.79Å; A445-F470 HydrophobicContact CB-CB 4.32Å; A445-F470 HydrophobicContact CB-CD2 3.79Å; A445-F470 HydrophobicContact CB-CE2 4.3Å; A445-F470 HydrophobicContact CB-CG 4.05Å
446	D	83.2	Confident	77.8	Confident	81 Å²	81	51 Å²	51	43%	0.433	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	141.8	169.3	-82.5	-51.9	0	0	0	110.3	K214 G448	K214-D446 IonicContact NZ-OD1 2.73Å; K214-D446 PolarHBondContact NZ-OD1 3.07Å; K214-D446 IonicContact NZ-OD2 2.65Å; D446-G448 PolarHBondContact O-N 2.62Å
447	C	88.1	Confident	75.8	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.014	28%	0.278	C	S	.	.			trans	-71.3	116.2	175.7	171.6	0	0	0	0	111	V449 C450 G451 F452 L454 F470 H472 C475	C447-V449 PolarHBondContact O-N 3.39Å; C447-C450 PolarHBondContact O-N 3.21Å; C447-G451 PolarHBondContact O-N 3.25Å; C447-F452 WeakPolarHBondContact CB-O 3.22Å; C447-F452 PolarHBondContact N-O 3.3Å; C447-L454 HydrophobicContact CB-CD1 3.87Å; C447-L454 HydrophobicContact CB-CG 4.35Å; C447-F470 WeakPolarHBondContact CA-O 3.2Å; C447-H472 VanDerWaalsContact CB-CE1 3.41Å; C447-H472 WeakPolarHBondContact CB-CE1 3.24Å; C447-H472 VanDerWaalsContact CB-ND1 3.29Å; C447-H472 WeakPolarHBondContact CB-ND1 3.43Å; C447-H472 PolarHBondContact SG-N 3.37Å; C447-H472 VanDerWaalsContact SG-N 3.44Å; C447-H472 PolarHBondContact SG-ND1 2.63Å; C447-H472 VanDerWaalsContact SG-ND1 3.4Å; C447-C475 VanDerWaalsContact SG-CB 3.56Å
448	G	85.3	Confident	74.5	Confident	57 Å²	57	53 Å²	53	59%	0.588	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	8.1	-177.5	0	0	0	0	0	116.3	D446 F470	D446-G448 PolarHBondContact O-N 2.62Å; G448-F470 PolarHBondContact N-O 2.85Å
449	V	86.4	Confident	73.6	Confident	51 Å²	51	51.1 Å²	51.1	31%	0.309	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-24.1	174.3	171.3	0	0	0	0	112.2	C447 I471 C475 I479	C447-V449 PolarHBondContact O-N 3.39Å; V449-I471 HydrophobicContact CG2-CG2 3.77Å; V449-C475 HydrophobicContact CB-CB 3.92Å; V449-C475 HydrophobicContact CG1-CB 3.95Å; V449-C475 HydrophobicContact CG2-CB 4.48Å; V449-I479 HydrophobicContact CG2-CG1 3.95Å
450	C	85.4	Confident	73.1	Confident	43 Å²	43	49.2 Å²	49.2	29%	0.291	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.5	-1.9	-174.3	73.6	0	0	0	0	116.4	C447 F452	C447-C450 PolarHBondContact O-N 3.21Å; C450-F452 HydrophobicContact CB-CD2 3.99Å; C450-F452 HydrophobicContact CB-CE2 4.23Å; C450-F452 PolarHBondContact O-N 3Å; C450-F452 VanDerWaalsContact O-N 3.16Å; C450-F452 WeakPolarHBondContact SG-CD2 3.22Å
451	G	80.7	Confident	73.2	Confident	38 Å²	38	46.6 Å²	46.6	39%	0.392	26%	0.262	S	S	.	.			trans	66.8	13.8	177	0	0	0	0	0	115.6	K214 C447	K214-G451 PolarHBondContact NZ-O 3.4Å; C447-G451 PolarHBondContact O-N 3.25Å
452	F	75.9	Confident	73.9	Confident	67 Å²	67	47 Å²	47	29%	0.294	26%	0.264	S	S	.	.			trans	-95.9	153.3	175.1	-56.1	-38.5	0	0	0	111.1	S326 C447 C450 H472	S326-F452 WeakPolarHBondContact O-CD1 3.45Å; S326-F452 WeakPolarHBondContact O-CE1 3.46Å; C447-F452 WeakPolarHBondContact CB-O 3.22Å; C447-F452 PolarHBondContact N-O 3.3Å; C450-F452 HydrophobicContact CB-CD2 3.99Å; C450-F452 HydrophobicContact CB-CE2 4.23Å; C450-F452 PolarHBondContact O-N 3Å; C450-F452 VanDerWaalsContact O-N 3.16Å; C450-F452 WeakPolarHBondContact SG-CD2 3.22Å; F452-H472 PolarHBondContact O-CE1 3.38Å
453	L	76.1	Confident	75.1	Confident	9 Å²	9	39.7 Å²	39.7	5%	0.047	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	143.1	-172.8	-133	72.8	0	0	0	113.5	T208 K214 I444 A445 H472	T208-L453 HydrophobicContact CG2-CD2 4.28Å; K214-L453 HydrophobicContact CD-CD1 4.39Å; I444-L453 HydrophobicContact CG1-CD2 4.4Å; I444-L453 HydrophobicContact CG2-CD1 3.59Å; I444-L453 HydrophobicContact CG2-CD2 4.18Å; I444-L453 HydrophobicContact CG2-CG 3.88Å; A445-L453 CarbonylContact O-C 3.48Å; L453-H472 PolarHBondContact O-CE1 3.09Å; L453-H472 PolarHBondContact O-NE2 3.15Å
454	L	74	Confident	76.2	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.1	167.7	-75.6	159.4	0	0	0	107.8	Y441 A445 C447 Q460 F470 H472	Y441-L454 HydrophobicContact CD1-CB 3.77Å; Y441-L454 HydrophobicContact CD2-CB 4.26Å; Y441-L454 HydrophobicContact CD2-CD2 4.46Å; Y441-L454 HydrophobicContact CE1-CB 3.79Å; Y441-L454 HydrophobicContact CE1-CD1 4.05Å; Y441-L454 HydrophobicContact CE1-CG 4.41Å; Y441-L454 HydrophobicContact CE2-CB 4.3Å; Y441-L454 HydrophobicContact CE2-CD2 4.05Å; Y441-L454 HydrophobicContact CG-CB 4.01Å; A445-L454 HydrophobicContact CB-CB 4.35Å; A445-L454 PolarHBondContact N-O 2.77Å; A445-L454 PolarHBondContact O-N 2.79Å; C447-L454 HydrophobicContact CB-CD1 3.87Å; C447-L454 HydrophobicContact CB-CG 4.35Å; L454-Q460 HydrophobicContact CD2-CB 4.13Å; L454-F470 HydrophobicContact CD1-CB 3.79Å; L454-H472 HydrophobicContact CD2-CB 4.47Å; L454-H472 WeakPolarHBondContact CD2-CD2 3.43Å
455	W	69.3	Low	77	Confident	30 Å²	30	32.6 Å²	32.6	11%	0.114	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	178.7	-176.5	57.3	-84	0	0	0	110.9	E205 T208 Y441 Q460	E205-W455 HydrophobicContact CB-CZ3 4.25Å; E205-W455 HydrophobicContact CG-CZ3 4.07Å; T208-W455 HydrophobicContact CG2-CB 4.33Å; T208-W455 HydrophobicContact CG2-CD2 4.14Å; T208-W455 HydrophobicContact CG2-CE3 4.46Å; T208-W455 HydrophobicContact CG2-CG 4.13Å; T208-W455 WeakPolarHBondContact OG1-CZ3 3.42Å; Y441-W455 VanDerWaalsContact CB-CA 3.45Å; Y441-W455 CarbonylContact O-C 3.55Å; W455-Q460 WeakPolarHBondContact O-CG 3.12Å; W455-Q460 PolarHBondContact O-NE2 3.43Å; W455-Q460 VanDerWaalsContact O-NE2 3.07Å; W455-Q460 PolarHBondContact O-OE1 2.9Å
456	G	56.6	Low	77.5	Confident	2 Å²	2	34 Å²	34	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	81.4	-171.8	159.2	0	0	0	0	0	115.9	T440 Y441	T440-G456 WeakPolarHBondContact CG2-O 3.49Å; Y441-G456 PolarHBondContact N-O 2.9Å; Y441-G456 PolarHBondContact O-N 3.33Å
457	L	49.1	Very low	77.8	Confident	40 Å²	40	32.7 Å²	32.7	21%	0.209	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-2.1	-150.1	-48.8	-176.2	0	0	0	114.5	R201 E205	R201-L457 HydrophobicContact CB-CD2 3.74Å; R201-L457 HydrophobicContact CG-CD1 3.86Å; R201-L457 HydrophobicContact CG-CD2 3.5Å; R201-L457 HydrophobicContact CG-CG 4.34Å; E205-L457 VanDerWaalsContact CD-CG 3.5Å; E205-L457 HydrophobicContact CG-CD1 3.87Å; E205-L457 HydrophobicContact CG-CD2 4.37Å; E205-L457 HydrophobicContact CG-CG 3.9Å; E205-L457 WeakPolarHBondContact OE1-CD1 3.47Å; E205-L457 VanDerWaalsContact OE1-CG 3.25Å; E205-L457 WeakPolarHBondContact OE1-CG 3.35Å; E205-L457 WeakPolarHBondContact OE2-CD1 3.31Å
458	S	58.9	Low	77.7	Confident	62 Å²	62	37.4 Å²	37.4	43%	0.434	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	167.7	171.7	62.2	0	0	0	0	110.9	Q460	S458-Q460 PolarHBondContact O-N 3.17Å
459	S	65.6	Low	77.9	Confident	42 Å²	42	36.7 Å²	36.7	29%	0.294	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	65.9	174.8	43.8	0	0	0	0	112.2	E438 Y439 G461	E438-S459 VanDerWaalsContact OE1-CB 3.22Å; E438-S459 WeakPolarHBondContact OE1-CB 3.48Å; E438-S459 PolarHBondContact OE1-OG 2.71Å; Y439-S459 WeakPolarHBondContact O-CA 3.44Å; S459-G461 PolarHBondContact O-N 3.35Å
460	Q	69.5	Low	78	Confident	41 Å²	41	37.2 Å²	37.2	19%	0.192	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	-19.6	179.1	-64.1	-165.6	4.2	0	0	113.4	L454 W455 S458 H472 L473	L454-Q460 HydrophobicContact CD2-CB 4.13Å; W455-Q460 WeakPolarHBondContact O-CG 3.12Å; W455-Q460 PolarHBondContact O-NE2 3.43Å; W455-Q460 VanDerWaalsContact O-NE2 3.07Å; W455-Q460 PolarHBondContact O-OE1 2.9Å; S458-Q460 PolarHBondContact O-N 3.17Å; Q460-H472 WeakPolarHBondContact O-CA 3.36Å; Q460-L473 PolarHBondContact O-N 3.3Å
461	G	80.8	Confident	78.1	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	-179.8	-175.5	0	0	0	0	0	115.2	Y439 S459 I471	Y439-G461 PolarHBondContact N-O 2.71Å; S459-G461 PolarHBondContact O-N 3.35Å; G461-I471 CarbonylContact C-O 3.49Å; G461-I471 WeakPolarHBondContact CA-O 3.48Å
462	F	87.5	Confident	78.4	Confident	13 Å²	13	33.8 Å²	33.8	6%	0.057	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	139.5	170.6	-59.5	-82.3	0	0	0	110.2	W429 F436 Y437 E438 Y441 I471 L473 K476	W429-F462 HydrophobicContact CB-CE1 4.49Å; W429-F462 HydrophobicContact CE3-CD2 4.44Å; F436-F462 HydrophobicContact CB-CB 3.89Å; F436-F462 HydrophobicContact CB-CD1 4.2Å; F436-F462 HydrophobicContact CB-CG 4.19Å; F436-F462 HydrophobicContact CD1-CB 3.53Å; F436-F462 HydrophobicContact CE1-CB 4.4Å; F436-F462 HydrophobicContact CG-CB 4.02Å; Y437-F462 CarbonylContact O-C 3.05Å; Y437-F462 WeakPolarHBondContact O-CA 3.15Å; E438-F462 HydrophobicContact CG-CD1 4.2Å; E438-F462 HydrophobicContact CG-CE1 3.86Å; Y441-F462 PolarHBondContact OH-O 3.48Å; F462-I471 HydrophobicContact CB-CD1 4.47Å; F462-I471 HydrophobicContact CB-CG1 4.02Å; F462-I471 HydrophobicContact CD2-CD1 4.43Å; F462-I471 HydrophobicContact CD2-CG1 4.37Å; F462-I471 PolarHBondContact N-O 3.04Å; F462-I471 PolarHBondContact O-N 3.11Å; F462-L473 HydrophobicContact CD2-CD1 4.02Å; F462-L473 HydrophobicContact CE1-CD1 4.14Å; F462-L473 HydrophobicContact CE2-CD1 3.45Å; F462-L473 VanDerWaalsContact CE2-CD1 3.45Å; F462-L473 HydrophobicContact CE2-CG 3.84Å; F462-L473 HydrophobicContact CZ-CD1 3.5Å; F462-L473 HydrophobicContact CZ-CG 4.08Å; F462-K476 HydrophobicContact CE2-CD 4.01Å; F462-K476 HydrophobicContact CE2-CG 4.33Å; F462-K476 HydrophobicContact CZ-CD 4.49Å
463	N	89.5	Confident	78.7	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.016	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	153.3	159.3	-174.9	29.5	0	0	0	109.8	F436 Y437 Y439 D468 L469 F470	F436-N463 CarbonylContact C-O 3.43Å; F436-N463 VanDerWaalsContact CA-O 3.23Å; F436-N463 WeakPolarHBondContact CA-O 3.23Å; F436-N463 WeakPolarHBondContact CD1-O 3.23Å; Y437-N463 HydrophobicContact CD1-CB 4.35Å; Y437-N463 WeakPolarHBondContact CD1-O 3.17Å; Y437-N463 HydrophobicContact CE1-CB 3.64Å; Y437-N463 WeakPolarHBondContact CE1-O 3.36Å; Y437-N463 PolarHBondContact N-O 3.48Å; Y437-N463 PolarHBondContact O-N 2.87Å; Y437-N463 PolarHBondContact OH-ND2 3.28Å; Y439-N463 HydrophobicContact CD1-CB 4.29Å; Y439-N463 HydrophobicContact CG-CB 4.04Å; N463-D468 PolarHBondContact ND2-OD1 2.82Å; N463-D468 VanDerWaalsContact OD1-C 3.27Å; N463-D468 WeakPolarHBondContact OD1-CA 3.27Å; N463-L469 PolarHBondContact OD1-O 3.35Å; N463-F470 HydrophobicContact CB-CD1 3.86Å; N463-F470 HydrophobicContact CB-CE1 3.98Å; N463-F470 VanDerWaalsContact OD1-CD1 3.29Å; N463-F470 WeakPolarHBondContact OD1-CD1 3.15Å; N463-F470 VanDerWaalsContact OD1-CE1 3.24Å; N463-F470 WeakPolarHBondContact OD1-CE1 3.15Å
464	C	91.5	Very high	79.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	112.5	174.6	173.6	0	0	0	0	111.9	H434 S435 F436 N466 C467 D468 L469	H434-C464 VanDerWaalsContact CA-SG 3.6Å; H434-C464 HydrophobicContact CB-CB 4.25Å; H434-C464 VanDerWaalsContact CB-SG 3.51Å; H434-C464 PolarHBondContact ND1-SG 3.46Å; H434-C464 VanDerWaalsContact ND1-SG 3.38Å; S435-C464 PolarHBondContact N-SG 2.9Å; S435-C464 WeakPolarHBondContact O-CA 3.42Å; F436-C464 HydrophobicContact CD1-CB 3.87Å; F436-C464 HydrophobicContact CE1-CB 3.69Å; F436-C464 HydrophobicContact CG-CB 4.49Å; F436-C464 HydrophobicContact CZ-CB 4.17Å; C464-N466 PolarHBondContact O-N 2.99Å; C464-C467 PolarHBondContact O-N 3.44Å; C464-C467 VanDerWaalsContact O-N 3.1Å; C464-D468 PolarHBondContact O-N 2.87Å; C464-L469 HydrophobicContact CB-CB 4.14Å; C464-L469 PolarHBondContact N-O 3.32Å
465	N	88.7	Confident	79.8	Confident	89 Å²	89	40.9 Å²	40.9	48%	0.476	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-23.1	178	-86.1	-18.4	0	0	0	115.3	S435 Y437	S435-N465 PolarHBondContact O-N 3.07Å; Y437-N465 WeakPolarHBondContact CD1-OD1 3.45Å; Y437-N465 WeakPolarHBondContact CE1-OD1 3.47Å
466	N	86.4	Confident	80.5	Confident	45 Å²	45	42.3 Å²	42.3	24%	0.241	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-21.4	-173.5	-65.7	33.9	0	0	0	113.2	S435 C464 C483 R485	S435-N466 WeakPolarHBondContact CB-OD1 3.09Å; C464-N466 PolarHBondContact O-N 2.99Å; N466-C483 WeakPolarHBondContact CB-SG 3.39Å; N466-R485 HydrophobicContact CB-CB 4.5Å; N466-R485 WeakPolarHBondContact O-CB 3.3Å; N466-R485 WeakPolarHBondContact O-CD 3.48Å
467	C	88.1	Confident	81.8	Confident	52 Å²	52	48.8 Å²	48.8	35%	0.351	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.4	11.1	-167.9	74.1	0	0	0	0	115.7	H434 C464 L469 C483	H434-C467 PolarHBondContact CE1-SG 3.06Å; H434-C467 PolarHBondContact ND1-SG 3.07Å; C464-C467 PolarHBondContact O-N 3.44Å; C464-C467 VanDerWaalsContact O-N 3.1Å; C467-L469 PolarHBondContact O-N 2.83Å; C467-L469 VanDerWaalsContact O-N 3.1Å; C467-C483 VanDerWaalsContact SG-SG 3.64Å
468	D	86.7	Confident	83.6	Confident	101 Å²	101	48.6 Å²	48.6	54%	0.54	27%	0.267	S	S	.	.			trans	51.7	34.7	177.9	-59.9	-59.8	0	0	0	115.6	N463 C464 F470	N463-D468 PolarHBondContact ND2-OD1 2.82Å; N463-D468 VanDerWaalsContact OD1-C 3.27Å; N463-D468 WeakPolarHBondContact OD1-CA 3.27Å; C464-D468 PolarHBondContact O-N 2.87Å; D468-F470 HydrophobicContact CB-CZ 4.28Å; D468-F470 WeakPolarHBondContact O-CD2 3.34Å; D468-F470 WeakPolarHBondContact O-CE2 3.37Å; D468-F470 PolarHBondContact O-N 3.17Å
469	L	89.4	Confident	84.8	Confident	42 Å²	42	46 Å²	46	22%	0.22	25%	0.248	C	C	.	.			trans	-77.6	113.2	171.5	177.3	59.3	0	0	0	109.8	H434 F436 N463 C464 C467 I471 I479	H434-L469 VanDerWaalsContact CE1-CD2 3.45Å; H434-L469 WeakPolarHBondContact CE1-CD2 3.48Å; F436-L469 WeakPolarHBondContact CE1-O 3.33Å; F436-L469 HydrophobicContact CZ-CD2 4.14Å; F436-L469 HydrophobicContact CZ-CG 4.43Å; N463-L469 PolarHBondContact OD1-O 3.35Å; C464-L469 HydrophobicContact CB-CB 4.14Å; C464-L469 PolarHBondContact N-O 3.32Å; C467-L469 PolarHBondContact O-N 2.83Å; C467-L469 VanDerWaalsContact O-N 3.1Å; L469-I471 HydrophobicContact CD1-CG2 4.49Å; L469-I471 HydrophobicContact CG-CG2 4.26Å; L469-I479 HydrophobicContact CD2-CG2 4.49Å
470	F	87.8	Confident	85.6	Confident	62 Å²	62	54 Å²	54	27%	0.272	27%	0.272	S	S	.	.			trans	-90.9	132.6	176.8	-51.5	-63.4	0	0	0	111.7	Y441 A445 C447 G448 L454 N463 D468	Y441-F470 HydrophobicContact CE1-CB 3.88Å; Y441-F470 AromaticContact CE1-CD1 3.49Å; Y441-F470 HydrophobicContact CE1-CD1 3.49Å; Y441-F470 VanDerWaalsContact CE1-CD1 3.49Å; Y441-F470 HydrophobicContact CE1-CE1 4.23Å; Y441-F470 AromaticContact CE1-CG 3.82Å; Y441-F470 HydrophobicContact CE1-CG 3.82Å; Y441-F470 AromaticContact CZ-CD1 3.95Å; A445-F470 HydrophobicContact CB-CB 4.32Å; A445-F470 HydrophobicContact CB-CD2 3.79Å; A445-F470 HydrophobicContact CB-CE2 4.3Å; A445-F470 HydrophobicContact CB-CG 4.05Å; C447-F470 WeakPolarHBondContact CA-O 3.2Å; G448-F470 PolarHBondContact N-O 2.85Å; L454-F470 HydrophobicContact CD1-CB 3.79Å; N463-F470 HydrophobicContact CB-CD1 3.86Å; N463-F470 HydrophobicContact CB-CE1 3.98Å; N463-F470 VanDerWaalsContact OD1-CD1 3.29Å; N463-F470 WeakPolarHBondContact OD1-CD1 3.15Å; N463-F470 VanDerWaalsContact OD1-CE1 3.24Å; N463-F470 WeakPolarHBondContact OD1-CE1 3.15Å; D468-F470 HydrophobicContact CB-CZ 4.28Å; D468-F470 WeakPolarHBondContact O-CD2 3.34Å; D468-F470 WeakPolarHBondContact O-CE2 3.37Å; D468-F470 PolarHBondContact O-N 3.17Å
471	I	88.7	Confident	86.2	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	149.5	176.9	61.5	178.8	0	0	0	112.5	W429 F436 V449 G461 F462 L469 C475 I479	W429-I471 HydrophobicContact CZ3-CD1 3.97Å; F436-I471 HydrophobicContact CD1-CD1 4.07Å; F436-I471 HydrophobicContact CD1-CG1 4.31Å; F436-I471 HydrophobicContact CE1-CD1 3.55Å; F436-I471 HydrophobicContact CE1-CG1 3.83Å; F436-I471 HydrophobicContact CE2-CD1 4.15Å; F436-I471 HydrophobicContact CZ-CD1 3.6Å; F436-I471 HydrophobicContact CZ-CG1 4.34Å; V449-I471 HydrophobicContact CG2-CG2 3.77Å; G461-I471 CarbonylContact C-O 3.49Å; G461-I471 WeakPolarHBondContact CA-O 3.48Å; F462-I471 HydrophobicContact CB-CD1 4.47Å; F462-I471 HydrophobicContact CB-CG1 4.02Å; F462-I471 HydrophobicContact CD2-CD1 4.43Å; F462-I471 HydrophobicContact CD2-CG1 4.37Å; F462-I471 PolarHBondContact N-O 3.04Å; F462-I471 PolarHBondContact O-N 3.11Å; L469-I471 HydrophobicContact CD1-CG2 4.49Å; L469-I471 HydrophobicContact CG-CG2 4.26Å; I471-C475 HydrophobicContact CB-CB 4.29Å; I471-I479 HydrophobicContact CD1-CD1 3.72Å; I471-I479 HydrophobicContact CD1-CG1 4.17Å
472	H	85.8	Confident	86.3	Confident	10 Å²	10	64 Å²	64	5%	0.046	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	156.1	168.5	-60.3	97.3	0	0	0	112.7	C447 F452 L453 L454 Q460 K474 C475 K476	C447-H472 VanDerWaalsContact CB-CE1 3.41Å; C447-H472 WeakPolarHBondContact CB-CE1 3.24Å; C447-H472 VanDerWaalsContact CB-ND1 3.29Å; C447-H472 WeakPolarHBondContact CB-ND1 3.43Å; C447-H472 PolarHBondContact SG-N 3.37Å; C447-H472 VanDerWaalsContact SG-N 3.44Å; C447-H472 PolarHBondContact SG-ND1 2.63Å; C447-H472 VanDerWaalsContact SG-ND1 3.4Å; F452-H472 PolarHBondContact O-CE1 3.38Å; L453-H472 PolarHBondContact O-CE1 3.09Å; L453-H472 PolarHBondContact O-NE2 3.15Å; L454-H472 HydrophobicContact CD2-CB 4.47Å; L454-H472 WeakPolarHBondContact CD2-CD2 3.43Å; Q460-H472 WeakPolarHBondContact O-CA 3.36Å; H472-K474 HydrophobicContact CB-CG 3.84Å; H472-K474 PolarHBondContact O-N 3.07Å; H472-K474 VanDerWaalsContact O-N 3.12Å; H472-C475 HydrophobicContact CB-CB 4.1Å; H472-C475 PolarHBondContact O-N 3.21Å; H472-K476 PolarHBondContact O-N 3.01Å
473	L	83.6	Confident	86.2	Confident	87 Å²	87	63.8 Å²	63.8	46%	0.455	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-32.7	173.1	-134.3	79.9	0	0	0	113.2	E438 Q460 F462 K476	E438-L473 HydrophobicContact CG-CD1 4.26Å; Q460-L473 PolarHBondContact O-N 3.3Å; F462-L473 HydrophobicContact CD2-CD1 4.02Å; F462-L473 HydrophobicContact CE1-CD1 4.14Å; F462-L473 HydrophobicContact CE2-CD1 3.45Å; F462-L473 VanDerWaalsContact CE2-CD1 3.45Å; F462-L473 HydrophobicContact CE2-CG 3.84Å; F462-L473 HydrophobicContact CZ-CD1 3.5Å; F462-L473 HydrophobicContact CZ-CG 4.08Å; L473-K476 VanDerWaalsContact O-CB 3.31Å; L473-K476 WeakPolarHBondContact O-CB 3.42Å
474	K	84.5	Confident	85.3	Confident	122 Å²	122	69.6 Å²	69.6	53%	0.53	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-32	174.5	62.2	-170.1	175.4	-168.8	0	114	H472 K476	H472-K474 HydrophobicContact CB-CG 3.84Å; H472-K474 PolarHBondContact O-N 3.07Å; H472-K474 VanDerWaalsContact O-N 3.12Å; K474-K476 VanDerWaalsContact C-N 3.29Å; K474-K476 PolarHBondContact O-N 3.04Å
475	C	87.6	Confident	84	Confident	15 Å²	15	78.6 Å²	78.6	10%	0.101	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-78.2	-13.9	-176.9	-69.8	0	0	0	0	113.9	C447 V449 I471 H472 N477 G478	C447-C475 VanDerWaalsContact SG-CB 3.56Å; V449-C475 HydrophobicContact CB-CB 3.92Å; V449-C475 HydrophobicContact CG1-CB 3.95Å; V449-C475 HydrophobicContact CG2-CB 4.48Å; I471-C475 HydrophobicContact CB-CB 4.29Å; H472-C475 HydrophobicContact CB-CB 4.1Å; H472-C475 PolarHBondContact O-N 3.21Å; C475-N477 VanDerWaalsContact C-N 3.26Å; C475-N477 PolarHBondContact O-N 3.08Å; C475-G478 PolarHBondContact O-N 3.27Å
476	K	85.2	Confident	82.1	Confident	61 Å²	61	81.8 Å²	81.8	27%	0.265	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-21.6	-57.6	164.4	-168.3	175.3	-166	164.1	0	115.5	W429 F462 H472 L473 K474 G478	W429-K476 HydrophobicContact CD2-CD 4.31Å; W429-K476 HydrophobicContact CD2-CG 4.06Å; W429-K476 HydrophobicContact CE3-CD 4.47Å; W429-K476 HydrophobicContact CE3-CG 3.91Å; W429-K476 HydrophobicContact CH2-CB 4.24Å; W429-K476 HydrophobicContact CH2-CG 3.34Å; W429-K476 WeakPolarHBondContact CH2-O 3.47Å; W429-K476 HydrophobicContact CZ2-CD 4.22Å; W429-K476 HydrophobicContact CZ2-CG 3.39Å; W429-K476 HydrophobicContact CZ3-CB 4.42Å; W429-K476 HydrophobicContact CZ3-CG 3.6Å; F462-K476 HydrophobicContact CE2-CD 4.01Å; F462-K476 HydrophobicContact CE2-CG 4.33Å; F462-K476 HydrophobicContact CZ-CD 4.49Å; H472-K476 PolarHBondContact O-N 3.01Å; L473-K476 VanDerWaalsContact O-CB 3.31Å; L473-K476 WeakPolarHBondContact O-CB 3.42Å; K474-K476 VanDerWaalsContact C-N 3.29Å; K474-K476 PolarHBondContact O-N 3.04Å; K476-G478 PolarHBondContact O-N 3.07Å
477	N	84.1	Confident	79.9	Confident	137 Å²	137	83 Å²	83	73%	0.733	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-84.1	-5.5	-174	-65	-12.7	0	0	0	114.6	C475	C475-N477 VanDerWaalsContact C-N 3.26Å; C475-N477 PolarHBondContact O-N 3.08Å
478	G	85.5	Confident	77.6	Confident	37 Å²	37	92.6 Å²	92.6	38%	0.381	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-93.1	-5.8	-175	0	0	0	0	0	115.3	C475 K476 R480	C475-G478 PolarHBondContact O-N 3.27Å; K476-G478 PolarHBondContact O-N 3.07Å; G478-R480 PolarHBondContact O-N 2.75Å
479	I	85.1	Confident	75.1	Confident	7 Å²	7	99 Å²	99	4%	0.036	48%	0.478	C	S	.	.			trans	-59	123.7	-179.8	-52.1	168.4	0	0	0	109.6	W429 K432 F436 V449 L469 I471	W429-I479 HydrophobicContact CH2-CD1 3.74Å; W429-I479 HydrophobicContact CZ3-CD1 3.93Å; K432-I479 PolarHBondContact NZ-O 2.96Å; F436-I479 HydrophobicContact CD2-CD1 4.44Å; F436-I479 HydrophobicContact CE2-CD1 3.34Å; F436-I479 HydrophobicContact CZ-CD1 3.5Å; F436-I479 VanDerWaalsContact CZ-CD1 3.5Å; V449-I479 HydrophobicContact CG2-CG1 3.95Å; L469-I479 HydrophobicContact CD2-CG2 4.49Å; I471-I479 HydrophobicContact CD1-CD1 3.72Å; I471-I479 HydrophobicContact CD1-CG1 4.17Å
480	R	82.6	Confident	72.6	Confident	210 Å²	210	103.1 Å²	103.1	79%	0.792	51%	0.505	S	S	*	.			trans	-91.6	-42.4	177.7	-67.2	-170.5	177.1	-170.6	-0.1	112	K432 G478	K432-R480 PolarHBondContact NZ-O 3.03Å; G478-R480 PolarHBondContact O-N 2.75Å
481	D	81.5	Confident	70	Confident	118 Å²	118	106.7 Å²	106.7	63%	0.631	53%	0.532	S	S	*	.	S	Bend	trans	-83	171.4	-168.9	-47.4	-68.8	0	0	0	113.5	K432	K432-D481 WeakPolarHBondContact CB-O 3.17Å; K432-D481 WeakPolarHBondContact CD-O 3.39Å
482	H	82.4	Confident	67.1	Low	132 Å²	132	110.2 Å²	110.2	61%	0.611	57%	0.568	S	S	*	*			trans	-107.5	153.1	174.3	-77.3	-106.8	0	0	0	110.4	K432 S484	K432-H482 CarbonylContact O-C 3.5Å; K432-H482 VanDerWaalsContact O-CA 3.29Å; K432-H482 WeakPolarHBondContact O-CA 3.43Å; H482-S484 PolarHBondContact O-N 3.39Å; H482-S484 VanDerWaalsContact O-N 3.13Å
483	C	85.1	Confident	64.5	Low	10 Å²	10	116.7 Å²	116.7	7%	0.068	61%	0.608	C	S	.	*			trans	-71.2	111.3	-178.8	-168.2	0	0	0	0	111.5	K432 H434 N466 C467 R485	K432-C483 PolarHBondContact O-N 3.29Å; H434-C483 HydrophobicContact CB-CB 4.29Å; H434-C483 PolarHBondContact NE2-N 3.04Å; N466-C483 WeakPolarHBondContact CB-SG 3.39Å; C467-C483 VanDerWaalsContact SG-SG 3.64Å; C483-R485 PolarHBondContact O-N 2.99Å
484	S	71.9	Confident	62	Low	125 Å²	125	116.6 Å²	116.6	87%	0.874	62%	0.62	S	S	*	*	S	Bend	trans	-68.1	19.3	-177.3	-44.3	0	0	0	0	115.7	H482	H482-S484 PolarHBondContact O-N 3.39Å; H482-S484 VanDerWaalsContact O-N 3.13Å
485	R	64.4	Low	59.2	Low	189 Å²	189	116.4 Å²	116.4	71%	0.713	63%	0.634	S	S	*	*			trans	-138.4	44.4	-173.3	-142.9	178.8	-161.8	-153	6.7	114.3	N466 C483	N466-R485 HydrophobicContact CB-CB 4.5Å; N466-R485 WeakPolarHBondContact O-CB 3.3Å; N466-R485 WeakPolarHBondContact O-CD 3.48Å; C483-R485 PolarHBondContact O-N 2.99Å
486	E	47.3	Very low	56.4	Low	155 Å²	155	120 Å²	120	72%	0.724	67%	0.665	S	S	*	*			trans	-76.4	126.4	165.1	-151.9	79.6	-114.1	0	0	109.3
487	G	41.6	Very low	53.6	Low	72 Å²	72	123.8 Å²	123.8	74%	0.742	69%	0.688	S	S	*	*			trans	126.2	16.9	158.9	0	0	0	0	0	122.2
488	R	38.7	Very low	51.1	Low	252 Å²	252	123.7 Å²	123.7	95%	0.951	69%	0.692	S	S	*	*			trans	-128.1	115.7	163.6	-70.4	-164.5	-173.8	-164.4	3.7	113.2
489	R	34.6	Very low	48.5	Very low	235 Å²	235	128.8 Å²	128.8	89%	0.887	71%	0.71	S	S	*	*			trans	-100.4	169.7	166.5	-71.3	176.8	166	139.9	-5.2	109.5
490	T	36.3	Very low	45.9	Very low	130 Å²	130	133.4 Å²	133.4	80%	0.798	74%	0.743	S	S	*	*			trans	70	147.9	163.3	49.5	0	0	0	0	120
491	T	32.9	Very low	43.4	Very low	137 Å²	137	126.7 Å²	126.7	84%	0.84	74%	0.739	S	S	*	*			trans	58.9	93.5	164.7	58.2	0	0	0	0	120.9
492	G	27.8	Very low	41.1	Very low	73 Å²	73	129 Å²	129	75%	0.753	75%	0.749	S	S	*	*				84	150.1	109.3	0	0	0	0	0	122
493	V	32.3	Very low	38.6	Very low	147 Å²	147	131.1 Å²	131.1	89%	0.891	76%	0.764	S	S	*	*			trans	76.9	125.4	163.5	-170.7	0	0	0	0	118.5
494	A	29.9	Very low	35.9	Very low	85 Å²	85	133.5 Å²	133.5	70%	0.702	79%	0.791	S	S	*	*			trans	57.1	132.3	166.7	0	0	0	0	0	117.9
495	S	27.5	Very low	34	Very low	117 Å²	117	133.1 Å²	133.1	82%	0.818	79%	0.788	S	S	*	*			cis	80.4	123.7	32.2	-56.1	0	0	0	0	115.8
496	A	27.2	Very low	32.3	Very low	90 Å²	90	130.7 Å²	130.7	74%	0.744	79%	0.788	S	S	*	*			trans	74.1	157.1	170.9	0	0	0	0	0	119.1
497	N	27.6	Very low	31.5	Very low	142 Å²	142	129.5 Å²	129.5	76%	0.759	79%	0.794	S	S	*	*			trans	72.7	69.8	163.8	-59.1	-8.2	0	0	0	120.1
498	V	32	Very low	30.8	Very low	135 Å²	135	132.3 Å²	132.3	82%	0.818	79%	0.791	S	S	*	*	S	Bend	trans	-128.2	48.3	150	-161.8	0	0	0	0	111.2
499	L	31.1	Very low	30.3	Very low	143 Å²	143	127.1 Å²	127.1	75%	0.749	78%	0.782	S	S	*	*	S	Bend	trans	-126.8	11.3	175	-90.3	171.8	0	0	0	113.7
500	S	30.4	Very low	30	Very low	105 Å²	105	122 Å²	122	73%	0.734	78%	0.777	S	S	*	*	S	Bend	trans	-141.8	26.1	-171.9	-46.2	0	0	0	0	113.5
501	G	30	Very low	29.6	Very low	69 Å²	69	123.7 Å²	123.7	71%	0.711	78%	0.778	S	S	*	*	S	Bend	trans	-112.9	-12.4	-164.5	0	0	0	0	0	118.3
502	I	33.3	Very low	29.4	Very low	165 Å²	165	124.7 Å²	124.7	85%	0.846	78%	0.778	S	S	*	*	S	Bend	trans	-125	-7.6	-175.5	-54.9	-177.6	0	0	0	112.7	G504	I502-G504 PolarHBondContact O-N 3.21Å
503	L	29.3	Very low	29.3	Very low	177 Å²	177	126.8 Å²	126.8	93%	0.927	78%	0.776	S	S	*	*	S	Bend	trans	-75.9	69.2	158.7	-74.5	165.9	0	0	0	109.1
504	G	28.5	Very low	29.2	Very low	60 Å²	60	127.7 Å²	127.7	62%	0.619	77%	0.77	S	S	*	*			trans	-170.3	20.9	-168	0	0	0	0	0	116.6	I502	I502-G504 PolarHBondContact O-N 3.21Å
505	S	31.1	Very low	29.1	Very low	117 Å²	117	129.6 Å²	129.6	82%	0.818	77%	0.773	S	S	*	*			trans	-136.1	72.7	173.8	-69.4	0	0	0	0	110.4
506	I	29.5	Very low	29.4	Very low	138 Å²	138	130 Å²	130	71%	0.708	77%	0.773	S	S	*	*			trans	-106.1	114.6	178.6	-59.4	170.6	0	0	0	108.4	N508	I506-N508 HydrophobicContact CG2-CB 3.78Å
507	P	30.3	Very low	29.3	Very low	131 Å²	131	128.8 Å²	128.8	85%	0.851	77%	0.769	S	S	*	*			trans	-80.5	112.8	146.5	31.4	-25.5	0	0	0	107.9
508	N	26	Very low	29.4	Very low	130 Å²	130	130.1 Å²	130.1	70%	0.695	78%	0.776	S	S	*	*			trans	-111.5	174.8	170.3	-157.9	-11.1	0	0	0	108.2	I506	I506-N508 HydrophobicContact CG2-CB 3.78Å
509	L	28.6	Very low	29.4	Very low	144 Å²	144	127.9 Å²	127.9	75%	0.754	77%	0.772	S	S	*	*			trans	73.3	137	178.4	-40.1	178.5	0	0	0	112.8
510	T	28.8	Very low	29.3	Very low	128 Å²	128	126.8 Å²	126.8	79%	0.785	77%	0.774	S	S	*	*			cis	-156.8	171.9	-7.5	4.3	0	0	0	0	109
511	M	26.6	Very low	29.1	Very low	164 Å²	164	128.1 Å²	128.1	81%	0.808	77%	0.773	S	S	*	*			trans	-58.2	144.5	158.4	-67.9	-71.3	-168	0	0	110.2
512	D	28.8	Very low	29.1	Very low	158 Å²	158	132.2 Å²	132.2	85%	0.845	77%	0.773	S	S	*	*				-178	163.1	112.8	-89.8	-16.3	0	0	0	112.9
513	T	27	Very low	28.8	Very low	117 Å²	117	129.1 Å²	129.1	72%	0.718	76%	0.762	S	S	*	*			trans	-85.9	165.8	-164	48.7	0	0	0	0	116.7
514	H	28.9	Very low	28.6	Very low	166 Å²	166	126.9 Å²	126.9	77%	0.769	75%	0.751	S	S	*	*			trans	84.7	95.4	144.9	-78.4	-57.4	0	0	0	122.6
515	V	29.3	Very low	28.6	Very low	125 Å²	125	132.3 Å²	132.3	76%	0.758	76%	0.76	S	S	*	*			trans	60.8	177	132	-116.3	0	0	0	0	119.1
516	P	33.7	Very low	28.6	Very low	125 Å²	125	131.5 Å²	131.5	81%	0.812	76%	0.755	S	S	*	*				-126.4	178.3	-122.7	43.5	-25.8	0	0	0	116.1
517	G	25.4	Very low	28.5	Very low	65 Å²	65	129.4 Å²	129.4	67%	0.67	75%	0.751	S	S	*	*			trans	154.2	134.9	151.5	0	0	0	0	0	118.4
518	N	29.1	Very low	28.5	Very low	170 Å²	170	128.9 Å²	128.9	91%	0.909	74%	0.741	S	S	*	*			trans	64.1	125.3	150.8	-60	-19.6	0	0	0	121.4
519	A	30.6	Very low	28.7	Very low	89 Å²	89	131 Å²	131	74%	0.736	74%	0.744	S	S	*	*			trans	-79.7	173	158.4	0	0	0	0	0	111
520	P	29.8	Very low	28.8	Very low	120 Å²	120	129.7 Å²	129.7	78%	0.779	74%	0.742	S	S	*	*				-148.1	132.8	73	36.1	-15.7	0	0	0	117.5
521	N	27.4	Very low	29.2	Very low	133 Å²	133	128.8 Å²	128.8	71%	0.711	74%	0.739	S	S	*	*				29.3	118.6	113.3	-163.7	9.6	0	0	0	119.3
522	Q	28.5	Very low	29.2	Very low	154 Å²	154	129.2 Å²	129.2	72%	0.72	74%	0.743	S	S	*	*				172.6	149.2	114.2	-96.6	-177.6	49.3	0	0	118.9
523	T	26.8	Very low	29.1	Very low	100 Å²	100	128 Å²	128	61%	0.613	74%	0.737	S	S	*	*			trans	75.8	109.1	142.8	52.4	0	0	0	0	124.8
524	N	26.7	Very low	29	Very low	130 Å²	130	126.5 Å²	126.5	70%	0.695	73%	0.731	S	S	*	*				112	108.2	114.9	-73	10.8	0	0	0	123.1
525	E	28.2	Very low	28.8	Very low	174 Å²	174	125.2 Å²	125.2	81%	0.813	73%	0.73	S	S	*	*				46.6	135.3	127.8	-43.3	-168.9	136.7	0	0	120.6
526	S	30.8	Very low	28.6	Very low	100 Å²	100	128.4 Å²	128.4	70%	0.699	74%	0.736	S	S	*	*				178.5	173.6	53.1	65	0	0	0	0	114.9
527	C	26.5	Very low	28.2	Very low	95 Å²	95	131.1 Å²	131.1	64%	0.642	74%	0.742	S	S	*	*			trans	83.3	97.1	144.4	-71	0	0	0	0	123.7
528	N	30.9	Very low	28.1	Very low	119 Å²	119	131.3 Å²	131.3	64%	0.636	74%	0.744	S	S	*	*				70.4	155.9	107.3	-64.8	-29.9	0	0	0	121
529	K	30.9	Very low	27.9	Very low	174 Å²	174	128.4 Å²	128.4	76%	0.757	74%	0.737	S	S	*	*			cis	-171	173.9	-18.9	-108.4	-179.9	176.7	80	0	106
530	V	30.4	Very low	27.6	Very low	118 Å²	118	130.9 Å²	130.9	72%	0.715	74%	0.738	S	S	*	*			cis	-149.1	154.2	7	84.8	0	0	0	0	109.3
531	P	36.7	Very low	27.3	Very low	109 Å²	109	131.9 Å²	131.9	71%	0.708	74%	0.737	S	S	*	*			trans	-104.4	167	177.2	39	-35.1	0	0	0	114.4
532	L	27.3	Very low	27.2	Very low	173 Å²	173	132 Å²	132	91%	0.906	74%	0.737	S	S	*	*			trans	-148.7	158.9	159.7	-73.9	-179.1	0	0	0	110.8
533	N	25.4	Very low	27.1	Very low	133 Å²	133	131.8 Å²	131.8	71%	0.711	74%	0.739	S	S	*	*				179.3	128.2	-65.9	175	53.4	0	0	0	109.3
534	S	25.9	Very low	27.4	Very low	84 Å²	84	135.3 Å²	135.3	59%	0.587	75%	0.748	S	S	*	*			trans	54.8	146.3	157.5	-74.6	0	0	0	0	123.4
535	N	24.5	Very low	27.4	Very low	140 Å²	140	137 Å²	137	75%	0.749	75%	0.751	S	S	*	*			trans	66.4	93.4	145.7	-60.2	-6.3	0	0	0	119.8
536	Q	24.9	Very low	27.2	Very low	192 Å²	192	132.8 Å²	132.8	90%	0.897	74%	0.74	S	S	*	*				-155	138.1	127	-117.2	142.4	107.8	0	0	113	G538	Q536-G538 PolarHBondContact O-N 3.09Å; Q536-G538 VanDerWaalsContact O-N 3.14Å
537	I	25.4	Very low	26.9	Very low	182 Å²	182	132.7 Å²	132.7	93%	0.933	74%	0.738	S	S	*	*			trans	-76.5	94	163.2	-65.6	170.9	0	0	0	105.7
538	G	24.2	Very low	27	Very low	68 Å²	68	133.6 Å²	133.6	70%	0.701	74%	0.741	S	S	*	*			trans	-103.7	130	-171.4	0	0	0	0	0	113	Q536	Q536-G538 PolarHBondContact O-N 3.09Å; Q536-G538 VanDerWaalsContact O-N 3.14Å
539	S	24.4	Very low	26.7	Very low	109 Å²	109	133.5 Å²	133.5	76%	0.762	75%	0.745	S	S	*	*			trans	-93	155.2	161.2	-60.8	0	0	0	0	110.1
540	N	23	Very low	26.6	Very low	141 Å²	141	133.6 Å²	133.6	75%	0.754	75%	0.748	S	S	*	*			trans	74.5	145.1	174.3	-46.7	-14.3	0	0	0	115.7
541	D	23.8	Very low	26.4	Very low	142 Å²	142	137.9 Å²	137.9	76%	0.759	75%	0.751	S	S	*	*			trans	61.7	133.1	150.5	-53.5	-23.6	0	0	0	118
542	L	24.9	Very low	26	Very low	136 Å²	136	142.9 Å²	142.9	71%	0.712	76%	0.756	S	S	*	*			cis	-163.4	164.1	2.2	-148.9	68.4	0	0	0	108.7
543	I	27.5	Very low	25.8	Very low	149 Å²	149	138.9 Å²	138.9	76%	0.764	74%	0.741	S	S	*	*			trans	70	132.2	163.8	-52.4	151.7	0	0	0	115.2
544	H	32.8	Very low	25.9	Very low	173 Å²	173	135.1 Å²	135.1	80%	0.801	73%	0.734	S	S	*	*			cis	-124.1	120.1	-2.4	-162.7	-72.3	0	0	0	112
545	H	26.8	Very low	25.9	Very low	165 Å²	165	136.3 Å²	136.3	76%	0.764	74%	0.742	S	S	*	*			trans	-61.9	150.9	177.6	-117.2	-46.5	0	0	0	114.7
546	C	24.7	Very low	26	Very low	87 Å²	87	136.3 Å²	136.3	59%	0.588	74%	0.742	S	S	*	*				65.8	177.2	129.3	-145.7	0	0	0	0	116.8
547	C	24.8	Very low	26	Very low	97 Å²	97	132.2 Å²	132.2	66%	0.655	73%	0.73	S	S	*	*			cis	-150.8	150.6	2.3	-93.9	0	0	0	0	108.3
548	T	27.8	Very low	26	Very low	115 Å²	115	133.8 Å²	133.8	71%	0.706	73%	0.725	S	S	*	*	S	Bend	cis	60.9	81.6	17.5	-38.8	0	0	0	0	114.4
549	T	25.5	Very low	26.1	Very low	117 Å²	117	138.2 Å²	138.2	72%	0.718	73%	0.727	S	S	*	*	S	Bend	trans	52	120.5	160.3	58.3	0	0	0	0	119.4
550	H	27	Very low	26.2	Very low	176 Å²	176	141.5 Å²	141.5	82%	0.815	73%	0.728	S	S	*	*			trans	43.9	103.6	148.2	-93	-76.6	0	0	0	119.2
551	R	28.1	Very low	26.4	Very low	208 Å²	208	141.8 Å²	141.8	79%	0.785	72%	0.724	S	S	*	*				167.9	159.6	113.3	-90.9	160.9	-169	-129.7	3.7	114.1
552	R	27.2	Very low	26.5	Very low	213 Å²	213	142.8 Å²	142.8	80%	0.804	72%	0.722	S	S	*	*			trans	-85	141.2	160.8	-97.8	-176.2	172.5	-176.4	-2.8	110.1
553	C	24.4	Very low	26.6	Very low	89 Å²	89	145.1 Å²	145.1	60%	0.601	73%	0.726	S	S	*	*				42.2	124.3	128.9	-162.1	0	0	0	0	120.2
554	G	25.6	Very low	26.6	Very low	54 Å²	54	141.8 Å²	141.8	56%	0.557	72%	0.721	S	S	*	*			trans	72.9	118.5	134.5	0	0	0	0	0	120	V1168	G554-V1168 WeakPolarHBondContact O-CG2 3.44Å
555	S	27.6	Very low	26.3	Very low	109 Å²	109	140.1 Å²	140.1	76%	0.762	72%	0.718	S	S	*	*				179.8	123.4	119.2	-94.5	0	0	0	0	112.9
556	D	26.1	Very low	26.2	Very low	140 Å²	140	137.4 Å²	137.4	75%	0.749	71%	0.713	S	S	*	*			trans	-36.9	142.9	176.9	-68.6	-82.2	0	0	0	122.5
557	T	25.2	Very low	26.2	Very low	106 Å²	106	140 Å²	140	65%	0.65	72%	0.72	S	S	*	*			trans	59.4	126.2	136	71.5	0	0	0	0	119.6
558	R	24.9	Very low	26.2	Very low	215 Å²	215	143.8 Å²	143.8	81%	0.811	73%	0.726	S	S	*	*				-172.7	152	55.9	-106.7	121.1	-169.2	-118.4	1	111.8
559	H	26.3	Very low	26	Very low	161 Å²	161	143 Å²	143	75%	0.745	72%	0.718	S	S	*	*			trans	-3.2	133.2	146.3	-52.4	-62.3	0	0	0	118.1
560	K	27.2	Very low	26	Very low	179 Å²	179	145.8 Å²	145.8	78%	0.778	72%	0.72	S	S	*	*			cis	-145.7	142.6	36.6	-90.3	111.7	177.6	-172	0	110.2
561	Q	26.3	Very low	26	Very low	146 Å²	146	144.2 Å²	144.2	68%	0.682	71%	0.713	S	S	*	*				76.9	135.3	54.8	-161.4	-153.4	57.8	0	0	113
562	K	26.9	Very low	25.9	Very low	164 Å²	164	141 Å²	141	71%	0.713	71%	0.71	S	S	*	*			trans	82.8	137.6	174	-62.8	179.2	-173.7	173.5	0	115.3
563	K	25.5	Very low	25.7	Very low	184 Å²	184	137.7 Å²	137.7	80%	0.8	71%	0.708	S	S	*	*			cis	-167.7	166.3	-16.5	-133.7	-174	-179.5	-165.4	0	109.1
564	A	27.6	Very low	25.8	Very low	79 Å²	79	138.6 Å²	138.6	65%	0.653	71%	0.712	S	S	*	*			trans	68.4	152.1	143.5	0	0	0	0	0	118.2
565	N	27.1	Very low	25.7	Very low	138 Å²	138	140.2 Å²	140.2	74%	0.738	72%	0.715	S	S	*	*			cis	-161.7	151.1	-27.4	-114.4	9.7	0	0	0	106.9
566	T	25	Very low	25.4	Very low	109 Å²	109	144.5 Å²	144.5	67%	0.669	72%	0.72	S	S	*	*			trans	40.7	117.3	147.7	60.5	0	0	0	0	118.8
567	L	24.1	Very low	25.3	Very low	140 Å²	140	145 Å²	145	73%	0.733	72%	0.722	S	S	*	*				61.5	132.9	65.2	-157.3	-177.8	0	0	0	110.5
568	K	24.8	Very low	25.2	Very low	177 Å²	177	146.5 Å²	146.5	77%	0.77	72%	0.722	S	S	*	*			trans	107.5	128.7	175	-61.1	-163.6	171.8	-161.5	0	114
569	D	24.6	Very low	25.2	Very low	100 Å²	100	145.3 Å²	145.3	54%	0.535	72%	0.717	S	S	.	*			cis	-155.9	-151.2	-15	-94.9	-35.1	0	0	0	104.1
570	F	25.1	Very low	25	Very low	174 Å²	174	142.8 Å²	142.8	76%	0.763	71%	0.709	S	S	*	*			trans	74.7	123.4	163.1	-52	-82.1	0	0	0	117
571	H	26.3	Very low	24.9	Very low	144 Å²	144	139.9 Å²	139.9	67%	0.667	70%	0.702	S	S	*	*			cis	-168.8	159.6	-10.9	-133.6	-150.9	0	0	0	110.9
572	L	26.3	Very low	24.8	Very low	140 Å²	140	139.5 Å²	139.5	73%	0.733	71%	0.705	S	S	*	*			trans	66.8	123.5	159.2	-54.5	162.3	0	0	0	116.4
573	L	22.9	Very low	24.7	Very low	143 Å²	143	136.5 Å²	136.5	75%	0.749	71%	0.71	S	S	*	*				47.4	142.5	67.7	-66.5	174.1	0	0	0	114.1
574	P	25.7	Very low	24.6	Very low	108 Å²	108	133.3 Å²	133.3	70%	0.701	70%	0.702	S	S	*	*			cis	-108.8	178.7	12.7	13.1	12.6	0	0	0	112	F576	P574-F576 HydrophobicContact CB-CD2 4.32Å
575	S	23.5	Very low	24.4	Very low	88 Å²	88	134.7 Å²	134.7	62%	0.615	71%	0.707	S	S	*	*			cis	67.4	151.7	44.4	-46.9	0	0	0	0	115.4
576	F	23.2	Very low	24.2	Very low	199 Å²	199	133.5 Å²	133.5	87%	0.873	70%	0.704	S	S	*	*			trans	87	141.2	168.9	-62	-75.3	0	0	0	121	P574	P574-F576 HydrophobicContact CB-CD2 4.32Å
577	L	22.6	Very low	24.1	Very low	150 Å²	150	134.6 Å²	134.6	79%	0.785	71%	0.706	S	S	*	*			trans	-58.2	166.5	161.6	-75.5	161.4	0	0	0	112
578	H	23.2	Very low	24.2	Very low	138 Å²	138	134.7 Å²	134.7	64%	0.639	71%	0.708	S	S	*	*			trans	68	113.6	159.5	-89.1	65.5	0	0	0	116.1
579	R	24.3	Very low	24.3	Very low	191 Å²	191	130.9 Å²	130.9	72%	0.721	70%	0.701	S	S	*	*				49.8	89.5	73.2	179.9	-171.9	175.8	-150	8.5	110.8
580	N	22.5	Very low	24.2	Very low	108 Å²	108	133.6 Å²	133.6	58%	0.578	71%	0.71	S	S	*	*				-168.2	154.4	95.9	-105	-19.5	0	0	0	113.1
581	N	25	Very low	24.2	Very low	117 Å²	117	131.3 Å²	131.3	63%	0.626	71%	0.706	S	S	*	*			trans	29.8	134.8	135.2	-43.7	-13.6	0	0	0	119.5
582	N	24.3	Very low	24	Very low	138 Å²	138	130.9 Å²	130.9	74%	0.738	71%	0.713	S	S	*	*				-177.2	88.8	90.9	-88.3	-48.4	0	0	0	111.3	N584	N582-N584 VanDerWaalsContact CA-OD1 3.25Å; N582-N584 WeakPolarHBondContact CA-OD1 3.48Å; N582-N584 PolarHBondContact OD1-OD1 3.19Å
583	A	25.3	Very low	23.9	Very low	101 Å²	101	129.9 Å²	129.9	84%	0.835	71%	0.712	S	S	*	*	S	Bend	trans	-169.8	47.8	162.7	0	0	0	0	0	107.2
584	N	23.9	Very low	23.9	Very low	117 Å²	117	127.3 Å²	127.3	63%	0.626	71%	0.712	S	S	*	*				86.1	149.4	76.6	-77.5	13.3	0	0	0	111.9	N582	N582-N584 VanDerWaalsContact CA-OD1 3.25Å; N582-N584 WeakPolarHBondContact CA-OD1 3.48Å; N582-N584 PolarHBondContact OD1-OD1 3.19Å
585	S	22.8	Very low	23.8	Very low	108 Å²	108	127.5 Å²	127.5	76%	0.755	72%	0.716	S	S	*	*			trans	73.8	115.5	158.9	-70.7	0	0	0	0	118
586	V	22.2	Very low	24	Very low	113 Å²	113	130 Å²	130	69%	0.685	72%	0.722	S	S	*	*				69.6	93.7	118.2	178	0	0	0	0	115.3
587	D	23.5	Very low	24	Very low	132 Å²	132	127 Å²	127	71%	0.706	72%	0.715	S	S	*	*				64.3	134.8	118.1	-55.2	-52.9	0	0	0	120.5
588	N	25.6	Very low	24.1	Very low	143 Å²	143	127.1 Å²	127.1	77%	0.765	71%	0.711	S	S	*	*				26.2	145	104.1	-119.2	10.5	0	0	0	118.4
589	P	27	Very low	24.2	Very low	97 Å²	97	125.1 Å²	125.1	63%	0.63	71%	0.709	S	S	*	*			cis	-135.1	-162	1.5	42.5	-23.3	0	0	0	113.1
590	H	23.2	Very low	24.3	Very low	156 Å²	156	123.7 Å²	123.7	72%	0.722	71%	0.714	S	S	*	*			trans	11.4	137.7	139.4	-82	-98	0	0	0	121.1
591	D	24.9	Very low	24.4	Very low	127 Å²	127	124.8 Å²	124.8	68%	0.679	72%	0.72	S	S	*	*			trans	53.9	119.3	138.9	-57.6	-43.6	0	0	0	120.4
592	V	22.6	Very low	24.4	Very low	135 Å²	135	123.9 Å²	123.9	82%	0.818	72%	0.723	S	S	*	*				-170.2	114.2	115	145.5	0	0	0	0	105.7
593	V	23.5	Very low	24.4	Very low	118 Å²	118	122.2 Å²	122.2	72%	0.715	72%	0.722	S	S	*	*				75.8	143.5	60.5	176.5	0	0	0	0	112.4
594	A	23.2	Very low	24.3	Very low	89 Å²	89	122.3 Å²	122.3	74%	0.736	72%	0.715	S	S	*	*			trans	63.6	89.7	169.7	0	0	0	0	0	118.7
595	S	23.9	Very low	24.4	Very low	113 Å²	113	125 Å²	125	79%	0.79	72%	0.724	S	S	*	*	S	Bend		177.6	126.7	123.8	-169.9	0	0	0	0	108.2
596	L	26.9	Very low	24.3	Very low	140 Å²	140	126.7 Å²	126.7	73%	0.733	73%	0.725	S	S	*	*			cis	-139.5	122.8	-1.1	-159.7	73.6	0	0	0	104.2
597	D	22.6	Very low	24.4	Very low	137 Å²	137	126.3 Å²	126.3	73%	0.733	73%	0.727	S	S	*	*				70.2	152.4	53.3	-148.3	-0	0	0	0	113.8
598	E	25.5	Very low	24.4	Very low	152 Å²	152	125.7 Å²	125.7	71%	0.71	73%	0.733	S	S	*	*			trans	68.5	96.7	173.7	-56.2	-156.8	114.3	0	0	120.3
599	T	25	Very low	24.3	Very low	96 Å²	96	122.3 Å²	122.3	59%	0.589	73%	0.732	S	S	*	*				66.9	117.4	114.7	-44.9	0	0	0	0	120.1
600	I	26.5	Very low	24.1	Very low	160 Å²	160	125 Å²	125	82%	0.821	74%	0.74	S	S	*	*				-155.5	109	104.9	-94.2	154.2	0	0	0	109.7
601	N	24.8	Very low	24.1	Very low	131 Å²	131	122.8 Å²	122.8	70%	0.701	73%	0.734	S	S	*	*				21	144.6	123.3	-63.3	-19.2	0	0	0	118.7
602	S	25.9	Very low	24	Very low	99 Å²	99	123.9 Å²	123.9	69%	0.692	74%	0.735	S	S	*	*			cis	-160	134.5	17.1	30.7	0	0	0	0	113
603	S	24.2	Very low	24	Very low	102 Å²	102	123 Å²	123	71%	0.713	73%	0.73	S	S	*	*			trans	17.6	158.7	133.6	62.9	0	0	0	0	122.9
604	C	22.8	Very low	24	Very low	103 Å²	103	122.7 Å²	122.7	70%	0.696	73%	0.733	S	S	*	*			trans	87.2	135.5	160	-65.2	0	0	0	0	116.7
605	Q	25.2	Very low	24	Very low	173 Å²	173	122.7 Å²	122.7	81%	0.808	73%	0.728	S	S	*	*			cis	-161.9	164.8	-16.9	-136	160.1	-18	0	0	110.6
606	D	22.3	Very low	24.1	Very low	145 Å²	145	124.6 Å²	124.6	78%	0.775	73%	0.727	S	S	*	*			trans	-63.1	170.2	167.4	-63.2	-79.5	0	0	0	113.4
607	S	23	Very low	24	Very low	105 Å²	105	123.6 Å²	123.6	73%	0.734	73%	0.732	S	S	*	*			trans	95.4	111.3	156.6	-42.2	0	0	0	0	117.2
608	S	23.1	Very low	24.2	Very low	119 Å²	119	120.2 Å²	120.2	83%	0.832	73%	0.729	S	S	*	*			trans	38.5	126.5	130.6	65.7	0	0	0	0	120
609	G	23.6	Very low	24.3	Very low	72 Å²	72	119.4 Å²	119.4	74%	0.742	74%	0.74	S	S	*	*			trans	166.7	88.9	154.5	0	0	0	0	0	115.6
610	L	23.8	Very low	24.5	Very low	153 Å²	153	118.3 Å²	118.3	80%	0.801	75%	0.748	S	S	*	*			trans	32.6	118.4	134.4	-61	174.1	0	0	0	118.9
611	N	23.7	Very low	24.7	Very low	110 Å²	110	114.5 Å²	114.5	59%	0.588	75%	0.748	S	S	*	*				91.7	144.7	119.6	-75.7	22.7	0	0	0	121.9
612	E	21.7	Very low	24.9	Very low	150 Å²	150	111.8 Å²	111.8	70%	0.701	75%	0.751	S	S	*	*			trans	62.6	86.1	135.5	-69.9	151.5	175.1	0	0	117
613	T	23.4	Very low	24.9	Very low	116 Å²	116	114 Å²	114	71%	0.712	76%	0.755	S	S	*	*				76.4	138.4	80.9	60	0	0	0	0	113.7
614	S	23.4	Very low	25	Very low	112 Å²	112	114.2 Å²	114.2	78%	0.783	75%	0.752	S	S	*	*			trans	67.5	169.8	174.2	87.4	0	0	0	0	113.1
615	S	23.9	Very low	25	Very low	89 Å²	89	114 Å²	114	62%	0.622	75%	0.753	S	S	*	*			cis	-145.6	143.9	5.6	-9.6	0	0	0	0	112.7
616	I	24.2	Very low	25	Very low	153 Å²	153	112.5 Å²	112.5	79%	0.785	75%	0.748	S	S	*	*			trans	63.2	127.1	131	-61.3	165.3	0	0	0	119.1
617	S	25.5	Very low	25.1	Very low	118 Å²	118	112.5 Å²	112.5	83%	0.825	75%	0.749	S	S	*	*			trans	73.5	141.5	156.1	73.2	0	0	0	0	119
618	G	27.6	Very low	25	Very low	66 Å²	66	116.1 Å²	116.1	68%	0.68	75%	0.751	S	S	*	*			cis	161.5	173.3	-10.7	0	0	0	0	0	115
619	S	27.3	Very low	25.3	Very low	135 Å²	135	116.2 Å²	116.2	94%	0.944	75%	0.749	S	S	*	*			trans	68.1	134.9	174.1	-51.3	0	0	0	0	115.4
620	G	28.6	Very low	25.2	Very low	73 Å²	73	117.6 Å²	117.6	75%	0.753	75%	0.747	S	S	*	*			cis	168.1	164.2	-3.2	0	0	0	0	0	111.3
621	G	30.6	Very low	25.5	Very low	80 Å²	80	116 Å²	116	83%	0.825	75%	0.746	S	S	*	*			trans	81.4	141.5	-169.5	0	0	0	0	0	111.7
622	G	30.2	Very low	25.5	Very low	74 Å²	74	113.5 Å²	113.5	76%	0.763	75%	0.746	S	S	*	*			cis	79.7	135.7	12.8	0	0	0	0	0	111.4
623	D	25.3	Very low	25.6	Very low	146 Å²	146	114.7 Å²	114.7	78%	0.781	76%	0.756	S	S	*	*			cis	-160	-179.3	-0	-144.4	-35.8	0	0	0	110.1
624	T	26.2	Very low	25.6	Very low	106 Å²	106	113.6 Å²	113.6	65%	0.65	75%	0.753	S	S	*	*			trans	47.8	104.3	153.4	54.2	0	0	0	0	120
625	S	23.4	Very low	25.8	Very low	100 Å²	100	115.9 Å²	115.9	70%	0.699	75%	0.749	S	S	*	*				75.9	-179.9	122.4	79.1	0	0	0	0	121
626	I	24.2	Very low	25.9	Very low	140 Å²	140	121.2 Å²	121.2	72%	0.718	76%	0.756	S	S	*	*			trans	74.5	95.3	162.3	-64.1	159.7	0	0	0	117.5
627	N	24.5	Very low	26.1	Very low	146 Å²	146	119.8 Å²	119.8	78%	0.781	75%	0.75	S	S	*	*			trans	66.9	143.7	133.1	-61	-12.4	0	0	0	123
628	F	21.4	Very low	26.2	Very low	181 Å²	181	118.6 Å²	118.6	79%	0.794	74%	0.741	S	S	*	*			trans	-48.1	157.6	156.2	-68.1	-102.6	0	0	0	112.5
629	P	28.4	Very low	26.1	Very low	121 Å²	121	122.4 Å²	122.4	79%	0.786	75%	0.745	S	S	*	*				-126.8	126.4	110.7	34.5	-30.5	0	0	0	113.5	P631	P629-P631 WeakPolarHBondContact O-CD 2.98Å
630	S	22.7	Very low	26.1	Very low	101 Å²	101	121.2 Å²	121.2	71%	0.706	74%	0.736	S	S	*	*			trans	-95.3	121.8	155.1	-57.5	0	0	0	0	109.4
631	P	29.5	Very low	26	Very low	119 Å²	119	122.2 Å²	122.2	77%	0.773	73%	0.732	S	S	*	*			trans	-111.8	113.1	154.1	33.1	-22.8	0	0	0	109.1	P629	P629-P631 WeakPolarHBondContact O-CD 2.98Å
632	G	24.2	Very low	25.8	Very low	57 Å²	57	126.9 Å²	126.9	59%	0.588	73%	0.734	S	S	*	*			cis	80	120.1	5.2	0	0	0	0	0	112.5
633	L	23.6	Very low	25.7	Very low	175 Å²	175	127.7 Å²	127.7	92%	0.916	73%	0.728	S	S	*	*			trans	71.3	148.1	167.7	-54.2	175.2	0	0	0	116
634	S	23.7	Very low	25.7	Very low	93 Å²	93	127 Å²	127	65%	0.65	73%	0.729	S	S	*	*			cis	-173.9	177.9	-15.1	175	0	0	0	0	108.5
635	K	26.2	Very low	25.8	Very low	161 Å²	161	125.2 Å²	125.2	70%	0.7	73%	0.732	S	S	*	*			trans	88.9	141.3	169	-54.3	157.3	-173.1	165.7	0	114.3
636	R	27	Very low	26	Very low	201 Å²	201	125.6 Å²	125.6	76%	0.758	73%	0.734	S	S	*	*			cis	-165.8	160.3	-6.6	-106.2	168.2	-177.6	160.1	-2.5	105.6
637	D	27.8	Very low	26.1	Very low	122 Å²	122	125.3 Å²	125.3	65%	0.652	74%	0.739	S	S	*	*			cis	-159.4	153.3	11.2	-123.1	-41.1	0	0	0	110.5
638	S	27.4	Very low	26	Very low	93 Å²	93	123.7 Å²	123.7	65%	0.65	74%	0.738	S	S	*	*			trans	65.1	148.1	144.3	-65	0	0	0	0	121.7
639	I	26.4	Very low	26.3	Very low	147 Å²	147	123.2 Å²	123.2	75%	0.754	74%	0.738	S	S	*	*			cis	-157.3	151.5	-6.6	-113.8	164.4	0	0	0	110.2
640	S	27.2	Very low	26	Very low	109 Å²	109	124 Å²	124	76%	0.762	74%	0.741	S	S	*	*			trans	65.7	144.2	168.9	-70.4	0	0	0	0	119.5
641	S	26.3	Very low	26.3	Very low	94 Å²	94	124.1 Å²	124.1	66%	0.657	74%	0.74	S	S	*	*			cis	-169.3	133.7	-15.6	47.9	0	0	0	0	112.5
642	M	26.7	Very low	26	Very low	178 Å²	178	124.3 Å²	124.3	88%	0.877	74%	0.738	S	S	*	*			trans	68	144.7	159.9	-60	170.7	73.9	0	0	117.4
643	S	27	Very low	25.9	Very low	91 Å²	91	128.3 Å²	128.3	64%	0.636	75%	0.746	S	S	*	*			cis	-164.7	149.5	-12	-104.2	0	0	0	0	111.4
644	V	26.9	Very low	25.9	Very low	133 Å²	133	125 Å²	125	81%	0.806	74%	0.737	S	S	*	*			trans	45.2	117	151.6	-172.1	0	0	0	0	117.7
645	G	28.1	Very low	25.9	Very low	68 Å²	68	130.4 Å²	130.4	70%	0.701	75%	0.745	S	S	*	*				93.4	151.4	66	0	0	0	0	0	110.9
646	S	27.2	Very low	25.7	Very low	107 Å²	107	127.2 Å²	127.2	75%	0.748	74%	0.735	S	S	*	*			cis	-165.8	172.3	0.2	-67.9	0	0	0	0	110.5
647	T	26.8	Very low	25.6	Very low	134 Å²	134	122.8 Å²	122.8	82%	0.822	72%	0.723	S	S	*	*			trans	83.7	155.6	153.6	-45.8	0	0	0	0	118.8
648	C	22.5	Very low	25.5	Very low	113 Å²	113	122.8 Å²	122.8	76%	0.764	73%	0.733	S	S	*	*			trans	-102.6	-168.3	-174	-50.7	0	0	0	0	112.5
649	Q	26.7	Very low	25.4	Very low	171 Å²	171	121.2 Å²	121.2	80%	0.799	73%	0.731	S	S	*	*			trans	94.9	83.3	157.9	-57.5	169.9	-8.9	0	0	119.4
650	T	22.7	Very low	25.3	Very low	137 Å²	137	122.8 Å²	122.8	84%	0.84	74%	0.739	S	S	*	*			trans	64.9	-152.7	144.5	51.1	0	0	0	0	115.8
651	P	28.8	Very low	25.3	Very low	104 Å²	104	120.9 Å²	120.9	68%	0.675	74%	0.736	S	S	*	*				-125.9	176.9	-97.5	40.2	-24.4	0	0	0	115.3
652	V	22.1	Very low	25.2	Very low	123 Å²	123	124.7 Å²	124.7	75%	0.745	74%	0.744	S	S	*	*			trans	58.5	140.6	165.8	-96.2	0	0	0	0	120.3
653	D	22.7	Very low	25.2	Very low	141 Å²	141	122 Å²	122	75%	0.754	74%	0.737	S	S	*	*			trans	62.4	136	144.7	-58	-21	0	0	0	123.4
654	S	24	Very low	25.2	Very low	104 Å²	104	122.8 Å²	122.8	73%	0.727	74%	0.735	S	S	*	*			trans	78.6	115.1	144.4	-61.2	0	0	0	0	122.3
655	Y	22.8	Very low	25.2	Very low	208 Å²	208	123.9 Å²	123.9	82%	0.816	73%	0.729	S	S	*	*				39	121.1	123.1	-78.2	-108	0	0	0	120.8
656	L	23.1	Very low	25.1	Very low	94 Å²	94	127.4 Å²	127.4	49%	0.492	73%	0.73	S	S	.	*				93.1	156.2	127.3	-77	-179.9	0	0	0	124.2	S1520	L656-S1520 WeakPolarHBondContact CD1-O 3.49Å
657	Q	24.4	Very low	25.1	Very low	107 Å²	107	130.8 Å²	130.8	50%	0.5	73%	0.731	S	S	.	*			trans	74.4	126.1	158.8	-113.5	61	10.8	0	0	124.2	D1521	Q657-D1521 VanDerWaalsContact CD-O 3.3Å; Q657-D1521 PolarHBondContact NE2-O 2.94Å; Q657-D1521 PolarHBondContact OE1-O 3.24Å
658	S	25.1	Very low	25.1	Very low	123 Å²	123	128.9 Å²	128.9	86%	0.86	72%	0.723	S	S	*	*			trans	72.1	145	151.5	75.4	0	0	0	0	118.4
659	G	25.8	Very low	25.3	Very low	60 Å²	60	131 Å²	131	62%	0.619	73%	0.727	S	S	*	*			cis	168.4	-176.9	-6.5	0	0	0	0	0	112.6
660	I	24.4	Very low	25.3	Very low	180 Å²	180	125.8 Å²	125.8	92%	0.923	72%	0.719	S	S	*	*			trans	73.9	113.4	176.6	-46.5	165.8	0	0	0	114.4
661	G	26.4	Very low	25.5	Very low	68 Å²	68	126.5 Å²	126.5	70%	0.701	71%	0.713	S	S	*	*			cis	164.8	-177	-13.4	0	0	0	0	0	116.6
662	Q	25.6	Very low	25.3	Very low	175 Å²	175	129.2 Å²	129.2	82%	0.818	72%	0.717	S	S	*	*			trans	76.8	116.9	158.6	-62.1	-175.2	-6.4	0	0	119.9
663	T	25.4	Very low	25.5	Very low	120 Å²	120	132 Å²	132	74%	0.736	72%	0.719	S	S	*	*			trans	67	130.6	145.8	57.4	0	0	0	0	118.4
664	D	27.2	Very low	25.8	Very low	109 Å²	109	128.6 Å²	128.6	58%	0.583	72%	0.718	S	S	*	*			cis	-157.4	153.1	3.8	-125.9	3.3	0	0	0	114.1
665	K	26.8	Very low	26.1	Very low	156 Å²	156	130.2 Å²	130.2	68%	0.678	72%	0.717	S	S	*	*			trans	29.8	128.9	137.8	-63.6	174.7	-168	80.5	0	117.5
666	I	27.3	Very low	26.3	Very low	141 Å²	141	128.3 Å²	128.3	72%	0.723	72%	0.717	S	S	*	*			cis	-168.6	177.9	42.7	-121.7	154.7	0	0	0	112.3
667	K	26.1	Very low	26.5	Very low	179 Å²	179	127 Å²	127	78%	0.778	73%	0.726	S	S	*	*			trans	-30.7	162	165.8	-44.2	166.5	-172.9	175.9	0	115.8
668	S	27.8	Very low	26.7	Very low	94 Å²	94	126.8 Å²	126.8	66%	0.657	73%	0.729	S	S	*	*			cis	-157.6	175.7	34.4	-45.9	0	0	0	0	115.1
669	N	26.8	Very low	26.8	Very low	156 Å²	156	127.1 Å²	127.1	83%	0.834	72%	0.721	S	S	*	*			trans	-0.2	152.3	144.1	-41.9	-3.9	0	0	0	118.2
670	G	26.4	Very low	26.9	Very low	62 Å²	62	130.1 Å²	130.1	64%	0.639	73%	0.732	S	S	*	*			cis	160	178.1	7	0	0	0	0	0	109.7
671	E	26.6	Very low	27	Very low	153 Å²	153	127.8 Å²	127.8	72%	0.715	71%	0.712	S	S	*	*			trans	62	149.3	172.4	-73.7	137.8	-137.3	0	0	116.8
672	E	25.6	Very low	27	Very low	160 Å²	160	131.6 Å²	131.6	75%	0.748	71%	0.706	S	S	*	*			cis	-139.6	172.1	-17.7	-146	178.3	172.9	0	0	111.5
673	F	26.4	Very low	27.1	Very low	181 Å²	181	129.2 Å²	129.2	79%	0.794	70%	0.703	S	S	*	*			trans	-43.2	158.8	-173.8	-65.2	-156	0	0	0	114.9
674	G	28.3	Very low	27.3	Very low	71 Å²	71	131.9 Å²	131.9	73%	0.732	70%	0.704	S	S	*	*			cis	142.4	-175.8	21	0	0	0	0	0	107.5
675	I	30.4	Very low	27.4	Very low	138 Å²	138	131 Å²	131	71%	0.708	70%	0.696	S	S	*	*			cis	-135.8	112.5	-7.1	-58.6	178.5	0	0	0	103.5
676	M	25.7	Very low	27.5	Very low	168 Å²	168	130.5 Å²	130.5	83%	0.828	70%	0.698	S	S	*	*				39.8	129.6	107.6	-59.6	168.7	60.6	0	0	114.8
677	G	28.1	Very low	27.6	Very low	65 Å²	65	130.5 Å²	130.5	67%	0.67	69%	0.693	S	S	*	*			cis	154.6	-156.9	1.9	0	0	0	0	0	109.8
678	N	27.7	Very low	27.8	Very low	104 Å²	104	128.1 Å²	128.1	56%	0.556	69%	0.689	S	S	*	*			trans	52	92.7	160.4	-59	-33.1	0	0	0	117.9	R681	N678-R681 PolarHBondContact ND2-NH2 3.45Å
679	D	28.5	Very low	27.9	Very low	130 Å²	130	129.1 Å²	129.1	70%	0.695	69%	0.687	S	S	*	*				-133.1	32.2	127.8	-128.2	-29.7	0	0	0	114	R681	D679-R681 PolarHBondContact O-N 3.1Å
680	S	27.8	Very low	27.8	Very low	122 Å²	122	132.8 Å²	132.8	85%	0.853	69%	0.69	S	S	*	*	S	Bend	trans	-78.4	69.6	155.9	-166.8	0	0	0	0	108.9
681	R	26.5	Very low	27.9	Very low	132 Å²	132	139.6 Å²	139.6	50%	0.498	71%	0.705	S	S	.	*			trans	-150.8	-34.7	176.8	-135.6	174.2	-79.3	-167.6	-2	116.3	N678 D679 V683 K684 Q685	N678-R681 PolarHBondContact ND2-NH2 3.45Å; D679-R681 PolarHBondContact O-N 3.1Å; R681-V683 PolarHBondContact O-N 2.87Å; R681-K684 PolarHBondContact O-N 3.47Å; R681-Q685 HydrophobicContact CG-CG 4.44Å; R681-Q685 VanDerWaalsContact CG-OE1 3.29Å; R681-Q685 PolarHBondContact O-N 3.26Å; R681-Q685 VanDerWaalsContact O-N 3.09Å
682	Y	25.6	Very low	28	Very low	148 Å²	148	135.5 Å²	135.5	58%	0.58	70%	0.704	S	S	*	*	H	α-helix	trans	-55	-49	-170	-125.2	-103.3	0	0	0	115.2	K684 Q685 M686	Y682-K684 VanDerWaalsContact C-N 3.26Å; Y682-K684 PolarHBondContact O-N 2.97Å; Y682-Q685 PolarHBondContact O-N 3.03Å; Y682-Q685 VanDerWaalsContact O-N 3.15Å; Y682-M686 HydrophobicContact CD1-CE 4.04Å; Y682-M686 HydrophobicContact CD1-SD 3.93Å; Y682-M686 HydrophobicContact CE1-CE 3.72Å; Y682-M686 HydrophobicContact CE1-SD 4.24Å; Y682-M686 PolarHBondContact O-N 2.66Å
683	V	27.3	Very low	28	Very low	125 Å²	125	133.2 Å²	133.2	76%	0.758	71%	0.706	S	S	*	*	H	α-helix	trans	-72.6	-14.9	-177.7	-175.1	0	0	0	0	113.2	R681	R681-V683 PolarHBondContact O-N 2.87Å
684	K	31.2	Very low	28.1	Very low	176 Å²	176	133.6 Å²	133.6	77%	0.765	71%	0.71	S	S	*	*	H	α-helix	trans	-97.2	-9.2	171.4	-106.2	-179.6	178.4	177.7	0	114.4	R681 Y682	R681-K684 PolarHBondContact O-N 3.47Å; Y682-K684 VanDerWaalsContact C-N 3.26Å; Y682-K684 PolarHBondContact O-N 2.97Å
685	Q	29.5	Very low	27.9	Very low	89 Å²	89	137.1 Å²	137.1	42%	0.416	71%	0.711	S	S	.	*	H	α-helix	trans	-87.6	-43.5	165.9	-76.3	179.1	-102.2	0	0	111.4	R681 Y682 K687 N688 L689	R681-Q685 HydrophobicContact CG-CG 4.44Å; R681-Q685 VanDerWaalsContact CG-OE1 3.29Å; R681-Q685 PolarHBondContact O-N 3.26Å; R681-Q685 VanDerWaalsContact O-N 3.09Å; Y682-Q685 PolarHBondContact O-N 3.03Å; Y682-Q685 VanDerWaalsContact O-N 3.15Å; Q685-K687 PolarHBondContact O-N 2.66Å; Q685-N688 PolarHBondContact O-N 3.05Å; Q685-L689 HydrophobicContact CB-CD1 4.28Å; Q685-L689 HydrophobicContact CG-CD1 4.38Å; Q685-L689 WeakPolarHBondContact O-CB 3.34Å; Q685-L689 PolarHBondContact O-N 2.67Å; Q685-L689 VanDerWaalsContact O-N 3.08Å
686	M	27.3	Very low	27.7	Very low	146 Å²	146	138.1 Å²	138.1	72%	0.719	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-16.7	-179.9	-78.8	179	151.8	0	0	115.4	Y682	Y682-M686 HydrophobicContact CD1-CE 4.04Å; Y682-M686 HydrophobicContact CD1-SD 3.93Å; Y682-M686 HydrophobicContact CE1-CE 3.72Å; Y682-M686 HydrophobicContact CE1-SD 4.24Å; Y682-M686 PolarHBondContact O-N 2.66Å
687	K	30.3	Very low	27.5	Very low	141 Å²	141	138 Å²	138	61%	0.613	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	1.1	-178.5	-148.5	166.6	-175.7	171.2	0	114.8	Q685	Q685-K687 PolarHBondContact O-N 2.66Å
688	N	30.9	Very low	27.3	Very low	130 Å²	130	143.6 Å²	143.6	70%	0.695	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.9	6.2	176.5	-75.2	-49	0	0	0	113.1	Q685	Q685-N688 PolarHBondContact O-N 3.05Å
689	L	28.5	Very low	27.2	Very low	115 Å²	115	144.3 Å²	144.3	60%	0.602	73%	0.731	S	S	*	*	S	Bend	trans	-130.3	60.1	175.7	-69.6	173.6	0	0	0	110.8	Q685	Q685-L689 HydrophobicContact CB-CD1 4.28Å; Q685-L689 HydrophobicContact CG-CD1 4.38Å; Q685-L689 WeakPolarHBondContact O-CB 3.34Å; Q685-L689 PolarHBondContact O-N 2.67Å; Q685-L689 VanDerWaalsContact O-N 3.08Å
690	Y	26.1	Very low	26.9	Very low	233 Å²	233	144.6 Å²	144.6	91%	0.914	73%	0.73	S	S	*	*	S	Bend	trans	-162.5	15	143.2	-111.9	-67	0	0	0	115.5
691	E	28.2	Very low	26.7	Very low	204 Å²	204	144.4 Å²	144.4	95%	0.953	73%	0.726	S	S	*	*	S	Bend	trans	-120	88.1	166.7	-72.6	-160.4	132.9	0	0	111.6
692	G	28.5	Very low	26.6	Very low	67 Å²	67	144.2 Å²	144.2	69%	0.691	74%	0.74	S	S	*	*			trans	131.6	103.5	153.5	0	0	0	0	0	119.6
693	S	26.1	Very low	26.5	Very low	113 Å²	113	141.6 Å²	141.6	79%	0.79	74%	0.743	S	S	*	*			trans	77.7	107.1	140	-41.9	0	0	0	0	121.2
694	E	27.6	Very low	26.4	Very low	189 Å²	189	147.2 Å²	147.2	88%	0.883	75%	0.751	S	S	*	*				173	99.4	126.3	-96.6	175.8	-171.9	0	0	108.2
695	I	23	Very low	26	Very low	144 Å²	144	143.5 Å²	143.5	74%	0.738	75%	0.747	S	S	*	*				66.4	61.3	81.2	-50.9	170.9	0	0	0	114
696	I	26.7	Very low	25.8	Very low	159 Å²	159	145.5 Å²	145.5	82%	0.815	76%	0.761	S	S	*	*			trans	-143.1	118.2	143.4	-51.8	178.7	0	0	0	104
697	Q	22.2	Very low	25.7	Very low	167 Å²	167	142.5 Å²	142.5	78%	0.78	75%	0.754	S	S	*	*			cis	73.1	61.2	25.4	-158.6	178	-26.8	0	0	115.5
698	E	23.9	Very low	25.4	Very low	181 Å²	181	141.9 Å²	141.9	85%	0.846	76%	0.762	S	S	*	*			trans	-163.3	147.9	137.3	-116.5	164.7	-157.3	0	0	115.7
699	T	25.3	Very low	25	Very low	120 Å²	120	140.3 Å²	140.3	74%	0.736	76%	0.757	S	S	*	*			trans	48.9	91	160	4.8	0	0	0	0	122.6
700	I	22.1	Very low	24.9	Very low	135 Å²	135	140.6 Å²	140.6	69%	0.692	77%	0.768	S	S	*	*				-5.8	130.8	119	-66	164.2	0	0	0	115.1	T702	I700-T702 HydrophobicContact CG2-CG2 4.31Å
701	P	24.5	Very low	24.8	Very low	118 Å²	118	135.6 Å²	135.6	77%	0.766	76%	0.757	S	S	*	*				-126.2	110.8	116.5	34.3	-29.9	0	0	0	113.7
702	T	23.4	Very low	24.6	Very low	128 Å²	128	133.7 Å²	133.7	79%	0.785	75%	0.752	S	S	*	*			trans	-96.3	104.8	167.5	49.2	0	0	0	0	110.4	I700	I700-T702 HydrophobicContact CG2-CG2 4.31Å
703	S	24.9	Very low	24.5	Very low	93 Å²	93	134.5 Å²	134.5	65%	0.65	75%	0.747	S	S	*	*			trans	-154.9	125.5	172.6	46.7	0	0	0	0	108.5
704	R	23.6	Very low	24.4	Very low	243 Å²	243	136.2 Å²	136.2	92%	0.917	75%	0.747	S	S	*	*				52.2	125.3	83.1	-73.7	177.6	160.5	173.7	-6.4	112.8
705	S	23.8	Very low	24.3	Very low	98 Å²	98	132.9 Å²	132.9	69%	0.685	74%	0.735	S	S	*	*			cis	-161.8	-176.6	-7.5	62	0	0	0	0	108.3
706	D	25.4	Very low	24.5	Very low	131 Å²	131	129.4 Å²	129.4	70%	0.701	72%	0.718	S	S	*	*			cis	-147.5	179.3	13.9	-117.5	-51.6	0	0	0	110.8
707	S	24.1	Very low	24.5	Very low	84 Å²	84	127.5 Å²	127.5	59%	0.587	72%	0.716	S	S	*	*				30.5	127.5	102.8	125.6	0	0	0	0	115.2
708	V	24.2	Very low	24.6	Very low	127 Å²	127	123.8 Å²	123.8	77%	0.77	71%	0.713	S	S	*	*			cis	-137	138.6	47.2	173	0	0	0	0	109.7
709	V	23.2	Very low	24.8	Very low	98 Å²	98	120 Å²	120	59%	0.594	71%	0.707	S	S	*	*			cis	83.9	75.6	27.4	-168.7	0	0	0	0	115.9	N711	V709-N711 HydrophobicContact CG1-CB 4.06Å
710	S	26.3	Very low	24.9	Very low	120 Å²	120	118.7 Å²	118.7	84%	0.839	70%	0.703	S	S	*	*			trans	-158.6	94.1	156.9	-81.9	0	0	0	0	108.8
711	N	23.5	Very low	25.1	Very low	128 Å²	128	119.2 Å²	119.2	68%	0.684	71%	0.707	S	S	*	*			cis	78.1	59.5	13.6	-128.7	27.2	0	0	0	116.3	V709	V709-N711 HydrophobicContact CG1-CB 4.06Å
712	I	25.2	Very low	25.3	Very low	164 Å²	164	119 Å²	119	84%	0.841	70%	0.703	S	S	*	*			trans	-122.5	106.1	147.9	-65.8	-178	0	0	0	105
713	S	24.7	Very low	25.5	Very low	85 Å²	85	116.6 Å²	116.6	59%	0.594	69%	0.689	S	S	*	*				69.4	133.2	66	-65.5	0	0	0	0	111.9
714	L	25.5	Very low	25.8	Very low	149 Å²	149	115.1 Å²	115.1	78%	0.78	69%	0.689	S	S	*	*			cis	-151.7	169.1	-3.8	-86.6	142.5	0	0	0	105.7
715	N	25.4	Very low	26.4	Very low	119 Å²	119	108.6 Å²	108.6	64%	0.636	68%	0.677	S	S	*	*			cis	-152.8	-174.1	4.1	-149.4	-7	0	0	0	110.4
716	L	26	Very low	26.5	Very low	71 Å²	71	109.2 Å²	109.2	37%	0.372	68%	0.681	S	S	.	*			trans	-104.1	160.8	146.3	-146.7	71.1	0	0	0	108.7	E17	E17-L716 HydrophobicContact CB-CD1 3.49Å; E17-L716 VanDerWaalsContact CB-CD1 3.49Å; E17-L716 HydrophobicContact CG-CD1 4.39Å
717	P	26.9	Very low	26.6	Very low	119 Å²	119	108.6 Å²	108.6	77%	0.773	68%	0.677	S	S	*	*				-149.1	176.8	90.1	38.6	-20.3	0	0	0	115.8
718	A	24.8	Very low	27	Very low	88 Å²	88	113.8 Å²	113.8	73%	0.727	68%	0.684	S	S	*	*			trans	-58	170.6	173.8	0	0	0	0	0	113.6
719	S	27.1	Very low	27.4	Very low	103 Å²	103	113 Å²	113	72%	0.72	68%	0.681	S	S	*	*			cis	-174.2	161.6	44.1	49.2	0	0	0	0	115.4
720	S	28.5	Very low	27.6	Very low	92 Å²	92	113.7 Å²	113.7	64%	0.643	69%	0.686	S	S	*	*			trans	57.6	122.7	148.5	64.4	0	0	0	0	122.1
721	N	26.7	Very low	27.5	Very low	145 Å²	145	116.1 Å²	116.1	78%	0.775	68%	0.684	S	S	*	*				54.3	135.8	124.6	-58.6	-6.2	0	0	0	119.9
722	T	27.9	Very low	27.6	Very low	113 Å²	113	115.8 Å²	115.8	69%	0.693	69%	0.686	S	S	*	*			cis	-165.1	159	16	-4.2	0	0	0	0	113.5
723	T	27.9	Very low	27.7	Very low	78 Å²	78	113.9 Å²	113.9	48%	0.479	68%	0.683	S	S	.	*			trans	62.5	81.1	148.8	54.5	0	0	0	0	123.1	R1495	T723-R1495 HydrophobicContact CG2-CG 4.49Å; T723-R1495 PolarHBondContact O-NH2 2.89Å
724	G	30	Very low	27.8	Very low	63 Å²	63	114.8 Å²	114.8	65%	0.649	69%	0.689	S	S	*	*				73.5	-177.4	124.5	0	0	0	0	0	122	R1495	G724-R1495 VanDerWaalsContact C-NH2 3.35Å; G724-R1495 VanDerWaalsContact CA-NH2 3.28Å
725	P	36.3	Very low	28.5	Very low	105 Å²	105	113.4 Å²	113.4	68%	0.682	69%	0.689	S	S	*	*				-138.2	-166.3	-116.1	42.1	-23.9	0	0	0	117.4
726	C	26.2	Very low	28.8	Very low	111 Å²	111	113.1 Å²	113.1	75%	0.75	69%	0.694	S	S	*	*			trans	79.6	137.9	174.8	-66.2	0	0	0	0	116.6
727	D	28.9	Very low	28.8	Very low	118 Å²	118	114 Å²	114	63%	0.631	71%	0.711	S	S	*	*			cis	-161.5	143.6	-4.9	-130.4	-57.4	0	0	0	113.2
728	R	31.8	Very low	28.8	Very low	193 Å²	193	113.6 Å²	113.6	73%	0.728	71%	0.711	S	S	*	*			trans	56.7	161.2	151.4	-83.3	164.9	-178.2	-130.5	-5	122.3
729	P	32.4	Very low	28.9	Very low	110 Å²	110	114.3 Å²	114.3	71%	0.714	71%	0.711	S	S	*	*				-138.5	-159.9	-55.3	35.7	-13.8	0	0	0	113.4
730	V	27.1	Very low	28.7	Very low	114 Å²	114	114.4 Å²	114.4	69%	0.691	71%	0.712	S	S	*	*			trans	107.9	120.3	156.9	-172.4	0	0	0	0	119.2
731	E	24.9	Very low	28.5	Very low	171 Å²	171	117.5 Å²	117.5	80%	0.799	72%	0.72	S	S	*	*			trans	75	141	151.7	-80.1	164.2	-153.9	0	0	127.5
732	T	25.8	Very low	28.5	Very low	120 Å²	120	115.4 Å²	115.4	74%	0.736	72%	0.717	S	S	*	*			trans	76.2	137.2	147.9	48.5	0	0	0	0	126
733	T	27.1	Very low	28.6	Very low	125 Å²	125	115.4 Å²	115.4	77%	0.767	72%	0.722	S	S	*	*			trans	69.6	92.1	156.7	45.5	0	0	0	0	122.2
734	S	27	Very low	28.5	Very low	104 Å²	104	117.3 Å²	117.3	73%	0.727	74%	0.735	S	S	*	*				10.4	157.9	118.4	59	0	0	0	0	121.4
735	P	40	Very low	28.3	Very low	119 Å²	119	119.9 Å²	119.9	77%	0.773	74%	0.738	S	S	*	*			cis	-129.7	-135.6	-10.7	37.6	-14.9	0	0	0	109.5
736	P	32.1	Very low	27.7	Very low	113 Å²	113	120.1 Å²	120.1	73%	0.734	74%	0.742	S	S	*	*			cis	-133.4	-179.6	-26.4	39.8	-21.6	0	0	0	116.4
737	A	26	Very low	27.8	Very low	89 Å²	89	121.2 Å²	121.2	74%	0.736	74%	0.741	S	S	*	*			trans	58.6	122.1	141.9	0	0	0	0	0	124.9
738	S	26.4	Very low	27.7	Very low	112 Å²	112	120.6 Å²	120.6	78%	0.783	74%	0.736	S	S	*	*			trans	95.2	138.6	132.3	79.1	0	0	0	0	123.1
739	S	25.9	Very low	27.5	Very low	103 Å²	103	116.6 Å²	116.6	72%	0.72	73%	0.729	S	S	*	*			trans	76.5	89	152.5	70.3	0	0	0	0	122.3
740	S	24	Very low	27.4	Very low	105 Å²	105	119 Å²	119	73%	0.734	73%	0.731	S	S	*	*				82.2	161.2	116.7	80.1	0	0	0	0	123
741	L	25	Very low	27.5	Very low	157 Å²	157	117.5 Å²	117.5	82%	0.822	72%	0.722	S	S	*	*			trans	83.9	112.2	157.8	-70	161.4	0	0	0	121.6
742	S	25	Very low	27.7	Very low	101 Å²	101	113 Å²	113	71%	0.706	71%	0.706	S	S	*	*			trans	84.7	94.4	140.8	64	0	0	0	0	121.8
743	S	31.1	Very low	27.8	Very low	113 Å²	113	114.5 Å²	114.5	79%	0.79	70%	0.698	S	S	*	*			trans	52.9	125.7	131	61.7	0	0	0	0	120.7
744	P	26	Very low	27.9	Very low	117 Å²	117	116.8 Å²	116.8	76%	0.76	70%	0.7	S	S	*	*				-144.6	142.6	107.1	36.7	-22.7	0	0	0	116.8
745	V	24.6	Very low	27.9	Very low	117 Å²	117	114 Å²	114	71%	0.709	68%	0.677	S	S	*	*			trans	26.7	95.8	148.6	-166.3	0	0	0	0	118.3	V776	V745-V776 HydrophobicContact CG2-CG1 4.12Å
746	S	25.3	Very low	27.3	Very low	111 Å²	111	112 Å²	112	78%	0.776	66%	0.662	S	S	*	*			trans	-147.2	66.5	165.2	63.6	0	0	0	0	111.9
747	N	28.3	Very low	27.3	Very low	134 Å²	134	112.4 Å²	112.4	72%	0.717	66%	0.663	S	S	*	*			trans	-160.7	177.7	173.1	-127.3	-48.2	0	0	0	111.1
748	I	25.5	Very low	27.4	Very low	104 Å²	104	113.7 Å²	113.7	53%	0.533	66%	0.662	S	S	.	*			trans	71.1	72.8	177.5	-43	152.9	0	0	0	113.9
749	N	29	Very low	27.6	Very low	109 Å²	109	115.6 Å²	115.6	58%	0.583	66%	0.663	S	S	*	*	S	Bend	trans	-145.8	-21.6	156.5	-103.7	-93.6	0	0	0	114.1	T751	N749-T751 PolarHBondContact O-N 2.91Å
750	E	28.8	Very low	27.8	Very low	161 Å²	161	120.4 Å²	120.4	75%	0.752	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	1.8	-176.4	-79.8	142.8	148.9	0	0	115.7
751	T	29	Very low	28.1	Very low	82 Å²	82	119.6 Å²	119.6	50%	0.503	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-127.7	55	176	49.3	0	0	0	0	113.3	N749 R753	N749-T751 PolarHBondContact O-N 2.91Å; T751-R753 PolarHBondContact O-N 3.43Å
752	V	29	Very low	28.5	Very low	78 Å²	78	119.6 Å²	119.6	47%	0.473	66%	0.661	S	S	.	*			trans	-71.6	64.4	163.5	-170.4	0	0	0	0	110.1	L755 Y812	V752-L755 HydrophobicContact CG1-CD1 4.01Å; V752-L755 HydrophobicContact CG1-CG 4.31Å; V752-Y812 HydrophobicContact CG1-CE2 4.27Å; V752-Y812 HydrophobicContact CG2-CE2 4.2Å
753	R	28.4	Very low	28.9	Very low	151 Å²	151	118.3 Å²	118.3	57%	0.57	65%	0.646	S	S	*	*			trans	-71.9	148.6	169.1	-69.3	175.5	173.2	128.6	2.8	108.7	F372 T751 L755	F372-R753 VanDerWaalsContact CZ-NH1 3.26Å; T751-R753 PolarHBondContact O-N 3.43Å; R753-L755 PolarHBondContact O-N 3.05Å
754	E	29.2	Very low	29.2	Very low	172 Å²	172	115.9 Å²	115.9	80%	0.804	63%	0.628	S	S	*	*			trans	57.3	51.3	163.8	-60.1	-178.3	127.2	0	0	116.6	V756	E754-V756 PolarHBondContact O-N 3.09Å
755	L	26.8	Very low	29.5	Very low	45 Å²	45	118.1 Å²	118.1	24%	0.236	63%	0.628	C	S	.	*			trans	-69	80.5	161.7	-109.8	174.3	0	0	0	111.7	V752 R753 Y812 L942	V752-L755 HydrophobicContact CG1-CD1 4.01Å; V752-L755 HydrophobicContact CG1-CG 4.31Å; R753-L755 PolarHBondContact O-N 3.05Å; L755-Y812 HydrophobicContact CD1-CE1 4.15Å; L755-L942 HydrophobicContact CD1-CD1 4.41Å; L755-L942 HydrophobicContact CD1-CD2 4.39Å
756	V	28.9	Very low	29.8	Very low	77 Å²	77	116.7 Å²	116.7	47%	0.467	62%	0.615	S	S	.	*			trans	74.4	86.5	162.2	-165.2	0	0	0	0	117.2	E754 N945	E754-V756 PolarHBondContact O-N 3.09Å; V756-N945 WeakPolarHBondContact CB-ND2 3.28Å; V756-N945 WeakPolarHBondContact CG2-ND2 3.43Å
757	T	31.1	Very low	30.4	Very low	123 Å²	123	116.1 Å²	116.1	76%	0.755	60%	0.602	S	S	*	*			trans	-132.1	88.5	137.9	49.3	0	0	0	0	110
758	T	29	Very low	30.8	Very low	115 Å²	115	112.4 Å²	112.4	71%	0.706	59%	0.59	S	S	*	*			trans	13.3	104.5	154.7	54.2	0	0	0	0	118.1
759	D	28.9	Very low	31.4	Very low	153 Å²	153	109.5 Å²	109.5	82%	0.818	59%	0.585	S	S	*	*				-170.7	126.1	101.5	-87.7	-18.3	0	0	0	111.4	S761	D759-S761 PolarHBondContact O-N 3.44Å
760	W	30.5	Very low	31.7	Very low	204 Å²	204	106.2 Å²	106.2	77%	0.773	57%	0.574	S	S	*	*			trans	-86.8	93.8	174.1	-78.7	83	0	0	0	109.5	M766	W760-M766 HydrophobicContact CE3-CE 3.74Å; W760-M766 HydrophobicContact CZ3-CE 4.02Å
761	S	30.2	Very low	32.6	Very low	87 Å²	87	101.6 Å²	101.6	61%	0.608	56%	0.559	S	S	*	*			trans	-61.5	148.3	171.1	-175.9	0	0	0	0	111.9	D759 D763	D759-S761 PolarHBondContact O-N 3.44Å; S761-D763 PolarHBondContact O-N 3.44Å
762	D	34.9	Very low	33.5	Very low	157 Å²	157	104.8 Å²	104.8	84%	0.84	57%	0.566	S	S	*	*			trans	-72.6	43.1	-176.6	-65.9	-65.5	0	0	0	114.5	P764	D762-P764 WeakPolarHBondContact O-CD 3.42Å
763	D	32.6	Very low	34.7	Very low	75 Å²	75	106 Å²	106	40%	0.401	57%	0.567	S	S	.	*			trans	-92.4	113.6	-178	-162.3	-30.6	0	0	0	112.6	S761 E765 M766 I767	S761-D763 PolarHBondContact O-N 3.44Å; D763-E765 VanDerWaalsContact C-N 3.31Å; D763-E765 PolarHBondContact O-N 3.27Å; D763-E765 PolarHBondContact OD1-N 2.81Å; D763-M766 HydrophobicContact CB-CB 4.28Å; D763-I767 WeakPolarHBondContact O-CG1 3.41Å; D763-I767 PolarHBondContact O-N 3.08Å
764	P	37	Very low	36	Very low	62 Å²	62	100.1 Å²	100.1	40%	0.403	55%	0.55	S	S	.	*	H	α-helix	trans	-66.4	-27.2	-179.6	-19.8	33.8	0	0	0	114.6	D762 I767 A768	D762-P764 WeakPolarHBondContact O-CD 3.42Å; P764-I767 PolarHBondContact O-N 3.46Å; P764-A768 PolarHBondContact O-N 2.94Å
765	E	33	Very low	37.3	Very low	163 Å²	163	92.3 Å²	92.3	76%	0.762	52%	0.515	S	S	*	.	H	α-helix	trans	-75.5	-35.7	-176.5	-65	-173.1	176.8	0	0	110.8	D763 A768 G769	D763-E765 VanDerWaalsContact C-N 3.31Å; D763-E765 PolarHBondContact O-N 3.27Å; D763-E765 PolarHBondContact OD1-N 2.81Å; E765-A768 WeakPolarHBondContact O-CB 3.42Å; E765-A768 PolarHBondContact O-N 2.8Å; E765-G769 PolarHBondContact O-N 3.24Å
766	M	30.2	Very low	39.1	Very low	88 Å²	88	92.2 Å²	92.2	43%	0.433	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-38.5	170.4	-169	178.3	69.6	0	0	111.8	W760 D763 A768 G769 A770	W760-M766 HydrophobicContact CE3-CE 3.74Å; W760-M766 HydrophobicContact CZ3-CE 4.02Å; D763-M766 HydrophobicContact CB-CB 4.28Å; M766-A768 VanDerWaalsContact C-N 3.33Å; M766-G769 PolarHBondContact O-N 3.5Å; M766-A770 PolarHBondContact O-N 3.14Å
767	I	39.1	Very low	40.7	Very low	99 Å²	99	91.6 Å²	91.6	51%	0.508	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-40.6	173.6	-66.2	168.5	0	0	0	110.8	D763 P764 S771	D763-I767 WeakPolarHBondContact O-CG1 3.41Å; D763-I767 PolarHBondContact O-N 3.08Å; P764-I767 PolarHBondContact O-N 3.46Å; I767-S771 WeakPolarHBondContact O-CB 3.35Å; I767-S771 PolarHBondContact O-N 2.91Å
768	A	36	Very low	42.3	Very low	55 Å²	55	86 Å²	86	46%	0.455	47%	0.473	S	S	.	.	H	α-helix	trans	-62.8	-47.2	175.7	0	0	0	0	0	111.8	P764 E765 M766 S771 F772	P764-A768 PolarHBondContact O-N 2.94Å; E765-A768 WeakPolarHBondContact O-CB 3.42Å; E765-A768 PolarHBondContact O-N 2.8Å; M766-A768 VanDerWaalsContact C-N 3.33Å; A768-S771 PolarHBondContact O-N 3.21Å; A768-S771 PolarHBondContact O-OG 2.99Å; A768-F772 PolarHBondContact O-N 3.33Å; A768-F772 VanDerWaalsContact O-N 3.09Å
769	G	37	Very low	44.1	Very low	43 Å²	43	87.7 Å²	87.7	44%	0.443	47%	0.467	S	S	.	.	H	α-helix	trans	-57.9	-51.8	177.2	0	0	0	0	0	113.2	E765 M766 S771 F772 E773	E765-G769 PolarHBondContact O-N 3.24Å; M766-G769 PolarHBondContact O-N 3.5Å; G769-S771 PolarHBondContact O-N 3.4Å; G769-F772 WeakPolarHBondContact O-CB 3.19Å; G769-F772 PolarHBondContact O-N 2.87Å; G769-F772 VanDerWaalsContact O-N 3.1Å; G769-E773 PolarHBondContact O-N 2.6Å
770	A	37.3	Very low	46	Very low	41 Å²	41	83.7 Å²	83.7	34%	0.339	46%	0.455	S	S	.	.	H	α-helix	trans	-61.2	-33.4	177	0	0	0	0	0	112.6	M766 A774	M766-A770 PolarHBondContact O-N 3.14Å; A770-A774 WeakPolarHBondContact O-CB 3.48Å; A770-A774 PolarHBondContact O-N 3.05Å; A770-A774 VanDerWaalsContact O-N 3.14Å
771	S	46.4	Very low	47.8	Very low	64 Å²	64	76 Å²	76	45%	0.448	43%	0.428	S	S	.	.	H	α-helix	trans	-69.5	-30.4	176.1	81	0	0	0	0	113.4	I767 A768 G769 A775	I767-S771 WeakPolarHBondContact O-CB 3.35Å; I767-S771 PolarHBondContact O-N 2.91Å; A768-S771 PolarHBondContact O-N 3.21Å; A768-S771 PolarHBondContact O-OG 2.99Å; G769-S771 PolarHBondContact O-N 3.4Å; S771-A775 WeakPolarHBondContact O-CB 3.4Å; S771-A775 PolarHBondContact O-N 2.95Å; S771-A775 VanDerWaalsContact O-N 3.08Å
772	F	47.6	Very low	49.7	Very low	148 Å²	148	72.5 Å²	72.5	65%	0.649	40%	0.402	S	S	*	.	H	α-helix	trans	-71.4	-47.8	175.4	176.9	-94.8	0	0	0	111.2	A768 G769 A774 A775 V776	A768-F772 PolarHBondContact O-N 3.33Å; A768-F772 VanDerWaalsContact O-N 3.09Å; G769-F772 WeakPolarHBondContact O-CB 3.19Å; G769-F772 PolarHBondContact O-N 2.87Å; G769-F772 VanDerWaalsContact O-N 3.1Å; F772-A774 PolarHBondContact O-N 3.23Å; F772-A775 PolarHBondContact O-N 3.3Å; F772-A775 VanDerWaalsContact O-N 3.11Å; F772-V776 HydrophobicContact CD1-CG2 4.2Å; F772-V776 HydrophobicContact CE1-CG2 3.77Å; F772-V776 HydrophobicContact CE2-CG2 4.31Å; F772-V776 HydrophobicContact CZ-CG2 3.83Å; F772-V776 WeakPolarHBondContact O-CG2 3.42Å; F772-V776 PolarHBondContact O-N 2.84Å
773	E	55.9	Low	51.2	Low	105 Å²	105	70 Å²	70	49%	0.491	39%	0.394	S	S	.	.	H	α-helix	trans	-61.3	-45.6	-179.6	-165.2	169.2	-118.4	0	0	111.3	G769 A775 V776 E777	G769-E773 PolarHBondContact O-N 2.6Å; E773-A775 VanDerWaalsContact C-N 3.33Å; E773-A775 PolarHBondContact O-N 3.1Å; E773-V776 PolarHBondContact O-N 3.43Å; E773-E777 PolarHBondContact O-N 3.42Å
774	A	53.7	Low	52.7	Low	26 Å²	26	72.2 Å²	72.2	22%	0.215	41%	0.406	C	S	.	.	H	α-helix	trans	-66.7	-30.4	174.2	0	0	0	0	0	113.4	A770 F772 L778 L801	A770-A774 WeakPolarHBondContact O-CB 3.48Å; A770-A774 PolarHBondContact O-N 3.05Å; A770-A774 VanDerWaalsContact O-N 3.14Å; F772-A774 PolarHBondContact O-N 3.23Å; A774-L778 WeakPolarHBondContact O-CB 3.17Å; A774-L778 WeakPolarHBondContact O-CG 3.23Å; A774-L778 PolarHBondContact O-N 2.74Å; A774-L801 HydrophobicContact CB-CD2 3.59Å
775	A	56.5	Low	54.1	Low	8 Å²	8	70.4 Å²	70.4	7%	0.066	39%	0.392	C	S	.	.	H	α-helix	trans	-72.9	-33.9	173.6	0	0	0	0	0	112.7	S771 F772 E773 R779 M787	S771-A775 WeakPolarHBondContact O-CB 3.4Å; S771-A775 PolarHBondContact O-N 2.95Å; S771-A775 VanDerWaalsContact O-N 3.08Å; F772-A775 PolarHBondContact O-N 3.3Å; F772-A775 VanDerWaalsContact O-N 3.11Å; E773-A775 VanDerWaalsContact C-N 3.33Å; E773-A775 PolarHBondContact O-N 3.1Å; A775-R779 WeakPolarHBondContact O-CG 3.26Å; A775-R779 PolarHBondContact O-N 2.88Å; A775-M787 HydrophobicContact CB-CE 3.88Å; A775-M787 HydrophobicContact CB-SD 4.26Å
776	V	64.8	Low	55.3	Low	43 Å²	43	69.8 Å²	69.8	26%	0.261	39%	0.389	S	S	.	.	H	α-helix	trans	-65.1	-46.1	170.8	170.4	0	0	0	0	110	V745 F772 E773 R779 A780	V745-V776 HydrophobicContact CG2-CG1 4.12Å; F772-V776 HydrophobicContact CD1-CG2 4.2Å; F772-V776 HydrophobicContact CE1-CG2 3.77Å; F772-V776 HydrophobicContact CE2-CG2 4.31Å; F772-V776 HydrophobicContact CZ-CG2 3.83Å; F772-V776 WeakPolarHBondContact O-CG2 3.42Å; F772-V776 PolarHBondContact O-N 2.84Å; E773-V776 PolarHBondContact O-N 3.43Å; V776-R779 PolarHBondContact O-N 2.7Å; V776-A780 PolarHBondContact O-N 2.88Å
777	E	63.9	Low	56.6	Low	65 Å²	65	69.4 Å²	69.4	30%	0.304	39%	0.387	S	S	.	.	H	α-helix	trans	-69.6	-34.1	179.5	-153.1	-168.3	128.9	0	0	112.8	E773 R779 A780 Q781 Q808	E773-E777 PolarHBondContact O-N 3.42Å; E777-R779 VanDerWaalsContact C-N 3.31Å; E777-R779 PolarHBondContact O-N 2.78Å; E777-A780 WeakPolarHBondContact O-CB 3.47Å; E777-A780 PolarHBondContact O-N 3.37Å; E777-A780 VanDerWaalsContact O-N 3.08Å; E777-Q781 HydrophobicContact CG-CG 4.47Å; E777-Q781 PolarHBondContact O-N 3.3Å; E777-Q781 PolarHBondContact OE1-NE2 3.29Å; E777-Q808 PolarHBondContact OE1-NE2 2.98Å; E777-Q808 PolarHBondContact OE2-NE2 3.02Å
778	L	64.1	Low	57.5	Low	4 Å²	4	66 Å²	66	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-61.7	-37.5	170.5	-81.5	-177.6	0	0	0	112.6	A774 A780 F782 Y797 T800 L801 L804	A774-L778 WeakPolarHBondContact O-CB 3.17Å; A774-L778 WeakPolarHBondContact O-CG 3.23Å; A774-L778 PolarHBondContact O-N 2.74Å; L778-A780 VanDerWaalsContact C-N 3.3Å; L778-F782 HydrophobicContact CD2-CD2 3.94Å; L778-F782 HydrophobicContact CD2-CE2 4.12Å; L778-F782 CarbonylContact O-C 3.54Å; L778-F782 WeakPolarHBondContact O-CA 3.39Å; L778-F782 WeakPolarHBondContact O-CB 3.46Å; L778-F782 PolarHBondContact O-N 2.9Å; L778-Y797 HydrophobicContact CD1-CD2 3.88Å; L778-Y797 HydrophobicContact CD1-CE2 3.44Å; L778-Y797 VanDerWaalsContact CD1-CE2 3.44Å; L778-T800 HydrophobicContact CD2-CG2 3.75Å; L778-L801 HydrophobicContact CD1-CD2 3.43Å; L778-L801 VanDerWaalsContact CD1-CD2 3.43Å; L778-L801 HydrophobicContact CD1-CG 3.71Å; L778-L801 HydrophobicContact CG-CD2 4.1Å; L778-L804 HydrophobicContact CD2-CD1 4.14Å; L778-L804 HydrophobicContact CD2-CD2 3.92Å; L778-L804 HydrophobicContact CG-CD2 4.13Å
779	R	66.6	Low	58.2	Low	152 Å²	152	69.1 Å²	69.1	57%	0.574	39%	0.39	S	S	*	.	H	α-helix	trans	-68.6	-29.4	172.3	-67.7	174.7	-164.2	-175.8	6.3	112.5	A775 V776 E777 P783 M787	A775-R779 WeakPolarHBondContact O-CG 3.26Å; A775-R779 PolarHBondContact O-N 2.88Å; V776-R779 PolarHBondContact O-N 2.7Å; E777-R779 VanDerWaalsContact C-N 3.31Å; E777-R779 PolarHBondContact O-N 2.78Å; R779-P783 VanDerWaalsContact O-CA 3.26Å; R779-P783 WeakPolarHBondContact O-CA 3.38Å; R779-M787 PolarHBondContact NH2-SD 2.81Å
780	A	69.8	Low	58.7	Low	69 Å²	69	76.2 Å²	76.2	57%	0.57	41%	0.408	S	S	*	.	H	α-helix	trans	-74.1	-40.3	175.3	0	0	0	0	0	112.5	V776 E777 L778	V776-A780 PolarHBondContact O-N 2.88Å; E777-A780 WeakPolarHBondContact O-CB 3.47Å; E777-A780 PolarHBondContact O-N 3.37Å; E777-A780 VanDerWaalsContact O-N 3.08Å; L778-A780 VanDerWaalsContact C-N 3.3Å
781	Q	66.6	Low	59.4	Low	42 Å²	42	76.7 Å²	76.7	20%	0.196	42%	0.417	C	S	.	.	H	α-helix	trans	-83.5	-27.8	179	-62.5	-152.9	33	0	0	113.5	E777 L804 Y867	E777-Q781 HydrophobicContact CG-CG 4.47Å; E777-Q781 PolarHBondContact O-N 3.3Å; E777-Q781 PolarHBondContact OE1-NE2 3.29Å; Q781-L804 HydrophobicContact CG-CD1 4.42Å; Q781-Y867 PolarHBondContact OE1-OH 3.45Å
782	F	70.8	Confident	59.8	Low	13 Å²	13	80.6 Å²	80.6	6%	0.057	43%	0.428	C	S	.	.			trans	-136.9	78.4	179.2	-53.8	-83.9	0	0	0	110.6	L778 N784 F785 T800 K862 T863 Y867	L778-F782 HydrophobicContact CD2-CD2 3.94Å; L778-F782 HydrophobicContact CD2-CE2 4.12Å; L778-F782 CarbonylContact O-C 3.54Å; L778-F782 WeakPolarHBondContact O-CA 3.39Å; L778-F782 WeakPolarHBondContact O-CB 3.46Å; L778-F782 PolarHBondContact O-N 2.9Å; F782-N784 PolarHBondContact O-N 2.75Å; F782-N784 VanDerWaalsContact O-N 3.09Å; F782-F785 HydrophobicContact CB-CB 3.75Å; F782-F785 VanDerWaalsContact O-CB 3.25Å; F782-F785 WeakPolarHBondContact O-CB 3.25Å; F782-F785 PolarHBondContact O-N 2.89Å; F782-T800 HydrophobicContact CD2-CG2 4.43Å; F782-T800 HydrophobicContact CE2-CG2 3.95Å; F782-T800 HydrophobicContact CZ-CG2 4.47Å; F782-K862 HydrophobicContact CE1-CB 4.2Å; F782-K862 HydrophobicContact CE1-CG 4.15Å; F782-K862 HydrophobicContact CZ-CG 4.21Å; F782-T863 WeakPolarHBondContact CD1-O 3.32Å; F782-T863 VanDerWaalsContact CE1-O 3.29Å; F782-T863 WeakPolarHBondContact CE1-O 3.47Å; F782-Y867 HydrophobicContact CE2-CD2 4.24Å; F782-Y867 AromaticContact CE2-CE2 3.66Å; F782-Y867 HydrophobicContact CE2-CE2 3.66Å; F782-Y867 AromaticContact CZ-CD2 3.94Å; F782-Y867 HydrophobicContact CZ-CD2 3.94Å; F782-Y867 HydrophobicContact CZ-CE1 4.26Å; F782-Y867 AromaticContact CZ-CE2 3.57Å; F782-Y867 HydrophobicContact CZ-CE2 3.57Å; F782-Y867 HydrophobicContact CZ-CG 4.4Å; F782-Y867 AromaticContact CZ-CZ 3.71Å
783	P	66.6	Low	60.4	Low	105 Å²	105	79 Å²	79	68%	0.682	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.5	-175.8	-27.9	36.3	0	0	0	115.2	R779 F785	R779-P783 VanDerWaalsContact O-CA 3.26Å; R779-P783 WeakPolarHBondContact O-CA 3.38Å; P783-F785 VanDerWaalsContact C-N 3.34Å
784	N	64.7	Low	60.9	Low	121 Å²	121	76 Å²	76	65%	0.647	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-1.5	178.4	-64	-9.9	0	0	0	113.4	F782 Q786 E864	F782-N784 PolarHBondContact O-N 2.75Å; F782-N784 VanDerWaalsContact O-N 3.09Å; N784-Q786 PolarHBondContact O-N 3.04Å; N784-E864 PolarHBondContact ND2-OE1 3.29Å
785	F	64.7	Low	61.8	Low	25 Å²	25	76.7 Å²	76.7	11%	0.11	41%	0.411	C	S	.	.			trans	-73.4	102.4	-173.6	-165.4	-76	0	0	0	111.8	F782 P783 M787 Y797	F782-F785 HydrophobicContact CB-CB 3.75Å; F782-F785 VanDerWaalsContact O-CB 3.25Å; F782-F785 WeakPolarHBondContact O-CB 3.25Å; F782-F785 PolarHBondContact O-N 2.89Å; P783-F785 VanDerWaalsContact C-N 3.34Å; F785-M787 PolarHBondContact O-N 3.04Å; F785-M787 VanDerWaalsContact O-N 3.16Å; F785-Y797 HydrophobicContact CD1-CD2 4.34Å; F785-Y797 AromaticContact CE1-CD2 3.53Å; F785-Y797 HydrophobicContact CE1-CD2 3.53Å; F785-Y797 HydrophobicContact CE1-CE2 4.39Å; F785-Y797 HydrophobicContact CE1-CG 4.31Å; F785-Y797 HydrophobicContact CZ-CD2 4.09Å
786	Q	58.3	Low	62.6	Low	150 Å²	150	79 Å²	79	70%	0.701	42%	0.42	S	S	*	.			trans	-76.5	102.2	179.4	-171.3	-179.9	54.6	0	0	111.3	N784 P788	N784-Q786 PolarHBondContact O-N 3.04Å; Q786-P788 WeakPolarHBondContact O-CD 3.46Å
787	M	59.3	Low	63.1	Low	79 Å²	79	78.7 Å²	78.7	39%	0.389	41%	0.414	S	S	.	.			trans	-52.9	117	176.9	-68.4	178	69.7	0	0	111.8	A775 R779 F785 Y797	A775-M787 HydrophobicContact CB-CE 3.88Å; A775-M787 HydrophobicContact CB-SD 4.26Å; R779-M787 PolarHBondContact NH2-SD 2.81Å; F785-M787 PolarHBondContact O-N 3.04Å; F785-M787 VanDerWaalsContact O-N 3.16Å; M787-Y797 HydrophobicContact CG-CE2 4.37Å
788	P	56.6	Low	63.8	Low	29 Å²	29	77.8 Å²	77.8	19%	0.188	41%	0.411	C	S	.	.			trans	-88.9	126.2	-173.4	32.5	-32.5	0	0	0	112.1	Q786 K793	Q786-P788 WeakPolarHBondContact O-CD 3.46Å; P788-K793 HydrophobicContact CB-CB 3.43Å; P788-K793 VanDerWaalsContact CB-CB 3.43Å; P788-K793 HydrophobicContact CB-CD 4.28Å; P788-K793 HydrophobicContact CB-CG 4.5Å; P788-K793 HydrophobicContact CG-CB 3.7Å; P788-K793 WeakPolarHBondContact CG-O 3.23Å
789	S	51.4	Low	64.7	Low	119 Å²	119	79 Å²	79	83%	0.832	42%	0.416	S	S	*	.	S	Bend	trans	-78.5	-16.9	-175.4	55.4	0	0	0	0	115.2
790	K	46.3	Very low	65.5	Low	192 Å²	192	71.8 Å²	71.8	84%	0.835	39%	0.389	S	S	*	.	S	Bend	trans	-173.4	166.8	170.3	-100.2	138.7	-172.6	173.2	0	110.3
791	G	53.7	Low	66	Low	51 Å²	51	70.7 Å²	70.7	53%	0.526	37%	0.373	S	S	.	.	S	Bend	trans	92.6	-175.1	173	0	0	0	0	0	114.3	K793 S794	G791-K793 PolarHBondContact O-N 3.42Å; G791-S794 WeakPolarHBondContact O-CB 3.49Å; G791-S794 PolarHBondContact O-N 3.08Å; G791-S794 PolarHBondContact O-OG 3.47Å
792	Q	54.5	Low	66.8	Low	146 Å²	146	69.3 Å²	69.3	68%	0.682	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-36	-168.7	-170	173.4	2.7	0	0	114.7	S794 E795 M963	Q792-S794 PolarHBondContact O-N 3.47Å; Q792-S794 VanDerWaalsContact O-N 3.12Å; Q792-E795 PolarHBondContact O-N 3Å; Q792-M963 HydrophobicContact CG-SD 3.84Å
793	K	59.5	Low	67.6	Low	115 Å²	115	68.7 Å²	68.7	50%	0.5	37%	0.365	S	S	.	.	H	α-helix	trans	-57.3	-23.3	175.2	-65.9	-173.7	174.8	-171.5	0	113.9	P788 G791 E796 Y797	P788-K793 HydrophobicContact CB-CB 3.43Å; P788-K793 VanDerWaalsContact CB-CB 3.43Å; P788-K793 HydrophobicContact CB-CD 4.28Å; P788-K793 HydrophobicContact CB-CG 4.5Å; P788-K793 HydrophobicContact CG-CB 3.7Å; P788-K793 WeakPolarHBondContact CG-O 3.23Å; G791-K793 PolarHBondContact O-N 3.42Å; K793-E796 WeakPolarHBondContact O-CB 3.33Å; K793-E796 PolarHBondContact O-N 2.84Å; K793-Y797 PolarHBondContact O-N 3.07Å
794	S	67.1	Low	68.5	Low	43 Å²	43	63.8 Å²	63.8	30%	0.301	33%	0.333	S	S	.	.	H	α-helix	trans	-71.4	-28.9	-180	69.4	0	0	0	0	113.5	G791 Q792 E796 I798	G791-S794 WeakPolarHBondContact O-CB 3.49Å; G791-S794 PolarHBondContact O-N 3.08Å; G791-S794 PolarHBondContact O-OG 3.47Å; Q792-S794 PolarHBondContact O-N 3.47Å; Q792-S794 VanDerWaalsContact O-N 3.12Å; S794-E796 VanDerWaalsContact C-N 3.33Å; S794-I798 WeakPolarHBondContact O-CD1 3.48Å; S794-I798 VanDerWaalsContact O-CG1 3.27Å; S794-I798 WeakPolarHBondContact O-CG1 3.41Å; S794-I798 PolarHBondContact O-N 3.41Å; S794-I798 VanDerWaalsContact O-N 3.1Å
795	E	72.3	Confident	69.3	Low	39 Å²	39	61 Å²	61	18%	0.182	32%	0.315	C	S	.	.	H	α-helix	trans	-67	-38.3	170.2	-69.6	-157.9	-177.8	0	0	110.5	Q792 I798 R799 T961 K962 M963 Y964	Q792-E795 PolarHBondContact O-N 3Å; E795-I798 PolarHBondContact O-N 3.17Å; E795-R799 WeakPolarHBondContact O-CB 3.46Å; E795-R799 PolarHBondContact O-N 3.14Å; E795-T961 HydrophobicContact CB-CG2 3.98Å; E795-T961 HydrophobicContact CG-CG2 4.28Å; E795-T961 WeakPolarHBondContact OE2-CA 3.47Å; E795-T961 WeakPolarHBondContact OE2-CB 3.39Å; E795-K962 PolarHBondContact OE1-N 3.42Å; E795-K962 PolarHBondContact OE2-N 2.8Å; E795-M963 WeakPolarHBondContact OE2-CB 3.37Å; E795-M963 PolarHBondContact OE2-N 3.45Å; E795-Y964 HydrophobicContact CB-CE2 4.02Å
796	E	74.3	Confident	70.2	Confident	57 Å²	57	60 Å²	60	27%	0.266	31%	0.311	S	S	.	.	H	α-helix	trans	-68	-36.4	179	-160.7	130.6	-113.8	0	0	112.5	K793 S794 T800 Y964	K793-E796 WeakPolarHBondContact O-CB 3.33Å; K793-E796 PolarHBondContact O-N 2.84Å; S794-E796 VanDerWaalsContact C-N 3.33Å; E796-T800 WeakPolarHBondContact O-CB 3.19Å; E796-T800 PolarHBondContact O-N 3.45Å; E796-T800 PolarHBondContact O-OG1 3.25Å; E796-Y964 WeakPolarHBondContact CA-OH 3.18Å; E796-Y964 WeakPolarHBondContact CB-OH 3.3Å; E796-Y964 WeakPolarHBondContact CG-OH 3.43Å; E796-Y964 PolarHBondContact OE1-OH 2.87Å
797	Y	74.2	Confident	71.6	Confident	36 Å²	36	52.8 Å²	52.8	14%	0.141	28%	0.278	C	S	.	.	H	α-helix	trans	-62.6	-46.8	169.3	176.6	-114.6	0	0	0	112.1	L778 F785 M787 K793 T800 L801	L778-Y797 HydrophobicContact CD1-CD2 3.88Å; L778-Y797 HydrophobicContact CD1-CE2 3.44Å; L778-Y797 VanDerWaalsContact CD1-CE2 3.44Å; F785-Y797 HydrophobicContact CD1-CD2 4.34Å; F785-Y797 AromaticContact CE1-CD2 3.53Å; F785-Y797 HydrophobicContact CE1-CD2 3.53Å; F785-Y797 HydrophobicContact CE1-CE2 4.39Å; F785-Y797 HydrophobicContact CE1-CG 4.31Å; F785-Y797 HydrophobicContact CZ-CD2 4.09Å; M787-Y797 HydrophobicContact CG-CE2 4.37Å; K793-Y797 PolarHBondContact O-N 3.07Å; Y797-T800 PolarHBondContact O-N 2.99Å; Y797-L801 HydrophobicContact CD1-CD1 4.02Å; Y797-L801 HydrophobicContact CE1-CD1 3.56Å; Y797-L801 HydrophobicContact CE1-CG 4.41Å; Y797-L801 HydrophobicContact CE2-CD1 4.3Å; Y797-L801 HydrophobicContact CE2-CG 4.31Å; Y797-L801 WeakPolarHBondContact O-CG 3.15Å; Y797-L801 PolarHBondContact O-N 2.71Å
798	I	78.3	Confident	72.7	Confident	47 Å²	47	51.4 Å²	51.4	24%	0.241	27%	0.27	C	S	.	.	H	α-helix	trans	-64	-43.1	177.5	-68.6	165.6	0	0	0	111	S794 E795 T800 L801 V802 R960 T961	S794-I798 WeakPolarHBondContact O-CD1 3.48Å; S794-I798 VanDerWaalsContact O-CG1 3.27Å; S794-I798 WeakPolarHBondContact O-CG1 3.41Å; S794-I798 PolarHBondContact O-N 3.41Å; S794-I798 VanDerWaalsContact O-N 3.1Å; E795-I798 PolarHBondContact O-N 3.17Å; I798-T800 VanDerWaalsContact C-N 3.34Å; I798-T800 PolarHBondContact O-N 3.16Å; I798-L801 PolarHBondContact O-N 3.28Å; I798-V802 HydrophobicContact CG2-CG2 4.39Å; I798-V802 WeakPolarHBondContact O-CB 3.38Å; I798-V802 VanDerWaalsContact O-CG2 3.27Å; I798-V802 WeakPolarHBondContact O-CG2 3.12Å; I798-V802 PolarHBondContact O-N 2.88Å; I798-R960 HydrophobicContact CG2-CB 3.74Å; I798-R960 HydrophobicContact CG2-CG 4.49Å; I798-T961 HydrophobicContact CB-CG2 4.19Å; I798-T961 HydrophobicContact CG2-CG2 3.94Å
799	R	83.7	Confident	73.7	Confident	29 Å²	29	52.5 Å²	52.5	11%	0.109	27%	0.272	C	S	.	.	H	α-helix	trans	-54.7	-50.6	171.8	175.2	-171.1	-175.4	-175.7	4.3	110.8	E795 L801 V802 L803 L957 Y964 E967	E795-R799 WeakPolarHBondContact O-CB 3.46Å; E795-R799 PolarHBondContact O-N 3.14Å; R799-L801 PolarHBondContact O-N 3.06Å; R799-V802 PolarHBondContact O-N 2.94Å; R799-L803 HydrophobicContact CG-CD1 3.69Å; R799-L803 HydrophobicContact CG-CG 4.26Å; R799-L803 WeakPolarHBondContact O-CB 3.2Å; R799-L803 VanDerWaalsContact O-CG 3.29Å; R799-L803 WeakPolarHBondContact O-CG 3.43Å; R799-L803 PolarHBondContact O-N 2.73Å; R799-L957 HydrophobicContact CB-CD2 4.18Å; R799-L957 HydrophobicContact CG-CD2 4.05Å; R799-Y964 HydrophobicContact CB-CD2 3.78Å; R799-Y964 HydrophobicContact CB-CE2 3.69Å; R799-Y964 HydrophobicContact CG-CD2 4.1Å; R799-Y964 HydrophobicContact CG-CE2 4.21Å; R799-Y964 HydrophobicContact CG-CG 4.39Å; R799-Y964 VanDerWaalsContact NH1-CE1 3.32Å; R799-E967 IonicContact CZ-OE1 3.3Å; R799-E967 IonicContact CZ-OE2 2.75Å; R799-E967 VanDerWaalsContact CZ-OE2 3.22Å; R799-E967 IonicContact NE-OE1 3.82Å; R799-E967 IonicContact NE-OE2 2.9Å; R799-E967 PolarHBondContact NE-OE2 2.88Å; R799-E967 IonicContact NH2-OE1 2.83Å; R799-E967 PolarHBondContact NH2-OE1 2.71Å; R799-E967 IonicContact NH2-OE2 2.66Å; R799-E967 PolarHBondContact NH2-OE2 3.39Å; R799-E967 VanDerWaalsContact NH2-OE2 3.14Å
800	T	83.5	Confident	75.1	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-65.5	-39.5	-176.3	-54.8	0	0	0	0	111.7	L778 F782 E796 Y797 I798 L804 Y867	L778-T800 HydrophobicContact CD2-CG2 3.75Å; F782-T800 HydrophobicContact CD2-CG2 4.43Å; F782-T800 HydrophobicContact CE2-CG2 3.95Å; F782-T800 HydrophobicContact CZ-CG2 4.47Å; E796-T800 WeakPolarHBondContact O-CB 3.19Å; E796-T800 PolarHBondContact O-N 3.45Å; E796-T800 PolarHBondContact O-OG1 3.25Å; Y797-T800 PolarHBondContact O-N 2.99Å; I798-T800 VanDerWaalsContact C-N 3.34Å; I798-T800 PolarHBondContact O-N 3.16Å; T800-L804 WeakPolarHBondContact O-CB 3.44Å; T800-L804 PolarHBondContact O-N 3.01Å; T800-Y867 HydrophobicContact CG2-CD2 4.14Å
801	L	80.7	Confident	76.8	Confident	46 Å²	46	39.5 Å²	39.5	24%	0.241	20%	0.201	C	C	.	.	H	α-helix	trans	-57.3	-48.6	170.2	-78.7	171.7	0	0	0	112.5	A774 L778 Y797 I798 R799 L804	A774-L801 HydrophobicContact CB-CD2 3.59Å; L778-L801 HydrophobicContact CD1-CD2 3.43Å; L778-L801 VanDerWaalsContact CD1-CD2 3.43Å; L778-L801 HydrophobicContact CD1-CG 3.71Å; L778-L801 HydrophobicContact CG-CD2 4.1Å; Y797-L801 HydrophobicContact CD1-CD1 4.02Å; Y797-L801 HydrophobicContact CE1-CD1 3.56Å; Y797-L801 HydrophobicContact CE1-CG 4.41Å; Y797-L801 HydrophobicContact CE2-CD1 4.3Å; Y797-L801 HydrophobicContact CE2-CG 4.31Å; Y797-L801 WeakPolarHBondContact O-CG 3.15Å; Y797-L801 PolarHBondContact O-N 2.71Å; I798-L801 PolarHBondContact O-N 3.28Å; R799-L801 PolarHBondContact O-N 3.06Å; L801-L804 VanDerWaalsContact O-CB 3.27Å; L801-L804 WeakPolarHBondContact O-CB 3.36Å; L801-L804 PolarHBondContact O-N 3.33Å
802	V	83.5	Confident	77.9	Confident	13 Å²	13	39.8 Å²	39.8	8%	0.079	19%	0.187	C	C	.	.	H	α-helix	trans	-69.6	-37.2	-176.3	171.5	0	0	0	0	111.4	I798 R799 L804 I953 D956 L957	I798-V802 HydrophobicContact CG2-CG2 4.39Å; I798-V802 WeakPolarHBondContact O-CB 3.38Å; I798-V802 VanDerWaalsContact O-CG2 3.27Å; I798-V802 WeakPolarHBondContact O-CG2 3.12Å; I798-V802 PolarHBondContact O-N 2.88Å; R799-V802 PolarHBondContact O-N 2.94Å; V802-L804 VanDerWaalsContact C-N 3.35Å; V802-I953 HydrophobicContact CG1-CB 3.99Å; V802-I953 HydrophobicContact CG1-CG1 3.78Å; V802-I953 HydrophobicContact CG1-CG2 3.91Å; V802-D956 HydrophobicContact CG1-CB 4.18Å; V802-D956 HydrophobicContact CG2-CB 4.06Å; V802-L957 HydrophobicContact CG1-CG 4.32Å
803	L	87.4	Confident	78.8	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-70.6	-29.4	174.2	-66.9	176.9	0	0	0	112.8	R799 E805 F806 H807 Y867 M870 I953 W971	R799-L803 HydrophobicContact CG-CD1 3.69Å; R799-L803 HydrophobicContact CG-CG 4.26Å; R799-L803 WeakPolarHBondContact O-CB 3.2Å; R799-L803 VanDerWaalsContact O-CG 3.29Å; R799-L803 WeakPolarHBondContact O-CG 3.43Å; R799-L803 PolarHBondContact O-N 2.73Å; L803-E805 VanDerWaalsContact C-N 3.26Å; L803-E805 PolarHBondContact O-N 3.14Å; L803-F806 PolarHBondContact O-N 3.26Å; L803-H807 PolarHBondContact O-N 2.99Å; L803-Y867 HydrophobicContact CB-CD2 4.04Å; L803-Y867 HydrophobicContact CB-CG 4.34Å; L803-M870 HydrophobicContact CB-SD 3.91Å; L803-M870 HydrophobicContact CD2-SD 4.29Å; L803-M870 HydrophobicContact CG-SD 4.5Å; L803-I953 HydrophobicContact CD2-CG2 4.39Å; L803-W971 HydrophobicContact CD2-CZ2 3.64Å; L803-W971 VanDerWaalsContact CD2-NE1 3.3Å
804	L	84.6	Confident	79.7	Confident	2 Å²	2	28.4 Å²	28.4	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-57.3	-38.6	176.9	-163.3	71.8	0	0	0	111.9	L778 Q781 T800 L801 V802 F806 H807 Q808 Y867	L778-L804 HydrophobicContact CD2-CD1 4.14Å; L778-L804 HydrophobicContact CD2-CD2 3.92Å; L778-L804 HydrophobicContact CG-CD2 4.13Å; Q781-L804 HydrophobicContact CG-CD1 4.42Å; T800-L804 WeakPolarHBondContact O-CB 3.44Å; T800-L804 PolarHBondContact O-N 3.01Å; L801-L804 VanDerWaalsContact O-CB 3.27Å; L801-L804 WeakPolarHBondContact O-CB 3.36Å; L801-L804 PolarHBondContact O-N 3.33Å; V802-L804 VanDerWaalsContact C-N 3.35Å; L804-F806 PolarHBondContact O-N 2.99Å; L804-H807 PolarHBondContact O-N 3.48Å; L804-H807 VanDerWaalsContact O-N 3.12Å; L804-Q808 HydrophobicContact CG-CG 4.27Å; L804-Q808 WeakPolarHBondContact O-CG 3.16Å; L804-Q808 PolarHBondContact O-N 3.44Å; L804-Y867 HydrophobicContact CD1-CE2 3.82Å
805	E	80.8	Confident	80	Confident	61 Å²	61	32.7 Å²	32.7	29%	0.285	15%	0.146	S	C	.	.	H	α-helix	trans	-56.4	-49	-178.7	-168.4	-166.9	168	0	0	111.7	L803 H807 Q808 K809 I949	L803-E805 VanDerWaalsContact C-N 3.26Å; L803-E805 PolarHBondContact O-N 3.14Å; E805-H807 VanDerWaalsContact C-N 3.29Å; E805-H807 PolarHBondContact O-N 3.49Å; E805-Q808 PolarHBondContact O-N 3.03Å; E805-K809 WeakPolarHBondContact O-CG 3.49Å; E805-K809 PolarHBondContact O-N 3.46Å; E805-I949 HydrophobicContact CG-CG2 4.4Å
806	F	84.4	Confident	79.8	Confident	4 Å²	4	31.1 Å²	31.1	2%	0.018	14%	0.138	C	C	.	.	H	α-helix	trans	-63.2	-37.7	179.5	-169.8	-91.4	0	0	0	111.7	L803 L804 T810 I858 M870 V874 L946 I949 I953 W971	L803-F806 PolarHBondContact O-N 3.26Å; L804-F806 PolarHBondContact O-N 2.99Å; F806-T810 HydrophobicContact CD1-CG2 4.15Å; F806-T810 HydrophobicContact CE1-CG2 3.84Å; F806-T810 HydrophobicContact CZ-CG2 4.26Å; F806-T810 WeakPolarHBondContact O-CG2 3.3Å; F806-T810 PolarHBondContact O-N 2.84Å; F806-T810 PolarHBondContact O-OG1 3.24Å; F806-I858 HydrophobicContact CD1-CD1 3.98Å; F806-I858 HydrophobicContact CE1-CD1 3.97Å; F806-M870 HydrophobicContact CB-CE 3.94Å; F806-M870 HydrophobicContact CD1-CE 3.66Å; F806-M870 HydrophobicContact CG-CE 4.22Å; F806-V874 HydrophobicContact CE1-CG1 4.04Å; F806-V874 HydrophobicContact CE1-CG2 4.14Å; F806-V874 HydrophobicContact CZ-CG1 4.05Å; F806-L946 HydrophobicContact CD2-CD2 4.15Å; F806-L946 HydrophobicContact CE2-CD2 3.57Å; F806-L946 HydrophobicContact CZ-CD2 4.07Å; F806-I949 HydrophobicContact CB-CG2 4.5Å; F806-I949 HydrophobicContact CD2-CG2 4.18Å; F806-I953 HydrophobicContact CB-CD1 3.67Å; F806-I953 HydrophobicContact CD2-CD1 4.49Å; F806-W971 HydrophobicContact CB-CH2 3.94Å; F806-W971 AromaticContact CD1-CH2 3.8Å; F806-W971 HydrophobicContact CD1-CH2 3.8Å; F806-W971 HydrophobicContact CD1-CZ3 4.41Å; F806-W971 AromaticContact CD2-CH2 3.74Å; F806-W971 HydrophobicContact CD2-CH2 3.74Å; F806-W971 AromaticContact CD2-CZ3 3.6Å; F806-W971 HydrophobicContact CD2-CZ3 3.6Å; F806-W971 HydrophobicContact CE1-CH2 4.17Å; F806-W971 HydrophobicContact CE2-CH2 4.13Å; F806-W971 AromaticContact CE2-CZ3 3.76Å; F806-W971 HydrophobicContact CE2-CZ3 3.76Å; F806-W971 AromaticContact CG-CH2 3.55Å; F806-W971 HydrophobicContact CG-CH2 3.55Å; F806-W971 AromaticContact CG-CZ3 3.94Å; F806-W971 HydrophobicContact CG-CZ3 3.94Å; F806-W971 HydrophobicContact CZ-CH2 4.33Å; F806-W971 HydrophobicContact CZ-CZ3 4.23Å
807	H	87.4	Confident	79.7	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-69.9	-43	177.7	-167	-161.9	0	0	0	111.8	L803 L804 E805 K809 T810 Q811 I858 D859 Y867 M870	L803-H807 PolarHBondContact O-N 2.99Å; L804-H807 PolarHBondContact O-N 3.48Å; L804-H807 VanDerWaalsContact O-N 3.12Å; E805-H807 VanDerWaalsContact C-N 3.29Å; E805-H807 PolarHBondContact O-N 3.49Å; H807-K809 PolarHBondContact O-N 2.94Å; H807-T810 WeakPolarHBondContact CA-OG1 3.49Å; H807-T810 PolarHBondContact O-N 3.18Å; H807-T810 PolarHBondContact O-OG1 3.27Å; H807-Q811 PolarHBondContact CE1-NE2 2.76Å; H807-Q811 PolarHBondContact NE2-NE2 2.83Å; H807-Q811 VanDerWaalsContact NE2-NE2 3.11Å; H807-Q811 WeakPolarHBondContact O-CB 3.17Å; H807-Q811 WeakPolarHBondContact O-CG 3.23Å; H807-Q811 PolarHBondContact O-N 2.72Å; H807-I858 HydrophobicContact CB-CG2 3.98Å; H807-D859 IonicContact CE1-OD1 2.74Å; H807-D859 PolarHBondContact CE1-OD1 3.45Å; H807-D859 VanDerWaalsContact CE1-OD1 3.27Å; H807-D859 IonicContact NE2-OD1 3.22Å; H807-Y867 AromaticContact ND1-CE1 3.72Å; H807-Y867 AromaticContact ND1-CZ 3.58Å; H807-Y867 PolarHBondContact ND1-OH 2.91Å; H807-M870 HydrophobicContact CB-CE 4.26Å
808	Q	81.8	Confident	79.6	Confident	50 Å²	50	32 Å²	32	23%	0.234	14%	0.142	C	C	.	.	H	α-helix	trans	-56	-48.5	172.7	-72.6	167.9	-15.3	0	0	111.7	E777 L804 E805 T810 Q811 Y812	E777-Q808 PolarHBondContact OE1-NE2 2.98Å; E777-Q808 PolarHBondContact OE2-NE2 3.02Å; L804-Q808 HydrophobicContact CG-CG 4.27Å; L804-Q808 WeakPolarHBondContact O-CG 3.16Å; L804-Q808 PolarHBondContact O-N 3.44Å; E805-Q808 PolarHBondContact O-N 3.03Å; Q808-T810 PolarHBondContact O-N 2.87Å; Q808-Q811 PolarHBondContact O-N 2.68Å; Q808-Y812 VanDerWaalsContact O-CB 3.23Å; Q808-Y812 WeakPolarHBondContact O-CB 3.25Å; Q808-Y812 PolarHBondContact O-N 2.98Å
809	K	79.4	Confident	79.1	Confident	52 Å²	52	35 Å²	35	23%	0.226	16%	0.155	C	C	.	.	H	α-helix	trans	-67.5	-34.2	-178.6	-56.8	-38.9	-179.5	-164.6	0	112.5	E805 H807 M813 L942 I949	E805-K809 WeakPolarHBondContact O-CG 3.49Å; E805-K809 PolarHBondContact O-N 3.46Å; H807-K809 PolarHBondContact O-N 2.94Å; K809-M813 WeakPolarHBondContact O-CG 3.19Å; K809-M813 PolarHBondContact O-N 3.15Å; K809-L942 HydrophobicContact CB-CD2 4.5Å; K809-I949 HydrophobicContact CB-CD1 4.24Å; K809-I949 HydrophobicContact CG-CD1 3.76Å
810	T	80.9	Confident	78.2	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-73.1	-40	175.1	47.1	0	0	0	0	112.5	F806 H807 Q808 M813 V814 L854 I858 L946	F806-T810 HydrophobicContact CD1-CG2 4.15Å; F806-T810 HydrophobicContact CE1-CG2 3.84Å; F806-T810 HydrophobicContact CZ-CG2 4.26Å; F806-T810 WeakPolarHBondContact O-CG2 3.3Å; F806-T810 PolarHBondContact O-N 2.84Å; F806-T810 PolarHBondContact O-OG1 3.24Å; H807-T810 WeakPolarHBondContact CA-OG1 3.49Å; H807-T810 PolarHBondContact O-N 3.18Å; H807-T810 PolarHBondContact O-OG1 3.27Å; Q808-T810 PolarHBondContact O-N 2.87Å; T810-M813 PolarHBondContact O-N 3.42Å; T810-V814 PolarHBondContact O-N 2.97Å; T810-V814 VanDerWaalsContact O-N 3.1Å; T810-L854 HydrophobicContact CG2-CD2 3.8Å; T810-L854 HydrophobicContact CG2-CG 4.42Å; T810-I858 HydrophobicContact CG2-CD1 4.47Å; T810-L946 HydrophobicContact CG2-CD2 4.47Å
811	Q	81.2	Confident	77.4	Confident	37 Å²	37	36.3 Å²	36.3	17%	0.173	16%	0.162	C	C	.	.	H	α-helix	trans	-63.3	-43.2	169.9	-73.3	-157.2	8.2	0	0	112.5	H807 Q808 M813 V814 R815 V855	H807-Q811 PolarHBondContact CE1-NE2 2.76Å; H807-Q811 PolarHBondContact NE2-NE2 2.83Å; H807-Q811 VanDerWaalsContact NE2-NE2 3.11Å; H807-Q811 WeakPolarHBondContact O-CB 3.17Å; H807-Q811 WeakPolarHBondContact O-CG 3.23Å; H807-Q811 PolarHBondContact O-N 2.72Å; Q808-Q811 PolarHBondContact O-N 2.68Å; Q811-M813 VanDerWaalsContact C-N 3.26Å; Q811-M813 PolarHBondContact O-N 3.16Å; Q811-V814 PolarHBondContact O-N 2.8Å; Q811-V814 VanDerWaalsContact O-N 3.11Å; Q811-R815 WeakPolarHBondContact O-CG 3.11Å; Q811-R815 PolarHBondContact O-N 3.06Å; Q811-V855 HydrophobicContact CG-CG1 4.13Å; Q811-V855 HydrophobicContact CG-CG2 4.26Å
812	Y	77	Confident	76.5	Confident	58 Å²	58	36.7 Å²	36.7	23%	0.227	16%	0.161	C	C	.	.	H	α-helix	trans	-57.7	-41.3	174.5	178.7	-91.7	0	0	0	110.7	V752 L755 Q808 V814 R815 H816 L942	V752-Y812 HydrophobicContact CG1-CE2 4.27Å; V752-Y812 HydrophobicContact CG2-CE2 4.2Å; L755-Y812 HydrophobicContact CD1-CE1 4.15Å; Q808-Y812 VanDerWaalsContact O-CB 3.23Å; Q808-Y812 WeakPolarHBondContact O-CB 3.25Å; Q808-Y812 PolarHBondContact O-N 2.98Å; Y812-V814 PolarHBondContact O-N 3.41Å; Y812-R815 PolarHBondContact O-N 3.24Å; Y812-H816 HydrophobicContact CE1-CB 4.27Å; Y812-H816 VanDerWaalsContact O-CB 3.28Å; Y812-H816 WeakPolarHBondContact O-CB 3.36Å; Y812-H816 PolarHBondContact O-N 3.37Å; Y812-L942 HydrophobicContact CD1-CD1 3.86Å; Y812-L942 HydrophobicContact CE1-CD1 3.65Å
813	M	72.2	Confident	75.3	Confident	4 Å²	4	36.2 Å²	36.2	2%	0.02	16%	0.158	C	C	.	.	H	α-helix	trans	-62.8	-39.3	174.1	-75.6	-87.6	68.2	0	0	113.1	K809 T810 Q811 H816 L817 F851 L942	K809-M813 WeakPolarHBondContact O-CG 3.19Å; K809-M813 PolarHBondContact O-N 3.15Å; T810-M813 PolarHBondContact O-N 3.42Å; Q811-M813 VanDerWaalsContact C-N 3.26Å; Q811-M813 PolarHBondContact O-N 3.16Å; M813-H816 HydrophobicContact CE-CB 4.18Å; M813-L817 WeakPolarHBondContact O-CB 3.33Å; M813-L817 WeakPolarHBondContact O-CG 3.47Å; M813-L817 PolarHBondContact O-N 2.64Å; M813-F851 HydrophobicContact CB-CD1 3.91Å; M813-F851 HydrophobicContact CB-CE1 3.89Å; M813-F851 HydrophobicContact CB-CG 4.27Å; M813-F851 HydrophobicContact CB-CZ 4.23Å; M813-F851 HydrophobicContact CG-CE1 4.15Å; M813-F851 HydrophobicContact CG-CZ 4.31Å; M813-F851 HydrophobicContact SD-CZ 4.32Å; M813-L942 HydrophobicContact CE-CB 4.27Å; M813-L942 HydrophobicContact CE-CD1 3.54Å; M813-L942 HydrophobicContact CE-CG 4.49Å; M813-L942 HydrophobicContact CG-CB 4.23Å; M813-L942 HydrophobicContact CG-CD1 4.35Å; M813-L942 HydrophobicContact SD-CB 3.46Å; M813-L942 WeakPolarHBondContact SD-CB 3.33Å; M813-L942 HydrophobicContact SD-CD1 3.83Å; M813-L942 HydrophobicContact SD-CG 4.16Å
814	V	78.9	Confident	74.1	Confident	17 Å²	17	39 Å²	39	10%	0.103	17%	0.173	C	C	.	.	H	α-helix	trans	-62.7	-47.4	171.4	177.8	0	0	0	0	111.1	T810 Q811 Y812 L817 K818 F851 R852 V855	T810-V814 PolarHBondContact O-N 2.97Å; T810-V814 VanDerWaalsContact O-N 3.1Å; Q811-V814 PolarHBondContact O-N 2.8Å; Q811-V814 VanDerWaalsContact O-N 3.11Å; Y812-V814 PolarHBondContact O-N 3.41Å; V814-L817 PolarHBondContact O-N 3.25Å; V814-K818 HydrophobicContact CG1-CG 4.42Å; V814-K818 WeakPolarHBondContact O-CB 3.36Å; V814-K818 VanDerWaalsContact O-CG 3.32Å; V814-K818 WeakPolarHBondContact O-CG 3.45Å; V814-K818 PolarHBondContact O-N 3.44Å; V814-F851 HydrophobicContact CG2-CB 3.69Å; V814-R852 HydrophobicContact CG1-CG 3.94Å; V814-R852 HydrophobicContact CG2-CG 4.39Å; V814-V855 HydrophobicContact CG2-CG2 3.88Å
815	R	73.3	Confident	72.7	Confident	134 Å²	134	45.8 Å²	45.8	51%	0.506	21%	0.208	S	C	.	.	H	α-helix	trans	-62.3	-45.7	-179.7	-66.3	179.1	-162	-176.1	7.8	111.7	Q811 Y812 K818 Q819	Q811-R815 WeakPolarHBondContact O-CG 3.11Å; Q811-R815 PolarHBondContact O-N 3.06Å; Y812-R815 PolarHBondContact O-N 3.24Å; R815-K818 WeakPolarHBondContact O-CB 3.3Å; R815-K818 PolarHBondContact O-N 3.18Å; R815-Q819 PolarHBondContact O-N 2.82Å
816	H	68.9	Low	71.5	Confident	5 Å²	5	49.7 Å²	49.7	2%	0.023	22%	0.22	C	C	.	.	H	α-helix	trans	-66.8	-42.2	177.4	-174.6	59.3	0	0	0	111.9	Y812 M813 K818 Q819 Y820 Q938	Y812-H816 HydrophobicContact CE1-CB 4.27Å; Y812-H816 VanDerWaalsContact O-CB 3.28Å; Y812-H816 WeakPolarHBondContact O-CB 3.36Å; Y812-H816 PolarHBondContact O-N 3.37Å; M813-H816 HydrophobicContact CE-CB 4.18Å; H816-K818 VanDerWaalsContact C-N 3.33Å; H816-K818 PolarHBondContact O-N 2.84Å; H816-Q819 PolarHBondContact ND1-OE1 3.1Å; H816-Q819 VanDerWaalsContact O-CB 3.28Å; H816-Q819 WeakPolarHBondContact O-CB 3.36Å; H816-Q819 PolarHBondContact O-N 3.29Å; H816-Q819 VanDerWaalsContact O-N 3.1Å; H816-Y820 AromaticContact CE1-CE2 3.78Å; H816-Y820 AromaticContact CE1-CZ 3.92Å; H816-Y820 PolarHBondContact CE1-OH 3.24Å; H816-Y820 AromaticContact NE2-CE2 3.75Å; H816-Y820 WeakPolarHBondContact O-CD2 3.24Å; H816-Y820 WeakPolarHBondContact O-CE2 3.5Å; H816-Q938 PolarHBondContact CE1-OE1 3.26Å; H816-Q938 PolarHBondContact NE2-OE1 3.4Å
817	L	71.2	Confident	70.1	Confident	1 Å²	1	61 Å²	61	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-38.3	173.2	-86	161.3	0	0	0	112.5	M813 V814 Q819 Y820 I844 L847 I848 F851 M939	M813-L817 WeakPolarHBondContact O-CB 3.33Å; M813-L817 WeakPolarHBondContact O-CG 3.47Å; M813-L817 PolarHBondContact O-N 2.64Å; V814-L817 PolarHBondContact O-N 3.25Å; L817-Q819 PolarHBondContact O-N 3.21Å; L817-Y820 PolarHBondContact O-N 2.96Å; L817-I844 HydrophobicContact CD2-CG2 4.19Å; L817-L847 HydrophobicContact CD1-CB 3.99Å; L817-L847 HydrophobicContact CD2-CB 4.12Å; L817-L847 HydrophobicContact CD2-CD1 4.49Å; L817-I848 HydrophobicContact CB-CD1 4.41Å; L817-I848 HydrophobicContact CB-CG1 3.62Å; L817-I848 HydrophobicContact CD2-CG1 4.35Å; L817-I848 HydrophobicContact CG-CG1 4.42Å; L817-F851 HydrophobicContact CD1-CB 4.49Å; L817-F851 HydrophobicContact CD1-CD2 3.4Å; L817-F851 HydrophobicContact CD1-CE2 3.91Å; L817-F851 HydrophobicContact CD1-CG 4.21Å; L817-M939 HydrophobicContact CD2-CE 3.41Å; L817-M939 VanDerWaalsContact CD2-CE 3.41Å; L817-M939 HydrophobicContact CD2-SD 4.27Å; L817-M939 HydrophobicContact CG-CE 4.33Å
818	K	73.6	Confident	68.9	Low	110 Å²	110	63.4 Å²	63.4	48%	0.478	27%	0.272	S	S	.	.	H	α-helix	trans	-59.6	-29.7	172.8	-77.4	-167.1	170.3	-170.3	0	112.7	V814 R815 H816 Y820 E821	V814-K818 HydrophobicContact CG1-CG 4.42Å; V814-K818 WeakPolarHBondContact O-CB 3.36Å; V814-K818 VanDerWaalsContact O-CG 3.32Å; V814-K818 WeakPolarHBondContact O-CG 3.45Å; V814-K818 PolarHBondContact O-N 3.44Å; R815-K818 WeakPolarHBondContact O-CB 3.3Å; R815-K818 PolarHBondContact O-N 3.18Å; H816-K818 VanDerWaalsContact C-N 3.33Å; H816-K818 PolarHBondContact O-N 2.84Å; K818-Y820 PolarHBondContact O-N 3.45Å; K818-E821 WeakPolarHBondContact CG-OE2 3.34Å; K818-E821 VanDerWaalsContact O-CB 3.29Å; K818-E821 WeakPolarHBondContact O-CB 3.49Å; K818-E821 PolarHBondContact O-N 2.83Å
819	Q	66.1	Low	68.1	Low	110 Å²	110	63.1 Å²	63.1	51%	0.514	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-11.9	172.5	-64.2	170.3	-31.7	0	0	112.8	R815 H816 L817 Y822	R815-Q819 PolarHBondContact O-N 2.82Å; H816-Q819 PolarHBondContact ND1-OE1 3.1Å; H816-Q819 VanDerWaalsContact O-CB 3.28Å; H816-Q819 WeakPolarHBondContact O-CB 3.36Å; H816-Q819 PolarHBondContact O-N 3.29Å; H816-Q819 VanDerWaalsContact O-N 3.1Å; L817-Q819 PolarHBondContact O-N 3.21Å; Q819-Y822 WeakPolarHBondContact O-CD1 3.45Å; Q819-Y822 WeakPolarHBondContact O-CE1 3.2Å
820	Y	65.2	Low	67.6	Low	3 Å²	3	67.1 Å²	67.1	1%	0.012	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-2.3	172.8	-55.3	-77.8	0	0	0	113.7	H816 L817 K818 Y822 L823 V931 L932 G935 M939	H816-Y820 AromaticContact CE1-CE2 3.78Å; H816-Y820 AromaticContact CE1-CZ 3.92Å; H816-Y820 PolarHBondContact CE1-OH 3.24Å; H816-Y820 AromaticContact NE2-CE2 3.75Å; H816-Y820 WeakPolarHBondContact O-CD2 3.24Å; H816-Y820 WeakPolarHBondContact O-CE2 3.5Å; L817-Y820 PolarHBondContact O-N 2.96Å; K818-Y820 PolarHBondContact O-N 3.45Å; Y820-Y822 PolarHBondContact O-N 3.29Å; Y820-L823 HydrophobicContact CD1-CD1 3.93Å; Y820-L823 WeakPolarHBondContact O-CB 3.46Å; Y820-L823 PolarHBondContact O-N 2.97Å; Y820-L823 VanDerWaalsContact O-N 3.1Å; Y820-V931 HydrophobicContact CE1-CB 4.4Å; Y820-V931 HydrophobicContact CE1-CG1 3.82Å; Y820-V931 VanDerWaalsContact CE1-O 3.22Å; Y820-V931 WeakPolarHBondContact CE1-O 3.3Å; Y820-V931 VanDerWaalsContact OH-CG1 3.31Å; Y820-V931 WeakPolarHBondContact OH-CG1 3.49Å; Y820-V931 PolarHBondContact OH-O 2.98Å; Y820-L932 HydrophobicContact CD1-CD2 4.04Å; Y820-L932 HydrophobicContact CD1-CG 4.36Å; Y820-L932 HydrophobicContact CE1-CD2 4.47Å; Y820-G935 WeakPolarHBondContact OH-CA 3.42Å; Y820-M939 HydrophobicContact CD2-CE 4.38Å
821	E	66.5	Low	67	Low	55 Å²	55	73.8 Å²	73.8	26%	0.257	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-28.8	-177.1	-155.9	158.7	-163.1	0	0	111	K818 L823 L824 L825 I848 R852	K818-E821 WeakPolarHBondContact CG-OE2 3.34Å; K818-E821 VanDerWaalsContact O-CB 3.29Å; K818-E821 WeakPolarHBondContact O-CB 3.49Å; K818-E821 PolarHBondContact O-N 2.83Å; E821-L823 VanDerWaalsContact C-N 3.26Å; E821-L823 PolarHBondContact O-N 3.18Å; E821-L824 WeakPolarHBondContact O-CA 3.44Å; E821-L824 VanDerWaalsContact O-CB 3.31Å; E821-L824 WeakPolarHBondContact O-CB 3.08Å; E821-L824 PolarHBondContact O-N 2.88Å; E821-L825 PolarHBondContact O-N 2.82Å; E821-I848 HydrophobicContact CB-CD1 4.24Å; E821-I848 HydrophobicContact CG-CD1 4.17Å; E821-R852 IonicContact OE1-CZ 3.67Å; E821-R852 IonicContact OE1-NH1 3.51Å; E821-R852 IonicContact OE1-NH2 3.16Å; E821-R852 PolarHBondContact OE1-NH2 3.41Å; E821-R852 IonicContact OE2-NH2 3.44Å; E821-R852 PolarHBondContact OE2-NH2 3.47Å
822	Y	61.5	Low	66.5	Low	54 Å²	54	72.2 Å²	72.2	21%	0.212	33%	0.327	C	S	.	.	H	α-helix	trans	-64.5	-22.5	175.3	81.1	-96.5	0	0	0	114.5	Q819 Y820 L824 L825 H927 N928	Q819-Y822 WeakPolarHBondContact O-CD1 3.45Å; Q819-Y822 WeakPolarHBondContact O-CE1 3.2Å; Y820-Y822 PolarHBondContact O-N 3.29Å; Y822-L824 PolarHBondContact O-N 3.13Å; Y822-L825 PolarHBondContact O-N 2.79Å; Y822-H927 HydrophobicContact CE1-CB 3.87Å; Y822-H927 HydrophobicContact CE2-CB 4.33Å; Y822-H927 WeakPolarHBondContact OH-CB 3.41Å; Y822-N928 WeakPolarHBondContact CE2-OD1 3.43Å; Y822-N928 WeakPolarHBondContact OH-CA 3.44Å; Y822-N928 PolarHBondContact OH-N 2.69Å; Y822-N928 PolarHBondContact OH-OD1 2.83Å
823	L	59.6	Low	66.3	Low	4 Å²	4	71.4 Å²	71.4	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-67.6	-15.9	171.5	-83.3	139.8	0	0	0	112.8	Y820 E821 W828 L841 N928 L932	Y820-L823 HydrophobicContact CD1-CD1 3.93Å; Y820-L823 WeakPolarHBondContact O-CB 3.46Å; Y820-L823 PolarHBondContact O-N 2.97Å; Y820-L823 VanDerWaalsContact O-N 3.1Å; E821-L823 VanDerWaalsContact C-N 3.26Å; E821-L823 PolarHBondContact O-N 3.18Å; L823-W828 HydrophobicContact CD2-CZ2 3.9Å; L823-W828 PolarHBondContact O-NE1 3.04Å; L823-L841 HydrophobicContact CD2-CD1 4.05Å; L823-L841 HydrophobicContact CD2-CD2 4.3Å; L823-N928 WeakPolarHBondContact CD2-OD1 3.48Å; L823-N928 WeakPolarHBondContact CG-OD1 2.92Å; L823-L932 HydrophobicContact CD1-CD1 3.87Å; L823-L932 HydrophobicContact CD1-CD2 3.87Å; L823-L932 HydrophobicContact CD1-CG 3.69Å; L823-L932 HydrophobicContact CD2-CD1 3.74Å; L823-L932 HydrophobicContact CG-CD1 4.47Å
824	L	61.4	Low	66.1	Low	59 Å²	59	78.3 Å²	78.3	31%	0.309	36%	0.362	S	S	.	.	H	α-helix	trans	-103.5	-29.1	-179	-46.1	171.9	0	0	0	111.1	E821 Y822 R826 L841 I844 P845	E821-L824 WeakPolarHBondContact O-CA 3.44Å; E821-L824 VanDerWaalsContact O-CB 3.31Å; E821-L824 WeakPolarHBondContact O-CB 3.08Å; E821-L824 PolarHBondContact O-N 2.88Å; Y822-L824 PolarHBondContact O-N 3.13Å; L824-R826 VanDerWaalsContact C-N 3.33Å; L824-R826 PolarHBondContact O-N 3.17Å; L824-L841 HydrophobicContact CD2-CB 4.1Å; L824-L841 WeakPolarHBondContact CD2-O 3.08Å; L824-I844 HydrophobicContact CD1-CB 4.48Å; L824-I844 HydrophobicContact CD1-CG2 4.35Å; L824-P845 HydrophobicContact CD1-CB 3.88Å; L824-P845 HydrophobicContact CD1-CG 3.89Å
825	L	54.6	Low	65.7	Low	143 Å²	143	77.5 Å²	77.5	75%	0.749	36%	0.357	S	S	*	.	H	α-helix	trans	-64.2	-31.4	179.8	-66.6	180	0	0	0	113.5	E821 Y822	E821-L825 PolarHBondContact O-N 2.82Å; Y822-L825 PolarHBondContact O-N 2.79Å
826	R	55.8	Low	65.5	Low	143 Å²	143	72.3 Å²	72.3	54%	0.54	34%	0.341	S	S	.	.	S	Bend	trans	-84.9	122.4	165.6	-75.7	-169.5	176.2	-168.9	-0.8	109.5	L824 W828	L824-R826 VanDerWaalsContact C-N 3.33Å; L824-R826 PolarHBondContact O-N 3.17Å; R826-W828 PolarHBondContact O-N 3.2Å
827	R	55.2	Low	65.6	Low	243 Å²	243	79.7 Å²	79.7	92%	0.917	37%	0.373	S	S	*	.			trans	-53.7	115	160.5	-81.2	-176.6	171.2	168.6	-1.4	108.1
828	W	62.8	Low	65.2	Low	49 Å²	49	81.5 Å²	81.5	19%	0.186	38%	0.383	C	S	.	.			trans	-62.1	134.4	170	-75.6	60.4	0	0	0	108	L823 R826 V830 H832 L835 L839 L841 I919 L923	L823-W828 HydrophobicContact CD2-CZ2 3.9Å; L823-W828 PolarHBondContact O-NE1 3.04Å; R826-W828 PolarHBondContact O-N 3.2Å; W828-V830 PolarHBondContact O-N 3.48Å; W828-H832 HydrophobicContact CE3-CB 4.06Å; W828-L835 HydrophobicContact CZ3-CB 4.05Å; W828-L835 HydrophobicContact CZ3-CD2 4.16Å; W828-L835 HydrophobicContact CZ3-CG 4.21Å; W828-L839 HydrophobicContact CH2-CD1 3.87Å; W828-L841 HydrophobicContact CH2-CD1 3.87Å; W828-L841 HydrophobicContact CZ2-CD1 3.2Å; W828-I919 HydrophobicContact CE3-CD1 4.48Å; W828-I919 HydrophobicContact CZ3-CD1 3.96Å; W828-L923 HydrophobicContact CH2-CD2 4.27Å
829	P	65.4	Low	64.8	Low	44 Å²	44	77.2 Å²	77.2	29%	0.286	37%	0.365	S	S	.	.			trans	-49.2	142.7	170.6	-28.7	36	0	0	0	110.4	E831 H832 A833 L922	P829-E831 HydrophobicContact CB-CB 4.48Å; P829-E831 PolarHBondContact O-N 2.73Å; P829-H832 HydrophobicContact CB-CB 4.29Å; P829-H832 CarbonylContact O-C 3.56Å; P829-H832 WeakPolarHBondContact O-CA 3.21Å; P829-H832 WeakPolarHBondContact O-CB 3.34Å; P829-H832 PolarHBondContact O-N 2.89Å; P829-A833 PolarHBondContact O-N 2.69Å; P829-L922 HydrophobicContact CG-CD1 3.97Å
830	V	68	Low	64.9	Low	137 Å²	137	73.1 Å²	73.1	83%	0.83	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-58.3	-37.3	-176.6	-176.9	0	0	0	0	110.3	W828 H832 A833	W828-V830 PolarHBondContact O-N 3.48Å; V830-H832 PolarHBondContact O-N 3.44Å; V830-A833 VanDerWaalsContact O-CB 3.3Å; V830-A833 WeakPolarHBondContact O-CB 3.26Å; V830-A833 PolarHBondContact O-N 2.96Å; V830-A833 VanDerWaalsContact O-N 3.13Å
831	E	68.2	Low	65.1	Low	139 Å²	139	73 Å²	73	65%	0.65	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-50.7	-33.2	170.4	-59.4	162.6	-84	0	0	113.2	P829 Y912	P829-E831 HydrophobicContact CB-CB 4.48Å; P829-E831 PolarHBondContact O-N 2.73Å; E831-Y912 PolarHBondContact O-OH 2.84Å
832	H	71.8	Confident	65.4	Low	4 Å²	4	74.2 Å²	74.2	2%	0.019	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-102.8	0.6	-176	-59.5	-21.6	0	0	0	114.5	W828 P829 V830 K834 L835 S836 Y912 D918 I919	W828-H832 HydrophobicContact CE3-CB 4.06Å; P829-H832 HydrophobicContact CB-CB 4.29Å; P829-H832 CarbonylContact O-C 3.56Å; P829-H832 WeakPolarHBondContact O-CA 3.21Å; P829-H832 WeakPolarHBondContact O-CB 3.34Å; P829-H832 PolarHBondContact O-N 2.89Å; V830-H832 PolarHBondContact O-N 3.44Å; H832-K834 PolarHBondContact O-N 3.33Å; H832-L835 PolarHBondContact O-N 3.24Å; H832-S836 PolarHBondContact O-N 2.79Å; H832-S836 VanDerWaalsContact O-N 3.14Å; H832-Y912 WeakPolarHBondContact CA-OH 3.46Å; H832-Y912 AromaticContact ND1-CE1 3.87Å; H832-Y912 AromaticContact ND1-CZ 3.89Å; H832-Y912 PolarHBondContact ND1-OH 3.08Å; H832-D918 IonicContact CE1-OD1 3.4Å; H832-D918 IonicContact CE1-OD2 3.17Å; H832-D918 PolarHBondContact CE1-OD2 3Å; H832-D918 IonicContact NE2-OD2 2.72Å; H832-I919 HydrophobicContact CB-CD1 3.77Å; H832-I919 VanDerWaalsContact CD2-CG1 3.48Å; H832-I919 WeakPolarHBondContact CD2-CG1 3.36Å; H832-I919 VanDerWaalsContact CG-CD1 3.48Å; H832-I919 WeakPolarHBondContact NE2-CB 3.27Å
833	A	72.4	Confident	66	Low	42 Å²	42	73.2 Å²	73.2	35%	0.347	35%	0.354	S	S	.	.	H	α-helix	trans	-54.7	-29.5	174	0	0	0	0	0	112	P829 V830 S836 K837	P829-A833 PolarHBondContact O-N 2.69Å; V830-A833 VanDerWaalsContact O-CB 3.3Å; V830-A833 WeakPolarHBondContact O-CB 3.26Å; V830-A833 PolarHBondContact O-N 2.96Å; V830-A833 VanDerWaalsContact O-N 3.13Å; A833-S836 PolarHBondContact O-N 3.48Å; A833-K837 WeakPolarHBondContact O-CG 3.47Å; A833-K837 PolarHBondContact O-N 2.95Å
834	K	68.1	Low	66.7	Low	149 Å²	149	73 Å²	73	65%	0.648	35%	0.353	S	S	*	.	H	α-helix	trans	-63.6	-37.5	172.4	-168.2	168.8	-173	168	0	113.1	H832 I838 Y912	H832-K834 PolarHBondContact O-N 3.33Å; K834-I838 HydrophobicContact CG-CD1 4.36Å; K834-I838 WeakPolarHBondContact O-CB 3.44Å; K834-I838 WeakPolarHBondContact O-CD1 3.34Å; K834-I838 VanDerWaalsContact O-CG1 3.24Å; K834-I838 WeakPolarHBondContact O-CG1 3.11Å; K834-I838 PolarHBondContact O-N 2.81Å; K834-Y912 HydrophobicContact CB-CE2 4.37Å
835	L	70	Confident	67.6	Low	0 Å²	0	72.4 Å²	72.4	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-75.6	-36.9	175	-168	67.2	0	0	0	111.9	W828 H832 K837 I838 L839 V909 Y912 I919 L923	W828-L835 HydrophobicContact CZ3-CB 4.05Å; W828-L835 HydrophobicContact CZ3-CD2 4.16Å; W828-L835 HydrophobicContact CZ3-CG 4.21Å; H832-L835 PolarHBondContact O-N 3.24Å; L835-K837 PolarHBondContact O-N 3.21Å; L835-I838 HydrophobicContact CD1-CB 4.09Å; L835-I838 HydrophobicContact CD1-CD1 4.37Å; L835-I838 HydrophobicContact CD1-CG2 3.84Å; L835-I838 CarbonylContact O-C 3.56Å; L835-I838 WeakPolarHBondContact O-CA 3.49Å; L835-I838 WeakPolarHBondContact O-CB 3.36Å; L835-I838 PolarHBondContact O-N 2.95Å; L835-I838 VanDerWaalsContact O-N 3.08Å; L835-L839 HydrophobicContact CD2-CD1 4.26Å; L835-L839 HydrophobicContact CG-CD1 4.05Å; L835-L839 HydrophobicContact CG-CG 4.31Å; L835-L839 WeakPolarHBondContact O-CG 3.49Å; L835-L839 PolarHBondContact O-N 2.85Å; L835-V909 HydrophobicContact CD1-CG2 4.16Å; L835-Y912 HydrophobicContact CB-CD1 3.97Å; L835-Y912 HydrophobicContact CB-CD2 4.49Å; L835-Y912 HydrophobicContact CB-CE1 3.97Å; L835-Y912 HydrophobicContact CB-CE2 4.49Å; L835-Y912 HydrophobicContact CB-CG 4.26Å; L835-Y912 HydrophobicContact CD1-CD1 4.22Å; L835-Y912 HydrophobicContact CD1-CG 4.03Å; L835-Y912 HydrophobicContact CD2-CD1 3.95Å; L835-Y912 HydrophobicContact CD2-CE1 4.46Å; L835-Y912 HydrophobicContact CG-CD1 4.26Å; L835-I919 HydrophobicContact CB-CD1 3.99Å; L835-I919 HydrophobicContact CD2-CD1 3.47Å; L835-I919 VanDerWaalsContact CD2-CD1 3.47Å; L835-I919 HydrophobicContact CD2-CG1 4.49Å; L835-I919 HydrophobicContact CG-CD1 4.32Å; L835-L923 HydrophobicContact CD2-CD1 3.82Å; L835-L923 HydrophobicContact CD2-CD2 4.05Å; L835-L923 HydrophobicContact CD2-CG 4.34Å
836	S	69.2	Low	68.8	Low	24 Å²	24	68.7 Å²	68.7	17%	0.168	33%	0.332	C	S	.	.	H	α-helix	trans	-59	-46.5	174	-178.3	0	0	0	0	111.8	H832 A833 I838 L839 C840 L841	H832-S836 PolarHBondContact O-N 2.79Å; H832-S836 VanDerWaalsContact O-N 3.14Å; A833-S836 PolarHBondContact O-N 3.48Å; S836-I838 VanDerWaalsContact C-N 3.33Å; S836-I838 PolarHBondContact O-N 3.45Å; S836-L839 CarbonylContact O-C 3.49Å; S836-L839 PolarHBondContact O-N 3.02Å; S836-C840 PolarHBondContact O-N 3.48Å; S836-L841 PolarHBondContact O-N 3.46Å
837	K	70.4	Confident	69.9	Low	160 Å²	160	62 Å²	62	70%	0.696	31%	0.307	S	S	*	.	H	α-helix	trans	-61.5	-36.2	171.1	-72.1	-177.6	177.4	-174.3	0	113	A833 L835 L839 C840	A833-K837 WeakPolarHBondContact O-CG 3.47Å; A833-K837 PolarHBondContact O-N 2.95Å; L835-K837 PolarHBondContact O-N 3.21Å; K837-L839 VanDerWaalsContact C-N 3.33Å; K837-C840 PolarHBondContact O-N 3.37Å
838	I	64.1	Low	71.1	Confident	40 Å²	40	50.4 Å²	50.4	21%	0.205	26%	0.263	C	S	.	.	H	α-helix	trans	-65.7	-35	171.7	-77.3	165.3	0	0	0	111.3	K834 L835 S836 C840 R1031	K834-I838 HydrophobicContact CG-CD1 4.36Å; K834-I838 WeakPolarHBondContact O-CB 3.44Å; K834-I838 WeakPolarHBondContact O-CD1 3.34Å; K834-I838 VanDerWaalsContact O-CG1 3.24Å; K834-I838 WeakPolarHBondContact O-CG1 3.11Å; K834-I838 PolarHBondContact O-N 2.81Å; L835-I838 HydrophobicContact CD1-CB 4.09Å; L835-I838 HydrophobicContact CD1-CD1 4.37Å; L835-I838 HydrophobicContact CD1-CG2 3.84Å; L835-I838 CarbonylContact O-C 3.56Å; L835-I838 WeakPolarHBondContact O-CA 3.49Å; L835-I838 WeakPolarHBondContact O-CB 3.36Å; L835-I838 PolarHBondContact O-N 2.95Å; L835-I838 VanDerWaalsContact O-N 3.08Å; S836-I838 VanDerWaalsContact C-N 3.33Å; S836-I838 PolarHBondContact O-N 3.45Å; I838-C840 VanDerWaalsContact C-N 3.35Å; I838-R1031 PolarHBondContact O-NH1 2.9Å; I838-R1031 PolarHBondContact O-NH2 3.43Å
839	L	64.1	Low	72.2	Confident	19 Å²	19	51.3 Å²	51.3	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-86.8	-3.8	-179	-70.2	172.6	0	0	0	113.7	W828 L835 S836 K837 L841 V905 V909 L923 L932	W828-L839 HydrophobicContact CH2-CD1 3.87Å; L835-L839 HydrophobicContact CD2-CD1 4.26Å; L835-L839 HydrophobicContact CG-CD1 4.05Å; L835-L839 HydrophobicContact CG-CG 4.31Å; L835-L839 WeakPolarHBondContact O-CG 3.49Å; L835-L839 PolarHBondContact O-N 2.85Å; S836-L839 CarbonylContact O-C 3.49Å; S836-L839 PolarHBondContact O-N 3.02Å; K837-L839 VanDerWaalsContact C-N 3.33Å; L839-L841 HydrophobicContact CB-CD1 4.13Å; L839-L841 HydrophobicContact CB-CD2 3.88Å; L839-L841 HydrophobicContact CB-CG 3.69Å; L839-L841 HydrophobicContact CD1-CD1 4.38Å; L839-L841 PolarHBondContact O-N 3.15Å; L839-V905 HydrophobicContact CD2-CG1 4.49Å; L839-V909 HydrophobicContact CD2-CG2 4.05Å; L839-L923 HydrophobicContact CD1-CD2 4.36Å; L839-L932 HydrophobicContact CD1-CD1 4.28Å
840	C	67.5	Low	73.1	Confident	25 Å²	25	50.2 Å²	50.2	17%	0.169	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	33.9	-178.9	-59	0	0	0	0	112.9	S836 K837 I838 D842 Q843 L896	S836-C840 PolarHBondContact O-N 3.48Å; K837-C840 PolarHBondContact O-N 3.37Å; I838-C840 VanDerWaalsContact C-N 3.35Å; C840-D842 WeakPolarHBondContact CA-OD1 3.39Å; C840-D842 PolarHBondContact O-N 3.4Å; C840-Q843 HydrophobicContact CB-CG 3.87Å; C840-Q843 WeakPolarHBondContact O-CB 3.45Å; C840-Q843 VanDerWaalsContact O-CG 3.3Å; C840-Q843 WeakPolarHBondContact O-CG 3.3Å; C840-Q843 PolarHBondContact O-N 3.23Å; C840-Q843 VanDerWaalsContact O-N 3.11Å; C840-L896 HydrophobicContact CB-CD2 4.17Å; C840-L896 WeakPolarHBondContact O-CD2 3.33Å
841	L	69.8	Low	73.8	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-67.7	-27.5	-176.5	-57.1	176.9	0	0	0	112.2	L823 L824 W828 S836 L839 Q843 I844 P845 L932	L823-L841 HydrophobicContact CD2-CD1 4.05Å; L823-L841 HydrophobicContact CD2-CD2 4.3Å; L824-L841 HydrophobicContact CD2-CB 4.1Å; L824-L841 WeakPolarHBondContact CD2-O 3.08Å; W828-L841 HydrophobicContact CH2-CD1 3.87Å; W828-L841 HydrophobicContact CZ2-CD1 3.2Å; S836-L841 PolarHBondContact O-N 3.46Å; L839-L841 HydrophobicContact CB-CD1 4.13Å; L839-L841 HydrophobicContact CB-CD2 3.88Å; L839-L841 HydrophobicContact CB-CG 3.69Å; L839-L841 HydrophobicContact CD1-CD1 4.38Å; L839-L841 PolarHBondContact O-N 3.15Å; L841-Q843 PolarHBondContact O-N 3.17Å; L841-I844 HydrophobicContact CD2-CD1 3.72Å; L841-I844 WeakPolarHBondContact O-CB 3.32Å; L841-I844 PolarHBondContact O-N 3.28Å; L841-I844 VanDerWaalsContact O-N 3.07Å; L841-P845 VanDerWaalsContact O-CD 3.24Å; L841-P845 WeakPolarHBondContact O-CD 3.28Å; L841-L932 HydrophobicContact CD2-CD1 4.15Å; L841-L932 HydrophobicContact CD2-CD2 3.85Å
842	D	72.9	Confident	74.6	Confident	80 Å²	80	41.1 Å²	41.1	43%	0.428	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-57.1	-22.3	171.1	57.9	-19.3	0	0	0	113.8	C840 P845	C840-D842 WeakPolarHBondContact CA-OD1 3.39Å; C840-D842 PolarHBondContact O-N 3.4Å; D842-P845 WeakPolarHBondContact O-CD 3.03Å
843	Q	75.1	Confident	75.4	Confident	33 Å²	33	43.6 Å²	43.6	15%	0.154	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-83.1	-22	177.3	-42.1	-54.9	-47.4	0	0	113.1	C840 L841 I846 L847 H892 A895 L896	C840-Q843 HydrophobicContact CB-CG 3.87Å; C840-Q843 WeakPolarHBondContact O-CB 3.45Å; C840-Q843 VanDerWaalsContact O-CG 3.3Å; C840-Q843 WeakPolarHBondContact O-CG 3.3Å; C840-Q843 PolarHBondContact O-N 3.23Å; C840-Q843 VanDerWaalsContact O-N 3.11Å; L841-Q843 PolarHBondContact O-N 3.17Å; Q843-I846 PolarHBondContact O-N 3.2Å; Q843-L847 PolarHBondContact O-N 3.22Å; Q843-L847 VanDerWaalsContact O-N 3.11Å; Q843-H892 HydrophobicContact CB-CB 4.37Å; Q843-H892 PolarHBondContact OE1-CE1 2.96Å; Q843-H892 PolarHBondContact OE1-ND1 2.8Å; Q843-A895 HydrophobicContact CG-CB 4.3Å; Q843-L896 HydrophobicContact CB-CD1 3.76Å; Q843-L896 HydrophobicContact CB-CD2 4.27Å; Q843-L896 HydrophobicContact CB-CG 3.89Å; Q843-L896 HydrophobicContact CG-CG 4.48Å
844	I	73.9	Confident	76.1	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-50	-176.8	-60.7	178.4	0	0	0	113	L817 L824 L841 I846 L847 I848 L896 L932	L817-I844 HydrophobicContact CD2-CG2 4.19Å; L824-I844 HydrophobicContact CD1-CB 4.48Å; L824-I844 HydrophobicContact CD1-CG2 4.35Å; L841-I844 HydrophobicContact CD2-CD1 3.72Å; L841-I844 WeakPolarHBondContact O-CB 3.32Å; L841-I844 PolarHBondContact O-N 3.28Å; L841-I844 VanDerWaalsContact O-N 3.07Å; I844-I846 PolarHBondContact O-N 3.43Å; I844-L847 PolarHBondContact O-N 2.62Å; I844-I848 HydrophobicContact CG2-CD1 3.93Å; I844-I848 HydrophobicContact CG2-CG1 4.43Å; I844-I848 WeakPolarHBondContact O-CG1 3.22Å; I844-I848 PolarHBondContact O-N 3.18Å; I844-L896 HydrophobicContact CG1-CD2 4.13Å; I844-L932 HydrophobicContact CD1-CD2 4.41Å
845	P	79.6	Confident	77.1	Confident	45 Å²	45	35.4 Å²	35.4	29%	0.292	18%	0.184	S	C	.	.	H	α-helix	trans	-67.4	-27.7	-179.5	27	-32.3	0	0	0	112.2	L824 L841 D842 I848 N849	L824-P845 HydrophobicContact CD1-CB 3.88Å; L824-P845 HydrophobicContact CD1-CG 3.89Å; L841-P845 VanDerWaalsContact O-CD 3.24Å; L841-P845 WeakPolarHBondContact O-CD 3.28Å; D842-P845 WeakPolarHBondContact O-CD 3.03Å; P845-I848 WeakPolarHBondContact O-CB 3.15Å; P845-I848 PolarHBondContact O-N 3.46Å; P845-N849 PolarHBondContact O-N 3.08Å
846	I	81.2	Confident	78	Confident	66 Å²	66	39 Å²	39	34%	0.338	21%	0.206	S	C	.	.	H	α-helix	trans	-67.7	-46.6	175.3	-51	174.8	0	0	0	110.1	Q843 I844 N849 L850	Q843-I846 PolarHBondContact O-N 3.2Å; I844-I846 PolarHBondContact O-N 3.43Å; I846-N849 PolarHBondContact O-N 2.77Å; I846-L850 HydrophobicContact CG2-CD1 4.22Å; I846-L850 WeakPolarHBondContact O-CG 3.16Å; I846-L850 PolarHBondContact O-N 3.49Å
847	L	77.9	Confident	78.9	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-41.7	172.6	-74.5	-167.7	0	0	0	112.4	L817 Q843 I844 N849 L850 F851 H892 C893 L896 M939	L817-L847 HydrophobicContact CD1-CB 3.99Å; L817-L847 HydrophobicContact CD2-CB 4.12Å; L817-L847 HydrophobicContact CD2-CD1 4.49Å; Q843-L847 PolarHBondContact O-N 3.22Å; Q843-L847 VanDerWaalsContact O-N 3.11Å; I844-L847 PolarHBondContact O-N 2.62Å; L847-N849 VanDerWaalsContact C-N 3.29Å; L847-N849 PolarHBondContact O-N 2.9Å; L847-L850 HydrophobicContact CD2-CD1 4.28Å; L847-L850 PolarHBondContact O-N 2.94Å; L847-F851 HydrophobicContact CB-CD2 4.47Å; L847-F851 WeakPolarHBondContact O-CD2 3.17Å; L847-F851 PolarHBondContact O-N 3.44Å; L847-H892 HydrophobicContact CD2-CB 3.73Å; L847-H892 HydrophobicContact CG-CB 4.03Å; L847-C893 VanDerWaalsContact CD1-SG 3.54Å; L847-L896 HydrophobicContact CD1-CD1 3.37Å; L847-L896 HydrophobicContact CG-CD1 4.09Å; L847-M939 HydrophobicContact CD1-SD 4.27Å
848	I	81.5	Confident	79.8	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-52.7	-49	174.3	-77.6	171.9	0	0	0	110.4	L817 E821 I844 P845 R852	L817-I848 HydrophobicContact CB-CD1 4.41Å; L817-I848 HydrophobicContact CB-CG1 3.62Å; L817-I848 HydrophobicContact CD2-CG1 4.35Å; L817-I848 HydrophobicContact CG-CG1 4.42Å; E821-I848 HydrophobicContact CB-CD1 4.24Å; E821-I848 HydrophobicContact CG-CD1 4.17Å; I844-I848 HydrophobicContact CG2-CD1 3.93Å; I844-I848 HydrophobicContact CG2-CG1 4.43Å; I844-I848 WeakPolarHBondContact O-CG1 3.22Å; I844-I848 PolarHBondContact O-N 3.18Å; P845-I848 WeakPolarHBondContact O-CB 3.15Å; P845-I848 PolarHBondContact O-N 3.46Å; I848-R852 HydrophobicContact CG2-CG 4.36Å; I848-R852 VanDerWaalsContact CG2-NH2 3.29Å; I848-R852 VanDerWaalsContact O-CB 3.3Å; I848-R852 WeakPolarHBondContact O-CB 3.33Å; I848-R852 WeakPolarHBondContact O-CG 3.09Å; I848-R852 PolarHBondContact O-N 3.45Å
849	N	84.7	Confident	81	Confident	67 Å²	67	32 Å²	32	36%	0.358	18%	0.176	S	C	.	.	H	α-helix	trans	-70.6	-35.9	-178.3	-72	-14.9	0	0	0	112.8	P845 I846 L847 S853	P845-N849 PolarHBondContact O-N 3.08Å; I846-N849 PolarHBondContact O-N 2.77Å; L847-N849 VanDerWaalsContact C-N 3.29Å; L847-N849 PolarHBondContact O-N 2.9Å; N849-S853 VanDerWaalsContact O-CB 3.31Å; N849-S853 WeakPolarHBondContact O-CB 3.28Å; N849-S853 PolarHBondContact O-N 2.92Å
850	L	83.7	Confident	82.1	Confident	22 Å²	22	38.4 Å²	38.4	12%	0.115	21%	0.206	C	C	.	.	H	α-helix	trans	-63.4	-48.5	172.7	-73.5	165.3	0	0	0	111.9	I846 L847 S853 L854 W877 T888 W889	I846-L850 HydrophobicContact CG2-CD1 4.22Å; I846-L850 WeakPolarHBondContact O-CG 3.16Å; I846-L850 PolarHBondContact O-N 3.49Å; L847-L850 HydrophobicContact CD2-CD1 4.28Å; L847-L850 PolarHBondContact O-N 2.94Å; L850-S853 WeakPolarHBondContact O-CB 3.36Å; L850-S853 PolarHBondContact O-N 3.15Å; L850-L854 PolarHBondContact O-N 2.76Å; L850-W877 HydrophobicContact CD2-CH2 4.38Å; L850-W877 HydrophobicContact CD2-CZ2 4.23Å; L850-W877 VanDerWaalsContact O-CZ2 3.3Å; L850-W877 WeakPolarHBondContact O-CZ2 3.31Å; L850-T888 HydrophobicContact CD1-CG2 4.26Å; L850-W889 HydrophobicContact CD1-CB 4.3Å
851	F	82.9	Confident	83.1	Confident	9 Å²	9	37.9 Å²	37.9	4%	0.039	20%	0.202	C	C	.	.	H	α-helix	trans	-68.5	-36.1	177.3	-81.2	-74.6	0	0	0	112.5	M813 V814 L817 L847 L854 V855 W889 L946	M813-F851 HydrophobicContact CB-CD1 3.91Å; M813-F851 HydrophobicContact CB-CE1 3.89Å; M813-F851 HydrophobicContact CB-CG 4.27Å; M813-F851 HydrophobicContact CB-CZ 4.23Å; M813-F851 HydrophobicContact CG-CE1 4.15Å; M813-F851 HydrophobicContact CG-CZ 4.31Å; M813-F851 HydrophobicContact SD-CZ 4.32Å; V814-F851 HydrophobicContact CG2-CB 3.69Å; L817-F851 HydrophobicContact CD1-CB 4.49Å; L817-F851 HydrophobicContact CD1-CD2 3.4Å; L817-F851 HydrophobicContact CD1-CE2 3.91Å; L817-F851 HydrophobicContact CD1-CG 4.21Å; L847-F851 HydrophobicContact CB-CD2 4.47Å; L847-F851 WeakPolarHBondContact O-CD2 3.17Å; L847-F851 PolarHBondContact O-N 3.44Å; F851-L854 PolarHBondContact O-N 3.49Å; F851-V855 WeakPolarHBondContact O-CB 3.45Å; F851-V855 WeakPolarHBondContact O-CG2 3.18Å; F851-V855 PolarHBondContact O-N 2.85Å; F851-W889 HydrophobicContact CZ-CZ2 4.15Å; F851-W889 AromaticContact CZ-NE1 3.81Å; F851-L946 HydrophobicContact CE1-CD1 4.37Å
852	R	86.6	Confident	83.8	Confident	75 Å²	75	41 Å²	41	28%	0.283	22%	0.215	S	C	.	.	H	α-helix	trans	-59.5	-45.9	170.3	-75.8	172.8	-173.2	170.3	5.9	110.7	V814 E821 I848 L854 V855 T856	V814-R852 HydrophobicContact CG1-CG 3.94Å; V814-R852 HydrophobicContact CG2-CG 4.39Å; E821-R852 IonicContact OE1-CZ 3.67Å; E821-R852 IonicContact OE1-NH1 3.51Å; E821-R852 IonicContact OE1-NH2 3.16Å; E821-R852 PolarHBondContact OE1-NH2 3.41Å; E821-R852 IonicContact OE2-NH2 3.44Å; E821-R852 PolarHBondContact OE2-NH2 3.47Å; I848-R852 HydrophobicContact CG2-CG 4.36Å; I848-R852 VanDerWaalsContact CG2-NH2 3.29Å; I848-R852 VanDerWaalsContact O-CB 3.3Å; I848-R852 WeakPolarHBondContact O-CB 3.33Å; I848-R852 WeakPolarHBondContact O-CG 3.09Å; I848-R852 PolarHBondContact O-N 3.45Å; R852-L854 PolarHBondContact O-N 3.14Å; R852-V855 PolarHBondContact O-N 3.09Å; R852-T856 PolarHBondContact O-N 3.41Å; R852-T856 PolarHBondContact O-OG1 3.04Å; R852-T856 VanDerWaalsContact O-OG1 3.09Å
853	S	88.4	Confident	84.2	Confident	56 Å²	56	39.8 Å²	39.8	39%	0.392	21%	0.211	S	C	.	.	H	α-helix	trans	-60.5	-44.2	177	178.4	0	0	0	0	112.7	N849 L850 T856 C857 W877	N849-S853 VanDerWaalsContact O-CB 3.31Å; N849-S853 WeakPolarHBondContact O-CB 3.28Å; N849-S853 PolarHBondContact O-N 2.92Å; L850-S853 WeakPolarHBondContact O-CB 3.36Å; L850-S853 PolarHBondContact O-N 3.15Å; S853-T856 PolarHBondContact O-N 3.12Å; S853-C857 WeakPolarHBondContact O-CB 3.32Å; S853-C857 PolarHBondContact O-N 2.77Å; S853-W877 PolarHBondContact OG-NE1 3.32Å
854	L	87.6	Confident	84	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-64	-42.2	175.2	178.9	59.1	0	0	0	112.1	T810 L850 F851 R852 C857 I858 V874 W877	T810-L854 HydrophobicContact CG2-CD2 3.8Å; T810-L854 HydrophobicContact CG2-CG 4.42Å; L850-L854 PolarHBondContact O-N 2.76Å; F851-L854 PolarHBondContact O-N 3.49Å; R852-L854 PolarHBondContact O-N 3.14Å; L854-C857 WeakPolarHBondContact O-CB 3.41Å; L854-C857 PolarHBondContact O-N 3.4Å; L854-I858 HydrophobicContact CD1-CD1 4.27Å; L854-I858 HydrophobicContact CG-CD1 4.14Å; L854-I858 WeakPolarHBondContact O-CG1 3.34Å; L854-I858 PolarHBondContact O-N 3.32Å; L854-V874 HydrophobicContact CD1-CG1 4.41Å; L854-V874 HydrophobicContact CD1-CG2 4.18Å; L854-W877 HydrophobicContact CB-CD2 4.29Å; L854-W877 HydrophobicContact CB-CE3 4.46Å; L854-W877 HydrophobicContact CB-CH2 4.16Å; L854-W877 HydrophobicContact CB-CZ2 3.97Å; L854-W877 HydrophobicContact CB-CZ3 4.39Å; L854-W877 HydrophobicContact CD1-CD2 3.99Å; L854-W877 HydrophobicContact CD1-CE3 3.9Å; L854-W877 HydrophobicContact CD1-CG 4.32Å; L854-W877 HydrophobicContact CD1-CZ3 4.41Å; L854-W877 HydrophobicContact CD2-CZ3 4.35Å
855	V	88.3	Confident	83.7	Confident	16 Å²	16	50.2 Å²	50.2	10%	0.097	26%	0.26	C	S	.	.	H	α-helix	trans	-63.9	-44.4	175.8	167.4	0	0	0	0	111.1	Q811 V814 F851 R852 C857 I858 D859	Q811-V855 HydrophobicContact CG-CG1 4.13Å; Q811-V855 HydrophobicContact CG-CG2 4.26Å; V814-V855 HydrophobicContact CG2-CG2 3.88Å; F851-V855 WeakPolarHBondContact O-CB 3.45Å; F851-V855 WeakPolarHBondContact O-CG2 3.18Å; F851-V855 PolarHBondContact O-N 2.85Å; R852-V855 PolarHBondContact O-N 3.09Å; V855-C857 VanDerWaalsContact C-N 3.29Å; V855-C857 PolarHBondContact O-N 3.34Å; V855-I858 PolarHBondContact O-N 3.06Å; V855-I858 VanDerWaalsContact O-N 3.1Å; V855-D859 WeakPolarHBondContact CG1-OD2 3.49Å; V855-D859 PolarHBondContact O-N 3.06Å
856	T	88.2	Confident	83.7	Confident	75 Å²	75	48.1 Å²	48.1	46%	0.46	25%	0.246	S	C	.	.	H	α-helix	trans	-60	-38.8	174.1	-58.4	0	0	0	0	112.3	R852 S853 I858 D859 Q860	R852-T856 PolarHBondContact O-N 3.41Å; R852-T856 PolarHBondContact O-OG1 3.04Å; R852-T856 VanDerWaalsContact O-OG1 3.09Å; S853-T856 PolarHBondContact O-N 3.12Å; T856-I858 VanDerWaalsContact C-N 3.34Å; T856-I858 PolarHBondContact O-N 3.46Å; T856-D859 PolarHBondContact O-N 3.06Å; T856-Q860 VanDerWaalsContact O-CG 3.27Å; T856-Q860 WeakPolarHBondContact O-CG 3.44Å; T856-Q860 PolarHBondContact O-N 3.23Å; T856-Q860 VanDerWaalsContact O-N 3.07Å
857	C	89.3	Confident	83.8	Confident	19 Å²	19	45.2 Å²	45.2	13%	0.128	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-37.1	174.7	-174.3	0	0	0	0	112.3	S853 L854 V855	S853-C857 WeakPolarHBondContact O-CB 3.32Å; S853-C857 PolarHBondContact O-N 2.77Å; L854-C857 WeakPolarHBondContact O-CB 3.41Å; L854-C857 PolarHBondContact O-N 3.4Å; V855-C857 VanDerWaalsContact C-N 3.29Å; V855-C857 PolarHBondContact O-N 3.34Å
858	I	89.1	Confident	84	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-73.1	-45	174.8	-64.6	161	0	0	0	111.4	F806 H807 T810 L854 V855 T856 Q860 T861 Y867 M870 V874	F806-I858 HydrophobicContact CD1-CD1 3.98Å; F806-I858 HydrophobicContact CE1-CD1 3.97Å; H807-I858 HydrophobicContact CB-CG2 3.98Å; T810-I858 HydrophobicContact CG2-CD1 4.47Å; L854-I858 HydrophobicContact CD1-CD1 4.27Å; L854-I858 HydrophobicContact CG-CD1 4.14Å; L854-I858 WeakPolarHBondContact O-CG1 3.34Å; L854-I858 PolarHBondContact O-N 3.32Å; V855-I858 PolarHBondContact O-N 3.06Å; V855-I858 VanDerWaalsContact O-N 3.1Å; T856-I858 VanDerWaalsContact C-N 3.34Å; T856-I858 PolarHBondContact O-N 3.46Å; I858-Q860 PolarHBondContact O-N 3.31Å; I858-T861 PolarHBondContact O-N 2.78Å; I858-T861 PolarHBondContact O-OG1 2.91Å; I858-Y867 HydrophobicContact CG2-CD1 4.26Å; I858-Y867 HydrophobicContact CG2-CE1 3.92Å; I858-M870 HydrophobicContact CD1-CE 4.18Å; I858-M870 HydrophobicContact CG1-CE 4.15Å; I858-M870 HydrophobicContact CG2-CE 3.76Å; I858-M870 HydrophobicContact CG2-CG 4.24Å; I858-M870 HydrophobicContact CG2-SD 4Å; I858-V874 HydrophobicContact CD1-CG2 4.27Å; I858-V874 HydrophobicContact CG1-CG2 3.77Å
859	D	88.3	Confident	84.1	Confident	58 Å²	58	54.7 Å²	54.7	31%	0.31	27%	0.272	S	S	.	.	H	α-helix	trans	-59	-34.6	178.5	-85	-45.1	0	0	0	112	H807 V855 T856 T861 K862	H807-D859 IonicContact CE1-OD1 2.74Å; H807-D859 PolarHBondContact CE1-OD1 3.45Å; H807-D859 VanDerWaalsContact CE1-OD1 3.27Å; H807-D859 IonicContact NE2-OD1 3.22Å; V855-D859 WeakPolarHBondContact CG1-OD2 3.49Å; V855-D859 PolarHBondContact O-N 3.06Å; T856-D859 PolarHBondContact O-N 3.06Å; D859-T861 PolarHBondContact O-N 3.44Å; D859-K862 WeakPolarHBondContact O-CB 3.24Å; D859-K862 PolarHBondContact O-N 2.93Å; D859-K862 WeakPolarHBondContact OD1-CD 3.46Å; D859-K862 WeakPolarHBondContact OD1-CE 3.4Å; D859-K862 IonicContact OD1-NZ 3.56Å; D859-K862 PolarHBondContact OD1-NZ 2.87Å
860	Q	87.8	Confident	84.4	Confident	153 Å²	153	51.5 Å²	51.5	72%	0.715	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-16.3	172.4	-75.9	170.3	-2.7	0	0	114.4	T856 I858	T856-Q860 VanDerWaalsContact O-CG 3.27Å; T856-Q860 WeakPolarHBondContact O-CG 3.44Å; T856-Q860 PolarHBondContact O-N 3.23Å; T856-Q860 VanDerWaalsContact O-N 3.07Å; I858-Q860 PolarHBondContact O-N 3.31Å
861	T	88.3	Confident	84.7	Confident	15 Å²	15	50.5 Å²	50.5	9%	0.092	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	3.6	177.4	68.9	0	0	0	0	113.9	I858 D859 R868 M870 A873	I858-T861 PolarHBondContact O-N 2.78Å; I858-T861 PolarHBondContact O-OG1 2.91Å; D859-T861 PolarHBondContact O-N 3.44Å; T861-R868 PolarHBondContact O-N 3.44Å; T861-M870 WeakPolarHBondContact OG1-CB 3.41Å; T861-A873 HydrophobicContact CG2-CB 3.59Å
862	K	84	Confident	85	Confident	67 Å²	67	56 Å²	56	29%	0.291	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	130.8	172.8	-73.9	177.1	166.2	170.6	0	110.9	F782 D859 Y867	F782-K862 HydrophobicContact CE1-CB 4.2Å; F782-K862 HydrophobicContact CE1-CG 4.15Å; F782-K862 HydrophobicContact CZ-CG 4.21Å; D859-K862 WeakPolarHBondContact O-CB 3.24Å; D859-K862 PolarHBondContact O-N 2.93Å; D859-K862 WeakPolarHBondContact OD1-CD 3.46Å; D859-K862 WeakPolarHBondContact OD1-CE 3.4Å; D859-K862 IonicContact OD1-NZ 3.56Å; D859-K862 PolarHBondContact OD1-NZ 2.87Å; K862-Y867 HydrophobicContact CD-CE1 4.34Å; K862-Y867 WeakPolarHBondContact CE-OH 3.43Å; K862-Y867 HydrophobicContact CG-CD1 4.09Å; K862-Y867 HydrophobicContact CG-CE1 3.54Å
863	T	81.4	Confident	85.1	Confident	53 Å²	53	53.6 Å²	53.6	33%	0.325	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	168.6	172.5	69.2	0	0	0	0	109.4	F782 Q865 G866 R868	F782-T863 WeakPolarHBondContact CD1-O 3.32Å; F782-T863 VanDerWaalsContact CE1-O 3.29Å; F782-T863 WeakPolarHBondContact CE1-O 3.47Å; T863-Q865 PolarHBondContact O-N 2.81Å; T863-Q865 VanDerWaalsContact O-N 3.12Å; T863-Q865 PolarHBondContact OG1-N 3.46Å; T863-G866 PolarHBondContact N-O 3.08Å; T863-G866 PolarHBondContact O-N 3.4Å; T863-G866 PolarHBondContact OG1-O 2.94Å; T863-R868 HydrophobicContact CG2-CB 3.88Å
864	E	71.7	Confident	85.2	Confident	137 Å²	137	50.9 Å²	50.9	64%	0.64	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-21.3	175	-56.9	-169.4	126.7	0	0	113.5	N784	N784-E864 PolarHBondContact ND2-OE1 3.29Å
865	Q	68.4	Low	85.2	Confident	116 Å²	116	52 Å²	52	54%	0.542	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	5.1	176.1	-55	-67.9	-40.1	0	0	113	T863	T863-Q865 PolarHBondContact O-N 2.81Å; T863-Q865 VanDerWaalsContact O-N 3.12Å; T863-Q865 PolarHBondContact OG1-N 3.46Å
866	G	78.3	Confident	85.2	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.01	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	102.7	-152.8	-174.2	0	0	0	0	0	113.6	T863 R868	T863-G866 PolarHBondContact N-O 3.08Å; T863-G866 PolarHBondContact O-N 3.4Å; T863-G866 PolarHBondContact OG1-O 2.94Å; G866-R868 PolarHBondContact O-N 3.4Å
867	Y	84	Confident	85.1	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.016	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	101.6	-175.2	-70	-75.3	0	0	0	112.1	Q781 F782 T800 L803 L804 H807 I858 K862 M870	Q781-Y867 PolarHBondContact OE1-OH 3.45Å; F782-Y867 HydrophobicContact CE2-CD2 4.24Å; F782-Y867 AromaticContact CE2-CE2 3.66Å; F782-Y867 HydrophobicContact CE2-CE2 3.66Å; F782-Y867 AromaticContact CZ-CD2 3.94Å; F782-Y867 HydrophobicContact CZ-CD2 3.94Å; F782-Y867 HydrophobicContact CZ-CE1 4.26Å; F782-Y867 AromaticContact CZ-CE2 3.57Å; F782-Y867 HydrophobicContact CZ-CE2 3.57Å; F782-Y867 HydrophobicContact CZ-CG 4.4Å; F782-Y867 AromaticContact CZ-CZ 3.71Å; T800-Y867 HydrophobicContact CG2-CD2 4.14Å; L803-Y867 HydrophobicContact CB-CD2 4.04Å; L803-Y867 HydrophobicContact CB-CG 4.34Å; L804-Y867 HydrophobicContact CD1-CE2 3.82Å; H807-Y867 AromaticContact ND1-CE1 3.72Å; H807-Y867 AromaticContact ND1-CZ 3.58Å; H807-Y867 PolarHBondContact ND1-OH 2.91Å; I858-Y867 HydrophobicContact CG2-CD1 4.26Å; I858-Y867 HydrophobicContact CG2-CE1 3.92Å; K862-Y867 HydrophobicContact CD-CE1 4.34Å; K862-Y867 WeakPolarHBondContact CE-OH 3.43Å; K862-Y867 HydrophobicContact CG-CD1 4.09Å; K862-Y867 HydrophobicContact CG-CE1 3.54Å; Y867-M870 HydrophobicContact CD1-SD 3.75Å; Y867-M870 HydrophobicContact CD2-SD 4.46Å; Y867-M870 HydrophobicContact CE1-SD 4.41Å; Y867-M870 HydrophobicContact CG-SD 3.79Å
868	R	81.5	Confident	84.8	Confident	186 Å²	186	50 Å²	50	70%	0.702	25%	0.248	S	C	*	.	S	Bend	trans	-108.3	111.6	-177.5	-165.8	-178.2	-172.1	-76.4	-0.1	110.9	T861 T863 G866	T861-R868 PolarHBondContact O-N 3.44Å; T863-R868 HydrophobicContact CG2-CB 3.88Å; G866-R868 PolarHBondContact O-N 3.4Å
869	G	84.4	Confident	84.2	Confident	16 Å²	16	52.9 Å²	52.9	17%	0.165	27%	0.265	C	S	.	.	S	Bend	trans	89.1	4.4	-178.2	0	0	0	0	0	114.3	A871 E872 A873	G869-A871 VanDerWaalsContact C-N 3.32Å; G869-A871 PolarHBondContact O-N 3.31Å; G869-E872 WeakPolarHBondContact O-CB 3.32Å; G869-E872 PolarHBondContact O-N 3.35Å; G869-A873 PolarHBondContact O-N 2.94Å
870	M	90.3	Very high	83.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-52.8	-44	-179.2	-179	179.6	171.2	0	0	113.3	L803 F806 H807 I858 T861 Y867 E872 A873 V874 W971	L803-M870 HydrophobicContact CB-SD 3.91Å; L803-M870 HydrophobicContact CD2-SD 4.29Å; L803-M870 HydrophobicContact CG-SD 4.5Å; F806-M870 HydrophobicContact CB-CE 3.94Å; F806-M870 HydrophobicContact CD1-CE 3.66Å; F806-M870 HydrophobicContact CG-CE 4.22Å; H807-M870 HydrophobicContact CB-CE 4.26Å; I858-M870 HydrophobicContact CD1-CE 4.18Å; I858-M870 HydrophobicContact CG1-CE 4.15Å; I858-M870 HydrophobicContact CG2-CE 3.76Å; I858-M870 HydrophobicContact CG2-CG 4.24Å; I858-M870 HydrophobicContact CG2-SD 4Å; T861-M870 WeakPolarHBondContact OG1-CB 3.41Å; Y867-M870 HydrophobicContact CD1-SD 3.75Å; Y867-M870 HydrophobicContact CD2-SD 4.46Å; Y867-M870 HydrophobicContact CE1-SD 4.41Å; Y867-M870 HydrophobicContact CG-SD 3.79Å; M870-E872 VanDerWaalsContact C-N 3.33Å; M870-E872 PolarHBondContact O-N 2.81Å; M870-A873 PolarHBondContact O-N 3.19Å; M870-V874 HydrophobicContact CG-CG2 4.31Å; M870-V874 WeakPolarHBondContact O-CB 3.08Å; M870-V874 VanDerWaalsContact O-CG2 3.26Å; M870-V874 WeakPolarHBondContact O-CG2 3.3Å; M870-V874 PolarHBondContact O-N 3.07Å; M870-W971 HydrophobicContact CE-CH2 4.37Å; M870-W971 HydrophobicContact CE-CZ2 4.36Å
871	A	89.5	Confident	81.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-37.1	178.7	0	0	0	0	0	112.5	G869 L875 E967 I970	G869-A871 VanDerWaalsContact C-N 3.32Å; G869-A871 PolarHBondContact O-N 3.31Å; A871-L875 VanDerWaalsContact O-CB 3.27Å; A871-L875 WeakPolarHBondContact O-CB 3.44Å; A871-L875 PolarHBondContact O-N 3.16Å; A871-E967 HydrophobicContact CB-CG 3.57Å; A871-I970 HydrophobicContact CB-CB 3.99Å; A871-I970 HydrophobicContact CB-CG2 3.62Å; A871-I970 VanDerWaalsContact O-CG2 3.27Å; A871-I970 WeakPolarHBondContact O-CG2 3.27Å
872	E	89.5	Confident	79.9	Confident	126 Å²	126	56.6 Å²	56.6	59%	0.589	30%	0.297	S	S	*	.	H	α-helix	trans	-68.8	-44.6	177.9	-65.6	168	165.4	0	0	110.4	G869 M870 L875 A876 I970	G869-E872 WeakPolarHBondContact O-CB 3.32Å; G869-E872 PolarHBondContact O-N 3.35Å; M870-E872 VanDerWaalsContact C-N 3.33Å; M870-E872 PolarHBondContact O-N 2.81Å; E872-L875 PolarHBondContact O-N 2.82Å; E872-A876 VanDerWaalsContact O-CB 3.25Å; E872-A876 WeakPolarHBondContact O-CB 3.38Å; E872-A876 PolarHBondContact O-N 3.42Å; E872-I970 HydrophobicContact CG-CD1 3.72Å
873	A	89.3	Confident	79	Confident	23 Å²	23	54.9 Å²	54.9	19%	0.19	29%	0.293	C	S	.	.	H	α-helix	trans	-63.9	-45.2	176.7	0	0	0	0	0	112.6	T861 G869 M870 A876 W877	T861-A873 HydrophobicContact CG2-CB 3.59Å; G869-A873 PolarHBondContact O-N 2.94Å; M870-A873 PolarHBondContact O-N 3.19Å; A873-A876 PolarHBondContact O-N 3.09Å; A873-W877 WeakPolarHBondContact O-CB 3.38Å; A873-W877 PolarHBondContact O-N 3.38Å
874	V	89.3	Confident	78.6	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.9	-41.4	176.6	171.8	0	0	0	0	111.3	F806 L854 I858 M870 L878 I974	F806-V874 HydrophobicContact CE1-CG1 4.04Å; F806-V874 HydrophobicContact CE1-CG2 4.14Å; F806-V874 HydrophobicContact CZ-CG1 4.05Å; L854-V874 HydrophobicContact CD1-CG1 4.41Å; L854-V874 HydrophobicContact CD1-CG2 4.18Å; I858-V874 HydrophobicContact CD1-CG2 4.27Å; I858-V874 HydrophobicContact CG1-CG2 3.77Å; M870-V874 HydrophobicContact CG-CG2 4.31Å; M870-V874 WeakPolarHBondContact O-CB 3.08Å; M870-V874 VanDerWaalsContact O-CG2 3.26Å; M870-V874 WeakPolarHBondContact O-CG2 3.3Å; M870-V874 PolarHBondContact O-N 3.07Å; V874-L878 HydrophobicContact CG1-CD1 4.02Å; V874-L878 VanDerWaalsContact O-CG 3.24Å; V874-L878 WeakPolarHBondContact O-CG 3.26Å; V874-L878 PolarHBondContact O-N 2.59Å; V874-L878 VanDerWaalsContact O-N 3.09Å; V874-I974 HydrophobicContact CB-CD1 4.09Å; V874-I974 HydrophobicContact CG1-CD1 3.83Å; V874-I974 HydrophobicContact CG1-CG1 4.33Å; V874-I974 HydrophobicContact CG1-CG2 4.4Å
875	L	89.4	Confident	78.8	Confident	26 Å²	26	48.9 Å²	48.9	14%	0.136	27%	0.268	C	S	.	.	H	α-helix	trans	-64.4	-44.9	174.9	-178.7	59.5	0	0	0	111.2	A871 E872 L878 T879 I970 Q973 I974 K977	A871-L875 VanDerWaalsContact O-CB 3.27Å; A871-L875 WeakPolarHBondContact O-CB 3.44Å; A871-L875 PolarHBondContact O-N 3.16Å; E872-L875 PolarHBondContact O-N 2.82Å; L875-L878 PolarHBondContact O-N 3.26Å; L875-T879 HydrophobicContact CD1-CG2 4.18Å; L875-T879 WeakPolarHBondContact O-CG2 3.22Å; L875-T879 PolarHBondContact O-N 3.07Å; L875-T879 PolarHBondContact O-OG1 2.96Å; L875-T879 VanDerWaalsContact O-OG1 3.09Å; L875-I970 HydrophobicContact CB-CG2 4.03Å; L875-I970 HydrophobicContact CD2-CG2 3.87Å; L875-Q973 HydrophobicContact CD1-CB 4.23Å; L875-Q973 HydrophobicContact CD2-CB 4.14Å; L875-I974 HydrophobicContact CB-CD1 4.32Å; L875-I974 HydrophobicContact CB-CG1 3.97Å; L875-I974 HydrophobicContact CD1-CG1 4.18Å; L875-K977 HydrophobicContact CD1-CG 4.41Å
876	A	86.6	Confident	79.1	Confident	46 Å²	46	43.9 Å²	43.9	38%	0.38	25%	0.245	S	C	.	.	H	α-helix	trans	-54.7	-54.9	175.6	0	0	0	0	0	110.5	E872 A873 L878 T879 D880	E872-A876 VanDerWaalsContact O-CB 3.25Å; E872-A876 WeakPolarHBondContact O-CB 3.38Å; E872-A876 PolarHBondContact O-N 3.42Å; A873-A876 PolarHBondContact O-N 3.09Å; A876-L878 VanDerWaalsContact C-N 3.27Å; A876-L878 PolarHBondContact O-N 3.37Å; A876-T879 WeakPolarHBondContact CA-OG1 3.35Å; A876-T879 CarbonylContact O-C 3.52Å; A876-T879 WeakPolarHBondContact O-CA 3.31Å; A876-T879 PolarHBondContact O-N 3.3Å; A876-T879 PolarHBondContact O-OG1 2.81Å; A876-D880 WeakPolarHBondContact O-CB 3.45Å; A876-D880 PolarHBondContact O-N 3.35Å
877	W	87.5	Confident	78.9	Confident	20 Å²	20	49.1 Å²	49.1	8%	0.076	27%	0.267	C	S	.	.	H	α-helix	trans	-55.7	-36.1	178.6	-173.1	95.1	0	0	0	113.7	L850 S853 L854 A873 N885 W889	L850-W877 HydrophobicContact CD2-CH2 4.38Å; L850-W877 HydrophobicContact CD2-CZ2 4.23Å; L850-W877 VanDerWaalsContact O-CZ2 3.3Å; L850-W877 WeakPolarHBondContact O-CZ2 3.31Å; S853-W877 PolarHBondContact OG-NE1 3.32Å; L854-W877 HydrophobicContact CB-CD2 4.29Å; L854-W877 HydrophobicContact CB-CE3 4.46Å; L854-W877 HydrophobicContact CB-CH2 4.16Å; L854-W877 HydrophobicContact CB-CZ2 3.97Å; L854-W877 HydrophobicContact CB-CZ3 4.39Å; L854-W877 HydrophobicContact CD1-CD2 3.99Å; L854-W877 HydrophobicContact CD1-CE3 3.9Å; L854-W877 HydrophobicContact CD1-CG 4.32Å; L854-W877 HydrophobicContact CD1-CZ3 4.41Å; L854-W877 HydrophobicContact CD2-CZ3 4.35Å; A873-W877 WeakPolarHBondContact O-CB 3.38Å; A873-W877 PolarHBondContact O-N 3.38Å; W877-N885 HydrophobicContact CE3-CB 4.47Å; W877-N885 HydrophobicContact CH2-CB 4.26Å; W877-N885 HydrophobicContact CZ2-CB 4.4Å; W877-N885 HydrophobicContact CZ3-CB 4.3Å; W877-N885 WeakPolarHBondContact O-CB 3.16Å; W877-N885 PolarHBondContact O-ND2 2.75Å; W877-W889 HydrophobicContact CZ3-CE3 4.49Å
878	L	81.4	Confident	78.4	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-74.4	-29.8	175.7	-69.4	168.4	0	0	0	113.2	V874 L875 A876 L886 W889 I974 L978	V874-L878 HydrophobicContact CG1-CD1 4.02Å; V874-L878 VanDerWaalsContact O-CG 3.24Å; V874-L878 WeakPolarHBondContact O-CG 3.26Å; V874-L878 PolarHBondContact O-N 2.59Å; V874-L878 VanDerWaalsContact O-N 3.09Å; L875-L878 PolarHBondContact O-N 3.26Å; A876-L878 VanDerWaalsContact C-N 3.27Å; A876-L878 PolarHBondContact O-N 3.37Å; L878-L886 HydrophobicContact CD2-CD1 4.17Å; L878-W889 HydrophobicContact CD2-CE3 4.3Å; L878-W889 HydrophobicContact CD2-CZ3 3.91Å; L878-I974 HydrophobicContact CD1-CB 4.43Å; L878-I974 HydrophobicContact CD1-CG1 4.27Å; L878-I974 HydrophobicContact CD1-CG2 3.85Å; L878-L978 HydrophobicContact CD1-CD2 4.35Å; L878-L978 HydrophobicContact CD2-CD2 4.12Å
879	T	78.2	Confident	78.1	Confident	60 Å²	60	42.2 Å²	42.2	37%	0.368	25%	0.246	S	C	.	.	H	α-helix	trans	-86.3	-23.3	176.9	54.4	0	0	0	0	114.2	L875 A876 S883	L875-T879 HydrophobicContact CD1-CG2 4.18Å; L875-T879 WeakPolarHBondContact O-CG2 3.22Å; L875-T879 PolarHBondContact O-N 3.07Å; L875-T879 PolarHBondContact O-OG1 2.96Å; L875-T879 VanDerWaalsContact O-OG1 3.09Å; A876-T879 WeakPolarHBondContact CA-OG1 3.35Å; A876-T879 CarbonylContact O-C 3.52Å; A876-T879 WeakPolarHBondContact O-CA 3.31Å; A876-T879 PolarHBondContact O-N 3.3Å; A876-T879 PolarHBondContact O-OG1 2.81Å; T879-S883 PolarHBondContact O-N 3.41Å
880	D	65.9	Low	77.4	Confident	94 Å²	94	41.8 Å²	41.8	50%	0.503	24%	0.241	S	C	.	.	H	α-helix	trans	-63.8	156.1	-168.2	-140.4	-24.3	0	0	0	113.2	A876 S882 S883 A884	A876-D880 WeakPolarHBondContact O-CB 3.45Å; A876-D880 PolarHBondContact O-N 3.35Å; D880-S882 VanDerWaalsContact C-N 3.27Å; D880-S882 PolarHBondContact O-N 3.26Å; D880-S883 PolarHBondContact O-N 3.4Å; D880-A884 PolarHBondContact O-N 3.17Å
881	N	56.6	Low	76.4	Confident	112 Å²	112	48.4 Å²	48.4	60%	0.599	27%	0.266	S	S	*	.	H	α-helix	trans	47.9	46.3	-170.7	-74.5	-46.7	0	0	0	112.8	S883 A884	N881-S883 PolarHBondContact O-N 3.38Å; N881-A884 HydrophobicContact CB-CB 3.77Å; N881-A884 WeakPolarHBondContact O-CB 3.08Å; N881-A884 PolarHBondContact O-N 2.82Å
882	S	51.2	Low	75.5	Confident	97 Å²	97	49.2 Å²	49.2	68%	0.678	27%	0.269	S	S	*	.	H	α-helix	trans	59.8	38.8	179.9	78.4	0	0	0	0	114.5	D880 A884 K887	D880-S882 VanDerWaalsContact C-N 3.27Å; D880-S882 PolarHBondContact O-N 3.26Å; S882-A884 VanDerWaalsContact C-N 3.28Å; S882-A884 PolarHBondContact O-N 3.06Å; S882-K887 PolarHBondContact O-NZ 3.09Å
883	S	65	Low	74.4	Confident	31 Å²	31	43.5 Å²	43.5	22%	0.217	24%	0.244	C	C	.	.	H	α-helix	trans	61.7	25.4	-168.2	68.9	0	0	0	0	114.6	T879 D880 N881 N885 L886 K887	T879-S883 PolarHBondContact O-N 3.41Å; D880-S883 PolarHBondContact O-N 3.4Å; N881-S883 PolarHBondContact O-N 3.38Å; S883-N885 VanDerWaalsContact C-N 3.31Å; S883-N885 PolarHBondContact O-N 3.24Å; S883-L886 PolarHBondContact O-N 3.46Å; S883-K887 WeakPolarHBondContact O-CB 2.98Å; S883-K887 WeakPolarHBondContact O-CD 3.29Å; S883-K887 VanDerWaalsContact O-CG 3.25Å; S883-K887 WeakPolarHBondContact O-CG 3.16Å; S883-K887 PolarHBondContact O-N 3.47Å; S883-K887 VanDerWaalsContact OG-CE 3.3Å; S883-K887 WeakPolarHBondContact OG-CE 3.3Å
884	A	73.2	Confident	73.2	Confident	32 Å²	32	44 Å²	44	26%	0.264	24%	0.242	S	C	.	.	H	α-helix	trans	-60.5	-39.3	175.5	0	0	0	0	0	112	D880 N881 S882 L886 K887 T888	D880-A884 PolarHBondContact O-N 3.17Å; N881-A884 HydrophobicContact CB-CB 3.77Å; N881-A884 WeakPolarHBondContact O-CB 3.08Å; N881-A884 PolarHBondContact O-N 2.82Å; S882-A884 VanDerWaalsContact C-N 3.28Å; S882-A884 PolarHBondContact O-N 3.06Å; A884-L886 PolarHBondContact O-N 2.97Å; A884-K887 PolarHBondContact O-N 3.45Å; A884-T888 WeakPolarHBondContact O-CB 3.14Å; A884-T888 PolarHBondContact O-N 2.74Å; A884-T888 PolarHBondContact O-OG1 3.42Å
885	N	76.4	Confident	72	Confident	32 Å²	32	45.8 Å²	45.8	17%	0.171	26%	0.256	C	S	.	.	H	α-helix	trans	-57.1	-50.6	174.9	-69.3	-13	0	0	0	110.9	W877 S883 T888 W889	W877-N885 HydrophobicContact CE3-CB 4.47Å; W877-N885 HydrophobicContact CH2-CB 4.26Å; W877-N885 HydrophobicContact CZ2-CB 4.4Å; W877-N885 HydrophobicContact CZ3-CB 4.3Å; W877-N885 WeakPolarHBondContact O-CB 3.16Å; W877-N885 PolarHBondContact O-ND2 2.75Å; S883-N885 VanDerWaalsContact C-N 3.31Å; S883-N885 PolarHBondContact O-N 3.24Å; N885-T888 PolarHBondContact O-N 2.98Å; N885-W889 VanDerWaalsContact O-CB 3.26Å; N885-W889 WeakPolarHBondContact O-CB 3.17Å; N885-W889 PolarHBondContact O-N 2.73Å
886	L	74.1	Confident	70.7	Confident	12 Å²	12	44.6 Å²	44.6	6%	0.063	25%	0.25	C	S	.	.	H	α-helix	trans	-62.3	-46.8	177.6	-173.7	67.8	0	0	0	112.4	L878 S883 A884 T888 W889 A890 K977 L978 L981	L878-L886 HydrophobicContact CD2-CD1 4.17Å; S883-L886 PolarHBondContact O-N 3.46Å; A884-L886 PolarHBondContact O-N 2.97Å; L886-T888 VanDerWaalsContact C-N 3.31Å; L886-T888 PolarHBondContact O-N 2.87Å; L886-W889 HydrophobicContact CD1-CE3 4.3Å; L886-A890 VanDerWaalsContact O-CB 3.23Å; L886-A890 WeakPolarHBondContact O-CB 3.21Å; L886-A890 PolarHBondContact O-N 3Å; L886-K977 HydrophobicContact CD2-CB 4.38Å; L886-L978 HydrophobicContact CD1-CD2 4.46Å; L886-L981 HydrophobicContact CD1-CD1 4.11Å; L886-L981 HydrophobicContact CD1-CD2 3.65Å; L886-L981 HydrophobicContact CD1-CG 4.03Å; L886-L981 HydrophobicContact CG-CD2 3.83Å
887	K	72.7	Confident	69.1	Low	110 Å²	110	42.9 Å²	42.9	48%	0.478	24%	0.236	S	C	.	.	H	α-helix	trans	-62.4	-36	177.3	-71	161.7	-179.8	163.8	0	112.7	S882 S883 A884 A890 R891	S882-K887 PolarHBondContact O-NZ 3.09Å; S883-K887 WeakPolarHBondContact O-CB 2.98Å; S883-K887 WeakPolarHBondContact O-CD 3.29Å; S883-K887 VanDerWaalsContact O-CG 3.25Å; S883-K887 WeakPolarHBondContact O-CG 3.16Å; S883-K887 PolarHBondContact O-N 3.47Å; S883-K887 VanDerWaalsContact OG-CE 3.3Å; S883-K887 WeakPolarHBondContact OG-CE 3.3Å; A884-K887 PolarHBondContact O-N 3.45Å; K887-A890 WeakPolarHBondContact O-CB 3.5Å; K887-R891 WeakPolarHBondContact O-CB 3.17Å; K887-R891 PolarHBondContact O-N 3.28Å
888	T	75.3	Confident	67.3	Low	37 Å²	37	42.5 Å²	42.5	23%	0.227	24%	0.236	C	C	.	.	H	α-helix	trans	-78.7	-47.5	-176.6	-58.5	0	0	0	0	109.5	L850 A884 N885 L886 A890 R891 H892	L850-T888 HydrophobicContact CD1-CG2 4.26Å; A884-T888 WeakPolarHBondContact O-CB 3.14Å; A884-T888 PolarHBondContact O-N 2.74Å; A884-T888 PolarHBondContact O-OG1 3.42Å; N885-T888 PolarHBondContact O-N 2.98Å; L886-T888 VanDerWaalsContact C-N 3.31Å; L886-T888 PolarHBondContact O-N 2.87Å; T888-A890 VanDerWaalsContact C-N 3.31Å; T888-A890 PolarHBondContact O-N 2.87Å; T888-R891 PolarHBondContact O-N 3.4Å; T888-R891 PolarHBondContact OG1-NH1 2.84Å; T888-H892 VanDerWaalsContact CG2-CD2 3.47Å; T888-H892 WeakPolarHBondContact CG2-CD2 3.01Å; T888-H892 WeakPolarHBondContact CG2-NE2 3.43Å; T888-H892 PolarHBondContact O-CD2 3.39Å; T888-H892 PolarHBondContact O-N 3.37Å
889	W	74.4	Confident	65.8	Low	8 Å²	8	42.8 Å²	42.8	3%	0.03	24%	0.238	C	C	.	.	H	α-helix	trans	-53.6	-46.2	167.7	178.6	22	0	0	0	112	L850 F851 W877 L878 N885 L886 R891 H892 C893 Y943 L946 L978	L850-W889 HydrophobicContact CD1-CB 4.3Å; F851-W889 HydrophobicContact CZ-CZ2 4.15Å; F851-W889 AromaticContact CZ-NE1 3.81Å; W877-W889 HydrophobicContact CZ3-CE3 4.49Å; L878-W889 HydrophobicContact CD2-CE3 4.3Å; L878-W889 HydrophobicContact CD2-CZ3 3.91Å; N885-W889 VanDerWaalsContact O-CB 3.26Å; N885-W889 WeakPolarHBondContact O-CB 3.17Å; N885-W889 PolarHBondContact O-N 2.73Å; L886-W889 HydrophobicContact CD1-CE3 4.3Å; W889-R891 PolarHBondContact O-N 3.2Å; W889-H892 PolarHBondContact O-N 3.18Å; W889-C893 PolarHBondContact NE1-SG 2.63Å; W889-C893 WeakPolarHBondContact O-CB 3.35Å; W889-C893 PolarHBondContact O-N 3.22Å; W889-Y943 HydrophobicContact CZ2-CD2 4.22Å; W889-Y943 AromaticContact NE1-CD2 3.78Å; W889-L946 HydrophobicContact CH2-CD1 3.88Å; W889-L946 HydrophobicContact CZ2-CD1 3.65Å; W889-L978 HydrophobicContact CH2-CD2 3.56Å; W889-L978 HydrophobicContact CZ3-CD2 3.37Å
890	A	70.1	Confident	64.3	Low	8 Å²	8	41.4 Å²	41.4	7%	0.066	23%	0.229	C	C	.	.	H	α-helix	trans	-53.1	-55.7	174.1	0	0	0	0	0	111.7	L886 K887 T888 H892 Q894 L981	L886-A890 VanDerWaalsContact O-CB 3.23Å; L886-A890 WeakPolarHBondContact O-CB 3.21Å; L886-A890 PolarHBondContact O-N 3Å; K887-A890 WeakPolarHBondContact O-CB 3.5Å; T888-A890 VanDerWaalsContact C-N 3.31Å; T888-A890 PolarHBondContact O-N 2.87Å; A890-H892 PolarHBondContact O-N 3Å; A890-Q894 WeakPolarHBondContact O-CB 3.41Å; A890-Q894 PolarHBondContact O-N 3.43Å; A890-L981 HydrophobicContact CB-CD2 3.54Å
891	R	68.3	Low	63.4	Low	139 Å²	139	37.8 Å²	37.8	53%	0.525	21%	0.209	S	C	.	.	H	α-helix	trans	-56.6	-47.1	-177.9	-171	-172.3	-61	112.3	-3.3	112.2	K887 T888 W889 A895	K887-R891 WeakPolarHBondContact O-CB 3.17Å; K887-R891 PolarHBondContact O-N 3.28Å; T888-R891 PolarHBondContact O-N 3.4Å; T888-R891 PolarHBondContact OG1-NH1 2.84Å; W889-R891 PolarHBondContact O-N 3.2Å; R891-A895 WeakPolarHBondContact O-CB 3.42Å; R891-A895 PolarHBondContact O-N 3.33Å
892	H	71.8	Confident	63.2	Low	16 Å²	16	33.5 Å²	33.5	7%	0.074	19%	0.186	C	C	.	.	H	α-helix	trans	-76.8	-41.6	-175.2	-58.1	-53.7	0	0	0	112.3	Q843 L847 T888 W889 A890 Q894 A895 L896	Q843-H892 HydrophobicContact CB-CB 4.37Å; Q843-H892 PolarHBondContact OE1-CE1 2.96Å; Q843-H892 PolarHBondContact OE1-ND1 2.8Å; L847-H892 HydrophobicContact CD2-CB 3.73Å; L847-H892 HydrophobicContact CG-CB 4.03Å; T888-H892 VanDerWaalsContact CG2-CD2 3.47Å; T888-H892 WeakPolarHBondContact CG2-CD2 3.01Å; T888-H892 WeakPolarHBondContact CG2-NE2 3.43Å; T888-H892 PolarHBondContact O-CD2 3.39Å; T888-H892 PolarHBondContact O-N 3.37Å; W889-H892 PolarHBondContact O-N 3.18Å; A890-H892 PolarHBondContact O-N 3Å; H892-Q894 VanDerWaalsContact C-N 3.32Å; H892-Q894 PolarHBondContact O-N 3.03Å; H892-A895 PolarHBondContact O-N 2.87Å; H892-L896 WeakPolarHBondContact O-CB 3.31Å; H892-L896 WeakPolarHBondContact O-CG 3.34Å; H892-L896 PolarHBondContact O-N 3.49Å
893	C	66.4	Low	63	Low	7 Å²	7	33.6 Å²	33.6	5%	0.047	18%	0.176	C	C	.	.	H	α-helix	trans	-66.5	-31.7	171.3	-83.2	0	0	0	0	112.5	L847 W889 S897 Y943	L847-C893 VanDerWaalsContact CD1-SG 3.54Å; W889-C893 PolarHBondContact NE1-SG 2.63Å; W889-C893 WeakPolarHBondContact O-CB 3.35Å; W889-C893 PolarHBondContact O-N 3.22Å; C893-S897 WeakPolarHBondContact O-CB 3.37Å; C893-S897 PolarHBondContact O-N 3.09Å; C893-S897 PolarHBondContact O-OG 2.8Å; C893-Y943 HydrophobicContact CB-CD2 3.52Å; C893-Y943 HydrophobicContact CB-CE2 3.55Å; C893-Y943 HydrophobicContact CB-CG 4.25Å
894	Q	64	Low	62.2	Low	33 Å²	33	32.9 Å²	32.9	15%	0.154	17%	0.171	C	C	.	.	H	α-helix	trans	-67.1	-48.2	173.5	-176.1	167.5	6.1	0	0	111	A890 H892 L896 S897 C898 I985	A890-Q894 WeakPolarHBondContact O-CB 3.41Å; A890-Q894 PolarHBondContact O-N 3.43Å; H892-Q894 VanDerWaalsContact C-N 3.32Å; H892-Q894 PolarHBondContact O-N 3.03Å; Q894-L896 PolarHBondContact O-N 2.93Å; Q894-S897 PolarHBondContact O-N 2.74Å; Q894-S897 PolarHBondContact O-OG 3.29Å; Q894-C898 VanDerWaalsContact O-CB 3.22Å; Q894-C898 WeakPolarHBondContact O-CB 3.48Å; Q894-C898 PolarHBondContact O-N 3.25Å; Q894-C898 PolarHBondContact O-SG 3.39Å; Q894-I985 HydrophobicContact CG-CD1 4.35Å
895	A	62.9	Low	61.3	Low	37 Å²	37	31.6 Å²	31.6	31%	0.306	16%	0.159	S	C	.	.	H	α-helix	trans	-56.1	-47.9	174.7	0	0	0	0	0	112.3	Q843 R891 H892	Q843-A895 HydrophobicContact CG-CB 4.3Å; R891-A895 WeakPolarHBondContact O-CB 3.42Å; R891-A895 PolarHBondContact O-N 3.33Å; H892-A895 PolarHBondContact O-N 2.87Å
896	L	61.9	Low	60.5	Low	2 Å²	2	33.2 Å²	33.2	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-69.9	-43.5	-179.4	-74.2	163.6	0	0	0	112.8	C840 Q843 I844 L847 H892 Q894 C898 S899 L936 M939	C840-L896 HydrophobicContact CB-CD2 4.17Å; C840-L896 WeakPolarHBondContact O-CD2 3.33Å; Q843-L896 HydrophobicContact CB-CD1 3.76Å; Q843-L896 HydrophobicContact CB-CD2 4.27Å; Q843-L896 HydrophobicContact CB-CG 3.89Å; Q843-L896 HydrophobicContact CG-CG 4.48Å; I844-L896 HydrophobicContact CG1-CD2 4.13Å; L847-L896 HydrophobicContact CD1-CD1 3.37Å; L847-L896 HydrophobicContact CG-CD1 4.09Å; H892-L896 WeakPolarHBondContact O-CB 3.31Å; H892-L896 WeakPolarHBondContact O-CG 3.34Å; H892-L896 PolarHBondContact O-N 3.49Å; Q894-L896 PolarHBondContact O-N 2.93Å; L896-C898 VanDerWaalsContact C-N 3.3Å; L896-C898 PolarHBondContact O-N 2.68Å; L896-S899 VanDerWaalsContact O-CB 3.23Å; L896-S899 WeakPolarHBondContact O-CB 3.13Å; L896-S899 PolarHBondContact O-N 2.59Å; L896-S899 PolarHBondContact O-OG 3.01Å; L896-L936 HydrophobicContact CB-CD2 3.78Å; L896-L936 HydrophobicContact CD2-CD2 3.58Å; L896-L936 HydrophobicContact CG-CD2 4.25Å; L896-M939 HydrophobicContact CB-SD 4.44Å; L896-M939 HydrophobicContact CD1-SD 4.19Å
897	S	53.9	Low	59.8	Low	10 Å²	10	35.4 Å²	35.4	7%	0.07	17%	0.173	C	C	.	.	H	α-helix	trans	-69.7	-25.5	177.8	61	0	0	0	0	113	C893 Q894 S899 N900 I985	C893-S897 WeakPolarHBondContact O-CB 3.37Å; C893-S897 PolarHBondContact O-N 3.09Å; C893-S897 PolarHBondContact O-OG 2.8Å; Q894-S897 PolarHBondContact O-N 2.74Å; Q894-S897 PolarHBondContact O-OG 3.29Å; S897-S899 PolarHBondContact O-N 3.44Å; S897-N900 WeakPolarHBondContact O-CB 3.38Å; S897-N900 PolarHBondContact O-N 3.49Å; S897-N900 PolarHBondContact O-ND2 3.13Å; S897-I985 VanDerWaalsContact OG-CD1 3.27Å; S897-I985 WeakPolarHBondContact OG-CD1 3.38Å
898	C	50.3	Low	59.2	Low	11 Å²	11	31 Å²	31	7%	0.074	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-79.3	-0.4	176.3	-64.1	0	0	0	0	113.7	Q894 L896 N900 P1030 F1034	Q894-C898 VanDerWaalsContact O-CB 3.22Å; Q894-C898 WeakPolarHBondContact O-CB 3.48Å; Q894-C898 PolarHBondContact O-N 3.25Å; Q894-C898 PolarHBondContact O-SG 3.39Å; L896-C898 VanDerWaalsContact C-N 3.3Å; L896-C898 PolarHBondContact O-N 2.68Å; C898-N900 PolarHBondContact O-N 3.46Å; C898-P1030 HydrophobicContact CB-CB 4.32Å; C898-P1030 WeakPolarHBondContact CB-O 3.47Å; C898-P1030 VanDerWaalsContact O-CB 3.24Å; C898-P1030 WeakPolarHBondContact O-CB 3.28Å; C898-P1030 WeakPolarHBondContact O-CG 3.23Å; C898-F1034 HydrophobicContact CB-CD2 4.23Å; C898-F1034 HydrophobicContact CB-CE2 3.79Å; C898-F1034 WeakPolarHBondContact SG-CE2 3.37Å
899	S	49.2	Very low	58.8	Low	11 Å²	11	30 Å²	30	8%	0.077	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-56.9	-21.3	155.5	69	0	0	0	0	112.9	L896 S897 M901 L902 V905 L936	L896-S899 VanDerWaalsContact O-CB 3.23Å; L896-S899 WeakPolarHBondContact O-CB 3.13Å; L896-S899 PolarHBondContact O-N 2.59Å; L896-S899 PolarHBondContact O-OG 3.01Å; S897-S899 PolarHBondContact O-N 3.44Å; S899-M901 VanDerWaalsContact C-N 3.26Å; S899-M901 CarbonylContact O-C 3.58Å; S899-M901 PolarHBondContact O-N 2.96Å; S899-M901 VanDerWaalsContact O-N 3.07Å; S899-L902 PolarHBondContact O-N 3.26Å; S899-V905 WeakPolarHBondContact O-CG2 3.17Å; S899-L936 WeakPolarHBondContact OG-CB 3.34Å
900	N	46.3	Very low	58.4	Low	31 Å²	31	33.4 Å²	33.4	17%	0.166	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-74	10.4	-171.2	-74.7	-72.4	0	0	0	117.2	S897 C898 L902 L936	S897-N900 WeakPolarHBondContact O-CB 3.38Å; S897-N900 PolarHBondContact O-N 3.49Å; S897-N900 PolarHBondContact O-ND2 3.13Å; C898-N900 PolarHBondContact O-N 3.46Å; N900-L902 HydrophobicContact CB-CG 4.49Å; N900-L902 PolarHBondContact O-N 3.21Å; N900-L936 PolarHBondContact ND2-O 3.48Å
901	M	47.5	Very low	58.2	Low	18 Å²	18	34.3 Å²	34.3	9%	0.089	17%	0.166	C	C	.	.			trans	-76.9	68	143.1	-60.5	-177.4	51.9	0	0	107.9	S899 E903 S904 V905 V993 I996 F1029 P1030	S899-M901 VanDerWaalsContact C-N 3.26Å; S899-M901 CarbonylContact O-C 3.58Å; S899-M901 PolarHBondContact O-N 2.96Å; S899-M901 VanDerWaalsContact O-N 3.07Å; M901-E903 PolarHBondContact O-N 3.23Å; M901-E903 VanDerWaalsContact O-N 3.09Å; M901-S904 WeakPolarHBondContact O-CB 3.39Å; M901-S904 PolarHBondContact O-N 3.47Å; M901-V905 PolarHBondContact O-N 3.14Å; M901-V993 HydrophobicContact CE-CG2 4.46Å; M901-V993 HydrophobicContact CG-CG2 3.51Å; M901-V993 HydrophobicContact SD-CG2 3.59Å; M901-V993 VanDerWaalsContact SD-CG2 3.59Å; M901-I996 HydrophobicContact CE-CD1 4.04Å; M901-F1029 HydrophobicContact CE-CB 3.95Å; M901-F1029 HydrophobicContact CE-CD1 4.1Å; M901-F1029 HydrophobicContact SD-CB 3.88Å; M901-F1029 HydrophobicContact SD-CD1 3.79Å; M901-F1029 HydrophobicContact SD-CG 4.34Å; M901-P1030 HydrophobicContact CB-CB 4.39Å; M901-P1030 HydrophobicContact CB-CG 3.75Å; M901-P1030 HydrophobicContact CG-CB 3.87Å; M901-P1030 HydrophobicContact CG-CG 3.78Å; M901-P1030 HydrophobicContact SD-CB 3.84Å; M901-P1030 VanDerWaalsContact SD-CD 3.52Å; M901-P1030 HydrophobicContact SD-CG 3.89Å
902	L	52.2	Low	58.3	Low	22 Å²	22	28.1 Å²	28.1	12%	0.115	14%	0.143	C	C	.	.	H	α-helix	trans	-55.5	-35.1	-169.7	-68.1	178.7	0	0	0	111.1	S899 N900 V905 R906 I933 K937	S899-L902 PolarHBondContact O-N 3.26Å; N900-L902 HydrophobicContact CB-CG 4.49Å; N900-L902 PolarHBondContact O-N 3.21Å; L902-V905 PolarHBondContact O-N 3.27Å; L902-R906 WeakPolarHBondContact O-CB 3.41Å; L902-R906 VanDerWaalsContact O-CD 3.26Å; L902-R906 WeakPolarHBondContact O-CD 3.31Å; L902-R906 WeakPolarHBondContact O-CG 3.44Å; L902-R906 PolarHBondContact O-N 3.5Å; L902-I933 HydrophobicContact CD1-CG2 3.91Å; L902-I933 HydrophobicContact CD2-CB 4.47Å; L902-I933 HydrophobicContact CD2-CG1 4.26Å; L902-I933 HydrophobicContact CD2-CG2 3.83Å; L902-I933 HydrophobicContact CG-CG2 4.42Å; L902-K937 HydrophobicContact CD1-CG 4.37Å
903	E	48	Very low	58.2	Low	99 Å²	99	27.7 Å²	27.7	46%	0.463	14%	0.142	S	C	.	.	H	α-helix	trans	-69.1	-37.5	-179.6	-154.1	52.4	-143.7	0	0	112.9	M901 R906 H907 R910	M901-E903 PolarHBondContact O-N 3.23Å; M901-E903 VanDerWaalsContact O-N 3.09Å; E903-R906 VanDerWaalsContact OE2-CD 3.31Å; E903-R906 WeakPolarHBondContact OE2-CD 3.49Å; E903-R906 IonicContact OE2-CZ 2.69Å; E903-R906 IonicContact OE2-NH1 3.49Å; E903-R906 PolarHBondContact OE2-NH1 3.43Å; E903-H907 VanDerWaalsContact O-CB 3.22Å; E903-H907 WeakPolarHBondContact O-CB 3.46Å; E903-H907 PolarHBondContact O-N 3.2Å; E903-R910 PolarHBondContact O-NH2 3.35Å; E903-R910 IonicContact OE1-CZ 2.96Å; E903-R910 VanDerWaalsContact OE1-CZ 3.3Å; E903-R910 IonicContact OE1-NH1 3.06Å; E903-R910 PolarHBondContact OE1-NH1 3.2Å; E903-R910 IonicContact OE1-NH2 3.59Å; E903-R910 PolarHBondContact OE1-NH2 2.92Å
904	S	47.4	Very low	58.5	Low	16 Å²	16	34.7 Å²	34.7	11%	0.112	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-45.2	172.2	-56.7	0	0	0	0	111.8	M901 H907 S908 L1026	M901-S904 WeakPolarHBondContact O-CB 3.39Å; M901-S904 PolarHBondContact O-N 3.47Å; S904-H907 PolarHBondContact O-N 3.43Å; S904-S908 PolarHBondContact O-N 2.94Å; S904-S908 PolarHBondContact O-OG 2.92Å; S904-L1026 WeakPolarHBondContact CB-O 3.24Å; S904-L1026 PolarHBondContact OG-O 3Å
905	V	54.2	Low	59.1	Low	5 Å²	5	41.7 Å²	41.7	3%	0.03	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-47	176.6	-178.7	0	0	0	0	111	L839 S899 M901 L902 H907 S908 V909 R1031	L839-V905 HydrophobicContact CD2-CG1 4.49Å; S899-V905 WeakPolarHBondContact O-CG2 3.17Å; M901-V905 PolarHBondContact O-N 3.14Å; L902-V905 PolarHBondContact O-N 3.27Å; V905-H907 PolarHBondContact O-N 2.97Å; V905-S908 PolarHBondContact O-N 3.28Å; V905-V909 HydrophobicContact CG1-CG2 4.19Å; V905-V909 WeakPolarHBondContact O-CB 3.13Å; V905-V909 WeakPolarHBondContact O-CG2 3.45Å; V905-V909 PolarHBondContact O-N 3.45Å; V905-R1031 VanDerWaalsContact CG2-NH2 3.26Å
906	R	58.7	Low	59.8	Low	66 Å²	66	42.9 Å²	42.9	25%	0.249	19%	0.191	C	C	.	.	H	α-helix	trans	-56.7	-35.7	172	-72.6	162	-176.8	168.7	-3.6	111.6	L902 E903 R910 I933	L902-R906 WeakPolarHBondContact O-CB 3.41Å; L902-R906 VanDerWaalsContact O-CD 3.26Å; L902-R906 WeakPolarHBondContact O-CD 3.31Å; L902-R906 WeakPolarHBondContact O-CG 3.44Å; L902-R906 PolarHBondContact O-N 3.5Å; E903-R906 VanDerWaalsContact OE2-CD 3.31Å; E903-R906 WeakPolarHBondContact OE2-CD 3.49Å; E903-R906 IonicContact OE2-CZ 2.69Å; E903-R906 IonicContact OE2-NH1 3.49Å; E903-R906 PolarHBondContact OE2-NH1 3.43Å; R906-R910 WeakPolarHBondContact O-CB 3.21Å; R906-R910 WeakPolarHBondContact O-CG 3.1Å; R906-R910 PolarHBondContact O-N 3.15Å; R906-R910 PolarHBondContact O-NE 3.16Å; R906-I933 HydrophobicContact CG-CD1 3.67Å
907	H	59.8	Low	60.4	Low	58 Å²	58	45.6 Å²	45.6	27%	0.269	21%	0.209	S	C	.	.	H	α-helix	trans	-74.4	-46.7	179	-159.4	120.8	0	0	0	110.7	E903 S904 V905 V909 R910 D911 L1027	E903-H907 VanDerWaalsContact O-CB 3.22Å; E903-H907 WeakPolarHBondContact O-CB 3.46Å; E903-H907 PolarHBondContact O-N 3.2Å; S904-H907 PolarHBondContact O-N 3.43Å; V905-H907 PolarHBondContact O-N 2.97Å; H907-V909 VanDerWaalsContact C-N 3.31Å; H907-V909 PolarHBondContact O-N 3.19Å; H907-R910 VanDerWaalsContact N-NH2 3.18Å; H907-R910 CarbonylContact O-C 3.59Å; H907-R910 PolarHBondContact O-N 3.16Å; H907-D911 IonicContact CD2-OD1 3.48Å; H907-D911 IonicContact CD2-OD2 3.9Å; H907-D911 PolarHBondContact CD2-OD2 2.9Å; H907-D911 IonicContact NE2-OD1 3.86Å; H907-D911 IonicContact NE2-OD2 3.82Å; H907-D911 PolarHBondContact NE2-OD2 3.45Å; H907-D911 VanDerWaalsContact O-CB 3.3Å; H907-D911 WeakPolarHBondContact O-CB 3.22Å; H907-D911 PolarHBondContact O-N 3.31Å; H907-L1027 HydrophobicContact CB-CD2 3.53Å
908	S	60.4	Low	61.2	Low	17 Å²	17	48.3 Å²	48.3	12%	0.119	22%	0.222	C	C	.	.	H	α-helix	trans	-57.7	-41.3	171.3	-70.1	0	0	0	0	112.6	S904 V905 D911 Y912	S904-S908 PolarHBondContact O-N 2.94Å; S904-S908 PolarHBondContact O-OG 2.92Å; V905-S908 PolarHBondContact O-N 3.28Å; S908-D911 PolarHBondContact O-N 3.14Å; S908-Y912 WeakPolarHBondContact O-CB 3.36Å; S908-Y912 PolarHBondContact O-N 2.99Å
909	V	66.2	Low	62.2	Low	17 Å²	17	47.8 Å²	47.8	10%	0.103	22%	0.219	C	C	.	.	H	α-helix	trans	-65.8	-49	173.4	172.5	0	0	0	0	110.3	L835 L839 V905 H907 D911 Y912 V913 L923	L835-V909 HydrophobicContact CD1-CG2 4.16Å; L839-V909 HydrophobicContact CD2-CG2 4.05Å; V905-V909 HydrophobicContact CG1-CG2 4.19Å; V905-V909 WeakPolarHBondContact O-CB 3.13Å; V905-V909 WeakPolarHBondContact O-CG2 3.45Å; V905-V909 PolarHBondContact O-N 3.45Å; H907-V909 VanDerWaalsContact C-N 3.31Å; H907-V909 PolarHBondContact O-N 3.19Å; V909-D911 PolarHBondContact O-N 3.49Å; V909-Y912 PolarHBondContact O-N 3.34Å; V909-V913 HydrophobicContact CG1-CG2 4.34Å; V909-V913 WeakPolarHBondContact O-CB 3.04Å; V909-V913 WeakPolarHBondContact O-CG2 3.34Å; V909-V913 PolarHBondContact O-N 2.8Å; V909-L923 HydrophobicContact CG1-CD1 3.98Å
910	R	65.9	Low	63.1	Low	79 Å²	79	47.3 Å²	47.3	30%	0.298	22%	0.215	S	C	.	.	H	α-helix	trans	-57.7	-31.8	175.2	-81.8	171.9	-66.8	-167.8	-1.4	112.6	E903 R906 H907 R914	E903-R910 PolarHBondContact O-NH2 3.35Å; E903-R910 IonicContact OE1-CZ 2.96Å; E903-R910 VanDerWaalsContact OE1-CZ 3.3Å; E903-R910 IonicContact OE1-NH1 3.06Å; E903-R910 PolarHBondContact OE1-NH1 3.2Å; E903-R910 IonicContact OE1-NH2 3.59Å; E903-R910 PolarHBondContact OE1-NH2 2.92Å; R906-R910 WeakPolarHBondContact O-CB 3.21Å; R906-R910 WeakPolarHBondContact O-CG 3.1Å; R906-R910 PolarHBondContact O-N 3.15Å; R906-R910 PolarHBondContact O-NE 3.16Å; H907-R910 VanDerWaalsContact N-NH2 3.18Å; H907-R910 CarbonylContact O-C 3.59Å; H907-R910 PolarHBondContact O-N 3.16Å; R910-R914 WeakPolarHBondContact O-CB 3.3Å; R910-R914 VanDerWaalsContact O-CG 3.27Å; R910-R914 WeakPolarHBondContact O-CG 3.47Å; R910-R914 PolarHBondContact O-N 3.05Å
911	D	67.7	Low	63.9	Low	26 Å²	26	48.6 Å²	48.6	14%	0.139	23%	0.226	C	C	.	.	H	α-helix	trans	-88.2	-27.8	-178.7	-77.3	3.6	0	0	0	113.8	H907 S908 V909 R914 R915	H907-D911 IonicContact CD2-OD1 3.48Å; H907-D911 IonicContact CD2-OD2 3.9Å; H907-D911 PolarHBondContact CD2-OD2 2.9Å; H907-D911 IonicContact NE2-OD1 3.86Å; H907-D911 IonicContact NE2-OD2 3.82Å; H907-D911 PolarHBondContact NE2-OD2 3.45Å; H907-D911 VanDerWaalsContact O-CB 3.3Å; H907-D911 WeakPolarHBondContact O-CB 3.22Å; H907-D911 PolarHBondContact O-N 3.31Å; S908-D911 PolarHBondContact O-N 3.14Å; V909-D911 PolarHBondContact O-N 3.49Å; D911-R914 IonicContact OD1-CZ 2.63Å; D911-R914 IonicContact OD1-NE 3.68Å; D911-R914 PolarHBondContact OD1-NE 3.31Å; D911-R914 IonicContact OD1-NH2 2.95Å; D911-R914 PolarHBondContact OD1-NH2 3.01Å; D911-R915 PolarHBondContact O-N 2.82Å; D911-R915 PolarHBondContact O-NE 3.36Å; D911-R915 PolarHBondContact O-NH2 3.42Å
912	Y	69.4	Low	64.5	Low	10 Å²	10	49.8 Å²	49.8	4%	0.039	23%	0.232	C	C	.	.	H	α-helix	trans	-67.3	-52	164.8	-168.9	-85.1	0	0	0	108.5	E831 H832 K834 L835 S908 V909 R914 R915 H916 I919	E831-Y912 PolarHBondContact O-OH 2.84Å; H832-Y912 WeakPolarHBondContact CA-OH 3.46Å; H832-Y912 AromaticContact ND1-CE1 3.87Å; H832-Y912 AromaticContact ND1-CZ 3.89Å; H832-Y912 PolarHBondContact ND1-OH 3.08Å; K834-Y912 HydrophobicContact CB-CE2 4.37Å; L835-Y912 HydrophobicContact CB-CD1 3.97Å; L835-Y912 HydrophobicContact CB-CD2 4.49Å; L835-Y912 HydrophobicContact CB-CE1 3.97Å; L835-Y912 HydrophobicContact CB-CE2 4.49Å; L835-Y912 HydrophobicContact CB-CG 4.26Å; L835-Y912 HydrophobicContact CD1-CD1 4.22Å; L835-Y912 HydrophobicContact CD1-CG 4.03Å; L835-Y912 HydrophobicContact CD2-CD1 3.95Å; L835-Y912 HydrophobicContact CD2-CE1 4.46Å; L835-Y912 HydrophobicContact CG-CD1 4.26Å; S908-Y912 WeakPolarHBondContact O-CB 3.36Å; S908-Y912 PolarHBondContact O-N 2.99Å; V909-Y912 PolarHBondContact O-N 3.34Å; Y912-R914 PolarHBondContact O-N 2.91Å; Y912-R914 VanDerWaalsContact O-N 3.12Å; Y912-R915 PolarHBondContact O-N 3.35Å; Y912-H916 HydrophobicContact CD1-CB 4.02Å; Y912-H916 AromaticContact CD2-CD2 3.87Å; Y912-H916 HydrophobicContact CE1-CB 3.57Å; Y912-H916 AromaticContact CE1-CD2 3.66Å; Y912-H916 AromaticContact CE1-CG 3.68Å; Y912-H916 AromaticContact CE2-CD2 3.41Å; Y912-H916 VanDerWaalsContact CE2-CD2 3.41Å; Y912-H916 WeakPolarHBondContact CE2-CD2 3.34Å; Y912-H916 AromaticContact CE2-NE2 3.79Å; Y912-H916 AromaticContact CZ-CD2 3.27Å; Y912-H916 AromaticContact CZ-CG 3.58Å; Y912-H916 AromaticContact CZ-NE2 3.84Å; Y912-H916 WeakPolarHBondContact O-CB 3.16Å; Y912-H916 PolarHBondContact O-N 3.43Å; Y912-I919 HydrophobicContact CD1-CD1 4.06Å; Y912-I919 HydrophobicContact CD1-CG2 4Å; Y912-I919 HydrophobicContact CE1-CB 4.31Å; Y912-I919 HydrophobicContact CE1-CD1 3.56Å; Y912-I919 HydrophobicContact CE1-CG2 4.09Å
913	V	70.7	Confident	65	Low	7 Å²	7	49.2 Å²	49.2	4%	0.042	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-23.7	171.1	161.9	0	0	0	0	114.7	V909 I919 V920 L923 L1558 K1561	V909-V913 HydrophobicContact CG1-CG2 4.34Å; V909-V913 WeakPolarHBondContact O-CB 3.04Å; V909-V913 WeakPolarHBondContact O-CG2 3.34Å; V909-V913 PolarHBondContact O-N 2.8Å; V913-I919 HydrophobicContact CG2-CG2 3.82Å; V913-V920 HydrophobicContact CG1-CG2 3.88Å; V913-L923 HydrophobicContact CG2-CD1 3.46Å; V913-L923 VanDerWaalsContact CG2-CD1 3.46Å; V913-L1558 HydrophobicContact CB-CD1 4.34Å; V913-L1558 HydrophobicContact CG1-CD1 3.57Å; V913-L1558 HydrophobicContact CG2-CD1 3.73Å; V913-K1561 HydrophobicContact CG1-CD 3.73Å
914	R	71.9	Confident	65.3	Low	154 Å²	154	45.7 Å²	45.7	58%	0.581	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-20.1	173.9	-88.5	-169.8	-84.8	-157.2	1.9	113.5	R910 D911 Y912	R910-R914 WeakPolarHBondContact O-CB 3.3Å; R910-R914 VanDerWaalsContact O-CG 3.27Å; R910-R914 WeakPolarHBondContact O-CG 3.47Å; R910-R914 PolarHBondContact O-N 3.05Å; D911-R914 IonicContact OD1-CZ 2.63Å; D911-R914 IonicContact OD1-NE 3.68Å; D911-R914 PolarHBondContact OD1-NE 3.31Å; D911-R914 IonicContact OD1-NH2 2.95Å; D911-R914 PolarHBondContact OD1-NH2 3.01Å; Y912-R914 PolarHBondContact O-N 2.91Å; Y912-R914 VanDerWaalsContact O-N 3.12Å
915	R	76.6	Confident	65.6	Low	179 Å²	179	47.3 Å²	47.3	68%	0.675	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-31	179.2	-75.1	175.6	-77.1	-170.4	-7.4	112.5	D911 Y912 P917	D911-R915 PolarHBondContact O-N 2.82Å; D911-R915 PolarHBondContact O-NE 3.36Å; D911-R915 PolarHBondContact O-NH2 3.42Å; Y912-R915 PolarHBondContact O-N 3.35Å; R915-P917 WeakPolarHBondContact O-CD 3.25Å
916	H	76.7	Confident	65.1	Low	62 Å²	62	54 Å²	54	29%	0.287	25%	0.247	S	C	.	.			trans	-118	81.5	178.1	-65.7	-76.9	0	0	0	107.6	Y912 D918 I919	Y912-H916 HydrophobicContact CD1-CB 4.02Å; Y912-H916 AromaticContact CD2-CD2 3.87Å; Y912-H916 HydrophobicContact CE1-CB 3.57Å; Y912-H916 AromaticContact CE1-CD2 3.66Å; Y912-H916 AromaticContact CE1-CG 3.68Å; Y912-H916 AromaticContact CE2-CD2 3.41Å; Y912-H916 VanDerWaalsContact CE2-CD2 3.41Å; Y912-H916 WeakPolarHBondContact CE2-CD2 3.34Å; Y912-H916 AromaticContact CE2-NE2 3.79Å; Y912-H916 AromaticContact CZ-CD2 3.27Å; Y912-H916 AromaticContact CZ-CG 3.58Å; Y912-H916 AromaticContact CZ-NE2 3.84Å; Y912-H916 WeakPolarHBondContact O-CB 3.16Å; Y912-H916 PolarHBondContact O-N 3.43Å; H916-D918 WeakPolarHBondContact CA-OD1 3.08Å; H916-D918 WeakPolarHBondContact CB-OD1 3.39Å; H916-D918 IonicContact CG-OD1 3.75Å; H916-D918 IonicContact ND1-OD1 2.74Å; H916-I919 HydrophobicContact CB-CG2 4.44Å; H916-I919 VanDerWaalsContact O-CG2 3.31Å; H916-I919 WeakPolarHBondContact O-CG2 3.12Å; H916-I919 PolarHBondContact O-N 2.94Å
917	P	75.1	Confident	64.6	Low	60 Å²	60	54.9 Å²	54.9	39%	0.39	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-65.5	-31.5	172.4	28.9	-33.3	0	0	0	110.7	R915 I919 V920 E1562	R915-P917 WeakPolarHBondContact O-CD 3.25Å; P917-I919 PolarHBondContact O-N 2.81Å; P917-V920 WeakPolarHBondContact O-CA 3.47Å; P917-V920 WeakPolarHBondContact O-CB 3.47Å; P917-V920 WeakPolarHBondContact O-CG2 3.31Å; P917-V920 PolarHBondContact O-N 3.26Å; P917-E1562 HydrophobicContact CB-CG 4.29Å; P917-E1562 VanDerWaalsContact O-OE1 3.11Å
918	D	70.8	Confident	64.2	Low	66 Å²	66	52.8 Å²	52.8	35%	0.353	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-49	-25.3	171.9	53.9	-35.8	0	0	0	115.9	H832 H916 P921	H832-D918 IonicContact CE1-OD1 3.4Å; H832-D918 IonicContact CE1-OD2 3.17Å; H832-D918 PolarHBondContact CE1-OD2 3Å; H832-D918 IonicContact NE2-OD2 2.72Å; H916-D918 WeakPolarHBondContact CA-OD1 3.08Å; H916-D918 WeakPolarHBondContact CB-OD1 3.39Å; H916-D918 IonicContact CG-OD1 3.75Å; H916-D918 IonicContact ND1-OD1 2.74Å; D918-P921 WeakPolarHBondContact O-CD 3.41Å
919	I	71.7	Confident	63.7	Low	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-85	-9.4	173.7	-148.4	167.4	0	0	0	114.2	W828 H832 L835 Y912 V913 H916 P917 L922 L923	W828-I919 HydrophobicContact CE3-CD1 4.48Å; W828-I919 HydrophobicContact CZ3-CD1 3.96Å; H832-I919 HydrophobicContact CB-CD1 3.77Å; H832-I919 VanDerWaalsContact CD2-CG1 3.48Å; H832-I919 WeakPolarHBondContact CD2-CG1 3.36Å; H832-I919 VanDerWaalsContact CG-CD1 3.48Å; H832-I919 WeakPolarHBondContact NE2-CB 3.27Å; L835-I919 HydrophobicContact CB-CD1 3.99Å; L835-I919 HydrophobicContact CD2-CD1 3.47Å; L835-I919 VanDerWaalsContact CD2-CD1 3.47Å; L835-I919 HydrophobicContact CD2-CG1 4.49Å; L835-I919 HydrophobicContact CG-CD1 4.32Å; Y912-I919 HydrophobicContact CD1-CD1 4.06Å; Y912-I919 HydrophobicContact CD1-CG2 4Å; Y912-I919 HydrophobicContact CE1-CB 4.31Å; Y912-I919 HydrophobicContact CE1-CD1 3.56Å; Y912-I919 HydrophobicContact CE1-CG2 4.09Å; V913-I919 HydrophobicContact CG2-CG2 3.82Å; H916-I919 HydrophobicContact CB-CG2 4.44Å; H916-I919 VanDerWaalsContact O-CG2 3.31Å; H916-I919 WeakPolarHBondContact O-CG2 3.12Å; H916-I919 PolarHBondContact O-N 2.94Å; P917-I919 PolarHBondContact O-N 2.81Å; I919-L922 HydrophobicContact CG1-CB 4.16Å; I919-L922 HydrophobicContact CG1-CD1 4.32Å; I919-L922 PolarHBondContact O-N 3.26Å; I919-L922 VanDerWaalsContact O-N 3.14Å; I919-L923 HydrophobicContact CG1-CG 4.41Å; I919-L923 HydrophobicContact CG2-CD1 4.05Å; I919-L923 PolarHBondContact O-N 3.49Å; I919-L923 VanDerWaalsContact O-N 3.08Å
920	V	67.5	Low	62.6	Low	1 Å²	1	54.3 Å²	54.3	1%	0.006	25%	0.247	C	C	.	.	H	α-helix	trans	-51.5	-53.1	179.6	163.3	0	0	0	0	108.9	V913 P917 L922 L923 Q924 L1558 K1561 E1562	V913-V920 HydrophobicContact CG1-CG2 3.88Å; P917-V920 WeakPolarHBondContact O-CA 3.47Å; P917-V920 WeakPolarHBondContact O-CB 3.47Å; P917-V920 WeakPolarHBondContact O-CG2 3.31Å; P917-V920 PolarHBondContact O-N 3.26Å; V920-L922 PolarHBondContact O-N 2.82Å; V920-L923 PolarHBondContact O-N 2.97Å; V920-Q924 VanDerWaalsContact O-CB 3.31Å; V920-Q924 WeakPolarHBondContact O-CB 2.92Å; V920-Q924 PolarHBondContact O-N 2.8Å; V920-Q924 PolarHBondContact O-NE2 3.26Å; V920-L1558 HydrophobicContact CB-CD1 4.28Å; V920-L1558 HydrophobicContact CB-CG 4.18Å; V920-L1558 HydrophobicContact CG1-CB 4.18Å; V920-L1558 HydrophobicContact CG1-CD1 4.4Å; V920-L1558 HydrophobicContact CG1-CG 3.87Å; V920-L1558 VanDerWaalsContact CG1-O 3.25Å; V920-L1558 WeakPolarHBondContact CG1-O 3.37Å; V920-L1558 HydrophobicContact CG2-CD1 3.98Å; V920-L1558 HydrophobicContact CG2-CG 4.33Å; V920-L1558 VanDerWaalsContact O-CD2 3.29Å; V920-L1558 WeakPolarHBondContact O-CD2 3.41Å; V920-L1558 WeakPolarHBondContact O-CG 3.28Å; V920-K1561 HydrophobicContact CG1-CB 4.39Å; V920-E1562 HydrophobicContact CB-CG 3.93Å; V920-E1562 HydrophobicContact CG1-CB 3.78Å; V920-E1562 HydrophobicContact CG1-CG 3.66Å; V920-E1562 HydrophobicContact CG2-CG 4.31Å
921	P	62.8	Low	61.9	Low	59 Å²	59	52.9 Å²	52.9	38%	0.383	25%	0.247	S	C	.	.	H	α-helix	trans	-62.8	-37.4	177.7	-23.7	37	0	0	0	114.1	D918 L923 Q924 T925 E1562	D918-P921 WeakPolarHBondContact O-CD 3.41Å; P921-L923 PolarHBondContact O-N 3.48Å; P921-Q924 WeakPolarHBondContact O-CB 3.37Å; P921-Q924 PolarHBondContact O-N 3.28Å; P921-T925 PolarHBondContact O-N 3.01Å; P921-E1562 WeakPolarHBondContact CD-OE2 3.41Å; P921-E1562 WeakPolarHBondContact CG-OE2 3.48Å
922	L	61.1	Low	61.2	Low	42 Å²	42	52 Å²	52	22%	0.22	24%	0.243	C	C	.	.	H	α-helix	trans	-66.9	-38.6	-178	-74.7	172.6	0	0	0	112.3	P829 I919 V920 Q924 T925 N928	P829-L922 HydrophobicContact CG-CD1 3.97Å; I919-L922 HydrophobicContact CG1-CB 4.16Å; I919-L922 HydrophobicContact CG1-CD1 4.32Å; I919-L922 PolarHBondContact O-N 3.26Å; I919-L922 VanDerWaalsContact O-N 3.14Å; V920-L922 PolarHBondContact O-N 2.82Å; L922-Q924 PolarHBondContact O-N 3.5Å; L922-T925 PolarHBondContact O-OG1 3.42Å; L922-N928 PolarHBondContact O-ND2 2.88Å
923	L	62.8	Low	60.4	Low	10 Å²	10	52.7 Å²	52.7	5%	0.052	25%	0.247	C	C	.	.	H	α-helix	trans	-77.1	-10.3	173.2	-64.3	173.6	0	0	0	113	W828 L835 L839 V909 V913 I919 V920 P921 N928 K929 L1558	W828-L923 HydrophobicContact CH2-CD2 4.27Å; L835-L923 HydrophobicContact CD2-CD1 3.82Å; L835-L923 HydrophobicContact CD2-CD2 4.05Å; L835-L923 HydrophobicContact CD2-CG 4.34Å; L839-L923 HydrophobicContact CD1-CD2 4.36Å; V909-L923 HydrophobicContact CG1-CD1 3.98Å; V913-L923 HydrophobicContact CG2-CD1 3.46Å; V913-L923 VanDerWaalsContact CG2-CD1 3.46Å; I919-L923 HydrophobicContact CG1-CG 4.41Å; I919-L923 HydrophobicContact CG2-CD1 4.05Å; I919-L923 PolarHBondContact O-N 3.49Å; I919-L923 VanDerWaalsContact O-N 3.08Å; V920-L923 PolarHBondContact O-N 2.97Å; P921-L923 PolarHBondContact O-N 3.48Å; L923-N928 WeakPolarHBondContact O-CB 3.13Å; L923-K929 WeakPolarHBondContact O-CA 3.49Å; L923-K929 VanDerWaalsContact O-CB 3.3Å; L923-K929 WeakPolarHBondContact O-CB 3.39Å; L923-K929 WeakPolarHBondContact O-CG 3.41Å; L923-K929 PolarHBondContact O-N 2.9Å; L923-L1558 HydrophobicContact CB-CD1 4.4Å; L923-L1558 HydrophobicContact CB-CD2 3.72Å; L923-L1558 HydrophobicContact CD1-CD1 4.49Å
924	Q	53.9	Low	59.5	Low	26 Å²	26	55.6 Å²	55.6	12%	0.121	26%	0.26	C	S	.	.	H	α-helix	trans	-89.8	-27.9	-169.7	-138.6	148.1	101.2	0	0	115.2	V920 P921 L922 R926 F1555 L1558 L1559	V920-Q924 VanDerWaalsContact O-CB 3.31Å; V920-Q924 WeakPolarHBondContact O-CB 2.92Å; V920-Q924 PolarHBondContact O-N 2.8Å; V920-Q924 PolarHBondContact O-NE2 3.26Å; P921-Q924 WeakPolarHBondContact O-CB 3.37Å; P921-Q924 PolarHBondContact O-N 3.28Å; L922-Q924 PolarHBondContact O-N 3.5Å; Q924-R926 PolarHBondContact O-N 3Å; Q924-F1555 VanDerWaalsContact O-CD1 3.25Å; Q924-F1555 WeakPolarHBondContact O-CD1 3.47Å; Q924-F1555 VanDerWaalsContact O-CE1 3.29Å; Q924-F1555 WeakPolarHBondContact O-CE1 3.2Å; Q924-L1558 HydrophobicContact CB-CD2 4Å; Q924-L1558 HydrophobicContact CG-CD2 3.96Å; Q924-L1558 HydrophobicContact CG-CG 4.49Å; Q924-L1558 VanDerWaalsContact NE2-CG 3.33Å; Q924-L1558 PolarHBondContact NE2-O 3.49Å; Q924-L1558 VanDerWaalsContact NE2-O 3.17Å; Q924-L1559 VanDerWaalsContact CD-CA 3.47Å; Q924-L1559 HydrophobicContact CG-CG 4.01Å
925	T	53.5	Low	58.6	Low	50 Å²	50	48.3 Å²	48.3	31%	0.307	23%	0.233	S	C	.	.	S	Bend	trans	-48.4	132.3	-179.4	52.2	0	0	0	0	108.3	P921 L922 H927 N928 F1555	P921-T925 PolarHBondContact O-N 3.01Å; L922-T925 PolarHBondContact O-OG1 3.42Å; T925-H927 CarbonylContact O-C 3.4Å; T925-H927 PolarHBondContact O-N 2.76Å; T925-N928 PolarHBondContact O-N 3.41Å; T925-N928 PolarHBondContact OG1-ND2 3.2Å; T925-N928 VanDerWaalsContact OG1-ND2 3.15Å; T925-F1555 VanDerWaalsContact O-CE1 3.25Å; T925-F1555 WeakPolarHBondContact O-CE1 3.48Å
926	R	43.4	Very low	57.6	Low	144 Å²	144	40.1 Å²	40.1	54%	0.543	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48	-2.9	-158.9	-164.3	169.6	174.3	169.9	-5.6	118.1	S271 Q924 F1555	S271-R926 PolarHBondContact OG-NH2 3.06Å; Q924-R926 PolarHBondContact O-N 3Å; R926-F1555 WeakPolarHBondContact O-CE2 3.43Å; R926-F1555 WeakPolarHBondContact O-CZ 2.99Å
927	H	48.8	Very low	56.7	Low	85 Å²	85	39 Å²	39	39%	0.394	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-32.4	176.9	-52.9	108.6	0	0	0	113.4	Y822 T925 K929 V931	Y822-H927 HydrophobicContact CE1-CB 3.87Å; Y822-H927 HydrophobicContact CE2-CB 4.33Å; Y822-H927 WeakPolarHBondContact OH-CB 3.41Å; T925-H927 CarbonylContact O-C 3.4Å; T925-H927 PolarHBondContact O-N 2.76Å; H927-K929 PolarHBondContact O-N 2.97Å; H927-V931 WeakPolarHBondContact O-CB 3.18Å; H927-V931 WeakPolarHBondContact O-CG2 3.29Å; H927-V931 PolarHBondContact O-N 3.38Å
928	N	52.2	Low	55.8	Low	15 Å²	15	39.2 Å²	39.2	8%	0.08	19%	0.193	C	C	.	.	H	α-helix	trans	-66.4	-41.9	-168.5	-94.1	-16.3	0	0	0	115.6	Y822 L823 L922 L923 T925	Y822-N928 WeakPolarHBondContact CE2-OD1 3.43Å; Y822-N928 WeakPolarHBondContact OH-CA 3.44Å; Y822-N928 PolarHBondContact OH-N 2.69Å; Y822-N928 PolarHBondContact OH-OD1 2.83Å; L823-N928 WeakPolarHBondContact CD2-OD1 3.48Å; L823-N928 WeakPolarHBondContact CG-OD1 2.92Å; L922-N928 PolarHBondContact O-ND2 2.88Å; L923-N928 WeakPolarHBondContact O-CB 3.13Å; T925-N928 PolarHBondContact O-N 3.41Å; T925-N928 PolarHBondContact OG1-ND2 3.2Å; T925-N928 VanDerWaalsContact OG1-ND2 3.15Å
929	K	48	Very low	55.2	Low	14 Å²	14	36.7 Å²	36.7	6%	0.061	18%	0.179	C	C	.	.	H	α-helix	trans	-70	-41.1	-165.2	-130.6	-160.7	169.4	-169.9	0	113.8	L923 H927 F1554 F1555 N1557 L1558	L923-K929 WeakPolarHBondContact O-CA 3.49Å; L923-K929 VanDerWaalsContact O-CB 3.3Å; L923-K929 WeakPolarHBondContact O-CB 3.39Å; L923-K929 WeakPolarHBondContact O-CG 3.41Å; L923-K929 PolarHBondContact O-N 2.9Å; H927-K929 PolarHBondContact O-N 2.97Å; K929-F1554 HydrophobicContact CB-CD1 3.84Å; K929-F1554 HydrophobicContact CB-CE1 4.3Å; K929-F1554 HydrophobicContact CD-CB 4.05Å; K929-F1554 HydrophobicContact CD-CD1 3.37Å; K929-F1554 HydrophobicContact CD-CD2 4Å; K929-F1554 HydrophobicContact CD-CE1 3.76Å; K929-F1554 HydrophobicContact CD-CE2 4.32Å; K929-F1554 HydrophobicContact CD-CG 3.48Å; K929-F1554 VanDerWaalsContact CD-CG 3.48Å; K929-F1554 HydrophobicContact CD-CZ 4.21Å; K929-F1554 WeakPolarHBondContact CD-O 3.23Å; K929-F1554 VanDerWaalsContact CE-CD2 3.45Å; K929-F1554 VanDerWaalsContact CE-CE2 3.41Å; K929-F1554 VanDerWaalsContact CE-CG 3.49Å; K929-F1554 VanDerWaalsContact CE-CZ 3.45Å; K929-F1554 WeakPolarHBondContact CE-O 3.32Å; K929-F1554 HydrophobicContact CG-CD1 3.39Å; K929-F1554 HydrophobicContact CG-CE1 3.51Å; K929-F1554 HydrophobicContact CG-CG 4.07Å; K929-F1554 HydrophobicContact CG-CZ 4.27Å; K929-F1554 PolarHBondContact NZ-O 3.27Å; K929-F1554 WeakPolarHBondContact O-CD1 3.44Å; K929-F1554 VanDerWaalsContact O-CE1 3.31Å; K929-F1554 WeakPolarHBondContact O-CE1 3.43Å; K929-F1555 HydrophobicContact CB-CD1 3.68Å; K929-F1555 HydrophobicContact CB-CE1 3.38Å; K929-F1555 HydrophobicContact CB-CE2 4.35Å; K929-F1555 HydrophobicContact CB-CG 4.26Å; K929-F1555 HydrophobicContact CB-CZ 3.73Å; K929-F1555 VanDerWaalsContact N-CZ 3.33Å; K929-N1557 PolarHBondContact NZ-O 2.99Å; K929-L1558 HydrophobicContact CD-CB 4.35Å; K929-L1558 HydrophobicContact CD-CD2 3.45Å; K929-L1558 VanDerWaalsContact CD-CD2 3.45Å; K929-L1558 HydrophobicContact CD-CG 4.36Å; K929-L1558 HydrophobicContact CG-CD2 3.65Å
930	F	44.9	Very low	54.6	Low	51 Å²	51	39.1 Å²	39.1	22%	0.224	19%	0.188	C	C	.	.	H	α-helix	trans	-100.5	-42.7	177.9	-84.4	-65.7	0	0	0	114.2	L932 I933 E934 D1551 F1552 F1554 F1555	F930-L932 PolarHBondContact O-N 3.25Å; F930-L932 VanDerWaalsContact O-N 3.15Å; F930-I933 PolarHBondContact O-N 3.44Å; F930-E934 PolarHBondContact O-N 3.48Å; F930-D1551 WeakPolarHBondContact CE1-O 3.41Å; F930-D1551 WeakPolarHBondContact CZ-O 3.45Å; F930-F1552 VanDerWaalsContact CE2-C 3.42Å; F930-F1552 WeakPolarHBondContact CE2-O 3.45Å; F930-F1552 VanDerWaalsContact CZ-C 3.41Å; F930-F1554 HydrophobicContact CD1-CB 4.19Å; F930-F1554 HydrophobicContact CD2-CB 3.96Å; F930-F1554 HydrophobicContact CE1-CB 3.61Å; F930-F1554 HydrophobicContact CE2-CB 3.35Å; F930-F1554 HydrophobicContact CG-CB 4.35Å; F930-F1554 HydrophobicContact CZ-CB 3.16Å; F930-F1554 HydrophobicContact CZ-CG 4.44Å; F930-F1555 HydrophobicContact CB-CE2 4.12Å; F930-F1555 AromaticContact CD2-CD2 3.64Å; F930-F1555 HydrophobicContact CD2-CD2 3.64Å; F930-F1555 AromaticContact CD2-CE2 3.82Å; F930-F1555 HydrophobicContact CD2-CE2 3.82Å; F930-F1555 HydrophobicContact CE2-CD2 4.3Å; F930-F1555 HydrophobicContact CG-CE2 4.46Å
931	V	50.9	Low	54.2	Low	49 Å²	49	42.5 Å²	42.5	30%	0.297	21%	0.205	S	C	.	.	H	α-helix	trans	-66.2	-28.4	-162.2	-172.2	0	0	0	0	110.8	Y820 H927 G935	Y820-V931 HydrophobicContact CE1-CB 4.4Å; Y820-V931 HydrophobicContact CE1-CG1 3.82Å; Y820-V931 VanDerWaalsContact CE1-O 3.22Å; Y820-V931 WeakPolarHBondContact CE1-O 3.3Å; Y820-V931 VanDerWaalsContact OH-CG1 3.31Å; Y820-V931 WeakPolarHBondContact OH-CG1 3.49Å; Y820-V931 PolarHBondContact OH-O 2.98Å; H927-V931 WeakPolarHBondContact O-CB 3.18Å; H927-V931 WeakPolarHBondContact O-CG2 3.29Å; H927-V931 PolarHBondContact O-N 3.38Å; V931-G935 WeakPolarHBondContact O-CA 3.12Å; V931-G935 PolarHBondContact O-N 3.44Å
932	L	52.1	Low	53.9	Low	9 Å²	9	39.9 Å²	39.9	5%	0.047	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-51	168.9	-96.1	172.7	0	0	0	112.9	Y820 L823 L839 L841 I844 F930 G935 L936	Y820-L932 HydrophobicContact CD1-CD2 4.04Å; Y820-L932 HydrophobicContact CD1-CG 4.36Å; Y820-L932 HydrophobicContact CE1-CD2 4.47Å; L823-L932 HydrophobicContact CD1-CD1 3.87Å; L823-L932 HydrophobicContact CD1-CD2 3.87Å; L823-L932 HydrophobicContact CD1-CG 3.69Å; L823-L932 HydrophobicContact CD2-CD1 3.74Å; L823-L932 HydrophobicContact CG-CD1 4.47Å; L839-L932 HydrophobicContact CD1-CD1 4.28Å; L841-L932 HydrophobicContact CD2-CD1 4.15Å; L841-L932 HydrophobicContact CD2-CD2 3.85Å; I844-L932 HydrophobicContact CD1-CD2 4.41Å; F930-L932 PolarHBondContact O-N 3.25Å; F930-L932 VanDerWaalsContact O-N 3.15Å; L932-G935 PolarHBondContact O-N 2.89Å; L932-L936 HydrophobicContact CD2-CD1 4.37Å; L932-L936 WeakPolarHBondContact O-CB 3.41Å; L932-L936 WeakPolarHBondContact O-CD1 3.25Å; L932-L936 WeakPolarHBondContact O-CG 3.5Å; L932-L936 PolarHBondContact O-N 3.45Å
933	I	52.3	Low	54.1	Low	23 Å²	23	38.8 Å²	38.8	12%	0.118	18%	0.181	C	C	.	.	H	α-helix	trans	-69	-37.9	-176.6	-80.2	175.2	0	0	0	111.4	L902 R906 F930 K937	L902-I933 HydrophobicContact CD1-CG2 3.91Å; L902-I933 HydrophobicContact CD2-CB 4.47Å; L902-I933 HydrophobicContact CD2-CG1 4.26Å; L902-I933 HydrophobicContact CD2-CG2 3.83Å; L902-I933 HydrophobicContact CG-CG2 4.42Å; R906-I933 HydrophobicContact CG-CD1 3.67Å; F930-I933 PolarHBondContact O-N 3.44Å; I933-K937 PolarHBondContact O-N 2.83Å
934	E	52.2	Low	54.2	Low	68 Å²	68	40.9 Å²	40.9	32%	0.318	19%	0.19	S	C	.	.	H	α-helix	trans	-75.7	-37.3	177.6	-147.1	60.5	-146.6	0	0	111.7	F930 L936 K937 Q938	F930-E934 PolarHBondContact O-N 3.48Å; E934-L936 PolarHBondContact O-N 3.45Å; E934-K937 WeakPolarHBondContact O-CA 3.48Å; E934-K937 WeakPolarHBondContact O-CB 3.29Å; E934-K937 PolarHBondContact O-N 3.4Å; E934-K937 VanDerWaalsContact O-N 3.08Å; E934-K937 WeakPolarHBondContact OE1-CD 3.25Å; E934-K937 IonicContact OE1-NZ 3.03Å; E934-K937 PolarHBondContact OE1-NZ 2.91Å; E934-K937 IonicContact OE2-NZ 2.71Å; E934-K937 PolarHBondContact OE2-NZ 3.06Å; E934-Q938 PolarHBondContact O-N 3.36Å
935	G	53.8	Low	54.9	Low	1 Å²	1	40.6 Å²	40.6	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-60.5	-41.2	172.2	0	0	0	0	0	113.6	Y820 V931 L932 K937 Q938 M939	Y820-G935 WeakPolarHBondContact OH-CA 3.42Å; V931-G935 WeakPolarHBondContact O-CA 3.12Å; V931-G935 PolarHBondContact O-N 3.44Å; L932-G935 PolarHBondContact O-N 2.89Å; G935-K937 PolarHBondContact O-N 3.21Å; G935-Q938 PolarHBondContact O-N 3.03Å; G935-M939 WeakPolarHBondContact O-CB 3.29Å; G935-M939 WeakPolarHBondContact O-CG 3.31Å; G935-M939 PolarHBondContact O-N 3.48Å
936	L	55.9	Low	56	Low	8 Å²	8	38.4 Å²	38.4	4%	0.042	18%	0.176	C	C	.	.	H	α-helix	trans	-71.2	-13.2	176.6	-65	166	0	0	0	112.9	L896 S899 N900 L932 E934 M939	L896-L936 HydrophobicContact CB-CD2 3.78Å; L896-L936 HydrophobicContact CD2-CD2 3.58Å; L896-L936 HydrophobicContact CG-CD2 4.25Å; S899-L936 WeakPolarHBondContact OG-CB 3.34Å; N900-L936 PolarHBondContact ND2-O 3.48Å; L932-L936 HydrophobicContact CD2-CD1 4.37Å; L932-L936 WeakPolarHBondContact O-CB 3.41Å; L932-L936 WeakPolarHBondContact O-CD1 3.25Å; L932-L936 WeakPolarHBondContact O-CG 3.5Å; L932-L936 PolarHBondContact O-N 3.45Å; E934-L936 PolarHBondContact O-N 3.45Å; L936-M939 HydrophobicContact CD2-CE 4.27Å; L936-M939 HydrophobicContact CD2-SD 4.11Å
937	K	56.2	Low	57.6	Low	37 Å²	37	32.6 Å²	32.6	16%	0.161	16%	0.157	C	C	.	.	H	α-helix	trans	-84.3	-42	161	-63.3	163.5	169.8	173.6	0	112.1	L902 I933 E934 G935 R940 I941	L902-K937 HydrophobicContact CD1-CG 4.37Å; I933-K937 PolarHBondContact O-N 2.83Å; E934-K937 WeakPolarHBondContact O-CA 3.48Å; E934-K937 WeakPolarHBondContact O-CB 3.29Å; E934-K937 PolarHBondContact O-N 3.4Å; E934-K937 VanDerWaalsContact O-N 3.08Å; E934-K937 WeakPolarHBondContact OE1-CD 3.25Å; E934-K937 IonicContact OE1-NZ 3.03Å; E934-K937 PolarHBondContact OE1-NZ 2.91Å; E934-K937 IonicContact OE2-NZ 2.71Å; E934-K937 PolarHBondContact OE2-NZ 3.06Å; G935-K937 PolarHBondContact O-N 3.21Å; K937-R940 CarbonylContact O-C 3.58Å; K937-R940 WeakPolarHBondContact O-CA 3.34Å; K937-R940 VanDerWaalsContact O-CB 3.25Å; K937-R940 WeakPolarHBondContact O-CB 3.41Å; K937-R940 PolarHBondContact O-N 2.91Å; K937-I941 WeakPolarHBondContact O-CG1 3.12Å; K937-I941 PolarHBondContact O-N 3.34Å
938	Q	57.8	Low	59	Low	66 Å²	66	32.7 Å²	32.7	31%	0.308	16%	0.159	S	C	.	.	H	α-helix	trans	-65	-41.2	-179.7	-70.7	-178.1	5.3	0	0	111.7	H816 E934 G935 R940 I941 L942	H816-Q938 PolarHBondContact CE1-OE1 3.26Å; H816-Q938 PolarHBondContact NE2-OE1 3.4Å; E934-Q938 PolarHBondContact O-N 3.36Å; G935-Q938 PolarHBondContact O-N 3.03Å; Q938-R940 PolarHBondContact O-N 3.1Å; Q938-I941 PolarHBondContact O-N 3.03Å; Q938-L942 PolarHBondContact O-N 3.16Å
939	M	58.5	Low	60.4	Low	13 Å²	13	32.6 Å²	32.6	6%	0.064	16%	0.159	C	C	.	.	H	α-helix	trans	-54	-40.6	166.2	-72.9	-167.4	-157.6	0	0	112.2	L817 Y820 L847 L896 G935 L936 Y943	L817-M939 HydrophobicContact CD2-CE 3.41Å; L817-M939 VanDerWaalsContact CD2-CE 3.41Å; L817-M939 HydrophobicContact CD2-SD 4.27Å; L817-M939 HydrophobicContact CG-CE 4.33Å; Y820-M939 HydrophobicContact CD2-CE 4.38Å; L847-M939 HydrophobicContact CD1-SD 4.27Å; L896-M939 HydrophobicContact CB-SD 4.44Å; L896-M939 HydrophobicContact CD1-SD 4.19Å; G935-M939 WeakPolarHBondContact O-CB 3.29Å; G935-M939 WeakPolarHBondContact O-CG 3.31Å; G935-M939 PolarHBondContact O-N 3.48Å; L936-M939 HydrophobicContact CD2-CE 4.27Å; L936-M939 HydrophobicContact CD2-SD 4.11Å; M939-Y943 WeakPolarHBondContact O-CB 3.37Å; M939-Y943 PolarHBondContact O-N 2.72Å
940	R	59.1	Low	62.2	Low	50 Å²	50	31.9 Å²	31.9	19%	0.189	16%	0.156	C	C	.	.	H	α-helix	trans	-64.1	-52	176.3	-176.2	-176.7	177.3	176.7	2.2	110.4	K937 Q938 L942 Y943 F944 D986 M990	K937-R940 CarbonylContact O-C 3.58Å; K937-R940 WeakPolarHBondContact O-CA 3.34Å; K937-R940 VanDerWaalsContact O-CB 3.25Å; K937-R940 WeakPolarHBondContact O-CB 3.41Å; K937-R940 PolarHBondContact O-N 2.91Å; Q938-R940 PolarHBondContact O-N 3.1Å; R940-L942 VanDerWaalsContact C-N 3.27Å; R940-L942 PolarHBondContact O-N 2.97Å; R940-Y943 PolarHBondContact O-N 3.49Å; R940-F944 HydrophobicContact CG-CD2 3.53Å; R940-F944 HydrophobicContact CG-CE2 3.7Å; R940-F944 VanDerWaalsContact O-CD2 3.31Å; R940-F944 WeakPolarHBondContact O-CD2 2.92Å; R940-F944 PolarHBondContact O-N 3.3Å; R940-D986 IonicContact CZ-OD1 2.89Å; R940-D986 IonicContact NH2-OD1 3.18Å; R940-D986 PolarHBondContact NH2-OD1 3.3Å; R940-M990 PolarHBondContact NH1-SD 3.39Å; R940-M990 VanDerWaalsContact NH2-CG 3.3Å; R940-M990 PolarHBondContact NH2-SD 3.09Å; R940-M990 VanDerWaalsContact NH2-SD 3.43Å
941	I	58.9	Low	64.2	Low	73 Å²	73	31.7 Å²	31.7	37%	0.374	16%	0.157	S	C	.	.	H	α-helix	trans	-52.5	-48.3	178.7	-67.6	166.9	0	0	0	109.9	K937 Q938 N945	K937-I941 WeakPolarHBondContact O-CG1 3.12Å; K937-I941 PolarHBondContact O-N 3.34Å; Q938-I941 PolarHBondContact O-N 3.03Å; I941-N945 WeakPolarHBondContact CG2-ND2 3.21Å; I941-N945 WeakPolarHBondContact O-CB 3.39Å; I941-N945 PolarHBondContact O-N 3.45Å; I941-N945 PolarHBondContact O-ND2 3Å; I941-N945 PolarHBondContact O-OD1 3.33Å
942	L	56.6	Low	65.9	Low	3 Å²	3	32.8 Å²	32.8	2%	0.016	16%	0.161	C	C	.	.	H	α-helix	trans	-74.1	-35.5	-177.6	-75.3	148.5	0	0	0	113.9	L755 K809 Y812 M813 Q938 R940 N945 L946	L755-L942 HydrophobicContact CD1-CD1 4.41Å; L755-L942 HydrophobicContact CD1-CD2 4.39Å; K809-L942 HydrophobicContact CB-CD2 4.5Å; Y812-L942 HydrophobicContact CD1-CD1 3.86Å; Y812-L942 HydrophobicContact CE1-CD1 3.65Å; M813-L942 HydrophobicContact CE-CB 4.27Å; M813-L942 HydrophobicContact CE-CD1 3.54Å; M813-L942 HydrophobicContact CE-CG 4.49Å; M813-L942 HydrophobicContact CG-CB 4.23Å; M813-L942 HydrophobicContact CG-CD1 4.35Å; M813-L942 HydrophobicContact SD-CB 3.46Å; M813-L942 WeakPolarHBondContact SD-CB 3.33Å; M813-L942 HydrophobicContact SD-CD1 3.83Å; M813-L942 HydrophobicContact SD-CG 4.16Å; Q938-L942 PolarHBondContact O-N 3.16Å; R940-L942 VanDerWaalsContact C-N 3.27Å; R940-L942 PolarHBondContact O-N 2.97Å; L942-N945 PolarHBondContact O-N 3.11Å; L942-L946 WeakPolarHBondContact O-CD1 3.38Å; L942-L946 WeakPolarHBondContact O-CG 3.17Å; L942-L946 PolarHBondContact O-N 3.31Å
943	Y	64.8	Low	67.5	Low	19 Å²	19	32.4 Å²	32.4	8%	0.075	16%	0.159	C	C	.	.	H	α-helix	trans	-61	-44.3	172.2	177.9	-96.7	0	0	0	112	W889 C893 M939 R940 P947 L981	W889-Y943 HydrophobicContact CZ2-CD2 4.22Å; W889-Y943 AromaticContact NE1-CD2 3.78Å; C893-Y943 HydrophobicContact CB-CD2 3.52Å; C893-Y943 HydrophobicContact CB-CE2 3.55Å; C893-Y943 HydrophobicContact CB-CG 4.25Å; M939-Y943 WeakPolarHBondContact O-CB 3.37Å; M939-Y943 PolarHBondContact O-N 2.72Å; R940-Y943 PolarHBondContact O-N 3.49Å; Y943-P947 VanDerWaalsContact O-CD 3.3Å; Y943-P947 WeakPolarHBondContact O-CD 3.44Å; Y943-L981 HydrophobicContact CE2-CD1 3.93Å
944	F	63.6	Low	69.2	Low	55 Å²	55	31.4 Å²	31.4	24%	0.241	15%	0.154	C	C	.	.	H	α-helix	trans	-78.2	-23	177.4	-76.1	-78.4	0	0	0	113.3	R940 P947 I985 D986	R940-F944 HydrophobicContact CG-CD2 3.53Å; R940-F944 HydrophobicContact CG-CE2 3.7Å; R940-F944 VanDerWaalsContact O-CD2 3.31Å; R940-F944 WeakPolarHBondContact O-CD2 2.92Å; R940-F944 PolarHBondContact O-N 3.3Å; F944-P947 WeakPolarHBondContact O-CD 3.04Å; F944-I985 HydrophobicContact CE2-CG2 4.43Å; F944-I985 HydrophobicContact CZ-CB 4.18Å; F944-I985 HydrophobicContact CZ-CD1 4.39Å; F944-I985 HydrophobicContact CZ-CG2 4.06Å; F944-D986 WeakPolarHBondContact CE1-OD2 3.44Å; F944-D986 WeakPolarHBondContact CZ-OD2 3.24Å
945	N	68.9	Low	70.9	Confident	20 Å²	20	33.5 Å²	33.5	11%	0.107	16%	0.162	C	C	.	.	H	α-helix	trans	-83.2	-23.8	175.6	-72.1	-9.9	0	0	0	114	V756 I941 L942 L948 I949	V756-N945 WeakPolarHBondContact CB-ND2 3.28Å; V756-N945 WeakPolarHBondContact CG2-ND2 3.43Å; I941-N945 WeakPolarHBondContact CG2-ND2 3.21Å; I941-N945 WeakPolarHBondContact O-CB 3.39Å; I941-N945 PolarHBondContact O-N 3.45Å; I941-N945 PolarHBondContact O-ND2 3Å; I941-N945 PolarHBondContact O-OD1 3.33Å; L942-N945 PolarHBondContact O-N 3.11Å; N945-L948 CarbonylContact O-C 3.55Å; N945-L948 WeakPolarHBondContact O-CA 3.28Å; N945-L948 WeakPolarHBondContact O-CB 3.19Å; N945-L948 PolarHBondContact O-N 3.07Å; N945-I949 HydrophobicContact CB-CD1 4.29Å; N945-I949 WeakPolarHBondContact O-CG1 3.16Å; N945-I949 PolarHBondContact O-N 3.22Å
946	L	76.4	Confident	72.4	Confident	4 Å²	4	35.2 Å²	35.2	2%	0.021	17%	0.171	C	C	.	.	H	α-helix	trans	-56	-42.7	177.3	-86.4	156.8	0	0	0	114.1	F806 T810 F851 W889 L942 L948 I949 A950 L978	F806-L946 HydrophobicContact CD2-CD2 4.15Å; F806-L946 HydrophobicContact CE2-CD2 3.57Å; F806-L946 HydrophobicContact CZ-CD2 4.07Å; T810-L946 HydrophobicContact CG2-CD2 4.47Å; F851-L946 HydrophobicContact CE1-CD1 4.37Å; W889-L946 HydrophobicContact CH2-CD1 3.88Å; W889-L946 HydrophobicContact CZ2-CD1 3.65Å; L942-L946 WeakPolarHBondContact O-CD1 3.38Å; L942-L946 WeakPolarHBondContact O-CG 3.17Å; L942-L946 PolarHBondContact O-N 3.31Å; L946-L948 VanDerWaalsContact C-N 3.29Å; L946-L948 PolarHBondContact O-N 2.83Å; L946-I949 PolarHBondContact O-N 2.74Å; L946-A950 WeakPolarHBondContact O-CB 3.33Å; L946-A950 PolarHBondContact O-N 2.99Å; L946-L978 HydrophobicContact CB-CD1 4.43Å
947	P	78.5	Confident	73.9	Confident	22 Å²	22	34.8 Å²	34.8	14%	0.143	17%	0.169	C	C	.	.	H	α-helix	trans	-59.3	-33.9	167.6	-20	26.4	0	0	0	114.3	Y943 F944 N951 Q975 L978	Y943-P947 VanDerWaalsContact O-CD 3.3Å; Y943-P947 WeakPolarHBondContact O-CD 3.44Å; F944-P947 WeakPolarHBondContact O-CD 3.04Å; P947-N951 WeakPolarHBondContact O-CB 3.25Å; P947-N951 PolarHBondContact O-N 3.19Å; P947-N951 VanDerWaalsContact O-N 3.1Å; P947-Q975 WeakPolarHBondContact O-CG 3.18Å; P947-L978 HydrophobicContact CB-CB 4.24Å; P947-L978 HydrophobicContact CG-CB 3.93Å
948	L	78.4	Confident	75.2	Confident	86 Å²	86	37.7 Å²	37.7	45%	0.45	18%	0.183	S	C	.	.	H	α-helix	trans	-75.8	-40.4	180	-60	178.3	0	0	0	111.7	N945 L946 N951 N952	N945-L948 CarbonylContact O-C 3.55Å; N945-L948 WeakPolarHBondContact O-CA 3.28Å; N945-L948 WeakPolarHBondContact O-CB 3.19Å; N945-L948 PolarHBondContact O-N 3.07Å; L946-L948 VanDerWaalsContact C-N 3.29Å; L946-L948 PolarHBondContact O-N 2.83Å; L948-N951 WeakPolarHBondContact O-CB 3.45Å; L948-N951 PolarHBondContact O-N 3.04Å; L948-N952 VanDerWaalsContact O-CG 3.24Å; L948-N952 PolarHBondContact O-N 2.99Å; L948-N952 PolarHBondContact O-OD1 3.38Å
949	I	81.1	Confident	76.4	Confident	13 Å²	13	43.2 Å²	43.2	7%	0.067	21%	0.206	C	C	.	.	H	α-helix	trans	-61.5	-47.2	173.8	-64	154.4	0	0	0	109.5	E805 F806 K809 N945 L946 N951 N952 I953	E805-I949 HydrophobicContact CG-CG2 4.4Å; F806-I949 HydrophobicContact CB-CG2 4.5Å; F806-I949 HydrophobicContact CD2-CG2 4.18Å; K809-I949 HydrophobicContact CB-CD1 4.24Å; K809-I949 HydrophobicContact CG-CD1 3.76Å; N945-I949 HydrophobicContact CB-CD1 4.29Å; N945-I949 WeakPolarHBondContact O-CG1 3.16Å; N945-I949 PolarHBondContact O-N 3.22Å; L946-I949 PolarHBondContact O-N 2.74Å; I949-N951 VanDerWaalsContact C-N 3.28Å; I949-N951 PolarHBondContact O-N 2.71Å; I949-N952 PolarHBondContact O-N 3.26Å; I949-N952 VanDerWaalsContact O-N 3.16Å; I949-I953 HydrophobicContact CG2-CD1 3.79Å; I949-I953 HydrophobicContact CG2-CG1 4.41Å; I949-I953 WeakPolarHBondContact O-CB 3.33Å; I949-I953 WeakPolarHBondContact O-CG1 3.4Å; I949-I953 PolarHBondContact O-N 3.32Å
950	A	85	Confident	77.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.2	-36	174.9	0	0	0	0	0	113	L946 A954 W971 I974 Q975 L978	L946-A950 WeakPolarHBondContact O-CB 3.33Å; L946-A950 PolarHBondContact O-N 2.99Å; A950-A954 WeakPolarHBondContact O-CB 3.4Å; A950-A954 PolarHBondContact O-N 2.78Å; A950-W971 HydrophobicContact CB-CE3 3.97Å; A950-W971 HydrophobicContact CB-CZ3 4.31Å; A950-I974 HydrophobicContact CB-CG2 4.17Å; A950-Q975 HydrophobicContact CB-CB 3.89Å; A950-L978 HydrophobicContact CB-CD1 4.23Å
951	N	86.6	Confident	78	Confident	47 Å²	47	46.9 Å²	46.9	25%	0.251	22%	0.219	S	C	.	.	H	α-helix	trans	-67.2	-43	173.8	-166.1	7.3	0	0	0	112.2	P947 L948 I949 A954 K955 Q975	P947-N951 WeakPolarHBondContact O-CB 3.25Å; P947-N951 PolarHBondContact O-N 3.19Å; P947-N951 VanDerWaalsContact O-N 3.1Å; L948-N951 WeakPolarHBondContact O-CB 3.45Å; L948-N951 PolarHBondContact O-N 3.04Å; I949-N951 VanDerWaalsContact C-N 3.28Å; I949-N951 PolarHBondContact O-N 2.71Å; N951-A954 PolarHBondContact O-N 2.68Å; N951-K955 WeakPolarHBondContact O-CB 3.26Å; N951-K955 VanDerWaalsContact O-CG 3.28Å; N951-K955 WeakPolarHBondContact O-CG 3.49Å; N951-K955 PolarHBondContact O-N 2.72Å; N951-K955 WeakPolarHBondContact OD1-CE 3.28Å; N951-Q975 HydrophobicContact CB-CG 3.95Å
952	N	86.5	Confident	79	Confident	72 Å²	72	51.9 Å²	51.9	39%	0.385	24%	0.238	S	C	.	.	H	α-helix	trans	-66.2	-44.7	178.4	-69.3	-8.5	0	0	0	111	L948 I949 A954 K955 D956	L948-N952 VanDerWaalsContact O-CG 3.24Å; L948-N952 PolarHBondContact O-N 2.99Å; L948-N952 PolarHBondContact O-OD1 3.38Å; I949-N952 PolarHBondContact O-N 3.26Å; I949-N952 VanDerWaalsContact O-N 3.16Å; N952-A954 PolarHBondContact O-N 3.2Å; N952-K955 PolarHBondContact O-N 3.07Å; N952-D956 WeakPolarHBondContact O-CB 3.49Å; N952-D956 PolarHBondContact O-N 3.04Å
953	I	86.9	Confident	80.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58.7	-46.2	174.2	-71.6	173	0	0	0	111.3	V802 L803 F806 I949 K955 D956 L957 W971	V802-I953 HydrophobicContact CG1-CB 3.99Å; V802-I953 HydrophobicContact CG1-CG1 3.78Å; V802-I953 HydrophobicContact CG1-CG2 3.91Å; L803-I953 HydrophobicContact CD2-CG2 4.39Å; F806-I953 HydrophobicContact CB-CD1 3.67Å; F806-I953 HydrophobicContact CD2-CD1 4.49Å; I949-I953 HydrophobicContact CG2-CD1 3.79Å; I949-I953 HydrophobicContact CG2-CG1 4.41Å; I949-I953 WeakPolarHBondContact O-CB 3.33Å; I949-I953 WeakPolarHBondContact O-CG1 3.4Å; I949-I953 PolarHBondContact O-N 3.32Å; I953-K955 PolarHBondContact O-N 2.76Å; I953-D956 PolarHBondContact O-N 2.89Å; I953-L957 HydrophobicContact CG2-CD1 3.89Å; I953-L957 HydrophobicContact CG2-CG 4.43Å; I953-L957 WeakPolarHBondContact O-CB 3.38Å; I953-L957 VanDerWaalsContact O-CG 3.29Å; I953-L957 WeakPolarHBondContact O-CG 3.17Å; I953-L957 PolarHBondContact O-N 3.28Å; I953-W971 HydrophobicContact CB-CD2 4.39Å; I953-W971 HydrophobicContact CD1-CH2 4.4Å; I953-W971 HydrophobicContact CD1-CZ3 4.41Å; I953-W971 HydrophobicContact CG2-CB 4.33Å; I953-W971 HydrophobicContact CG2-CD2 3.54Å; I953-W971 HydrophobicContact CG2-CE3 4.16Å; I953-W971 HydrophobicContact CG2-CG 3.58Å; I953-W971 HydrophobicContact CG2-CZ2 4.32Å
954	A	87.9	Confident	81	Confident	2 Å²	2	56.3 Å²	56.3	2%	0.017	26%	0.26	C	S	.	.	H	α-helix	trans	-59	-46	175.3	0	0	0	0	0	112.3	A950 N951 N952 E958 W971 Q972	A950-A954 WeakPolarHBondContact O-CB 3.4Å; A950-A954 PolarHBondContact O-N 2.78Å; N951-A954 PolarHBondContact O-N 2.68Å; N952-A954 PolarHBondContact O-N 3.2Å; A954-E958 WeakPolarHBondContact O-CB 3.25Å; A954-E958 PolarHBondContact O-N 2.74Å; A954-W971 HydrophobicContact CB-CB 3.9Å; A954-Q972 HydrophobicContact CB-CG 3.91Å
955	K	87.8	Confident	82	Confident	112 Å²	112	58.8 Å²	58.8	49%	0.487	27%	0.271	S	S	.	.	H	α-helix	trans	-65.1	-41.2	178	-74	167.3	178.5	171	0	112.8	N951 N952 I953 E958 K959	N951-K955 WeakPolarHBondContact O-CB 3.26Å; N951-K955 VanDerWaalsContact O-CG 3.28Å; N951-K955 WeakPolarHBondContact O-CG 3.49Å; N951-K955 PolarHBondContact O-N 2.72Å; N951-K955 WeakPolarHBondContact OD1-CE 3.28Å; N952-K955 PolarHBondContact O-N 3.07Å; I953-K955 PolarHBondContact O-N 2.76Å; K955-E958 PolarHBondContact O-N 3.1Å; K955-K959 WeakPolarHBondContact O-CB 3.34Å; K955-K959 PolarHBondContact O-N 3.33Å
956	D	85.3	Confident	82.9	Confident	37 Å²	37	61.2 Å²	61.2	20%	0.198	29%	0.294	C	S	.	.	H	α-helix	trans	-76.4	-35.2	-178	-89.8	-29.6	0	0	0	112.4	V802 N952 I953 R960	V802-D956 HydrophobicContact CG1-CB 4.18Å; V802-D956 HydrophobicContact CG2-CB 4.06Å; N952-D956 WeakPolarHBondContact O-CB 3.49Å; N952-D956 PolarHBondContact O-N 3.04Å; I953-D956 PolarHBondContact O-N 2.89Å; D956-R960 HydrophobicContact CB-CG 4.5Å; D956-R960 WeakPolarHBondContact O-CA 3.23Å; D956-R960 WeakPolarHBondContact O-CB 3.33Å; D956-R960 VanDerWaalsContact O-CG 3.31Å; D956-R960 WeakPolarHBondContact O-CG 3.48Å; D956-R960 PolarHBondContact O-N 3.16Å; D956-R960 IonicContact OD1-CZ 3.95Å; D956-R960 IonicContact OD1-NE 3.76Å; D956-R960 PolarHBondContact OD1-NE 3.4Å; D956-R960 IonicContact OD1-NH2 3.16Å; D956-R960 PolarHBondContact OD1-NH2 3.1Å; D956-R960 VanDerWaalsContact OD1-NH2 3.08Å; D956-R960 IonicContact OD2-CZ 2.98Å; D956-R960 IonicContact OD2-NE 3.42Å; D956-R960 IonicContact OD2-NH2 2.68Å; D956-R960 PolarHBondContact OD2-NH2 3.47Å
957	L	86.4	Confident	83.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.4	-47	166.7	-70	171.9	0	0	0	110.6	R799 V802 I953 T961 E967 A968	R799-L957 HydrophobicContact CB-CD2 4.18Å; R799-L957 HydrophobicContact CG-CD2 4.05Å; V802-L957 HydrophobicContact CG1-CG 4.32Å; I953-L957 HydrophobicContact CG2-CD1 3.89Å; I953-L957 HydrophobicContact CG2-CG 4.43Å; I953-L957 WeakPolarHBondContact O-CB 3.38Å; I953-L957 VanDerWaalsContact O-CG 3.29Å; I953-L957 WeakPolarHBondContact O-CG 3.17Å; I953-L957 PolarHBondContact O-N 3.28Å; L957-T961 CarbonylContact O-C 3.54Å; L957-T961 PolarHBondContact O-N 3.33Å; L957-T961 VanDerWaalsContact O-N 3.08Å; L957-T961 PolarHBondContact O-OG1 3.02Å; L957-E967 HydrophobicContact CD1-CB 4.46Å; L957-E967 HydrophobicContact CD1-CG 4.2Å; L957-A968 HydrophobicContact CB-CB 3.98Å
958	E	84.9	Confident	84	Confident	97 Å²	97	60.7 Å²	60.7	45%	0.453	29%	0.29	S	S	.	.	H	α-helix	trans	-68	-35.1	179.8	-179.1	161.3	-141.1	0	0	114.2	A954 K955 A968	A954-E958 WeakPolarHBondContact O-CB 3.25Å; A954-E958 PolarHBondContact O-N 2.74Å; K955-E958 PolarHBondContact O-N 3.1Å; E958-A968 HydrophobicContact CB-CB 4.31Å
959	K	82.3	Confident	84.6	Confident	182 Å²	182	63.1 Å²	63.1	79%	0.791	30%	0.297	S	S	*	.	H	α-helix	trans	-84.2	-38.8	-178.4	-174.9	-177.9	178	-174.5	0	113.1	K955	K955-K959 WeakPolarHBondContact O-CB 3.34Å; K955-K959 PolarHBondContact O-N 3.33Å
960	R	76.8	Confident	85	Confident	138 Å²	138	63.8 Å²	63.8	52%	0.521	30%	0.3	S	S	.	.	H	α-helix	trans	-101.3	-17.6	-171.4	-49.4	-174.7	-165.2	-160.1	14.3	114.2	I798 D956	I798-R960 HydrophobicContact CG2-CB 3.74Å; I798-R960 HydrophobicContact CG2-CG 4.49Å; D956-R960 HydrophobicContact CB-CG 4.5Å; D956-R960 WeakPolarHBondContact O-CA 3.23Å; D956-R960 WeakPolarHBondContact O-CB 3.33Å; D956-R960 VanDerWaalsContact O-CG 3.31Å; D956-R960 WeakPolarHBondContact O-CG 3.48Å; D956-R960 PolarHBondContact O-N 3.16Å; D956-R960 IonicContact OD1-CZ 3.95Å; D956-R960 IonicContact OD1-NE 3.76Å; D956-R960 PolarHBondContact OD1-NE 3.4Å; D956-R960 IonicContact OD1-NH2 3.16Å; D956-R960 PolarHBondContact OD1-NH2 3.1Å; D956-R960 VanDerWaalsContact OD1-NH2 3.08Å; D956-R960 IonicContact OD2-CZ 2.98Å; D956-R960 IonicContact OD2-NE 3.42Å; D956-R960 IonicContact OD2-NH2 2.68Å; D956-R960 PolarHBondContact OD2-NH2 3.47Å
961	T	75.4	Confident	85.3	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.012	30%	0.3	C	S	.	.			trans	-131.7	128.3	-178.5	68.7	0	0	0	0	112.1	E795 I798 L957 Y964	E795-T961 HydrophobicContact CB-CG2 3.98Å; E795-T961 HydrophobicContact CG-CG2 4.28Å; E795-T961 WeakPolarHBondContact OE2-CA 3.47Å; E795-T961 WeakPolarHBondContact OE2-CB 3.39Å; I798-T961 HydrophobicContact CB-CG2 4.19Å; I798-T961 HydrophobicContact CG2-CG2 3.94Å; L957-T961 CarbonylContact O-C 3.54Å; L957-T961 PolarHBondContact O-N 3.33Å; L957-T961 VanDerWaalsContact O-N 3.08Å; L957-T961 PolarHBondContact O-OG1 3.02Å; T961-Y964 HydrophobicContact CG2-CD2 4Å; T961-Y964 HydrophobicContact CG2-CE2 4.47Å
962	K	78	Confident	85.4	Confident	178 Å²	178	65.3 Å²	65.3	77%	0.774	31%	0.306	S	S	*	.	S	Bend	trans	-81.8	-29	176.7	-68.9	178.2	-178.4	174.3	0	111.9	E795	E795-K962 PolarHBondContact OE1-N 3.42Å; E795-K962 PolarHBondContact OE2-N 2.8Å
963	M	80.5	Confident	85.5	Confident	96 Å²	96	66.7 Å²	66.7	47%	0.473	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-38.8	-176.8	-69.3	-177.8	57.7	0	0	113.3	Q792 E795 K965	Q792-M963 HydrophobicContact CG-SD 3.84Å; E795-M963 WeakPolarHBondContact OE2-CB 3.37Å; E795-M963 PolarHBondContact OE2-N 3.45Å; M963-K965 PolarHBondContact O-N 3.04Å
964	Y	83.5	Confident	85.5	Confident	20 Å²	20	66.7 Å²	66.7	8%	0.078	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	23.5	-167	-49.5	-65.1	0	0	0	114.9	E795 E796 R799 T961 A966 E967 A968	E795-Y964 HydrophobicContact CB-CE2 4.02Å; E796-Y964 WeakPolarHBondContact CA-OH 3.18Å; E796-Y964 WeakPolarHBondContact CB-OH 3.3Å; E796-Y964 WeakPolarHBondContact CG-OH 3.43Å; E796-Y964 PolarHBondContact OE1-OH 2.87Å; R799-Y964 HydrophobicContact CB-CD2 3.78Å; R799-Y964 HydrophobicContact CB-CE2 3.69Å; R799-Y964 HydrophobicContact CG-CD2 4.1Å; R799-Y964 HydrophobicContact CG-CE2 4.21Å; R799-Y964 HydrophobicContact CG-CG 4.39Å; R799-Y964 VanDerWaalsContact NH1-CE1 3.32Å; T961-Y964 HydrophobicContact CG2-CD2 4Å; T961-Y964 HydrophobicContact CG2-CE2 4.47Å; Y964-A966 PolarHBondContact O-N 3.42Å; Y964-E967 WeakPolarHBondContact O-CB 3.22Å; Y964-E967 PolarHBondContact O-N 3.01Å; Y964-A968 PolarHBondContact O-N 2.86Å
965	K	85.3	Confident	85.4	Confident	106 Å²	106	68.6 Å²	68.6	46%	0.461	32%	0.319	S	S	.	.	H	α-helix	trans	-58.3	-27.2	174.5	-69.4	-166.2	174.9	-154.5	0	114.2	M963 K969	M963-K965 PolarHBondContact O-N 3.04Å; K965-K969 PolarHBondContact O-N 3.43Å
966	A	86.8	Confident	85.3	Confident	72 Å²	72	68.6 Å²	68.6	60%	0.595	32%	0.323	S	S	*	.	H	α-helix	trans	-65.6	-44.3	172.1	0	0	0	0	0	111.2	Y964 K969 I970	Y964-A966 PolarHBondContact O-N 3.42Å; A966-K969 WeakPolarHBondContact O-CB 2.93Å; A966-K969 PolarHBondContact O-N 2.93Å; A966-I970 PolarHBondContact O-N 3.34Å
967	E	89.5	Confident	85.1	Confident	12 Å²	12	71 Å²	71	6%	0.056	33%	0.332	C	S	.	.	H	α-helix	trans	-68.8	-36.9	177.7	-167.6	172.9	-135.8	0	0	112.1	R799 A871 L957 Y964 K969 I970 W971	R799-E967 IonicContact CZ-OE1 3.3Å; R799-E967 IonicContact CZ-OE2 2.75Å; R799-E967 VanDerWaalsContact CZ-OE2 3.22Å; R799-E967 IonicContact NE-OE1 3.82Å; R799-E967 IonicContact NE-OE2 2.9Å; R799-E967 PolarHBondContact NE-OE2 2.88Å; R799-E967 IonicContact NH2-OE1 2.83Å; R799-E967 PolarHBondContact NH2-OE1 2.71Å; R799-E967 IonicContact NH2-OE2 2.66Å; R799-E967 PolarHBondContact NH2-OE2 3.39Å; R799-E967 VanDerWaalsContact NH2-OE2 3.14Å; A871-E967 HydrophobicContact CB-CG 3.57Å; L957-E967 HydrophobicContact CD1-CB 4.46Å; L957-E967 HydrophobicContact CD1-CG 4.2Å; Y964-E967 WeakPolarHBondContact O-CB 3.22Å; Y964-E967 PolarHBondContact O-N 3.01Å; E967-K969 VanDerWaalsContact C-N 3.26Å; E967-K969 PolarHBondContact O-N 3.23Å; E967-I970 WeakPolarHBondContact O-CA 3.4Å; E967-I970 WeakPolarHBondContact O-CB 3.12Å; E967-I970 PolarHBondContact O-N 3.4Å; E967-W971 PolarHBondContact O-N 2.87Å
968	A	88.8	Confident	84.7	Confident	2 Å²	2	71.2 Å²	71.2	2%	0.017	33%	0.333	C	S	.	.	H	α-helix	trans	-56.2	-38.4	172.2	0	0	0	0	0	112.5	L957 E958 Y964 I970 W971 Q972	L957-A968 HydrophobicContact CB-CB 3.98Å; E958-A968 HydrophobicContact CB-CB 4.31Å; Y964-A968 PolarHBondContact O-N 2.86Å; A968-I970 VanDerWaalsContact C-N 3.34Å; A968-W971 PolarHBondContact O-N 2.98Å; A968-Q972 WeakPolarHBondContact O-CG 3.35Å; A968-Q972 PolarHBondContact O-N 3.25Å
969	K	90.3	Very high	84.1	Confident	137 Å²	137	68.2 Å²	68.2	60%	0.596	33%	0.325	S	S	*	.	H	α-helix	trans	-68.6	-28.7	173.4	-68.8	177.1	178.7	-176.5	0	113.4	K965 A966 E967 Q973	K965-K969 PolarHBondContact O-N 3.43Å; A966-K969 WeakPolarHBondContact O-CB 2.93Å; A966-K969 PolarHBondContact O-N 2.93Å; E967-K969 VanDerWaalsContact C-N 3.26Å; E967-K969 PolarHBondContact O-N 3.23Å; K969-Q973 WeakPolarHBondContact O-CG 2.94Å; K969-Q973 PolarHBondContact O-N 2.85Å; K969-Q973 VanDerWaalsContact O-N 3.13Å; K969-Q973 PolarHBondContact O-NE2 3Å
970	I	91.1	Very high	83.4	Confident	28 Å²	28	63.4 Å²	63.4	14%	0.144	31%	0.314	C	S	.	.	H	α-helix	trans	-72.9	-41.3	173.6	-59	172.5	0	0	0	109.2	A871 E872 L875 A966 E967 A968 Q972 Q973 I974	A871-I970 HydrophobicContact CB-CB 3.99Å; A871-I970 HydrophobicContact CB-CG2 3.62Å; A871-I970 VanDerWaalsContact O-CG2 3.27Å; A871-I970 WeakPolarHBondContact O-CG2 3.27Å; E872-I970 HydrophobicContact CG-CD1 3.72Å; L875-I970 HydrophobicContact CB-CG2 4.03Å; L875-I970 HydrophobicContact CD2-CG2 3.87Å; A966-I970 PolarHBondContact O-N 3.34Å; E967-I970 WeakPolarHBondContact O-CA 3.4Å; E967-I970 WeakPolarHBondContact O-CB 3.12Å; E967-I970 PolarHBondContact O-N 3.4Å; A968-I970 VanDerWaalsContact C-N 3.34Å; I970-Q972 VanDerWaalsContact C-N 3.34Å; I970-Q972 PolarHBondContact O-N 2.92Å; I970-Q973 WeakPolarHBondContact O-CB 3.36Å; I970-Q973 PolarHBondContact O-N 3.21Å; I970-Q973 VanDerWaalsContact O-N 3.08Å; I970-I974 HydrophobicContact CG2-CD1 4.33Å; I970-I974 WeakPolarHBondContact O-CG1 3.4Å; I970-I974 PolarHBondContact O-N 3.32Å
971	W	90.3	Very high	82.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-34	171.8	-77.9	106.3	0	0	0	113.7	L803 F806 M870 A950 I953 A954 E967 A968 I974 Q975	L803-W971 HydrophobicContact CD2-CZ2 3.64Å; L803-W971 VanDerWaalsContact CD2-NE1 3.3Å; F806-W971 HydrophobicContact CB-CH2 3.94Å; F806-W971 AromaticContact CD1-CH2 3.8Å; F806-W971 HydrophobicContact CD1-CH2 3.8Å; F806-W971 HydrophobicContact CD1-CZ3 4.41Å; F806-W971 AromaticContact CD2-CH2 3.74Å; F806-W971 HydrophobicContact CD2-CH2 3.74Å; F806-W971 AromaticContact CD2-CZ3 3.6Å; F806-W971 HydrophobicContact CD2-CZ3 3.6Å; F806-W971 HydrophobicContact CE1-CH2 4.17Å; F806-W971 HydrophobicContact CE2-CH2 4.13Å; F806-W971 AromaticContact CE2-CZ3 3.76Å; F806-W971 HydrophobicContact CE2-CZ3 3.76Å; F806-W971 AromaticContact CG-CH2 3.55Å; F806-W971 HydrophobicContact CG-CH2 3.55Å; F806-W971 AromaticContact CG-CZ3 3.94Å; F806-W971 HydrophobicContact CG-CZ3 3.94Å; F806-W971 HydrophobicContact CZ-CH2 4.33Å; F806-W971 HydrophobicContact CZ-CZ3 4.23Å; M870-W971 HydrophobicContact CE-CH2 4.37Å; M870-W971 HydrophobicContact CE-CZ2 4.36Å; A950-W971 HydrophobicContact CB-CE3 3.97Å; A950-W971 HydrophobicContact CB-CZ3 4.31Å; I953-W971 HydrophobicContact CB-CD2 4.39Å; I953-W971 HydrophobicContact CD1-CH2 4.4Å; I953-W971 HydrophobicContact CD1-CZ3 4.41Å; I953-W971 HydrophobicContact CG2-CB 4.33Å; I953-W971 HydrophobicContact CG2-CD2 3.54Å; I953-W971 HydrophobicContact CG2-CE3 4.16Å; I953-W971 HydrophobicContact CG2-CG 3.58Å; I953-W971 HydrophobicContact CG2-CZ2 4.32Å; A954-W971 HydrophobicContact CB-CB 3.9Å; E967-W971 PolarHBondContact O-N 2.87Å; A968-W971 PolarHBondContact O-N 2.98Å; W971-I974 HydrophobicContact CD2-CD1 3.99Å; W971-I974 HydrophobicContact CE3-CB 4.22Å; W971-I974 HydrophobicContact CE3-CD1 3.75Å; W971-I974 HydrophobicContact CE3-CG2 4.05Å; W971-I974 HydrophobicContact CH2-CD1 4.38Å; W971-I974 HydrophobicContact CZ3-CD1 3.96Å; W971-I974 HydrophobicContact CZ3-CG2 4.06Å; W971-I974 PolarHBondContact O-N 3.09Å; W971-Q975 VanDerWaalsContact O-CB 3.23Å; W971-Q975 WeakPolarHBondContact O-CB 3.39Å; W971-Q975 PolarHBondContact O-N 2.96Å
972	Q	89.4	Confident	81.6	Confident	79 Å²	79	60.5 Å²	60.5	37%	0.369	31%	0.312	S	S	.	.	H	α-helix	trans	-63.2	-39.9	168.6	-72.3	170.6	1.7	0	0	111.9	A954 A968 I970 Q975 L976	A954-Q972 HydrophobicContact CB-CG 3.91Å; A968-Q972 WeakPolarHBondContact O-CG 3.35Å; A968-Q972 PolarHBondContact O-N 3.25Å; I970-Q972 VanDerWaalsContact C-N 3.34Å; I970-Q972 PolarHBondContact O-N 2.92Å; Q972-Q975 PolarHBondContact O-N 3.32Å; Q972-L976 WeakPolarHBondContact O-CB 3.38Å; Q972-L976 VanDerWaalsContact O-CG 3.31Å; Q972-L976 WeakPolarHBondContact O-CG 2.96Å; Q972-L976 PolarHBondContact O-N 2.75Å
973	Q	88.7	Confident	80.4	Confident	100 Å²	100	56.9 Å²	56.9	47%	0.467	30%	0.298	S	S	.	.	H	α-helix	trans	-66.3	-41.8	174	-73.3	174.2	78.5	0	0	112.4	L875 K969 I970 L976 K977	L875-Q973 HydrophobicContact CD1-CB 4.23Å; L875-Q973 HydrophobicContact CD2-CB 4.14Å; K969-Q973 WeakPolarHBondContact O-CG 2.94Å; K969-Q973 PolarHBondContact O-N 2.85Å; K969-Q973 VanDerWaalsContact O-N 3.13Å; K969-Q973 PolarHBondContact O-NE2 3Å; I970-Q973 WeakPolarHBondContact O-CB 3.36Å; I970-Q973 PolarHBondContact O-N 3.21Å; I970-Q973 VanDerWaalsContact O-N 3.08Å; Q973-L976 PolarHBondContact O-N 2.82Å; Q973-K977 VanDerWaalsContact O-CG 3.31Å; Q973-K977 WeakPolarHBondContact O-CG 3.35Å; Q973-K977 PolarHBondContact O-N 3.02Å
974	I	87.5	Confident	78.9	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-57.7	-50.4	171.8	-69.1	164.9	0	0	0	109.7	V874 L875 L878 A950 I970 W971 L976 K977 L978	V874-I974 HydrophobicContact CB-CD1 4.09Å; V874-I974 HydrophobicContact CG1-CD1 3.83Å; V874-I974 HydrophobicContact CG1-CG1 4.33Å; V874-I974 HydrophobicContact CG1-CG2 4.4Å; L875-I974 HydrophobicContact CB-CD1 4.32Å; L875-I974 HydrophobicContact CB-CG1 3.97Å; L875-I974 HydrophobicContact CD1-CG1 4.18Å; L878-I974 HydrophobicContact CD1-CB 4.43Å; L878-I974 HydrophobicContact CD1-CG1 4.27Å; L878-I974 HydrophobicContact CD1-CG2 3.85Å; A950-I974 HydrophobicContact CB-CG2 4.17Å; I970-I974 HydrophobicContact CG2-CD1 4.33Å; I970-I974 WeakPolarHBondContact O-CG1 3.4Å; I970-I974 PolarHBondContact O-N 3.32Å; W971-I974 HydrophobicContact CD2-CD1 3.99Å; W971-I974 HydrophobicContact CE3-CB 4.22Å; W971-I974 HydrophobicContact CE3-CD1 3.75Å; W971-I974 HydrophobicContact CE3-CG2 4.05Å; W971-I974 HydrophobicContact CH2-CD1 4.38Å; W971-I974 HydrophobicContact CZ3-CD1 3.96Å; W971-I974 HydrophobicContact CZ3-CG2 4.06Å; W971-I974 PolarHBondContact O-N 3.09Å; I974-L976 VanDerWaalsContact C-N 3.33Å; I974-L976 PolarHBondContact O-N 2.91Å; I974-K977 PolarHBondContact O-N 3.21Å; I974-K977 VanDerWaalsContact O-N 3.14Å; I974-L978 HydrophobicContact CG2-CD1 3.75Å; I974-L978 HydrophobicContact CG2-CG 4.23Å; I974-L978 VanDerWaalsContact O-CG 3.27Å; I974-L978 WeakPolarHBondContact O-CG 3.36Å; I974-L978 PolarHBondContact O-N 3.03Å
975	Q	85.8	Confident	77.3	Confident	43 Å²	43	54.5 Å²	54.5	20%	0.201	29%	0.291	C	S	.	.	H	α-helix	trans	-57.5	-42.5	178.3	-178.9	-85.4	-26.6	0	0	112.1	P947 A950 N951 W971 Q972 A979	P947-Q975 WeakPolarHBondContact O-CG 3.18Å; A950-Q975 HydrophobicContact CB-CB 3.89Å; N951-Q975 HydrophobicContact CB-CG 3.95Å; W971-Q975 VanDerWaalsContact O-CB 3.23Å; W971-Q975 WeakPolarHBondContact O-CB 3.39Å; W971-Q975 PolarHBondContact O-N 2.96Å; Q972-Q975 PolarHBondContact O-N 3.32Å; Q975-A979 WeakPolarHBondContact O-CB 3.47Å; Q975-A979 PolarHBondContact O-N 3.23Å
976	L	84.4	Confident	75.6	Confident	111 Å²	111	52.2 Å²	52.2	58%	0.581	28%	0.284	S	S	*	.	H	α-helix	trans	-66.8	-40.2	175.1	-72.9	170.6	0	0	0	112.6	Q972 Q973 I974 A979 S980	Q972-L976 WeakPolarHBondContact O-CB 3.38Å; Q972-L976 VanDerWaalsContact O-CG 3.31Å; Q972-L976 WeakPolarHBondContact O-CG 2.96Å; Q972-L976 PolarHBondContact O-N 2.75Å; Q973-L976 PolarHBondContact O-N 2.82Å; I974-L976 VanDerWaalsContact C-N 3.33Å; I974-L976 PolarHBondContact O-N 2.91Å; L976-A979 PolarHBondContact O-N 2.76Å; L976-S980 WeakPolarHBondContact O-CB 3.35Å; L976-S980 PolarHBondContact O-N 2.86Å
977	K	81.4	Confident	73.8	Confident	87 Å²	87	53.6 Å²	53.6	38%	0.378	28%	0.281	S	S	.	.	H	α-helix	trans	-63.2	-46	174.7	-69.7	-69.4	-178.5	-179.1	0	111.2	L875 L886 Q973 I974 S980	L875-K977 HydrophobicContact CD1-CG 4.41Å; L886-K977 HydrophobicContact CD2-CB 4.38Å; Q973-K977 VanDerWaalsContact O-CG 3.31Å; Q973-K977 WeakPolarHBondContact O-CG 3.35Å; Q973-K977 PolarHBondContact O-N 3.02Å; I974-K977 PolarHBondContact O-N 3.21Å; I974-K977 VanDerWaalsContact O-N 3.14Å; K977-S980 PolarHBondContact O-N 3.4Å; K977-S980 PolarHBondContact O-OG 2.88Å
978	L	78.3	Confident	71.9	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-65.2	-38.5	176	-62.6	175.2	0	0	0	112	L878 L886 W889 L946 P947 A950 I974 S980 L981	L878-L978 HydrophobicContact CD1-CD2 4.35Å; L878-L978 HydrophobicContact CD2-CD2 4.12Å; L886-L978 HydrophobicContact CD1-CD2 4.46Å; W889-L978 HydrophobicContact CH2-CD2 3.56Å; W889-L978 HydrophobicContact CZ3-CD2 3.37Å; L946-L978 HydrophobicContact CB-CD1 4.43Å; P947-L978 HydrophobicContact CB-CB 4.24Å; P947-L978 HydrophobicContact CG-CB 3.93Å; A950-L978 HydrophobicContact CB-CD1 4.23Å; I974-L978 HydrophobicContact CG2-CD1 3.75Å; I974-L978 HydrophobicContact CG2-CG 4.23Å; I974-L978 VanDerWaalsContact O-CG 3.27Å; I974-L978 WeakPolarHBondContact O-CG 3.36Å; I974-L978 PolarHBondContact O-N 3.03Å; L978-S980 VanDerWaalsContact C-N 3.32Å; L978-S980 PolarHBondContact O-N 3.32Å; L978-L981 WeakPolarHBondContact O-CB 3.37Å; L978-L981 VanDerWaalsContact O-CD1 3.3Å; L978-L981 WeakPolarHBondContact O-CD1 3.45Å; L978-L981 VanDerWaalsContact O-CG 3.23Å; L978-L981 WeakPolarHBondContact O-CG 3.24Å; L978-L981 PolarHBondContact O-N 3.27Å
979	A	71.7	Confident	70	Confident	35 Å²	35	56.4 Å²	56.4	29%	0.289	30%	0.299	S	S	.	.	H	α-helix	trans	-73.6	-20.4	176.7	0	0	0	0	0	113.9	Q975 L976 L981	Q975-A979 WeakPolarHBondContact O-CB 3.47Å; Q975-A979 PolarHBondContact O-N 3.23Å; L976-A979 PolarHBondContact O-N 2.76Å; A979-L981 PolarHBondContact O-N 3.35Å
980	S	67.2	Low	68.2	Low	80 Å²	80	52.6 Å²	52.6	56%	0.559	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-4.9	174.9	74.6	0	0	0	0	114.1	L976 K977 L978	L976-S980 WeakPolarHBondContact O-CB 3.35Å; L976-S980 PolarHBondContact O-N 2.86Å; K977-S980 PolarHBondContact O-N 3.4Å; K977-S980 PolarHBondContact O-OG 2.88Å; L978-S980 VanDerWaalsContact C-N 3.32Å; L978-S980 PolarHBondContact O-N 3.32Å
981	L	62.8	Low	66.3	Low	20 Å²	20	53.2 Å²	53.2	11%	0.105	29%	0.29	C	S	.	.	S	Bend	trans	-62.3	146.8	172.3	-68.7	172.7	0	0	0	111.2	L886 A890 Y943 L978 A979 Q983	L886-L981 HydrophobicContact CD1-CD1 4.11Å; L886-L981 HydrophobicContact CD1-CD2 3.65Å; L886-L981 HydrophobicContact CD1-CG 4.03Å; L886-L981 HydrophobicContact CG-CD2 3.83Å; A890-L981 HydrophobicContact CB-CD2 3.54Å; Y943-L981 HydrophobicContact CE2-CD1 3.93Å; L978-L981 WeakPolarHBondContact O-CB 3.37Å; L978-L981 VanDerWaalsContact O-CD1 3.3Å; L978-L981 WeakPolarHBondContact O-CD1 3.45Å; L978-L981 VanDerWaalsContact O-CG 3.23Å; L978-L981 WeakPolarHBondContact O-CG 3.24Å; L978-L981 PolarHBondContact O-N 3.27Å; A979-L981 PolarHBondContact O-N 3.35Å; L981-Q983 PolarHBondContact O-N 2.64Å
982	P	53.4	Low	64.4	Low	60 Å²	60	53.7 Å²	53.7	39%	0.39	29%	0.292	S	S	.	.			trans	-61.6	99.7	-171.1	-26.4	36.3	0	0	0	114.7	T984	P982-T984 HydrophobicContact CB-CG2 4.17Å; P982-T984 PolarHBondContact O-N 2.89Å; P982-T984 PolarHBondContact O-OG1 3.43Å
983	Q	51.9	Low	62.6	Low	102 Å²	102	50.8 Å²	50.8	48%	0.477	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	7.9	168.3	-63.3	-178.6	-0.9	0	0	114	L981 I985 D986 N987	L981-Q983 PolarHBondContact O-N 2.64Å; Q983-I985 PolarHBondContact O-N 3.12Å; Q983-I985 VanDerWaalsContact O-N 3.1Å; Q983-D986 CarbonylContact O-C 3.36Å; Q983-D986 PolarHBondContact O-N 3.23Å; Q983-N987 VanDerWaalsContact CB-ND2 3.33Å; Q983-N987 WeakPolarHBondContact CB-ND2 3.36Å; Q983-N987 WeakPolarHBondContact O-CB 3.28Å; Q983-N987 PolarHBondContact O-N 3.22Å; Q983-N987 PolarHBondContact OE1-ND2 2.95Å; Q983-N987 VanDerWaalsContact OE1-ND2 3.09Å
984	T	48.8	Very low	60.7	Low	55 Å²	55	52.5 Å²	52.5	34%	0.337	29%	0.286	S	S	.	.	H	α-helix	trans	-51.2	-30.5	173.2	57.4	0	0	0	0	113.2	P982 V988 C989	P982-T984 HydrophobicContact CB-CG2 4.17Å; P982-T984 PolarHBondContact O-N 2.89Å; P982-T984 PolarHBondContact O-OG1 3.43Å; T984-V988 WeakPolarHBondContact O-CA 3.24Å; T984-V988 WeakPolarHBondContact O-CB 3.16Å; T984-V988 PolarHBondContact O-N 3.1Å; T984-C989 PolarHBondContact O-N 3.27Å
985	I	50.3	Low	58.9	Low	11 Å²	11	55 Å²	55	6%	0.056	30%	0.295	C	S	.	.	I	π-helix	trans	-60.6	-51.7	170.3	-65.8	176.6	0	0	0	110.7	Q894 S897 F944 Q983 C989 M990	Q894-I985 HydrophobicContact CG-CD1 4.35Å; S897-I985 VanDerWaalsContact OG-CD1 3.27Å; S897-I985 WeakPolarHBondContact OG-CD1 3.38Å; F944-I985 HydrophobicContact CE2-CG2 4.43Å; F944-I985 HydrophobicContact CZ-CB 4.18Å; F944-I985 HydrophobicContact CZ-CD1 4.39Å; F944-I985 HydrophobicContact CZ-CG2 4.06Å; Q983-I985 PolarHBondContact O-N 3.12Å; Q983-I985 VanDerWaalsContact O-N 3.1Å; I985-C989 CarbonylContact O-C 3.59Å; I985-C989 PolarHBondContact O-N 2.91Å; I985-M990 HydrophobicContact CG2-CG 4.14Å; I985-M990 VanDerWaalsContact O-CB 3.26Å; I985-M990 WeakPolarHBondContact O-CB 3.41Å; I985-M990 VanDerWaalsContact O-CG 3.23Å; I985-M990 WeakPolarHBondContact O-CG 3.24Å; I985-M990 PolarHBondContact O-N 3.46Å
986	D	48.9	Very low	57.2	Low	58 Å²	58	55.2 Å²	55.2	31%	0.31	30%	0.297	S	S	.	.	I	π-helix	trans	-86.8	-19.5	-174.9	-69.1	-31	0	0	0	114.7	R940 F944 Q983 M990 P991	R940-D986 IonicContact CZ-OD1 2.89Å; R940-D986 IonicContact NH2-OD1 3.18Å; R940-D986 PolarHBondContact NH2-OD1 3.3Å; F944-D986 WeakPolarHBondContact CE1-OD2 3.44Å; F944-D986 WeakPolarHBondContact CZ-OD2 3.24Å; Q983-D986 CarbonylContact O-C 3.36Å; Q983-D986 PolarHBondContact O-N 3.23Å; D986-M990 WeakPolarHBondContact OD1-CG 3.01Å; D986-P991 WeakPolarHBondContact O-CD 3.3Å; D986-P991 WeakPolarHBondContact O-CG 3.49Å
987	N	49	Very low	55.4	Low	101 Å²	101	54.3 Å²	54.3	54%	0.54	29%	0.293	S	S	.	.	I	π-helix	trans	-99.5	-24.1	-177.7	-65.4	-16.9	0	0	0	113.7	Q983	Q983-N987 VanDerWaalsContact CB-ND2 3.33Å; Q983-N987 WeakPolarHBondContact CB-ND2 3.36Å; Q983-N987 WeakPolarHBondContact O-CB 3.28Å; Q983-N987 PolarHBondContact O-N 3.22Å; Q983-N987 PolarHBondContact OE1-ND2 2.95Å; Q983-N987 VanDerWaalsContact OE1-ND2 3.09Å
988	V	48.9	Very low	53.8	Low	57 Å²	57	54.8 Å²	54.8	35%	0.345	30%	0.299	S	S	.	.	I	π-helix	trans	-121.9	-58.3	179.3	-176.8	0	0	0	0	111.2	T984 P991 L992	T984-V988 WeakPolarHBondContact O-CA 3.24Å; T984-V988 WeakPolarHBondContact O-CB 3.16Å; T984-V988 PolarHBondContact O-N 3.1Å; V988-P991 WeakPolarHBondContact O-CD 3.45Å; V988-L992 HydrophobicContact CG1-CD1 4.3Å; V988-L992 WeakPolarHBondContact O-CB 3.28Å; V988-L992 PolarHBondContact O-N 2.97Å
989	C	50.3	Low	52.1	Low	15 Å²	15	56.7 Å²	56.7	10%	0.101	32%	0.32	C	S	.	.	I	π-helix	trans	-72.9	-38.3	-171.4	-63.7	0	0	0	0	113.2	T984 I985 L992 V993 F1034	T984-C989 PolarHBondContact O-N 3.27Å; I985-C989 CarbonylContact O-C 3.59Å; I985-C989 PolarHBondContact O-N 2.91Å; C989-L992 WeakPolarHBondContact O-CB 3.31Å; C989-L992 PolarHBondContact O-N 3.48Å; C989-V993 WeakPolarHBondContact O-CB 3.41Å; C989-V993 VanDerWaalsContact O-CG2 3.23Å; C989-V993 WeakPolarHBondContact O-CG2 3.39Å; C989-V993 PolarHBondContact O-N 3.46Å; C989-F1034 VanDerWaalsContact SG-CZ 3.54Å
990	M	52.4	Low	50.8	Low	58 Å²	58	58.7 Å²	58.7	29%	0.286	32%	0.323	S	S	.	.	H	α-helix	trans	-74.9	-37.5	178.6	-78	-69.6	-68.7	0	0	113.6	R940 I985 D986 L992 V993 K994	R940-M990 PolarHBondContact NH1-SD 3.39Å; R940-M990 VanDerWaalsContact NH2-CG 3.3Å; R940-M990 PolarHBondContact NH2-SD 3.09Å; R940-M990 VanDerWaalsContact NH2-SD 3.43Å; I985-M990 HydrophobicContact CG2-CG 4.14Å; I985-M990 VanDerWaalsContact O-CB 3.26Å; I985-M990 WeakPolarHBondContact O-CB 3.41Å; I985-M990 VanDerWaalsContact O-CG 3.23Å; I985-M990 WeakPolarHBondContact O-CG 3.24Å; I985-M990 PolarHBondContact O-N 3.46Å; D986-M990 WeakPolarHBondContact OD1-CG 3.01Å; M990-L992 VanDerWaalsContact C-N 3.27Å; M990-L992 PolarHBondContact O-N 3.14Å; M990-V993 PolarHBondContact O-N 2.99Å; M990-K994 WeakPolarHBondContact O-CA 3.28Å; M990-K994 WeakPolarHBondContact O-CB 3.32Å; M990-K994 PolarHBondContact O-N 3.24Å
991	P	51	Low	49.7	Very low	41 Å²	41	56.7 Å²	56.7	27%	0.266	31%	0.306	S	S	.	.	H	α-helix	trans	-61	-40	169.3	-28.8	38.9	0	0	0	110.9	D986 V988 R995	D986-P991 WeakPolarHBondContact O-CD 3.3Å; D986-P991 WeakPolarHBondContact O-CG 3.49Å; V988-P991 WeakPolarHBondContact O-CD 3.45Å; P991-R995 WeakPolarHBondContact O-CB 3.28Å; P991-R995 WeakPolarHBondContact O-CD 3.33Å; P991-R995 WeakPolarHBondContact O-CG 3.37Å; P991-R995 PolarHBondContact O-N 3.32Å
992	L	50.1	Low	48.5	Very low	10 Å²	10	60 Å²	60	5%	0.052	33%	0.33	C	S	.	.	H	α-helix	trans	-61.7	-53.7	170.7	-89.3	160.7	0	0	0	112.5	V988 C989 M990 K994 R995 I996 L1001 F1029 L1069 M1080	V988-L992 HydrophobicContact CG1-CD1 4.3Å; V988-L992 WeakPolarHBondContact O-CB 3.28Å; V988-L992 PolarHBondContact O-N 2.97Å; C989-L992 WeakPolarHBondContact O-CB 3.31Å; C989-L992 PolarHBondContact O-N 3.48Å; M990-L992 VanDerWaalsContact C-N 3.27Å; M990-L992 PolarHBondContact O-N 3.14Å; L992-K994 PolarHBondContact O-N 2.55Å; L992-R995 CarbonylContact O-C 3.56Å; L992-R995 WeakPolarHBondContact O-CB 3.49Å; L992-R995 PolarHBondContact O-N 2.87Å; L992-R995 VanDerWaalsContact O-N 3.16Å; L992-I996 WeakPolarHBondContact O-CG1 3.31Å; L992-I996 PolarHBondContact O-N 3.48Å; L992-L1001 HydrophobicContact CD2-CD1 4.06Å; L992-F1029 HydrophobicContact CD1-CE1 4.2Å; L992-F1029 HydrophobicContact CD1-CZ 4.31Å; L992-F1029 HydrophobicContact CD2-CE1 4.39Å; L992-L1069 HydrophobicContact CD1-CD2 4.28Å; L992-M1080 HydrophobicContact CD2-CE 3.9Å; L992-M1080 HydrophobicContact CD2-SD 4.07Å
993	V	51.8	Low	48	Very low	17 Å²	17	60 Å²	60	10%	0.103	33%	0.329	C	S	.	.	H	α-helix	trans	-67	-37.1	-177.4	169.7	0	0	0	0	112.5	M901 C989 M990 I996 N997	M901-V993 HydrophobicContact CE-CG2 4.46Å; M901-V993 HydrophobicContact CG-CG2 3.51Å; M901-V993 HydrophobicContact SD-CG2 3.59Å; M901-V993 VanDerWaalsContact SD-CG2 3.59Å; C989-V993 WeakPolarHBondContact O-CB 3.41Å; C989-V993 VanDerWaalsContact O-CG2 3.23Å; C989-V993 WeakPolarHBondContact O-CG2 3.39Å; C989-V993 PolarHBondContact O-N 3.46Å; M990-V993 PolarHBondContact O-N 2.99Å; V993-I996 PolarHBondContact O-N 2.68Å; V993-N997 VanDerWaalsContact O-CB 3.32Å; V993-N997 WeakPolarHBondContact O-CB 3.18Å; V993-N997 PolarHBondContact O-N 3.04Å; V993-N997 PolarHBondContact O-ND2 3.05Å
994	K	49.5	Very low	47.6	Very low	137 Å²	137	58 Å²	58	60%	0.596	33%	0.326	S	S	*	.	H	α-helix	trans	-66.6	-38	172.6	-167.8	171.2	-176.6	177.3	0	110.4	M990 L992 L998	M990-K994 WeakPolarHBondContact O-CA 3.28Å; M990-K994 WeakPolarHBondContact O-CB 3.32Å; M990-K994 PolarHBondContact O-N 3.24Å; L992-K994 PolarHBondContact O-N 2.55Å; K994-L998 HydrophobicContact CG-CD1 3.81Å; K994-L998 HydrophobicContact CG-CG 4.39Å; K994-L998 VanDerWaalsContact O-CB 3.23Å; K994-L998 WeakPolarHBondContact O-CB 3.32Å; K994-L998 WeakPolarHBondContact O-CG 3.17Å; K994-L998 PolarHBondContact O-N 3.4Å
995	R	49.3	Very low	47.3	Very low	51 Å²	51	57 Å²	57	19%	0.192	32%	0.319	C	S	.	.	H	α-helix	trans	-67.8	-37.5	171.8	-72.5	163.5	-173.1	176.3	-4.6	112.4	P991 L992 G999 Q1000 L1001 E1085	P991-R995 WeakPolarHBondContact O-CB 3.28Å; P991-R995 WeakPolarHBondContact O-CD 3.33Å; P991-R995 WeakPolarHBondContact O-CG 3.37Å; P991-R995 PolarHBondContact O-N 3.32Å; L992-R995 CarbonylContact O-C 3.56Å; L992-R995 WeakPolarHBondContact O-CB 3.49Å; L992-R995 PolarHBondContact O-N 2.87Å; L992-R995 VanDerWaalsContact O-N 3.16Å; R995-G999 PolarHBondContact O-N 2.92Å; R995-Q1000 HydrophobicContact CB-CB 4.24Å; R995-Q1000 HydrophobicContact CG-CB 4.31Å; R995-Q1000 CarbonylContact O-C 3.54Å; R995-Q1000 WeakPolarHBondContact O-CA 3.49Å; R995-Q1000 PolarHBondContact O-N 2.95Å; R995-L1001 PolarHBondContact O-N 3.04Å; R995-E1085 PolarHBondContact NH1-O 2.94Å; R995-E1085 PolarHBondContact NH2-O 3.24Å
996	I	49.3	Very low	46.6	Very low	49 Å²	49	60.7 Å²	60.7	25%	0.251	34%	0.339	S	S	.	.	H	α-helix	trans	-61.7	-55	171.8	-68.9	165.2	0	0	0	110.1	M901 L992 V993 L998 G999 L1001	M901-I996 HydrophobicContact CE-CD1 4.04Å; L992-I996 WeakPolarHBondContact O-CG1 3.31Å; L992-I996 PolarHBondContact O-N 3.48Å; V993-I996 PolarHBondContact O-N 2.68Å; I996-L998 PolarHBondContact O-N 3.3Å; I996-G999 PolarHBondContact O-N 3.45Å; I996-L1001 HydrophobicContact CD1-CD1 4.27Å; I996-L1001 HydrophobicContact CG1-CB 4.29Å; I996-L1001 HydrophobicContact CG1-CD1 3.58Å
997	N	46.1	Very low	45.8	Very low	92 Å²	92	65.4 Å²	65.4	49%	0.492	36%	0.356	S	S	.	.	H	α-helix	trans	-67.4	-32.1	-173.5	-68	-10.3	0	0	0	113.3	V993 G999	V993-N997 VanDerWaalsContact O-CB 3.32Å; V993-N997 WeakPolarHBondContact O-CB 3.18Å; V993-N997 PolarHBondContact O-N 3.04Å; V993-N997 PolarHBondContact O-ND2 3.05Å; N997-G999 PolarHBondContact O-N 3.33Å
998	L	48.9	Very low	45.2	Very low	96 Å²	96	68.8 Å²	68.8	50%	0.503	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	3.6	173.7	-65.7	173	0	0	0	113.4	K994 I996 Q1000	K994-L998 HydrophobicContact CG-CD1 3.81Å; K994-L998 HydrophobicContact CG-CG 4.39Å; K994-L998 VanDerWaalsContact O-CB 3.23Å; K994-L998 WeakPolarHBondContact O-CB 3.32Å; K994-L998 WeakPolarHBondContact O-CG 3.17Å; K994-L998 PolarHBondContact O-N 3.4Å; I996-L998 PolarHBondContact O-N 3.3Å; L998-Q1000 HydrophobicContact CB-CG 3.79Å; L998-Q1000 PolarHBondContact O-N 2.93Å; L998-Q1000 VanDerWaalsContact O-N 3.09Å
999	G	42.6	Very low	44.5	Very low	46 Å²	46	70.6 Å²	70.6	47%	0.474	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	5.1	-173.8	0	0	0	0	0	114.6	R995 I996 N997 L1001 C1002	R995-G999 PolarHBondContact O-N 2.92Å; I996-G999 PolarHBondContact O-N 3.45Å; N997-G999 PolarHBondContact O-N 3.33Å; G999-L1001 VanDerWaalsContact C-N 3.26Å; G999-L1001 PolarHBondContact O-N 3.23Å; G999-C1002 PolarHBondContact O-SG 3.13Å
1000	Q	44.8	Very low	43.9	Very low	76 Å²	76	72.9 Å²	72.9	36%	0.355	39%	0.385	S	S	.	.			trans	-74.1	-14.9	-177.9	-64.3	179.7	0.4	0	0	113.2	R995 L998 C1002	R995-Q1000 HydrophobicContact CB-CB 4.24Å; R995-Q1000 HydrophobicContact CG-CB 4.31Å; R995-Q1000 CarbonylContact O-C 3.54Å; R995-Q1000 WeakPolarHBondContact O-CA 3.49Å; R995-Q1000 PolarHBondContact O-N 2.95Å; L998-Q1000 HydrophobicContact CB-CG 3.79Å; L998-Q1000 PolarHBondContact O-N 2.93Å; L998-Q1000 VanDerWaalsContact O-N 3.09Å; Q1000-C1002 PolarHBondContact O-N 3.43Å
1001	L	43.3	Very low	42.9	Very low	38 Å²	38	76.4 Å²	76.4	20%	0.199	40%	0.404	C	S	.	.	S	Bend	trans	-76.7	59.2	162.7	-137.8	170.6	0	0	0	109.5	L992 R995 I996 G999 T1003 M1080 L1089	L992-L1001 HydrophobicContact CD2-CD1 4.06Å; R995-L1001 PolarHBondContact O-N 3.04Å; I996-L1001 HydrophobicContact CD1-CD1 4.27Å; I996-L1001 HydrophobicContact CG1-CB 4.29Å; I996-L1001 HydrophobicContact CG1-CD1 3.58Å; G999-L1001 VanDerWaalsContact C-N 3.26Å; G999-L1001 PolarHBondContact O-N 3.23Å; L1001-T1003 PolarHBondContact O-N 3.31Å; L1001-M1080 HydrophobicContact CD1-CE 4.12Å; L1001-M1080 HydrophobicContact CD2-CE 4.16Å; L1001-M1080 HydrophobicContact CG-CE 4.29Å; L1001-L1089 HydrophobicContact CD2-CB 4.07Å
1002	C	38.2	Very low	41.9	Very low	89 Å²	89	77.9 Å²	77.9	60%	0.601	42%	0.415	S	S	*	.			trans	-63.2	102.2	173.3	-77.2	0	0	0	0	109.1	G999 Q1000 S1004	G999-C1002 PolarHBondContact O-SG 3.13Å; Q1000-C1002 PolarHBondContact O-N 3.43Å; C1002-S1004 PolarHBondContact O-N 3.35Å; C1002-S1004 VanDerWaalsContact O-N 3.16Å
1003	T	43.4	Very low	41.1	Very low	62 Å²	62	85 Å²	85	38%	0.38	45%	0.446	S	S	.	.			trans	-66.4	111.8	167.6	57.4	0	0	0	0	108.3	L1001 L1005 L1089	L1001-T1003 PolarHBondContact O-N 3.31Å; T1003-L1005 PolarHBondContact O-N 2.67Å; T1003-L1005 VanDerWaalsContact O-N 3.13Å; T1003-L1089 HydrophobicContact CG2-CD2 4.14Å
1004	S	42.2	Very low	40.1	Very low	59 Å²	59	89.5 Å²	89.5	41%	0.413	48%	0.475	S	S	.	.			trans	-75	9.5	170.5	52.8	0	0	0	0	112.9	C1002 D1006 R1090	C1002-S1004 PolarHBondContact O-N 3.35Å; C1002-S1004 VanDerWaalsContact O-N 3.16Å; S1004-D1006 VanDerWaalsContact C-N 3.32Å; S1004-D1006 PolarHBondContact O-N 2.95Å; S1004-R1090 VanDerWaalsContact OG-CA 3.28Å; S1004-R1090 WeakPolarHBondContact OG-CA 3.35Å; S1004-R1090 VanDerWaalsContact OG-CB 3.26Å; S1004-R1090 WeakPolarHBondContact OG-CB 3.22Å
1005	L	43.5	Very low	39.5	Very low	33 Å²	33	88.1 Å²	88.1	17%	0.173	47%	0.474	C	S	.	.	S	Bend	trans	-62.1	92.5	155	-61	167.3	0	0	0	108.6	T1003 K1007 I1010 L1089 V1193	T1003-L1005 PolarHBondContact O-N 2.67Å; T1003-L1005 VanDerWaalsContact O-N 3.13Å; L1005-K1007 PolarHBondContact O-N 3.3Å; L1005-I1010 HydrophobicContact CD2-CD1 3.55Å; L1005-L1089 HydrophobicContact CD1-CD2 4.39Å; L1005-V1193 HydrophobicContact CD2-CG1 4.37Å
1006	D	34.5	Very low	39	Very low	89 Å²	89	90.6 Å²	90.6	48%	0.476	50%	0.497	S	S	.	.			trans	-44.4	127.1	174.3	-76.5	-69.2	0	0	0	111.3	S1004 K1008 D1009 K1191	S1004-D1006 VanDerWaalsContact C-N 3.32Å; S1004-D1006 PolarHBondContact O-N 2.95Å; D1006-K1008 PolarHBondContact O-N 2.68Å; D1006-D1009 PolarHBondContact O-N 2.96Å; D1006-D1009 VanDerWaalsContact O-N 3.16Å; D1006-K1191 IonicContact OD2-NZ 3.53Å; D1006-K1191 PolarHBondContact OD2-NZ 3.31Å
1007	K	33.5	Very low	38.6	Very low	157 Å²	157	94.2 Å²	94.2	68%	0.683	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-10.2	-176.8	-66.3	-173.9	-177.7	179.8	0	114.9	L1005 E1543	L1005-K1007 PolarHBondContact O-N 3.3Å; K1007-E1543 IonicContact NZ-OE1 3.56Å; K1007-E1543 IonicContact NZ-OE2 3.89Å; K1007-E1543 PolarHBondContact NZ-OE2 3.2Å
1008	K	35.3	Very low	38.2	Very low	173 Å²	173	93 Å²	93	75%	0.752	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-21.9	-174.8	-69.9	-176.3	175	-179.7	0	115.4	D1006 S1012	D1006-K1008 PolarHBondContact O-N 2.68Å; K1008-S1012 VanDerWaalsContact O-CB 3.3Å; K1008-S1012 WeakPolarHBondContact O-CB 2.89Å; K1008-S1012 PolarHBondContact O-OG 3.36Å
1009	D	34.5	Very low	37.6	Very low	95 Å²	95	92.9 Å²	92.9	51%	0.508	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-26.5	-156.8	-76.9	7.8	0	0	0	115.7	D1006	D1006-D1009 PolarHBondContact O-N 2.96Å; D1006-D1009 VanDerWaalsContact O-N 3.16Å
1010	I	37.4	Very low	37.5	Very low	63 Å²	63	96 Å²	96	32%	0.323	51%	0.514	S	S	.	.	S	Bend	trans	-122.4	-41	-170	-67.1	162.3	0	0	0	113	L1005 S1012 V1193	L1005-I1010 HydrophobicContact CD2-CD1 3.55Å; I1010-S1012 PolarHBondContact O-N 3.49Å; I1010-V1193 HydrophobicContact CD1-CG2 4.09Å; I1010-V1193 HydrophobicContact CG2-CG2 4.43Å
1011	L	32.1	Very low	37.5	Very low	131 Å²	131	93.8 Å²	93.8	69%	0.686	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-7.9	174.7	-65.5	175.1	0	0	0	113.6	L1019	L1011-L1019 HydrophobicContact CD2-CD2 4.22Å
1012	S	30.3	Very low	37.4	Very low	73 Å²	73	95.2 Å²	95.2	51%	0.51	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-15.2	-177.8	57.9	0	0	0	0	114.1	K1008 I1010	K1008-S1012 VanDerWaalsContact O-CB 3.3Å; K1008-S1012 WeakPolarHBondContact O-CB 2.89Å; K1008-S1012 PolarHBondContact O-OG 3.36Å; I1010-S1012 PolarHBondContact O-N 3.49Å
1013	K	33.5	Very low	37.6	Very low	158 Å²	158	95.9 Å²	95.9	69%	0.687	51%	0.506	S	S	*	.	S	Bend	trans	-96	115.4	171.6	-77.2	-179.2	176.7	174	0	108.6	L1015	K1013-L1015 VanDerWaalsContact C-N 3.33Å; K1013-L1015 PolarHBondContact O-N 3.45Å
1014	P	30.6	Very low	37.7	Very low	112 Å²	112	97.7 Å²	97.7	73%	0.727	51%	0.51	S	S	*	.			trans	-71	91.9	173.4	29.6	-33.2	0	0	0	109.3	P1016	P1014-P1016 WeakPolarHBondContact O-CD 3.36Å
1015	L	36.8	Very low	37.9	Very low	108 Å²	108	95.7 Å²	95.7	57%	0.565	49%	0.494	S	S	*	.			trans	-84.7	105.4	156.1	-140.1	77.4	0	0	0	105.5	K1013 D1017 L1018	K1013-L1015 VanDerWaalsContact C-N 3.33Å; K1013-L1015 PolarHBondContact O-N 3.45Å; L1015-D1017 PolarHBondContact O-N 2.88Å; L1015-L1018 HydrophobicContact CB-CB 4.03Å; L1015-L1018 HydrophobicContact CD2-CB 4.07Å; L1015-L1018 HydrophobicContact CD2-CD2 4.11Å; L1015-L1018 PolarHBondContact O-N 3.25Å
1016	P	37.2	Very low	38.1	Very low	103 Å²	103	97.4 Å²	97.4	67%	0.669	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-36.4	-160.3	-30.3	37.4	0	0	0	114.6	P1014	P1014-P1016 WeakPolarHBondContact O-CD 3.36Å
1017	D	41.1	Very low	38.6	Very low	126 Å²	126	94 Å²	94	67%	0.674	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-17.3	-175	-44.1	-59.3	0	0	0	113.8	L1015 P1021	L1015-D1017 PolarHBondContact O-N 2.88Å; D1017-P1021 WeakPolarHBondContact O-CD 3.42Å
1018	L	38.5	Very low	39.3	Very low	67 Å²	67	89.1 Å²	89.1	35%	0.351	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	0.6	-168	-146.3	79.1	0	0	0	114.5	L1015 P1197	L1015-L1018 HydrophobicContact CB-CB 4.03Å; L1015-L1018 HydrophobicContact CD2-CB 4.07Å; L1015-L1018 HydrophobicContact CD2-CD2 4.11Å; L1015-L1018 PolarHBondContact O-N 3.25Å; L1018-P1197 HydrophobicContact CD1-CB 4.19Å; L1018-P1197 HydrophobicContact CD1-CG 3.81Å
1019	L	37.3	Very low	39.9	Very low	93 Å²	93	81.5 Å²	81.5	49%	0.487	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-27.8	170.2	-84.8	155.1	0	0	0	112.5	L1011	L1011-L1019 HydrophobicContact CD2-CD2 4.22Å
1020	L	40.4	Very low	40.5	Very low	110 Å²	110	77.3 Å²	77.3	58%	0.576	41%	0.411	S	S	*	.	H	α-helix	trans	-59	-47.4	177.5	-93.6	69.2	0	0	0	113.3	F1022 Q1023 H1024	L1020-F1022 PolarHBondContact O-N 2.9Å; L1020-Q1023 PolarHBondContact O-N 2.97Å; L1020-H1024 WeakPolarHBondContact O-CB 3.43Å; L1020-H1024 PolarHBondContact O-N 2.96Å
1021	P	43.6	Very low	40.7	Very low	31 Å²	31	76.6 Å²	76.6	20%	0.201	40%	0.404	C	S	.	.	H	α-helix	trans	-57.8	-41.3	-173.5	-28.7	36	0	0	0	114.6	D1017 L1025	D1017-P1021 WeakPolarHBondContact O-CD 3.42Å; P1021-L1025 WeakPolarHBondContact O-CA 3.39Å; P1021-L1025 WeakPolarHBondContact O-CB 3.48Å; P1021-L1025 PolarHBondContact O-N 3.33Å
1022	F	41	Very low	41.5	Very low	67 Å²	67	71.5 Å²	71.5	29%	0.294	38%	0.379	S	S	.	.	H	α-helix	trans	-78.6	-33.9	-175.7	-154.3	-116.2	0	0	0	112.9	L1020 L1025 L1026 L1089 I1195	L1020-F1022 PolarHBondContact O-N 2.9Å; F1022-L1025 HydrophobicContact CD2-CD2 3.73Å; F1022-L1025 HydrophobicContact CE2-CD2 3.68Å; F1022-L1026 HydrophobicContact CD1-CD1 3.88Å; F1022-L1026 HydrophobicContact CD1-CG 4.49Å; F1022-L1026 HydrophobicContact CE1-CD1 3.77Å; F1022-L1026 HydrophobicContact CE1-CG 4.37Å; F1022-L1026 HydrophobicContact CZ-CD1 4.5Å; F1022-L1026 WeakPolarHBondContact O-CG 3.44Å; F1022-L1026 PolarHBondContact O-N 3.22Å; F1022-L1089 HydrophobicContact CE2-CD2 3.88Å; F1022-L1089 HydrophobicContact CZ-CD2 4.05Å; F1022-I1195 HydrophobicContact CD2-CD1 3.36Å; F1022-I1195 HydrophobicContact CE2-CD1 3.6Å; F1022-I1195 HydrophobicContact CG-CD1 4.42Å
1023	Q	43.9	Very low	42.3	Very low	103 Å²	103	68.8 Å²	68.8	48%	0.481	36%	0.358	S	S	.	.	H	α-helix	trans	-72.1	-43.8	173.3	-165.8	165.7	-6.6	0	0	110.5	L1020 L1025 L1026 L1027	L1020-Q1023 PolarHBondContact O-N 2.97Å; Q1023-L1025 VanDerWaalsContact C-N 3.33Å; Q1023-L1025 PolarHBondContact O-N 3.34Å; Q1023-L1026 PolarHBondContact O-N 3.19Å; Q1023-L1027 HydrophobicContact CG-CD1 3.94Å; Q1023-L1027 HydrophobicContact CG-CG 4.35Å; Q1023-L1027 VanDerWaalsContact O-CB 3.25Å; Q1023-L1027 WeakPolarHBondContact O-CB 3.45Å; Q1023-L1027 WeakPolarHBondContact O-CG 3.32Å; Q1023-L1027 PolarHBondContact O-N 3.33Å
1024	H	43.9	Very low	42.7	Very low	101 Å²	101	64.9 Å²	64.9	47%	0.468	34%	0.341	S	S	.	.	H	α-helix	trans	-61.2	-38.8	171.3	-93.5	-80.2	0	0	0	112.9	L1020 N1028	L1020-H1024 WeakPolarHBondContact O-CB 3.43Å; L1020-H1024 PolarHBondContact O-N 2.96Å; H1024-N1028 WeakPolarHBondContact O-CB 3.49Å; H1024-N1028 PolarHBondContact O-N 3.45Å
1025	L	46	Very low	43.5	Very low	16 Å²	16	67.1 Å²	67.1	8%	0.084	34%	0.342	C	S	.	.	H	α-helix	trans	-56.1	-60.5	172.8	178.2	79.8	0	0	0	109.7	P1021 F1022 Q1023 L1027 N1028 F1029 L1073 I1078	P1021-L1025 WeakPolarHBondContact O-CA 3.39Å; P1021-L1025 WeakPolarHBondContact O-CB 3.48Å; P1021-L1025 PolarHBondContact O-N 3.33Å; F1022-L1025 HydrophobicContact CD2-CD2 3.73Å; F1022-L1025 HydrophobicContact CE2-CD2 3.68Å; Q1023-L1025 VanDerWaalsContact C-N 3.33Å; Q1023-L1025 PolarHBondContact O-N 3.34Å; L1025-L1027 VanDerWaalsContact C-N 3.3Å; L1025-L1027 PolarHBondContact O-N 3.28Å; L1025-N1028 CarbonylContact O-C 3.55Å; L1025-N1028 PolarHBondContact O-N 3.13Å; L1025-F1029 HydrophobicContact CD1-CD2 3.61Å; L1025-F1029 HydrophobicContact CD1-CE2 3.89Å; L1025-F1029 HydrophobicContact CG-CD2 3.86Å; L1025-F1029 HydrophobicContact CG-CE2 4.3Å; L1025-F1029 VanDerWaalsContact O-CA 3.23Å; L1025-F1029 WeakPolarHBondContact O-CA 3.36Å; L1025-F1029 VanDerWaalsContact O-CB 3.24Å; L1025-F1029 WeakPolarHBondContact O-CB 3.25Å; L1025-F1029 PolarHBondContact O-N 2.77Å; L1025-L1073 HydrophobicContact CD1-CD1 3.49Å; L1025-L1073 VanDerWaalsContact CD1-CD1 3.49Å; L1025-L1073 HydrophobicContact CD1-CD2 3.69Å; L1025-L1073 HydrophobicContact CD1-CG 4.26Å; L1025-I1078 HydrophobicContact CD1-CD1 3.62Å; L1025-I1078 HydrophobicContact CD2-CD1 3.37Å; L1025-I1078 HydrophobicContact CG-CD1 4.08Å
1026	L	47.8	Very low	44.3	Very low	69 Å²	69	63 Å²	63	36%	0.361	32%	0.32	S	S	.	.	H	α-helix	trans	-61.3	-39.2	-175.6	-70.5	170.7	0	0	0	111.8	S904 F1022 Q1023	S904-L1026 WeakPolarHBondContact CB-O 3.24Å; S904-L1026 PolarHBondContact OG-O 3Å; F1022-L1026 HydrophobicContact CD1-CD1 3.88Å; F1022-L1026 HydrophobicContact CD1-CG 4.49Å; F1022-L1026 HydrophobicContact CE1-CD1 3.77Å; F1022-L1026 HydrophobicContact CE1-CG 4.37Å; F1022-L1026 HydrophobicContact CZ-CD1 4.5Å; F1022-L1026 WeakPolarHBondContact O-CG 3.44Å; F1022-L1026 PolarHBondContact O-N 3.22Å; Q1023-L1026 PolarHBondContact O-N 3.19Å
1027	L	45	Very low	45.2	Very low	19 Å²	19	62.6 Å²	62.6	10%	0.099	31%	0.305	C	S	.	.	H	α-helix	trans	-65.3	-37.8	176.7	-72	174	0	0	0	113.3	H907 Q1023 L1025	H907-L1027 HydrophobicContact CB-CD2 3.53Å; Q1023-L1027 HydrophobicContact CG-CD1 3.94Å; Q1023-L1027 HydrophobicContact CG-CG 4.35Å; Q1023-L1027 VanDerWaalsContact O-CB 3.25Å; Q1023-L1027 WeakPolarHBondContact O-CB 3.45Å; Q1023-L1027 WeakPolarHBondContact O-CG 3.32Å; Q1023-L1027 PolarHBondContact O-N 3.33Å; L1025-L1027 VanDerWaalsContact C-N 3.3Å; L1025-L1027 PolarHBondContact O-N 3.28Å
1028	N	49.6	Very low	46	Very low	53 Å²	53	59.2 Å²	59.2	28%	0.283	29%	0.289	S	S	.	.	H	α-helix	trans	-100.7	-9	-175.4	-65.9	-21.8	0	0	0	114	H1024 L1025 P1030 R1031 V1032	H1024-N1028 WeakPolarHBondContact O-CB 3.49Å; H1024-N1028 PolarHBondContact O-N 3.45Å; L1025-N1028 CarbonylContact O-C 3.55Å; L1025-N1028 PolarHBondContact O-N 3.13Å; N1028-P1030 WeakPolarHBondContact O-CD 3.35Å; N1028-P1030 VanDerWaalsContact O-N 3.09Å; N1028-R1031 WeakPolarHBondContact O-CA 3.16Å; N1028-R1031 WeakPolarHBondContact O-CB 3.33Å; N1028-R1031 PolarHBondContact O-N 3.37Å; N1028-V1032 HydrophobicContact CB-CB 4.17Å; N1028-V1032 HydrophobicContact CB-CG2 3.57Å; N1028-V1032 WeakPolarHBondContact O-CB 3.43Å; N1028-V1032 PolarHBondContact O-N 3.4Å
1029	F	47.7	Very low	47.1	Very low	13 Å²	13	57.1 Å²	57.1	6%	0.057	28%	0.278	C	S	.	.	H	α-helix	trans	-45.4	-50.2	-162	-158.7	-126.4	0	0	0	114.9	M901 L992 L1025 R1031 L1033 I1071	M901-F1029 HydrophobicContact CE-CB 3.95Å; M901-F1029 HydrophobicContact CE-CD1 4.1Å; M901-F1029 HydrophobicContact SD-CB 3.88Å; M901-F1029 HydrophobicContact SD-CD1 3.79Å; M901-F1029 HydrophobicContact SD-CG 4.34Å; L992-F1029 HydrophobicContact CD1-CE1 4.2Å; L992-F1029 HydrophobicContact CD1-CZ 4.31Å; L992-F1029 HydrophobicContact CD2-CE1 4.39Å; L1025-F1029 HydrophobicContact CD1-CD2 3.61Å; L1025-F1029 HydrophobicContact CD1-CE2 3.89Å; L1025-F1029 HydrophobicContact CG-CD2 3.86Å; L1025-F1029 HydrophobicContact CG-CE2 4.3Å; L1025-F1029 VanDerWaalsContact O-CA 3.23Å; L1025-F1029 WeakPolarHBondContact O-CA 3.36Å; L1025-F1029 VanDerWaalsContact O-CB 3.24Å; L1025-F1029 WeakPolarHBondContact O-CB 3.25Å; L1025-F1029 PolarHBondContact O-N 2.77Å; F1029-R1031 VanDerWaalsContact C-N 3.3Å; F1029-R1031 PolarHBondContact O-N 2.88Å; F1029-L1033 HydrophobicContact CD1-CD1 3.76Å; F1029-L1033 HydrophobicContact CD2-CD1 4.26Å; F1029-L1033 HydrophobicContact CD2-CG 4.39Å; F1029-L1033 HydrophobicContact CE1-CD1 3.67Å; F1029-L1033 HydrophobicContact CE2-CD1 4.17Å; F1029-L1033 HydrophobicContact CE2-CG 4.34Å; F1029-L1033 HydrophobicContact CG-CD1 4.07Å; F1029-L1033 HydrophobicContact CZ-CD1 3.88Å; F1029-L1033 HydrophobicContact CZ-CG 4.48Å; F1029-L1033 VanDerWaalsContact O-CB 3.24Å; F1029-L1033 WeakPolarHBondContact O-CB 3.35Å; F1029-L1033 WeakPolarHBondContact O-CD1 3.16Å; F1029-L1033 WeakPolarHBondContact O-CG 3.36Å; F1029-L1033 PolarHBondContact O-N 3.44Å; F1029-I1071 HydrophobicContact CE2-CD1 4.2Å; F1029-I1071 HydrophobicContact CZ-CD1 4.15Å
1030	P	46.9	Very low	47.9	Very low	7 Å²	7	54.9 Å²	54.9	5%	0.045	27%	0.273	C	S	.	.	H	α-helix	trans	-83.2	-6.7	-176.1	41.5	-41.7	0	0	0	113.1	C898 M901 N1028 F1034	C898-P1030 HydrophobicContact CB-CB 4.32Å; C898-P1030 WeakPolarHBondContact CB-O 3.47Å; C898-P1030 VanDerWaalsContact O-CB 3.24Å; C898-P1030 WeakPolarHBondContact O-CB 3.28Å; C898-P1030 WeakPolarHBondContact O-CG 3.23Å; M901-P1030 HydrophobicContact CB-CB 4.39Å; M901-P1030 HydrophobicContact CB-CG 3.75Å; M901-P1030 HydrophobicContact CG-CB 3.87Å; M901-P1030 HydrophobicContact CG-CG 3.78Å; M901-P1030 HydrophobicContact SD-CB 3.84Å; M901-P1030 VanDerWaalsContact SD-CD 3.52Å; M901-P1030 HydrophobicContact SD-CG 3.89Å; N1028-P1030 WeakPolarHBondContact O-CD 3.35Å; N1028-P1030 VanDerWaalsContact O-N 3.09Å; P1030-F1034 WeakPolarHBondContact O-CD2 3.46Å; P1030-F1034 WeakPolarHBondContact O-CE2 3.26Å
1031	R	42.6	Very low	48.6	Very low	49 Å²	49	55.5 Å²	55.5	19%	0.185	27%	0.273	C	S	.	.	H	α-helix	trans	-95.4	-40.5	175	-61	130.7	169.7	-77.8	-10.6	110.1	I838 V905 N1028 F1029	I838-R1031 PolarHBondContact O-NH1 2.9Å; I838-R1031 PolarHBondContact O-NH2 3.43Å; V905-R1031 VanDerWaalsContact CG2-NH2 3.26Å; N1028-R1031 WeakPolarHBondContact O-CA 3.16Å; N1028-R1031 WeakPolarHBondContact O-CB 3.33Å; N1028-R1031 PolarHBondContact O-N 3.37Å; F1029-R1031 VanDerWaalsContact C-N 3.3Å; F1029-R1031 PolarHBondContact O-N 2.88Å
1032	V	48.2	Very low	49.2	Very low	24 Å²	24	54.1 Å²	54.1	15%	0.145	26%	0.264	C	S	.	.	H	α-helix	trans	-68.7	-45	176.3	151.1	0	0	0	0	110.2	N1028 F1034 H1035 H1036 L1073	N1028-V1032 HydrophobicContact CB-CB 4.17Å; N1028-V1032 HydrophobicContact CB-CG2 3.57Å; N1028-V1032 WeakPolarHBondContact O-CB 3.43Å; N1028-V1032 PolarHBondContact O-N 3.4Å; V1032-F1034 PolarHBondContact O-N 3.23Å; V1032-H1035 CarbonylContact O-C 3.52Å; V1032-H1035 PolarHBondContact O-N 2.87Å; V1032-H1036 HydrophobicContact CG1-CB 4.17Å; V1032-H1036 WeakPolarHBondContact O-CB 3.22Å; V1032-H1036 PolarHBondContact O-N 3Å; V1032-H1036 PolarHBondContact O-ND1 3.33Å; V1032-L1073 HydrophobicContact CG1-CD2 3.36Å
1033	L	46.5	Very low	50	Low	15 Å²	15	54.5 Å²	54.5	8%	0.079	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-13.1	179.4	-84	170.2	0	0	0	116.8	F1029 V1038 I1071	F1029-L1033 HydrophobicContact CD1-CD1 3.76Å; F1029-L1033 HydrophobicContact CD2-CD1 4.26Å; F1029-L1033 HydrophobicContact CD2-CG 4.39Å; F1029-L1033 HydrophobicContact CE1-CD1 3.67Å; F1029-L1033 HydrophobicContact CE2-CD1 4.17Å; F1029-L1033 HydrophobicContact CE2-CG 4.34Å; F1029-L1033 HydrophobicContact CG-CD1 4.07Å; F1029-L1033 HydrophobicContact CZ-CD1 3.88Å; F1029-L1033 HydrophobicContact CZ-CG 4.48Å; F1029-L1033 VanDerWaalsContact O-CB 3.24Å; F1029-L1033 WeakPolarHBondContact O-CB 3.35Å; F1029-L1033 WeakPolarHBondContact O-CD1 3.16Å; F1029-L1033 WeakPolarHBondContact O-CG 3.36Å; F1029-L1033 PolarHBondContact O-N 3.44Å; L1033-V1038 HydrophobicContact CD2-CG2 3.55Å; L1033-I1071 HydrophobicContact CD2-CD1 4.37Å; L1033-I1071 HydrophobicContact CD2-CG2 4.02Å
1034	F	41.9	Very low	50.9	Low	77 Å²	77	49.6 Å²	49.6	34%	0.338	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-9.4	174.7	-55.4	-69.8	0	0	0	114.3	C898 C989 P1030 V1032	C898-F1034 HydrophobicContact CB-CD2 4.23Å; C898-F1034 HydrophobicContact CB-CE2 3.79Å; C898-F1034 WeakPolarHBondContact SG-CE2 3.37Å; C989-F1034 VanDerWaalsContact SG-CZ 3.54Å; P1030-F1034 WeakPolarHBondContact O-CD2 3.46Å; P1030-F1034 WeakPolarHBondContact O-CE2 3.26Å; V1032-F1034 PolarHBondContact O-N 3.23Å
1035	H	48.2	Very low	51.9	Low	158 Å²	158	46 Å²	46	73%	0.731	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-7.3	164.6	-85.3	-75.3	0	0	0	112.7	V1032	V1032-H1035 CarbonylContact O-C 3.52Å; V1032-H1035 PolarHBondContact O-N 2.87Å
1036	H	53.1	Low	52.7	Low	22 Å²	22	45.2 Å²	45.2	10%	0.102	23%	0.225	C	C	.	.	S	Bend	trans	-135	148.5	-164.8	-67.5	80.4	0	0	0	110.8	V1032 L1072 L1073 H1074 Y1242	V1032-H1036 HydrophobicContact CG1-CB 4.17Å; V1032-H1036 WeakPolarHBondContact O-CB 3.22Å; V1032-H1036 PolarHBondContact O-N 3Å; V1032-H1036 PolarHBondContact O-ND1 3.33Å; H1036-L1072 VanDerWaalsContact CB-O 3.27Å; H1036-L1072 WeakPolarHBondContact CB-O 3.2Å; H1036-L1072 PolarHBondContact CD2-O 3.43Å; H1036-L1073 VanDerWaalsContact CD2-CA 3.48Å; H1036-L1073 WeakPolarHBondContact CD2-CA 3.29Å; H1036-H1074 PolarHBondContact CD2-N 2.86Å; H1036-H1074 VanDerWaalsContact CD2-N 3.32Å; H1036-H1074 PolarHBondContact NE2-N 3.28Å; H1036-H1074 VanDerWaalsContact NE2-N 3.14Å; H1036-Y1242 PolarHBondContact CD2-OH 2.96Å; H1036-Y1242 PolarHBondContact NE2-OH 3.19Å
1037	W	55.8	Low	53.6	Low	95 Å²	95	42 Å²	42	36%	0.36	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	140	-166.2	-57.1	74.7	0	0	0	111.5	L1072 E1235 N1238 W1239	W1037-L1072 PolarHBondContact O-N 3.36Å; W1037-L1072 VanDerWaalsContact O-N 3.12Å; W1037-E1235 HydrophobicContact CZ3-CG 4.35Å; W1037-N1238 HydrophobicContact CH2-CB 3.59Å; W1037-N1238 HydrophobicContact CZ2-CB 3.48Å; W1037-N1238 VanDerWaalsContact CZ2-CB 3.48Å; W1037-N1238 HydrophobicContact CZ3-CB 4.35Å; W1037-W1239 HydrophobicContact CB-CD2 4.47Å; W1037-W1239 HydrophobicContact CB-CZ2 3.48Å; W1037-W1239 VanDerWaalsContact CB-CZ2 3.48Å; W1037-W1239 AromaticContact CD2-CD1 3.9Å; W1037-W1239 AromaticContact CD2-NE1 3.67Å; W1037-W1239 AromaticContact CE3-NE1 3.75Å; W1037-W1239 AromaticContact CG-CD1 3.88Å; W1037-W1239 AromaticContact CG-NE1 3.4Å
1038	V	58.5	Low	54.4	Low	55 Å²	55	43 Å²	43	33%	0.333	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	114.9	179.8	-179	0	0	0	0	108.5	L1033 L1069 A1070 I1071	L1033-V1038 HydrophobicContact CD2-CG2 3.55Å; V1038-L1069 HydrophobicContact CG1-CD1 3.42Å; V1038-L1069 VanDerWaalsContact CG1-CD1 3.42Å; V1038-L1069 HydrophobicContact CG1-CG 4.3Å; V1038-A1070 WeakPolarHBondContact CA-O 3.47Å; V1038-I1071 HydrophobicContact CG2-CG2 4.45Å
1039	V	61.8	Low	54.9	Low	22 Å²	22	42.4 Å²	42.4	13%	0.133	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	113.3	169.6	176.6	0	0	0	0	107.8	H1041 A1042 L1069 A1070 F1230 W1239	V1039-H1041 VanDerWaalsContact C-N 3.32Å; V1039-A1042 HydrophobicContact CG1-CB 3.9Å; V1039-L1069 WeakPolarHBondContact O-CA 3.28Å; V1039-A1070 HydrophobicContact CB-CB 4.44Å; V1039-A1070 PolarHBondContact N-O 2.89Å; V1039-A1070 PolarHBondContact O-N 3.25Å; V1039-F1230 HydrophobicContact CG2-CD1 4.01Å; V1039-F1230 HydrophobicContact CG2-CE1 3.5Å; V1039-F1230 HydrophobicContact CG2-CZ 4.21Å; V1039-W1239 HydrophobicContact CB-CZ2 4.46Å; V1039-W1239 HydrophobicContact CG2-CH2 4.06Å; V1039-W1239 HydrophobicContact CG2-CZ2 3.6Å
1040	A	54.2	Low	55.3	Low	46 Å²	46	43.3 Å²	43.3	38%	0.38	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	-27.4	-178	0	0	0	0	0	113.5	Y1087	A1040-Y1087 PolarHBondContact O-OH 2.93Å
1041	H	55.5	Low	55.3	Low	123 Å²	123	46.3 Å²	46.3	57%	0.569	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140.2	92.8	-179.2	-53.7	-80.5	0	0	0	109.7	V1039 E1067	V1039-H1041 VanDerWaalsContact C-N 3.32Å; H1041-E1067 IonicContact CE1-OE2 3.72Å; H1041-E1067 PolarHBondContact CE1-OE2 2.78Å; H1041-E1067 IonicContact ND1-OE2 2.67Å; H1041-E1067 PolarHBondContact ND1-OE2 3.22Å
1042	A	55	Low	55.6	Low	3 Å²	3	46.7 Å²	46.7	3%	0.025	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	136.9	165	0	0	0	0	0	109.8	V1039 V1044 M1068 L1228	V1039-A1042 HydrophobicContact CG1-CB 3.9Å; A1042-V1044 HydrophobicContact CB-CG2 3.75Å; A1042-M1068 PolarHBondContact N-O 2.72Å; A1042-M1068 PolarHBondContact O-N 2.8Å; A1042-L1228 HydrophobicContact CB-CD2 4.23Å
1043	E	59.3	Low	55.5	Low	74 Å²	74	58.3 Å²	58.3	35%	0.346	29%	0.288	S	S	.	.			trans	-78.9	123	157.9	-170.1	-175.3	170.3	0	0	107.4	R1065 L1229	E1043-R1065 IonicContact OE1-CZ 3.38Å; E1043-R1065 IonicContact OE1-NE 2.7Å; E1043-R1065 PolarHBondContact OE1-NE 2.86Å; E1043-R1065 IonicContact OE1-NH2 3.14Å; E1043-R1065 PolarHBondContact OE1-NH2 3.37Å; E1043-R1065 VanDerWaalsContact OE1-NH2 3.14Å; E1043-L1229 HydrophobicContact CB-CD1 4.13Å
1044	V	61.2	Low	55.7	Low	1 Å²	1	61.3 Å²	61.3	1%	0.006	31%	0.309	C	S	.	.			trans	-121.8	101	-170.5	-168.3	0	0	0	0	111.3	A1042 V1046 M1068 L1079 I1226 R1227 L1228	A1042-V1044 HydrophobicContact CB-CG2 3.75Å; V1044-V1046 HydrophobicContact CG1-CG2 4.1Å; V1044-M1068 HydrophobicContact CB-CG 4.38Å; V1044-M1068 HydrophobicContact CB-SD 4.06Å; V1044-M1068 HydrophobicContact CG2-CB 3.8Å; V1044-M1068 HydrophobicContact CG2-CG 4.08Å; V1044-M1068 HydrophobicContact CG2-SD 4.23Å; V1044-L1079 HydrophobicContact CG1-CD1 3.73Å; V1044-L1079 HydrophobicContact CG1-CD2 4.24Å; V1044-L1079 HydrophobicContact CG2-CD2 4.45Å; V1044-I1226 HydrophobicContact CG1-CG2 3.51Å; V1044-R1227 WeakPolarHBondContact CA-O 3.41Å; V1044-L1228 HydrophobicContact CB-CD2 4.44Å; V1044-L1228 HydrophobicContact CG1-CD2 3.97Å; V1044-L1228 HydrophobicContact CG2-CD2 3.72Å
1045	T	65.2	Low	55.8	Low	24 Å²	24	64.4 Å²	64.4	15%	0.147	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	130.9	172.1	68	0	0	0	0	109.9	I1226 R1227	T1045-I1226 WeakPolarHBondContact O-CA 3.13Å; T1045-R1227 PolarHBondContact O-N 3.03Å; T1045-R1227 WeakPolarHBondContact OG1-CB 3.5Å; T1045-R1227 WeakPolarHBondContact OG1-CD 3.28Å; T1045-R1227 VanDerWaalsContact OG1-CG 3.26Å; T1045-R1227 WeakPolarHBondContact OG1-CG 3.29Å; T1045-R1227 PolarHBondContact OG1-NH1 3.35Å
1046	V	64	Low	55.5	Low	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	98.4	-177.2	-173.7	0	0	0	0	109.1	V1044 I1062 F1092 L1192 V1224 L1225	V1044-V1046 HydrophobicContact CG1-CG2 4.1Å; V1046-I1062 HydrophobicContact CB-CB 4.4Å; V1046-I1062 PolarHBondContact N-O 2.88Å; V1046-I1062 CarbonylContact O-C 3.47Å; V1046-I1062 WeakPolarHBondContact O-CA 3.37Å; V1046-I1062 WeakPolarHBondContact O-CB 3.49Å; V1046-I1062 PolarHBondContact O-N 2.89Å; V1046-F1092 HydrophobicContact CG2-CD1 4.07Å; V1046-F1092 HydrophobicContact CG2-CE1 3.79Å; V1046-F1092 HydrophobicContact CG2-CZ 4.36Å; V1046-L1192 HydrophobicContact CG1-CD1 3.49Å; V1046-L1192 VanDerWaalsContact CG1-CD1 3.49Å; V1046-V1224 HydrophobicContact CG1-CG1 3.39Å; V1046-L1225 CarbonylContact C-O 3.58Å; V1046-L1225 WeakPolarHBondContact CA-O 3.49Å
1047	D	66.6	Low	55.2	Low	1 Å²	1	66.4 Å²	66.4	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	121.7	-178.5	-64.8	-14.3	0	0	0	110.3	Y1061 V1224 L1225 R1227	D1047-Y1061 WeakPolarHBondContact OD1-CD1 3.38Å; D1047-V1224 WeakPolarHBondContact O-CA 3.38Å; D1047-L1225 HydrophobicContact CB-CB 4.36Å; D1047-L1225 PolarHBondContact N-O 2.89Å; D1047-L1225 PolarHBondContact O-N 2.85Å; D1047-R1227 IonicContact OD1-NH1 3.66Å; D1047-R1227 IonicContact OD2-CZ 3.68Å; D1047-R1227 IonicContact OD2-NH1 3.19Å; D1047-R1227 PolarHBondContact OD2-NH1 3.2Å; D1047-R1227 IonicContact OD2-NH2 2.59Å; D1047-R1227 PolarHBondContact OD2-NH2 2.86Å
1048	K	61.5	Low	54.8	Low	42 Å²	42	65.5 Å²	65.5	18%	0.183	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	121.5	174.2	-169.5	-170	178.7	-165.6	0	109.7	T1050 D1060 I1062 S1190	K1048-T1050 HydrophobicContact CD-CG2 4.01Å; K1048-T1050 HydrophobicContact CG-CG2 4.13Å; K1048-T1050 PolarHBondContact O-N 3.46Å; K1048-D1060 HydrophobicContact CB-CB 4.22Å; K1048-D1060 PolarHBondContact N-O 3.39Å; K1048-D1060 PolarHBondContact O-N 2.97Å; K1048-I1062 HydrophobicContact CB-CD1 4.23Å; K1048-S1190 PolarHBondContact NZ-OG 2.89Å
1049	L	59.6	Low	54.3	Low	39 Å²	39	67.4 Å²	67.4	20%	0.204	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	97.1	-175.6	-54	176.8	0	0	0	109.8	V1057 V1218 T1223 L1225	L1049-V1057 HydrophobicContact CB-CG1 3.82Å; L1049-V1057 HydrophobicContact CD2-CG1 3.96Å; L1049-V1057 HydrophobicContact CG-CG1 4.47Å; L1049-V1218 HydrophobicContact CD1-CG1 4.15Å; L1049-T1223 PolarHBondContact N-O 3.3Å; L1049-T1223 WeakPolarHBondContact O-CB 3.45Å; L1049-L1225 HydrophobicContact CD2-CB 4.47Å
1050	T	55.2	Low	53.7	Low	32 Å²	32	68.6 Å²	68.6	20%	0.196	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	106.7	-177.5	53.4	0	0	0	0	112.1	K1048 N1052 N1058 D1060	K1048-T1050 HydrophobicContact CD-CG2 4.01Å; K1048-T1050 HydrophobicContact CG-CG2 4.13Å; K1048-T1050 PolarHBondContact O-N 3.46Å; T1050-N1052 PolarHBondContact O-N 2.94Å; T1050-N1058 PolarHBondContact N-O 2.86Å; T1050-N1058 PolarHBondContact O-N 3.42Å; T1050-N1058 WeakPolarHBondContact OG1-CB 3.46Å; T1050-N1058 PolarHBondContact OG1-O 3.23Å; T1050-D1060 WeakPolarHBondContact CG2-OD2 3.05Å; T1050-D1060 PolarHBondContact OG1-OD2 3.41Å
1051	A	48.4	Very low	53.4	Low	71 Å²	71	73.4 Å²	73.4	59%	0.587	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	122.9	174.7	0	0	0	0	0	111
1052	N	49.1	Very low	53.3	Low	56 Å²	56	67.8 Å²	67.8	30%	0.299	34%	0.338	S	S	.	.			trans	-85.6	175	173.9	75.2	25.4	0	0	0	111.8	T1050 S1054 N1055 K1056	T1050-N1052 PolarHBondContact O-N 2.94Å; N1052-S1054 PolarHBondContact O-N 3.18Å; N1052-S1054 WeakPolarHBondContact OD1-CA 3.5Å; N1052-S1054 WeakPolarHBondContact OD1-CB 3.26Å; N1052-S1054 PolarHBondContact OD1-N 3.41Å; N1052-S1054 PolarHBondContact OD1-OG 3.18Å; N1052-N1055 PolarHBondContact O-N 3.2Å; N1052-K1056 PolarHBondContact N-O 3.45Å; N1052-K1056 PolarHBondContact OD1-N 3.3Å
1053	R	46	Very low	53.1	Low	269 Å²	269	70.9 Å²	70.9	100%	1.015	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-13.2	179.4	-85.2	-171.5	175.9	-177.7	-0.4	115.4
1054	S	49.4	Very low	52.8	Low	77 Å²	77	68.7 Å²	68.7	54%	0.538	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	17.3	175.8	64.4	0	0	0	0	113.5	N1052 K1056	N1052-S1054 PolarHBondContact O-N 3.18Å; N1052-S1054 WeakPolarHBondContact OD1-CA 3.5Å; N1052-S1054 WeakPolarHBondContact OD1-CB 3.26Å; N1052-S1054 PolarHBondContact OD1-N 3.41Å; N1052-S1054 PolarHBondContact OD1-OG 3.18Å; S1054-K1056 PolarHBondContact O-N 3.19Å
1055	N	43.8	Very low	52.6	Low	143 Å²	143	77.6 Å²	77.6	77%	0.765	38%	0.383	S	S	*	.	S	Bend	trans	56.1	12	-174	-92.7	9.8	0	0	0	115.6	N1052	N1052-N1055 PolarHBondContact O-N 3.2Å
1056	K	42.7	Very low	52.3	Low	147 Å²	147	78.7 Å²	78.7	64%	0.639	39%	0.389	S	S	*	.			trans	-75	129.2	168.3	-63.1	-174.4	178.6	-172.3	0	108.8	N1052 S1054 N1058	N1052-K1056 PolarHBondContact N-O 3.45Å; N1052-K1056 PolarHBondContact OD1-N 3.3Å; S1054-K1056 PolarHBondContact O-N 3.19Å; K1056-N1058 PolarHBondContact O-N 3.44Å
1057	V	47.5	Very low	52.3	Low	75 Å²	75	82.5 Å²	82.5	46%	0.455	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	114.2	171.2	-179.7	0	0	0	0	108.1	L1049	L1049-V1057 HydrophobicContact CB-CG1 3.82Å; L1049-V1057 HydrophobicContact CD2-CG1 3.96Å; L1049-V1057 HydrophobicContact CG-CG1 4.47Å
1058	N	47.2	Very low	52.3	Low	75 Å²	75	82.5 Å²	82.5	40%	0.401	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	138.9	160	-90.1	15.6	0	0	0	108.5	T1050 K1056 D1060	T1050-N1058 PolarHBondContact N-O 2.86Å; T1050-N1058 PolarHBondContact O-N 3.42Å; T1050-N1058 WeakPolarHBondContact OG1-CB 3.46Å; T1050-N1058 PolarHBondContact OG1-O 3.23Å; K1056-N1058 PolarHBondContact O-N 3.44Å; N1058-D1060 PolarHBondContact O-N 2.71Å
1059	H	47.8	Very low	52.7	Low	96 Å²	96	80.8 Å²	80.8	44%	0.444	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	95.5	164.6	-60.1	-82.1	0	0	0	107.9	Y1061	H1059-Y1061 VanDerWaalsContact C-N 3.32Å; H1059-Y1061 HydrophobicContact CB-CD2 4.37Å; H1059-Y1061 HydrophobicContact CB-CE2 4.04Å; H1059-Y1061 WeakPolarHBondContact O-CD2 3.44Å; H1059-Y1061 PolarHBondContact O-N 3.45Å; H1059-Y1061 VanDerWaalsContact O-N 3.12Å
1060	D	49.1	Very low	53.5	Low	47 Å²	47	79 Å²	79	25%	0.251	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	90.1	164.4	-76.8	-51	0	0	0	106.9	K1048 T1050 N1058 I1062	K1048-D1060 HydrophobicContact CB-CB 4.22Å; K1048-D1060 PolarHBondContact N-O 3.39Å; K1048-D1060 PolarHBondContact O-N 2.97Å; T1050-D1060 WeakPolarHBondContact CG2-OD2 3.05Å; T1050-D1060 PolarHBondContact OG1-OD2 3.41Å; N1058-D1060 PolarHBondContact O-N 2.71Å; D1060-I1062 PolarHBondContact O-N 3.44Å
1061	Y	47.7	Very low	54.4	Low	146 Å²	146	77.5 Å²	77.5	57%	0.573	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.2	131	-179.1	-71.9	-84.3	0	0	0	112	D1047 H1059	D1047-Y1061 WeakPolarHBondContact OD1-CD1 3.38Å; H1059-Y1061 VanDerWaalsContact C-N 3.32Å; H1059-Y1061 HydrophobicContact CB-CD2 4.37Å; H1059-Y1061 HydrophobicContact CB-CE2 4.04Å; H1059-Y1061 WeakPolarHBondContact O-CD2 3.44Å; H1059-Y1061 PolarHBondContact O-N 3.45Å; H1059-Y1061 VanDerWaalsContact O-N 3.12Å
1062	I	52.8	Low	55.7	Low	5 Å²	5	74.1 Å²	74.1	3%	0.026	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	71.2	167.3	-39.9	-177.7	0	0	0	107.6	V1046 K1048 D1060 E1064 F1092 K1093 A1094 L1192	V1046-I1062 HydrophobicContact CB-CB 4.4Å; V1046-I1062 PolarHBondContact N-O 2.88Å; V1046-I1062 CarbonylContact O-C 3.47Å; V1046-I1062 WeakPolarHBondContact O-CA 3.37Å; V1046-I1062 WeakPolarHBondContact O-CB 3.49Å; V1046-I1062 PolarHBondContact O-N 2.89Å; K1048-I1062 HydrophobicContact CB-CD1 4.23Å; D1060-I1062 PolarHBondContact O-N 3.44Å; I1062-E1064 PolarHBondContact O-N 3.49Å; I1062-F1092 HydrophobicContact CG2-CB 4.13Å; I1062-K1093 WeakPolarHBondContact CG2-O 3.29Å; I1062-A1094 HydrophobicContact CD1-CB 3.65Å; I1062-A1094 HydrophobicContact CG1-CB 3.99Å; I1062-L1192 HydrophobicContact CD1-CD1 3.73Å; I1062-L1192 HydrophobicContact CD1-CG 4.1Å
1063	C	50.7	Low	56.7	Low	68 Å²	68	72.1 Å²	72.1	46%	0.459	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	95.4	179.3	-162.6	0	0	0	0	109.9	R1065	C1063-R1065 PolarHBondContact O-N 3.24Å
1064	E	54	Low	57.6	Low	29 Å²	29	64.1 Å²	64.1	14%	0.136	32%	0.316	C	S	.	.			trans	-98.8	79.7	174.9	-167.6	151	-95.3	0	0	109.4	I1062 T1066 M1068 R1090 F1092	I1062-E1064 PolarHBondContact O-N 3.49Å; E1064-T1066 VanDerWaalsContact C-N 3.26Å; E1064-T1066 HydrophobicContact CG-CG2 4.5Å; E1064-T1066 PolarHBondContact O-N 3.48Å; E1064-T1066 PolarHBondContact O-OG1 3.34Å; E1064-M1068 HydrophobicContact CB-CE 3.82Å; E1064-M1068 HydrophobicContact CG-CE 3.7Å; E1064-R1090 IonicContact OE1-CZ 2.71Å; E1064-R1090 IonicContact OE1-NE 2.71Å; E1064-R1090 PolarHBondContact OE1-NE 3.33Å; E1064-R1090 IonicContact OE1-NH2 2.86Å; E1064-R1090 PolarHBondContact OE1-NH2 2.7Å; E1064-R1090 IonicContact OE2-CZ 2.69Å; E1064-R1090 IonicContact OE2-NE 3.14Å; E1064-R1090 PolarHBondContact OE2-NE 2.68Å; E1064-R1090 IonicContact OE2-NH2 3.18Å; E1064-F1092 HydrophobicContact CB-CD1 4.04Å; E1064-F1092 HydrophobicContact CB-CE1 4.29Å
1065	R	55.5	Low	58.7	Low	188 Å²	188	65.6 Å²	65.6	71%	0.709	32%	0.318	S	S	*	.			trans	-69.9	77.7	179	-81.6	-175.8	155.8	150.5	0.1	112.4	E1043 C1063	E1043-R1065 IonicContact OE1-CZ 3.38Å; E1043-R1065 IonicContact OE1-NE 2.7Å; E1043-R1065 PolarHBondContact OE1-NE 2.86Å; E1043-R1065 IonicContact OE1-NH2 3.14Å; E1043-R1065 PolarHBondContact OE1-NH2 3.37Å; E1043-R1065 VanDerWaalsContact OE1-NH2 3.14Å; C1063-R1065 PolarHBondContact O-N 3.24Å
1066	T	59.5	Low	60.1	Low	46 Å²	46	59 Å²	59	28%	0.282	28%	0.284	S	S	.	.	S	Bend	trans	-138.1	148.1	174.2	49.9	0	0	0	0	108	E1064 M1068 V1081	E1064-T1066 VanDerWaalsContact C-N 3.26Å; E1064-T1066 HydrophobicContact CG-CG2 4.5Å; E1064-T1066 PolarHBondContact O-N 3.48Å; E1064-T1066 PolarHBondContact O-OG1 3.34Å; T1066-M1068 WeakPolarHBondContact O-CG 3.43Å; T1066-M1068 PolarHBondContact O-N 2.81Å; T1066-M1068 VanDerWaalsContact O-N 3.14Å; T1066-M1068 VanDerWaalsContact OG1-CE 3.26Å; T1066-M1068 WeakPolarHBondContact OG1-CE 3.48Å; T1066-V1081 HydrophobicContact CG2-CG1 4.29Å; T1066-V1081 WeakPolarHBondContact OG1-CG1 3.47Å
1067	E	63.5	Low	61.9	Low	81 Å²	81	52 Å²	52	38%	0.379	25%	0.253	S	S	.	.			trans	-53.3	123.2	168.1	-67.8	173.3	-117.7	0	0	109.5	H1041 K1082	H1041-E1067 IonicContact CE1-OE2 3.72Å; H1041-E1067 PolarHBondContact CE1-OE2 2.78Å; H1041-E1067 IonicContact ND1-OE2 2.67Å; H1041-E1067 PolarHBondContact ND1-OE2 3.22Å; E1067-K1082 HydrophobicContact CB-CB 4.01Å; E1067-K1082 HydrophobicContact CB-CD 3.73Å; E1067-K1082 HydrophobicContact CG-CD 4.21Å; E1067-K1082 WeakPolarHBondContact O-CB 3.32Å; E1067-K1082 PolarHBondContact O-N 2.81Å; E1067-K1082 IonicContact OE1-NZ 2.72Å; E1067-K1082 PolarHBondContact OE1-NZ 3.3Å; E1067-K1082 WeakPolarHBondContact OE2-CD 3.41Å; E1067-K1082 IonicContact OE2-NZ 2.76Å; E1067-K1082 PolarHBondContact OE2-NZ 2.7Å
1068	M	67.8	Low	63.3	Low	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	139.1	174.9	-58.4	-150.7	176.8	0	0	111.5	A1042 V1044 E1064 T1066 L1079 M1080 V1081 F1092	A1042-M1068 PolarHBondContact N-O 2.72Å; A1042-M1068 PolarHBondContact O-N 2.8Å; V1044-M1068 HydrophobicContact CB-CG 4.38Å; V1044-M1068 HydrophobicContact CB-SD 4.06Å; V1044-M1068 HydrophobicContact CG2-CB 3.8Å; V1044-M1068 HydrophobicContact CG2-CG 4.08Å; V1044-M1068 HydrophobicContact CG2-SD 4.23Å; E1064-M1068 HydrophobicContact CB-CE 3.82Å; E1064-M1068 HydrophobicContact CG-CE 3.7Å; T1066-M1068 WeakPolarHBondContact O-CG 3.43Å; T1066-M1068 PolarHBondContact O-N 2.81Å; T1066-M1068 VanDerWaalsContact O-N 3.14Å; T1066-M1068 VanDerWaalsContact OG1-CE 3.26Å; T1066-M1068 WeakPolarHBondContact OG1-CE 3.48Å; M1068-L1079 HydrophobicContact SD-CB 4.25Å; M1068-M1080 VanDerWaalsContact CA-O 3.3Å; M1068-M1080 WeakPolarHBondContact CA-O 3.25Å; M1068-V1081 HydrophobicContact CE-CB 4.41Å; M1068-V1081 HydrophobicContact CE-CG1 4.3Å; M1068-V1081 HydrophobicContact CE-CG2 3.62Å; M1068-V1081 HydrophobicContact SD-CG2 4.05Å; M1068-F1092 HydrophobicContact CE-CD1 4.38Å; M1068-F1092 HydrophobicContact CE-CE1 3.47Å; M1068-F1092 VanDerWaalsContact CE-CE1 3.47Å; M1068-F1092 HydrophobicContact CE-CZ 3.97Å; M1068-F1092 HydrophobicContact SD-CE1 3.78Å; M1068-F1092 HydrophobicContact SD-CZ 3.72Å
1069	L	70.5	Confident	64.8	Low	7 Å²	7	45.2 Å²	45.2	4%	0.037	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	108.7	164.9	-176.7	70.1	0	0	0	107.5	L992 V1038 V1039 I1071 M1080 Y1087	L992-L1069 HydrophobicContact CD1-CD2 4.28Å; V1038-L1069 HydrophobicContact CG1-CD1 3.42Å; V1038-L1069 VanDerWaalsContact CG1-CD1 3.42Å; V1038-L1069 HydrophobicContact CG1-CG 4.3Å; V1039-L1069 WeakPolarHBondContact O-CA 3.28Å; L1069-I1071 HydrophobicContact CD2-CD1 4.22Å; L1069-I1071 HydrophobicContact CG-CD1 4.42Å; L1069-I1071 HydrophobicContact CG-CG1 4.24Å; L1069-M1080 HydrophobicContact CB-CB 4.3Å; L1069-M1080 HydrophobicContact CD2-SD 4.34Å; L1069-M1080 PolarHBondContact N-O 3.23Å; L1069-M1080 PolarHBondContact O-N 3.42Å; L1069-Y1087 HydrophobicContact CB-CD1 3.79Å; L1069-Y1087 HydrophobicContact CB-CE1 3.83Å; L1069-Y1087 HydrophobicContact CB-CG 4.25Å
1070	A	75.6	Confident	66	Low	0 Å²	0	41 Å²	41	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	129.4	176.1	0	0	0	0	0	110.2	V1038 V1039 I1078 L1079 L1228 W1239	V1038-A1070 WeakPolarHBondContact CA-O 3.47Å; V1039-A1070 HydrophobicContact CB-CB 4.44Å; V1039-A1070 PolarHBondContact N-O 2.89Å; V1039-A1070 PolarHBondContact O-N 3.25Å; A1070-I1078 WeakPolarHBondContact CA-O 3.43Å; A1070-L1079 HydrophobicContact CB-CD2 3.89Å; A1070-L1228 HydrophobicContact CB-CD2 4.32Å; A1070-W1239 HydrophobicContact CB-CH2 4.15Å
1071	I	73	Confident	67.2	Low	1 Å²	1	38.7 Å²	38.7	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	111.1	-176.9	-51	173	0	0	0	108.5	F1029 L1033 V1038 L1069 L1073 I1078 M1080	F1029-I1071 HydrophobicContact CE2-CD1 4.2Å; F1029-I1071 HydrophobicContact CZ-CD1 4.15Å; L1033-I1071 HydrophobicContact CD2-CD1 4.37Å; L1033-I1071 HydrophobicContact CD2-CG2 4.02Å; V1038-I1071 HydrophobicContact CG2-CG2 4.45Å; L1069-I1071 HydrophobicContact CD2-CD1 4.22Å; L1069-I1071 HydrophobicContact CG-CD1 4.42Å; L1069-I1071 HydrophobicContact CG-CG1 4.24Å; I1071-L1073 HydrophobicContact CG2-CD2 3.7Å; I1071-L1073 HydrophobicContact CG2-CG 4.25Å; I1071-I1078 PolarHBondContact N-O 3.03Å; I1071-I1078 PolarHBondContact O-N 2.6Å; I1071-M1080 HydrophobicContact CD1-SD 4.45Å
1072	L	76.4	Confident	68.3	Low	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	109	-179	172.2	60.6	0	0	0	110.9	H1036 W1037 L1077 L1198 W1239 Y1242 I1243	H1036-L1072 VanDerWaalsContact CB-O 3.27Å; H1036-L1072 WeakPolarHBondContact CB-O 3.2Å; H1036-L1072 PolarHBondContact CD2-O 3.43Å; W1037-L1072 PolarHBondContact O-N 3.36Å; W1037-L1072 VanDerWaalsContact O-N 3.12Å; L1072-L1077 HydrophobicContact CB-CD1 4.36Å; L1072-L1198 HydrophobicContact CD1-CD1 3.82Å; L1072-L1198 HydrophobicContact CD1-CD2 4.34Å; L1072-W1239 HydrophobicContact CB-CD2 4.17Å; L1072-W1239 HydrophobicContact CB-CE3 3.8Å; L1072-W1239 HydrophobicContact CB-CH2 3.6Å; L1072-W1239 HydrophobicContact CB-CZ2 3.97Å; L1072-W1239 HydrophobicContact CB-CZ3 3.52Å; L1072-W1239 HydrophobicContact CD2-CB 4.11Å; L1072-W1239 HydrophobicContact CD2-CD2 3.54Å; L1072-W1239 HydrophobicContact CD2-CE3 3.53Å; L1072-W1239 HydrophobicContact CD2-CG 3.82Å; L1072-W1239 HydrophobicContact CD2-CZ3 4.18Å; L1072-W1239 HydrophobicContact CG-CE3 4.22Å; L1072-W1239 HydrophobicContact CG-CZ3 4.4Å; L1072-Y1242 HydrophobicContact CD1-CD1 4.36Å; L1072-Y1242 HydrophobicContact CD2-CD1 3.85Å; L1072-Y1242 HydrophobicContact CG-CD1 3.98Å; L1072-Y1242 HydrophobicContact CG-CE1 4.27Å; L1072-I1243 HydrophobicContact CD1-CD1 4.03Å; L1072-I1243 HydrophobicContact CD1-CG1 3.7Å; L1072-I1243 HydrophobicContact CD2-CD1 4.09Å; L1072-I1243 HydrophobicContact CD2-CG1 3.93Å; L1072-I1243 HydrophobicContact CG-CG1 4.48Å
1073	L	69.6	Low	68.9	Low	15 Å²	15	39.1 Å²	39.1	8%	0.079	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	153.1	-175.5	-40.4	150	0	0	0	109.5	L1025 V1032 H1036 I1071 N1075 A1076 I1078 L1198	L1025-L1073 HydrophobicContact CD1-CD1 3.49Å; L1025-L1073 VanDerWaalsContact CD1-CD1 3.49Å; L1025-L1073 HydrophobicContact CD1-CD2 3.69Å; L1025-L1073 HydrophobicContact CD1-CG 4.26Å; V1032-L1073 HydrophobicContact CG1-CD2 3.36Å; H1036-L1073 VanDerWaalsContact CD2-CA 3.48Å; H1036-L1073 WeakPolarHBondContact CD2-CA 3.29Å; I1071-L1073 HydrophobicContact CG2-CD2 3.7Å; I1071-L1073 HydrophobicContact CG2-CG 4.25Å; L1073-N1075 PolarHBondContact O-N 3.35Å; L1073-A1076 CarbonylContact C-O 3.57Å; L1073-A1076 VanDerWaalsContact CA-O 3.31Å; L1073-A1076 WeakPolarHBondContact CA-O 3.46Å; L1073-A1076 WeakPolarHBondContact CB-O 3.49Å; L1073-A1076 HydrophobicContact CD1-CB 4.05Å; L1073-A1076 WeakPolarHBondContact CD1-O 3.29Å; L1073-A1076 WeakPolarHBondContact CG-O 3.37Å; L1073-A1076 PolarHBondContact N-O 2.98Å; L1073-A1076 PolarHBondContact O-N 3.35Å; L1073-A1076 VanDerWaalsContact O-O 3.06Å; L1073-I1078 HydrophobicContact CD1-CD1 3.65Å; L1073-I1078 HydrophobicContact CD1-CG1 3.74Å; L1073-L1198 WeakPolarHBondContact O-CD1 3.34Å
1074	H	66.4	Low	69.8	Low	100 Å²	100	38.7 Å²	38.7	46%	0.463	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-39.7	-39.3	178.9	-157.8	-50.3	0	0	0	116	H1036 Y1242 N1246	H1036-H1074 PolarHBondContact CD2-N 2.86Å; H1036-H1074 VanDerWaalsContact CD2-N 3.32Å; H1036-H1074 PolarHBondContact NE2-N 3.28Å; H1036-H1074 VanDerWaalsContact NE2-N 3.14Å; H1074-Y1242 WeakPolarHBondContact CA-OH 3.27Å; H1074-Y1242 PolarHBondContact N-OH 3.48Å; H1074-N1246 PolarHBondContact CE1-OD1 2.86Å; H1074-N1246 PolarHBondContact ND1-OD1 3.48Å; H1074-N1246 PolarHBondContact O-OD1 2.87Å
1075	N	71.3	Confident	70.1	Confident	109 Å²	109	45.3 Å²	45.3	58%	0.583	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.8	2.9	-177.7	-63.1	20.4	0	0	0	113.6	L1073 P1197 L1198	L1073-N1075 PolarHBondContact O-N 3.35Å; N1075-P1197 WeakPolarHBondContact O-CA 3.23Å; N1075-L1198 PolarHBondContact O-N 3.22Å
1076	A	73.2	Confident	69.8	Low	5 Å²	5	42.3 Å²	42.3	4%	0.041	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	149.7	-176.5	0	0	0	0	0	114	L1073 I1195 F1196	L1073-A1076 CarbonylContact C-O 3.57Å; L1073-A1076 VanDerWaalsContact CA-O 3.31Å; L1073-A1076 WeakPolarHBondContact CA-O 3.46Å; L1073-A1076 WeakPolarHBondContact CB-O 3.49Å; L1073-A1076 HydrophobicContact CD1-CB 4.05Å; L1073-A1076 WeakPolarHBondContact CD1-O 3.29Å; L1073-A1076 WeakPolarHBondContact CG-O 3.37Å; L1073-A1076 PolarHBondContact N-O 2.98Å; L1073-A1076 PolarHBondContact O-N 3.35Å; L1073-A1076 VanDerWaalsContact O-O 3.06Å; A1076-I1195 HydrophobicContact CB-CG2 4.43Å; A1076-F1196 CarbonylContact C-O 3.57Å; A1076-F1196 VanDerWaalsContact CA-O 3.25Å; A1076-F1196 WeakPolarHBondContact CA-O 3.46Å
1077	L	80.7	Confident	70.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	134.7	165.5	177.2	63.5	0	0	0	109.6	L1072 L1079 F1196 L1198 I1217 F1219 I1226 W1239	L1072-L1077 HydrophobicContact CB-CD1 4.36Å; L1077-L1079 HydrophobicContact CG-CD2 4.47Å; L1077-F1196 HydrophobicContact CB-CB 4.48Å; L1077-F1196 PolarHBondContact N-O 3.22Å; L1077-F1196 PolarHBondContact O-N 3.47Å; L1077-L1198 HydrophobicContact CB-CD2 4.46Å; L1077-I1217 HydrophobicContact CD2-CD1 3.81Å; L1077-F1219 HydrophobicContact CB-CZ 4.13Å; L1077-F1219 HydrophobicContact CD2-CE2 4.29Å; L1077-F1219 HydrophobicContact CD2-CZ 4.02Å; L1077-I1226 HydrophobicContact CD2-CD1 4.15Å; L1077-W1239 HydrophobicContact CD1-CZ3 3.99Å
1078	I	77	Confident	70	Confident	6 Å²	6	39.8 Å²	39.8	3%	0.031	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.2	175.9	-64.1	-171.9	0	0	0	110.5	L1025 A1070 I1071 L1073 M1080 L1089 P1194 I1195	L1025-I1078 HydrophobicContact CD1-CD1 3.62Å; L1025-I1078 HydrophobicContact CD2-CD1 3.37Å; L1025-I1078 HydrophobicContact CG-CD1 4.08Å; A1070-I1078 WeakPolarHBondContact CA-O 3.43Å; I1071-I1078 PolarHBondContact N-O 3.03Å; I1071-I1078 PolarHBondContact O-N 2.6Å; L1073-I1078 HydrophobicContact CD1-CD1 3.65Å; L1073-I1078 HydrophobicContact CD1-CG1 3.74Å; I1078-M1080 HydrophobicContact CG2-CG 4.27Å; I1078-L1089 HydrophobicContact CG2-CD1 3.81Å; I1078-P1194 WeakPolarHBondContact CA-O 3.21Å; I1078-I1195 HydrophobicContact CD1-CD1 4.14Å; I1078-I1195 HydrophobicContact CD1-CG1 4.17Å; I1078-I1195 HydrophobicContact CD1-CG2 4.29Å; I1078-I1195 HydrophobicContact CG1-CB 4.39Å; I1078-I1195 HydrophobicContact CG1-CG1 4.07Å; I1078-I1195 HydrophobicContact CG1-CG2 4.04Å
1079	L	77.7	Confident	70.1	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.7	176.8	-56.6	178	0	0	0	109.7	V1044 M1068 A1070 L1077 F1092 P1194 F1196 I1226 L1228	V1044-L1079 HydrophobicContact CG1-CD1 3.73Å; V1044-L1079 HydrophobicContact CG1-CD2 4.24Å; V1044-L1079 HydrophobicContact CG2-CD2 4.45Å; M1068-L1079 HydrophobicContact SD-CB 4.25Å; A1070-L1079 HydrophobicContact CB-CD2 3.89Å; L1077-L1079 HydrophobicContact CG-CD2 4.47Å; L1079-F1092 HydrophobicContact CB-CE2 4.19Å; L1079-F1092 HydrophobicContact CB-CZ 3.83Å; L1079-F1092 HydrophobicContact CD1-CE1 4.39Å; L1079-F1092 HydrophobicContact CD1-CE2 4.07Å; L1079-F1092 HydrophobicContact CD1-CZ 3.53Å; L1079-F1092 HydrophobicContact CG-CZ 4.35Å; L1079-P1194 PolarHBondContact N-O 3.39Å; L1079-P1194 VanDerWaalsContact N-O 3.13Å; L1079-P1194 WeakPolarHBondContact O-CB 3.31Å; L1079-F1196 HydrophobicContact CD1-CE2 3.94Å; L1079-F1196 HydrophobicContact CG-CE2 4.42Å; L1079-I1226 HydrophobicContact CD1-CD1 4.13Å; L1079-I1226 HydrophobicContact CD1-CG2 4.35Å; L1079-L1228 HydrophobicContact CD2-CD2 4.47Å
1080	M	73.7	Confident	69.8	Low	7 Å²	7	43.2 Å²	43.2	3%	0.034	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	130.2	172.9	-57.5	-178.8	62.7	0	0	110.6	L992 L1001 M1068 L1069 I1071 I1078 Y1087 L1089	L992-M1080 HydrophobicContact CD2-CE 3.9Å; L992-M1080 HydrophobicContact CD2-SD 4.07Å; L1001-M1080 HydrophobicContact CD1-CE 4.12Å; L1001-M1080 HydrophobicContact CD2-CE 4.16Å; L1001-M1080 HydrophobicContact CG-CE 4.29Å; M1068-M1080 VanDerWaalsContact CA-O 3.3Å; M1068-M1080 WeakPolarHBondContact CA-O 3.25Å; L1069-M1080 HydrophobicContact CB-CB 4.3Å; L1069-M1080 HydrophobicContact CD2-SD 4.34Å; L1069-M1080 PolarHBondContact N-O 3.23Å; L1069-M1080 PolarHBondContact O-N 3.42Å; I1071-M1080 HydrophobicContact CD1-SD 4.45Å; I1078-M1080 HydrophobicContact CG2-CG 4.27Å; M1080-Y1087 WeakPolarHBondContact CE-O 3.38Å; M1080-L1089 HydrophobicContact CG-CD1 4.11Å
1081	V	74.2	Confident	69.4	Low	0 Å²	0	44 Å²	44	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	130.5	-172.3	-176.5	0	0	0	0	110.3	T1066 M1068 Y1087 I1088 R1090	T1066-V1081 HydrophobicContact CG2-CG1 4.29Å; T1066-V1081 WeakPolarHBondContact OG1-CG1 3.47Å; M1068-V1081 HydrophobicContact CE-CB 4.41Å; M1068-V1081 HydrophobicContact CE-CG1 4.3Å; M1068-V1081 HydrophobicContact CE-CG2 3.62Å; M1068-V1081 HydrophobicContact SD-CG2 4.05Å; V1081-Y1087 CarbonylContact O-C 3.51Å; V1081-Y1087 WeakPolarHBondContact O-CA 3.44Å; V1081-I1088 HydrophobicContact CB-CG1 4.4Å; V1081-I1088 PolarHBondContact N-O 2.63Å; V1081-I1088 WeakPolarHBondContact O-CG1 3.28Å; V1081-I1088 PolarHBondContact O-N 3.35Å; V1081-R1090 HydrophobicContact CB-CG 4.2Å; V1081-R1090 HydrophobicContact CG2-CG 3.69Å
1082	K	70.5	Confident	69	Low	65 Å²	65	44 Å²	44	28%	0.283	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	127.8	172.6	-166.7	179.2	-179	-176.2	0	110.9	E1067 G1084 R1086 Y1087	E1067-K1082 HydrophobicContact CB-CB 4.01Å; E1067-K1082 HydrophobicContact CB-CD 3.73Å; E1067-K1082 HydrophobicContact CG-CD 4.21Å; E1067-K1082 WeakPolarHBondContact O-CB 3.32Å; E1067-K1082 PolarHBondContact O-N 2.81Å; E1067-K1082 IonicContact OE1-NZ 2.72Å; E1067-K1082 PolarHBondContact OE1-NZ 3.3Å; E1067-K1082 WeakPolarHBondContact OE2-CD 3.41Å; E1067-K1082 IonicContact OE2-NZ 2.76Å; E1067-K1082 PolarHBondContact OE2-NZ 2.7Å; K1082-G1084 WeakPolarHBondContact CE-O 3.5Å; K1082-G1084 WeakPolarHBondContact CG-O 3.46Å; K1082-R1086 CarbonylContact C-O 3.49Å; K1082-R1086 VanDerWaalsContact CA-O 3.32Å; K1082-R1086 WeakPolarHBondContact CA-O 2.94Å; K1082-Y1087 HydrophobicContact CB-CD1 3.97Å; K1082-Y1087 HydrophobicContact CB-CE1 3.69Å; K1082-Y1087 HydrophobicContact CD-CE1 4.42Å; K1082-Y1087 HydrophobicContact CG-CE1 4.11Å
1083	D	66.4	Low	68.1	Low	94 Å²	94	50 Å²	50	50%	0.503	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	99.3	178.6	-172.3	14.4	0	0	0	108.1	E1085 R1086 I1088	D1083-E1085 PolarHBondContact O-N 3.22Å; D1083-R1086 PolarHBondContact N-O 3.44Å; D1083-R1086 WeakPolarHBondContact O-CB 3.39Å; D1083-R1086 PolarHBondContact O-N 3.48Å; D1083-I1088 HydrophobicContact CB-CD1 3.69Å; D1083-I1088 HydrophobicContact CB-CG1 3.85Å; D1083-I1088 WeakPolarHBondContact OD2-CD1 3.25Å
1084	G	69.8	Low	67.2	Low	59 Å²	59	50.3 Å²	50.3	61%	0.608	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	-124.9	-162.7	0	0	0	0	0	111.7	K1082 R1086	K1082-G1084 WeakPolarHBondContact CE-O 3.5Å; K1082-G1084 WeakPolarHBondContact CG-O 3.46Å; G1084-R1086 VanDerWaalsContact C-N 3.31Å
1085	E	60.8	Low	66.3	Low	169 Å²	169	50.7 Å²	50.7	79%	0.79	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-4.8	174.4	-58.3	-176.3	151.4	0	0	113.7	R995 D1083	R995-E1085 PolarHBondContact NH1-O 2.94Å; R995-E1085 PolarHBondContact NH2-O 3.24Å; D1083-E1085 PolarHBondContact O-N 3.22Å
1086	R	48.7	Very low	64.7	Low	125 Å²	125	53.4 Å²	53.4	47%	0.472	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	148.8	-171	-53.9	-176.2	-169.9	-134	-0.5	110.3	K1082 D1083 G1084	K1082-R1086 CarbonylContact C-O 3.49Å; K1082-R1086 VanDerWaalsContact CA-O 3.32Å; K1082-R1086 WeakPolarHBondContact CA-O 2.94Å; D1083-R1086 PolarHBondContact N-O 3.44Å; D1083-R1086 WeakPolarHBondContact O-CB 3.39Å; D1083-R1086 PolarHBondContact O-N 3.48Å; G1084-R1086 VanDerWaalsContact C-N 3.31Å
1087	Y	64.5	Low	63	Low	43 Å²	43	61.7 Å²	61.7	17%	0.169	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	122.8	164.8	-72.9	-78.6	0	0	0	107.9	A1040 L1069 M1080 V1081 K1082	A1040-Y1087 PolarHBondContact O-OH 2.93Å; L1069-Y1087 HydrophobicContact CB-CD1 3.79Å; L1069-Y1087 HydrophobicContact CB-CE1 3.83Å; L1069-Y1087 HydrophobicContact CB-CG 4.25Å; M1080-Y1087 WeakPolarHBondContact CE-O 3.38Å; V1081-Y1087 CarbonylContact O-C 3.51Å; V1081-Y1087 WeakPolarHBondContact O-CA 3.44Å; K1082-Y1087 HydrophobicContact CB-CD1 3.97Å; K1082-Y1087 HydrophobicContact CB-CE1 3.69Å; K1082-Y1087 HydrophobicContact CD-CE1 4.42Å; K1082-Y1087 HydrophobicContact CG-CE1 4.11Å
1088	I	62	Low	60.7	Low	30 Å²	30	70.7 Å²	70.7	15%	0.154	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	136.6	-178.1	49.2	167.3	0	0	0	111.7	V1081 D1083 R1090	V1081-I1088 HydrophobicContact CB-CG1 4.4Å; V1081-I1088 PolarHBondContact N-O 2.63Å; V1081-I1088 WeakPolarHBondContact O-CG1 3.28Å; V1081-I1088 PolarHBondContact O-N 3.35Å; D1083-I1088 HydrophobicContact CB-CD1 3.69Å; D1083-I1088 HydrophobicContact CB-CG1 3.85Å; D1083-I1088 WeakPolarHBondContact OD2-CD1 3.25Å; I1088-R1090 HydrophobicContact CD1-CB 4.43Å; I1088-R1090 PolarHBondContact O-N 3.05Å
1089	L	69.1	Low	58.4	Low	5 Å²	5	74.1 Å²	74.1	3%	0.026	38%	0.38	C	S	.	.			trans	-83.7	92.1	173.2	-169.3	74	0	0	0	108.6	L1001 T1003 L1005 F1022 I1078 M1080 P1194 I1195	L1001-L1089 HydrophobicContact CD2-CB 4.07Å; T1003-L1089 HydrophobicContact CG2-CD2 4.14Å; L1005-L1089 HydrophobicContact CD1-CD2 4.39Å; F1022-L1089 HydrophobicContact CE2-CD2 3.88Å; F1022-L1089 HydrophobicContact CZ-CD2 4.05Å; I1078-L1089 HydrophobicContact CG2-CD1 3.81Å; M1080-L1089 HydrophobicContact CG-CD1 4.11Å; L1089-P1194 HydrophobicContact CD1-CB 3.83Å; L1089-P1194 HydrophobicContact CD1-CG 3.57Å; L1089-P1194 HydrophobicContact CG-CB 4.42Å; L1089-P1194 HydrophobicContact CG-CG 3.66Å; L1089-I1195 HydrophobicContact CD2-CD1 4.34Å
1090	R	65.9	Low	55.8	Low	74 Å²	74	77.6 Å²	77.6	28%	0.279	42%	0.415	S	S	.	.			trans	-114.6	151.3	-175.8	86.6	-168	-156	168.7	9.7	112.8	S1004 E1064 V1081 I1088 P1194	S1004-R1090 VanDerWaalsContact OG-CA 3.28Å; S1004-R1090 WeakPolarHBondContact OG-CA 3.35Å; S1004-R1090 VanDerWaalsContact OG-CB 3.26Å; S1004-R1090 WeakPolarHBondContact OG-CB 3.22Å; E1064-R1090 IonicContact OE1-CZ 2.71Å; E1064-R1090 IonicContact OE1-NE 2.71Å; E1064-R1090 PolarHBondContact OE1-NE 3.33Å; E1064-R1090 IonicContact OE1-NH2 2.86Å; E1064-R1090 PolarHBondContact OE1-NH2 2.7Å; E1064-R1090 IonicContact OE2-CZ 2.69Å; E1064-R1090 IonicContact OE2-NE 3.14Å; E1064-R1090 PolarHBondContact OE2-NE 2.68Å; E1064-R1090 IonicContact OE2-NH2 3.18Å; V1081-R1090 HydrophobicContact CB-CG 4.2Å; V1081-R1090 HydrophobicContact CG2-CG 3.69Å; I1088-R1090 HydrophobicContact CD1-CB 4.43Å; I1088-R1090 PolarHBondContact O-N 3.05Å; R1090-P1194 WeakPolarHBondContact O-CB 3.35Å; R1090-P1194 VanDerWaalsContact O-CG 3.31Å; R1090-P1194 WeakPolarHBondContact O-CG 3.36Å
1091	S	66.1	Low	53.5	Low	17 Å²	17	83.2 Å²	83.2	12%	0.119	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-76.4	123.4	172.1	64.3	0	0	0	0	110.8	K1093 K1191 L1192	S1091-K1093 PolarHBondContact O-N 2.91Å; S1091-K1191 WeakPolarHBondContact OG-CD 3.34Å; S1091-L1192 CarbonylContact C-O 3.59Å; S1091-L1192 WeakPolarHBondContact CA-O 3.26Å; S1091-L1192 WeakPolarHBondContact CB-O 3.39Å
1092	F	65.7	Low	51.1	Low	0 Å²	0	89.3 Å²	89.3	0%	0	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	127.7	174.5	-59.9	-108.5	0	0	0	109.2	V1046 I1062 E1064 M1068 L1079 K1191 L1192 P1194	V1046-F1092 HydrophobicContact CG2-CD1 4.07Å; V1046-F1092 HydrophobicContact CG2-CE1 3.79Å; V1046-F1092 HydrophobicContact CG2-CZ 4.36Å; I1062-F1092 HydrophobicContact CG2-CB 4.13Å; E1064-F1092 HydrophobicContact CB-CD1 4.04Å; E1064-F1092 HydrophobicContact CB-CE1 4.29Å; M1068-F1092 HydrophobicContact CE-CD1 4.38Å; M1068-F1092 HydrophobicContact CE-CE1 3.47Å; M1068-F1092 VanDerWaalsContact CE-CE1 3.47Å; M1068-F1092 HydrophobicContact CE-CZ 3.97Å; M1068-F1092 HydrophobicContact SD-CE1 3.78Å; M1068-F1092 HydrophobicContact SD-CZ 3.72Å; L1079-F1092 HydrophobicContact CB-CE2 4.19Å; L1079-F1092 HydrophobicContact CB-CZ 3.83Å; L1079-F1092 HydrophobicContact CD1-CE1 4.39Å; L1079-F1092 HydrophobicContact CD1-CE2 4.07Å; L1079-F1092 HydrophobicContact CD1-CZ 3.53Å; L1079-F1092 HydrophobicContact CG-CZ 4.35Å; F1092-K1191 CarbonylContact O-C 3.43Å; F1092-K1191 WeakPolarHBondContact O-CA 3.41Å; F1092-L1192 HydrophobicContact CB-CB 4.24Å; F1092-L1192 PolarHBondContact N-O 3.29Å; F1092-L1192 VanDerWaalsContact N-O 3.15Å; F1092-L1192 PolarHBondContact O-N 2.8Å; F1092-P1194 HydrophobicContact CD2-CB 4.41Å; F1092-P1194 HydrophobicContact CE2-CB 3.88Å
1093	K	56.1	Low	49.1	Very low	128 Å²	128	89.6 Å²	89.6	56%	0.557	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	122.1	177.4	-174	-179.9	-179.8	-177	0	109.3	I1062 S1091 V1095	I1062-K1093 WeakPolarHBondContact CG2-O 3.29Å; S1091-K1093 PolarHBondContact O-N 2.91Å; K1093-V1095 PolarHBondContact O-N 2.91Å
1094	A	50.8	Low	47.2	Very low	21 Å²	21	90.6 Å²	90.6	17%	0.174	53%	0.533	C	S	.	.			trans	-58.8	103.5	172.2	0	0	0	0	0	111.2	I1062 R1096	I1062-A1094 HydrophobicContact CD1-CB 3.65Å; I1062-A1094 HydrophobicContact CG1-CB 3.99Å; A1094-R1096 PolarHBondContact O-N 2.95Å
1095	V	47.8	Very low	45.1	Very low	107 Å²	107	93.4 Å²	93.4	65%	0.648	54%	0.543	S	S	*	.			trans	-87.4	96.7	171.8	179.9	0	0	0	0	107.6	K1093 E1097	K1093-V1095 PolarHBondContact O-N 2.91Å; V1095-E1097 PolarHBondContact O-N 2.97Å; V1095-E1097 VanDerWaalsContact O-N 3.16Å
1096	R	38.8	Very low	43.6	Very low	166 Å²	166	88.3 Å²	88.3	63%	0.626	54%	0.536	S	S	*	.			trans	-78.1	97.9	174.7	-165.8	-177.1	-158.1	-140.1	2.1	109	A1094 Q1098	A1094-R1096 PolarHBondContact O-N 2.95Å; R1096-Q1098 PolarHBondContact O-N 3.4Å
1097	E	36.5	Very low	42.5	Very low	180 Å²	180	90 Å²	90	84%	0.841	55%	0.552	S	S	*	*			trans	-56.2	127.5	169	-70	-162.1	140.7	0	0	109.6	V1095 G1099	V1095-E1097 PolarHBondContact O-N 2.97Å; V1095-E1097 VanDerWaalsContact O-N 3.16Å; E1097-G1099 PolarHBondContact O-N 2.88Å
1098	Q	32.4	Very low	40.7	Very low	188 Å²	188	92.5 Å²	92.5	88%	0.879	58%	0.576	S	S	*	*			trans	-81.6	97.4	172.8	-68.3	-171.4	7.6	0	0	108.3	R1096 G1100	R1096-Q1098 PolarHBondContact O-N 3.4Å; Q1098-G1100 PolarHBondContact O-N 3.06Å
1099	G	29.5	Very low	39.1	Very low	79 Å²	79	96 Å²	96	81%	0.814	60%	0.603	S	S	*	*			trans	-55.5	105.3	162.2	0	0	0	0	0	108.8	E1097 C1101	E1097-G1099 PolarHBondContact O-N 2.88Å; G1099-C1101 PolarHBondContact O-N 2.99Å
1100	G	22.8	Very low	37.2	Very low	72 Å²	72	101.6 Å²	101.6	74%	0.742	64%	0.638	S	S	*	*			trans	-72.4	127.3	-164.9	0	0	0	0	0	112.9	Q1098	Q1098-G1100 PolarHBondContact O-N 3.06Å
1101	C	24.6	Very low	35.5	Very low	126 Å²	126	103.4 Å²	103.4	85%	0.851	66%	0.662	S	S	*	*			trans	-142.6	117.8	162.8	-93.8	0	0	0	0	111.3	G1099	G1099-C1101 PolarHBondContact O-N 2.99Å
1102	S	24.8	Very low	33.8	Very low	127 Å²	127	106.7 Å²	106.7	89%	0.888	69%	0.69	S	S	*	*			trans	-42.2	146.9	166.9	48.1	0	0	0	0	116.5
1103	G	28	Very low	32.1	Very low	72 Å²	72	111.4 Å²	111.4	74%	0.742	72%	0.723	S	S	*	*			trans	125.8	87.1	171.3	0	0	0	0	0	111.8
1104	S	25.7	Very low	30.8	Very low	115 Å²	115	112.6 Å²	112.6	80%	0.804	74%	0.736	S	S	*	*			cis	77.8	132.8	48.7	-161.4	0	0	0	0	114.8
1105	S	27.4	Very low	29.8	Very low	117 Å²	117	116.6 Å²	116.6	82%	0.818	76%	0.762	S	S	*	*			trans	88.9	139.2	169	-39.1	0	0	0	0	119.2
1106	G	28.9	Very low	28.8	Very low	63 Å²	63	115.8 Å²	115.8	65%	0.649	76%	0.761	S	S	*	*			trans	86	103.7	170.3	0	0	0	0	0	114.9
1107	I	25	Very low	28.2	Very low	160 Å²	160	113.6 Å²	113.6	82%	0.821	77%	0.766	S	S	*	*			cis	61.7	114.6	29.2	-38.3	174.9	0	0	0	109.5
1108	S	27.9	Very low	27.7	Very low	96 Å²	96	110.5 Å²	110.5	67%	0.671	76%	0.76	S	S	*	*				-165.8	166.6	65.1	-49.3	0	0	0	0	114.2
1109	S	28.2	Very low	27.4	Very low	102 Å²	102	106.9 Å²	106.9	71%	0.713	74%	0.743	S	S	*	*			trans	63.9	139.4	140.3	60.5	0	0	0	0	120.8
1110	T	29.3	Very low	27.3	Very low	124 Å²	124	112 Å²	112	76%	0.761	74%	0.737	S	S	*	*			cis	-165	156.2	-2.3	11.3	0	0	0	0	111.6
1111	S	29.3	Very low	27.5	Very low	112 Å²	112	115.6 Å²	115.6	78%	0.783	74%	0.739	S	S	*	*			trans	59	135.2	149.2	57.4	0	0	0	0	120.3
1112	A	30.2	Very low	27.6	Very low	85 Å²	85	114.2 Å²	114.2	70%	0.702	73%	0.731	S	S	*	*			cis	-160.6	157.6	-3.7	0	0	0	0	0	112.6
1113	S	30.4	Very low	27.6	Very low	100 Å²	100	112.7 Å²	112.7	70%	0.699	72%	0.72	S	S	*	*			trans	57.4	132.9	153.6	55.4	0	0	0	0	120.1
1114	N	29.6	Very low	27.5	Very low	153 Å²	153	119.1 Å²	119.1	82%	0.818	73%	0.728	S	S	*	*			cis	-160.5	151.8	-1.6	-114.2	-1.1	0	0	0	111.1
1115	S	28	Very low	27.7	Very low	104 Å²	104	117.4 Å²	117.4	73%	0.727	73%	0.729	S	S	*	*			trans	44.4	139.7	147.6	-127	0	0	0	0	120.8
1116	S	27.9	Very low	27.6	Very low	90 Å²	90	117.5 Å²	117.5	63%	0.629	73%	0.729	S	S	*	*			cis	-155.5	116.5	-3.5	-1	0	0	0	0	105.6
1117	T	26	Very low	27.9	Very low	120 Å²	120	120.7 Å²	120.7	74%	0.736	74%	0.739	S	S	*	*				65.1	146.6	78.6	65.9	0	0	0	0	114.9
1118	V	26.5	Very low	28	Very low	116 Å²	116	116.1 Å²	116.1	70%	0.703	73%	0.73	S	S	*	*			trans	78.4	132.3	149.1	163.5	0	0	0	0	115.7
1119	E	25.9	Very low	28	Very low	111 Å²	111	117.7 Å²	117.7	52%	0.519	74%	0.736	S	S	.	*			cis	-153.8	137	-8	-112.8	-173.6	-141.4	0	0	110.2
1120	R	26.3	Very low	27.9	Very low	186 Å²	186	119.4 Å²	119.4	70%	0.702	74%	0.743	S	S	*	*				71.4	145.5	92.8	-92.4	-169.9	-143	135.9	10.6	116.2
1121	L	26.7	Very low	27.9	Very low	148 Å²	148	117.5 Å²	117.5	78%	0.775	74%	0.735	S	S	*	*			trans	66.6	150.1	153.5	-63.2	158.4	0	0	0	116
1122	S	27.2	Very low	27.9	Very low	98 Å²	98	119.2 Å²	119.2	69%	0.685	73%	0.73	S	S	*	*			cis	-157.1	158.1	-20	44.5	0	0	0	0	111.8
1123	S	24.8	Very low	28.1	Very low	94 Å²	94	122.8 Å²	122.8	66%	0.657	73%	0.73	S	S	*	*			trans	-44.7	176.6	166	-46	0	0	0	0	117
1124	F	26.7	Very low	28.5	Very low	207 Å²	207	125.4 Å²	125.4	91%	0.908	74%	0.736	S	S	*	*			trans	88.7	142.6	168.4	-50.8	-71.7	0	0	0	116.6
1125	G	28.7	Very low	28.5	Very low	80 Å²	80	125.5 Å²	125.5	83%	0.825	73%	0.725	S	S	*	*			trans	112.4	67.5	163	0	0	0	0	0	117.6
1126	S	27.2	Very low	28.8	Very low	118 Å²	118	125.3 Å²	125.3	83%	0.825	72%	0.721	S	S	*	*			trans	-83.7	167.5	146.7	-38.6	0	0	0	0	109.1
1127	P	34.4	Very low	29.1	Very low	131 Å²	131	128.6 Å²	128.6	85%	0.851	73%	0.732	S	S	*	*			cis	-129.1	-179.8	-22.8	38.6	-23.2	0	0	0	112.9
1128	G	27	Very low	29.5	Very low	63 Å²	63	128.6 Å²	128.6	65%	0.649	74%	0.736	S	S	*	*			trans	128.4	118.1	147.6	0	0	0	0	0	119.7
1129	T	27.4	Very low	30	Very low	129 Å²	129	126.8 Å²	126.8	79%	0.791	74%	0.742	S	S	*	*			trans	52.2	132.6	132.6	55.7	0	0	0	0	123.5
1130	T	26.9	Very low	30.4	Very low	139 Å²	139	128.5 Å²	128.5	85%	0.853	75%	0.754	S	S	*	*			trans	65.7	151.9	148.8	51	0	0	0	0	119.6
1131	S	29.1	Very low	30.7	Very low	84 Å²	84	126.7 Å²	126.7	59%	0.587	76%	0.757	S	S	*	*			cis	-169.5	147.6	-20.6	-169.2	0	0	0	0	109.2
1132	E	29.3	Very low	30.8	Very low	148 Å²	148	124.4 Å²	124.4	69%	0.692	75%	0.754	S	S	*	*			trans	62.3	159.5	157.6	-72.7	163	106.9	0	0	118.9
1133	K	34.1	Very low	30.8	Very low	159 Å²	159	123 Å²	123	69%	0.691	75%	0.754	S	S	*	*			cis	-163.8	178.9	-9	-124.1	166.7	-174.5	155.7	0	113
1134	D	37.7	Very low	31.1	Very low	155 Å²	155	128.5 Å²	128.5	83%	0.829	76%	0.762	S	S	*	*			trans	91.6	165.6	154.6	-58.1	-28.3	0	0	0	122.9
1135	R	31.4	Very low	31.3	Very low	156 Å²	156	123.2 Å²	123.2	59%	0.589	75%	0.751	S	S	*	*			trans	-147.1	-169.6	-142.7	-121.7	178.8	-170.3	159	5.6	110.9	V1757 E1758	R1135-V1757 PolarHBondContact NH2-O 2.91Å; R1135-E1758 IonicContact NH1-OE2 2.97Å; R1135-E1758 PolarHBondContact NH1-OE2 2.62Å; R1135-E1758 IonicContact NH2-OE2 2.64Å
1136	P	34.5	Very low	31.3	Very low	100 Å²	100	124 Å²	124	65%	0.649	74%	0.744	S	S	*	*			cis	-141.4	-173.7	-15.3	39.7	-18.9	0	0	0	117.2
1137	N	32.3	Very low	31.2	Very low	158 Å²	158	125.9 Å²	125.9	85%	0.845	74%	0.743	S	S	*	*			trans	58.2	123.6	146.8	-75.4	-1.8	0	0	0	125.2
1138	S	35.6	Very low	30.8	Very low	120 Å²	120	123.4 Å²	123.4	84%	0.839	73%	0.729	S	S	*	*				174.8	120.3	104.5	65.1	0	0	0	0	116.4
1139	G	37.4	Very low	30.7	Very low	79 Å²	79	122.8 Å²	122.8	81%	0.814	71%	0.714	S	S	*	*			trans	71.2	156.9	156.1	0	0	0	0	0	120.1
1140	N	33.8	Very low	30.7	Very low	146 Å²	146	120.5 Å²	120.5	78%	0.781	70%	0.703	S	S	*	*			cis	-164	153.9	-19.1	-144.8	16.6	0	0	0	111.5
1141	I	32.7	Very low	30.7	Very low	148 Å²	148	117.5 Å²	117.5	76%	0.759	69%	0.688	S	S	*	*			trans	64.5	139.3	160.3	-62.3	164.1	0	0	0	117.2
1142	S	28.6	Very low	30.5	Very low	101 Å²	101	115.7 Å²	115.7	71%	0.706	68%	0.675	S	S	*	*			cis	-163.1	-179.6	-24.1	65	0	0	0	0	109.1
1143	G	28.1	Very low	30.2	Very low	68 Å²	68	114.8 Å²	114.8	70%	0.701	67%	0.674	S	S	*	*			trans	102.7	40.2	163.4	0	0	0	0	0	118.8
1144	Y	30.9	Very low	29.8	Very low	209 Å²	209	109.7 Å²	109.7	82%	0.82	65%	0.654	S	S	*	*			trans	-37.2	131.4	176.1	-52.9	-84.4	0	0	0	115.2
1145	S	29.3	Very low	29.1	Very low	96 Å²	96	108.2 Å²	108.2	67%	0.671	66%	0.656	S	S	*	*			cis	78.9	144.1	36.8	90.7	0	0	0	0	113.9
1146	S	28.8	Very low	28.8	Very low	98 Å²	98	107.6 Å²	107.6	69%	0.685	66%	0.663	S	S	*	*			cis	156.7	134.6	-21.2	-101.9	0	0	0	0	106.7
1147	I	25.8	Very low	28.4	Very low	157 Å²	157	108.2 Å²	108.2	81%	0.805	67%	0.668	S	S	*	*	S	Bend	trans	-137.6	141.7	168.4	-52.9	176.5	0	0	0	106.9	K1534	I1147-K1534 PolarHBondContact O-NZ 2.89Å
1148	S	26.4	Very low	28.2	Very low	79 Å²	79	104.5 Å²	104.5	55%	0.552	67%	0.666	S	S	*	*			cis	-123.5	-159	-19.5	46.3	0	0	0	0	109.9	K1534	S1148-K1534 WeakPolarHBondContact O-CD 3.33Å; S1148-K1534 WeakPolarHBondContact O-CE 3.47Å; S1148-K1534 PolarHBondContact O-NZ 3.18Å
1149	S	25	Very low	27.7	Very low	49 Å²	49	103.5 Å²	103.5	34%	0.343	66%	0.659	S	S	.	*			trans	-134.4	169.1	-162.4	-26.3	0	0	0	0	114	D1531 K1532 R1533	S1149-D1531 WeakPolarHBondContact CB-OD1 3.43Å; S1149-D1531 PolarHBondContact OG-OD1 2.86Å; S1149-K1532 VanDerWaalsContact CB-CA 3.46Å; S1149-K1532 WeakPolarHBondContact OG-CA 3.46Å; S1149-R1533 PolarHBondContact OG-N 2.99Å
1150	C	26.6	Very low	27.2	Very low	81 Å²	81	106.7 Å²	106.7	55%	0.547	66%	0.658	S	S	.	*			cis	79.2	146.2	4.7	-48.2	0	0	0	0	118.2	K1532 R1533 K1534	C1150-K1532 CarbonylContact O-C 3.6Å; C1150-K1532 WeakPolarHBondContact O-CA 3.39Å; C1150-K1532 PolarHBondContact O-N 2.87Å; C1150-K1532 VanDerWaalsContact O-O 3.08Å; C1150-R1533 CarbonylContact C-O 3.35Å; C1150-R1533 WeakPolarHBondContact CA-O 3.36Å; C1150-R1533 WeakPolarHBondContact CB-O 3.44Å; C1150-R1533 PolarHBondContact O-N 3.06Å; C1150-K1534 HydrophobicContact CB-CB 4.41Å
1151	S	26.6	Very low	26.9	Very low	77 Å²	77	104.6 Å²	104.6	54%	0.538	65%	0.65	S	S	.	*			trans	-159.9	-179	175.3	-58.6	0	0	0	0	115.1	D1531 K1532 R1533	S1151-D1531 PolarHBondContact OG-O 2.63Å; S1151-K1532 WeakPolarHBondContact CA-O 3.41Å; S1151-K1532 PolarHBondContact OG-N 2.92Å; S1151-K1532 PolarHBondContact OG-O 3.15Å; S1151-R1533 PolarHBondContact N-O 3.37Å
1152	S	25.5	Very low	26.7	Very low	45 Å²	45	106 Å²	106	32%	0.315	65%	0.654	S	S	.	*			trans	-76.8	-179.9	-171	-54.7	0	0	0	0	118.7	N1753 D1754	S1152-N1753 VanDerWaalsContact CB-CG 3.4Å; S1152-N1753 WeakPolarHBondContact CB-ND2 3.32Å; S1152-N1753 VanDerWaalsContact CB-OD1 3.28Å; S1152-N1753 WeakPolarHBondContact CB-OD1 3.25Å; S1152-D1754 WeakPolarHBondContact CB-OD1 3.47Å; S1152-D1754 PolarHBondContact OG-OD1 3.32Å
1153	L	23.7	Very low	26.6	Very low	130 Å²	130	105.1 Å²	105.1	68%	0.681	65%	0.647	S	S	*	*			cis	99.9	178.7	3.1	-66.8	163.2	0	0	0	119.5	N1752 N1753	L1153-N1752 HydrophobicContact CB-CB 4.43Å; L1153-N1753 WeakPolarHBondContact CA-OD1 3.39Å; L1153-N1753 WeakPolarHBondContact CB-OD1 3.28Å; L1153-N1753 PolarHBondContact O-ND2 2.71Å
1154	I	25.2	Very low	26.8	Very low	52 Å²	52	109.7 Å²	109.7	27%	0.267	65%	0.65	S	S	.	*			trans	36.1	129.5	-172.6	-67.7	-163	0	0	0	122	L1156 V1751 N1752 N1753	I1154-L1156 HydrophobicContact CG2-CD1 3.97Å; I1154-L1156 HydrophobicContact CG2-CG 4.09Å; I1154-V1751 HydrophobicContact CD1-CG1 3.75Å; I1154-V1751 HydrophobicContact CG1-CG1 3.97Å; I1154-N1752 HydrophobicContact CD1-CB 3.83Å; I1154-N1752 WeakPolarHBondContact CD1-O 3.39Å; I1154-N1752 HydrophobicContact CG1-CB 3.58Å; I1154-N1753 HydrophobicContact CB-CB 3.59Å; I1154-N1753 HydrophobicContact CD1-CB 3.85Å; I1154-N1753 HydrophobicContact CG1-CB 3.67Å; I1154-N1753 WeakPolarHBondContact CG1-OD1 3.48Å; I1154-N1753 HydrophobicContact CG2-CB 4.4Å; I1154-N1753 PolarHBondContact N-ND2 3.28Å; I1154-N1753 PolarHBondContact N-OD1 3.49Å
1155	S	24	Very low	26.8	Very low	123 Å²	123	105.3 Å²	105.3	86%	0.86	65%	0.645	S	S	*	*				-122.1	139.9	128.2	-56.6	0	0	0	0	108.6
1156	L	24.9	Very low	26.9	Very low	143 Å²	143	105.2 Å²	105.2	75%	0.749	64%	0.644	S	S	*	*			trans	-89.1	166.3	173.3	-89.5	134.3	0	0	0	110.1	I1154	I1154-L1156 HydrophobicContact CG2-CD1 3.97Å; I1154-L1156 HydrophobicContact CG2-CG 4.09Å
1157	P	26.5	Very low	26.8	Very low	114 Å²	114	106.6 Å²	106.6	74%	0.74	64%	0.644	S	S	*	*			cis	-128.3	163.9	-8.4	38.5	-24	0	0	0	114.8
1158	G	26.7	Very low	27	Very low	79 Å²	79	102 Å²	102	81%	0.814	62%	0.622	S	S	*	*			trans	69.7	177.2	155.8	0	0	0	0	0	117.6
1159	S	25.3	Very low	27.2	Very low	100 Å²	100	100.4 Å²	100.4	70%	0.699	61%	0.611	S	S	*	*			cis	-169.3	149	-19.4	51.8	0	0	0	0	109.5
1160	N	26.6	Very low	27.3	Very low	146 Å²	146	103.3 Å²	103.3	78%	0.781	64%	0.638	S	S	*	*			trans	66.9	149.3	165.2	-60.3	-8.5	0	0	0	117.1
1161	T	27.5	Very low	28	Very low	102 Å²	102	103.5 Å²	103.5	63%	0.626	65%	0.646	S	S	*	*			cis	-171.7	164.9	-26.7	34.2	0	0	0	0	106.4
1162	Q	28.8	Very low	27.8	Very low	178 Å²	178	102.8 Å²	102.8	83%	0.832	65%	0.645	S	S	*	*			trans	67.1	161.1	161	-69.5	165.3	18.1	0	0	115.9
1163	S	27.1	Very low	27.8	Very low	81 Å²	81	103.4 Å²	103.4	57%	0.566	65%	0.649	S	S	*	*			cis	-168.6	170.5	-31.3	57.9	0	0	0	0	109.7
1164	H	31.9	Very low	27.9	Very low	165 Å²	165	100.8 Å²	100.8	76%	0.764	65%	0.646	S	S	*	*			trans	65.8	130.3	153.5	-66.6	-56.3	0	0	0	122.3
1165	T	31	Very low	27.6	Very low	116 Å²	116	101.2 Å²	101.2	71%	0.712	66%	0.657	S	S	*	*			trans	62.7	96.2	137.2	58	0	0	0	0	121.2
1166	S	31	Very low	27.4	Very low	94 Å²	94	101.3 Å²	101.3	66%	0.657	65%	0.653	S	S	*	*				49.5	127.5	114.7	66.8	0	0	0	0	122.2
1167	L	27.5	Very low	27.2	Very low	128 Å²	128	97.5 Å²	97.5	67%	0.67	64%	0.641	S	S	*	*				56.3	120.6	130	-60.6	171.8	0	0	0	118.3
1168	V	29.8	Very low	27.1	Very low	59 Å²	59	96.9 Å²	96.9	36%	0.358	64%	0.64	S	S	.	*	S	Bend	cis	-142.6	149.8	3.4	-175.2	0	0	0	0	108.2	G554	G554-V1168 WeakPolarHBondContact O-CG2 3.44Å
1169	S	29.6	Very low	26.9	Very low	46 Å²	46	100.4 Å²	100.4	32%	0.322	64%	0.637	S	S	.	*			trans	62.6	75.2	-176.2	-70	0	0	0	0	114.3	A1171	S1169-A1171 CarbonylContact C-O 3.49Å; S1169-A1171 VanDerWaalsContact O-O 3.13Å
1170	A	27.3	Very low	26.9	Very low	110 Å²	110	99.4 Å²	99.4	91%	0.909	63%	0.627	S	S	*	*	S	Bend	trans	-132.5	23.8	164.7	0	0	0	0	0	116.1
1171	A	41.4	Very low	26.7	Very low	85 Å²	85	98 Å²	98	70%	0.702	62%	0.62	S	S	*	*	S	Bend	cis	42.6	171	13.4	0	0	0	0	0	116.1	S1169	S1169-A1171 CarbonylContact C-O 3.49Å; S1169-A1171 VanDerWaalsContact O-O 3.13Å
1172	A	23	Very low	26.8	Very low	62 Å²	62	103.1 Å²	103.1	51%	0.512	63%	0.627	S	S	.	*			trans	-161.1	165.1	176.7	0	0	0	0	0	106.5	A1175	A1172-A1175 HydrophobicContact CB-CB 3.98Å
1173	S	24.6	Very low	26.8	Very low	59 Å²	59	99.4 Å²	99.4	41%	0.413	62%	0.621	S	S	.	*	S	Bend	cis	62.2	178.3	20.8	-127.6	0	0	0	0	110.9
1174	A	27.3	Very low	26.7	Very low	74 Å²	74	100.6 Å²	100.6	61%	0.612	63%	0.629	S	S	*	*	S	Bend	cis	61	37.5	7.5	0	0	0	0	0	114.4	A1177	A1174-A1177 HydrophobicContact CB-CB 4.34Å; A1174-A1177 WeakPolarHBondContact O-CB 3.16Å
1175	A	18.1	Very low	26.4	Very low	61 Å²	61	99.2 Å²	99.2	50%	0.504	63%	0.633	S	S	.	*	S	Bend	trans	-125.6	98.2	171.2	0	0	0	0	0	106.7	A1172	A1172-A1175 HydrophobicContact CB-CB 3.98Å
1176	V	19	Very low	26.3	Very low	126 Å²	126	99.3 Å²	99.3	76%	0.764	64%	0.638	S	S	*	*	S	Bend	cis	-119.1	88.4	-13	177.7	0	0	0	0	106.4
1177	A	21.8	Very low	26	Very low	62 Å²	62	101.6 Å²	101.6	51%	0.512	64%	0.642	S	S	.	*				76.7	-147.8	96.6	0	0	0	0	0	111.3	A1174 M1179	A1174-A1177 HydrophobicContact CB-CB 4.34Å; A1174-A1177 WeakPolarHBondContact O-CB 3.16Å; A1177-M1179 VanDerWaalsContact C-N 3.27Å; A1177-M1179 PolarHBondContact O-N 2.8Å
1178	S	24.2	Very low	26.2	Very low	101 Å²	101	98.8 Å²	98.8	71%	0.706	64%	0.644	S	S	*	*			trans	-58.5	83.4	165.5	170.9	0	0	0	0	111.9
1179	M	21.6	Very low	26.7	Very low	153 Å²	153	99.1 Å²	99.1	75%	0.754	65%	0.649	S	S	*	*				-113.2	112.8	121.6	-56.7	-144.5	95.9	0	0	104.7	A1177	A1177-M1179 VanDerWaalsContact C-N 3.27Å; A1177-M1179 PolarHBondContact O-N 2.8Å
1180	T	26.2	Very low	27.7	Very low	80 Å²	80	99.4 Å²	99.4	49%	0.491	65%	0.651	S	S	.	*				48.4	119.4	78.9	74.2	0	0	0	0	109.7
1181	D	23.2	Very low	29.4	Very low	117 Å²	117	98.8 Å²	98.8	63%	0.626	63%	0.628	S	S	*	*			cis	-137.2	152.6	44.3	-87.7	-68.9	0	0	0	112.6
1182	R	28.8	Very low	30.5	Very low	208 Å²	208	95.4 Å²	95.4	79%	0.785	60%	0.598	S	S	*	*				40.2	129.6	82.1	-45.4	168	96.5	-162	5.7	112.2
1183	S	28.6	Very low	32.7	Very low	101 Å²	101	94.1 Å²	94.1	71%	0.706	58%	0.584	S	S	*	*	S	Bend	trans	36	116.1	149.1	55.5	0	0	0	0	120.1
1184	S	25.7	Very low	35	Very low	105 Å²	105	91.3 Å²	91.3	73%	0.734	56%	0.564	S	S	*	*			trans	74	137.2	145.8	49.1	0	0	0	0	121.6
1185	T	25.3	Very low	37.2	Very low	136 Å²	136	88.9 Å²	88.9	83%	0.834	54%	0.54	S	S	*	.			trans	60.9	96.1	147.5	50.2	0	0	0	0	120.3
1186	S	27.9	Very low	39.9	Very low	118 Å²	118	86 Å²	86	83%	0.825	52%	0.516	S	S	*	.				-156.6	169.3	114.4	58.1	0	0	0	0	110.5
1187	L	26.1	Very low	42.6	Very low	142 Å²	142	80.6 Å²	80.6	74%	0.743	48%	0.484	S	S	*	.			trans	-96	127.8	-168.9	-78	64.8	0	0	0	111.6
1188	G	30.3	Very low	45.2	Very low	70 Å²	70	77.9 Å²	77.9	72%	0.722	46%	0.461	S	S	*	.			trans	-149.8	131.3	172.8	0	0	0	0	0	111.5	S1190	G1188-S1190 PolarHBondContact O-N 3.22Å; G1188-S1190 VanDerWaalsContact O-N 3.13Å
1189	S	40.2	Very low	47.5	Very low	66 Å²	66	75.9 Å²	75.9	46%	0.462	44%	0.442	S	S	.	.			trans	-42.1	110.3	-171.2	55.4	0	0	0	0	114.6	K1191	S1189-K1191 PolarHBondContact O-N 2.67Å
1190	S	51.1	Low	50	Low	51 Å²	51	69.8 Å²	69.8	36%	0.357	41%	0.412	S	S	.	.			trans	-66	115.8	168.2	-45.9	0	0	0	0	109.3	K1048 G1188 L1192	K1048-S1190 PolarHBondContact NZ-OG 2.89Å; G1188-S1190 PolarHBondContact O-N 3.22Å; G1188-S1190 VanDerWaalsContact O-N 3.13Å; S1190-L1192 PolarHBondContact O-N 2.94Å
1191	K	62.6	Low	52.5	Low	97 Å²	97	66.2 Å²	66.2	42%	0.422	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	122.6	164.5	-77	178.2	174.1	-178.3	0	108.1	D1006 S1091 F1092 S1189	D1006-K1191 IonicContact OD2-NZ 3.53Å; D1006-K1191 PolarHBondContact OD2-NZ 3.31Å; S1091-K1191 WeakPolarHBondContact OG-CD 3.34Å; F1092-K1191 CarbonylContact O-C 3.43Å; F1092-K1191 WeakPolarHBondContact O-CA 3.41Å; S1189-K1191 PolarHBondContact O-N 2.67Å
1192	L	65.5	Low	55.2	Low	15 Å²	15	66.1 Å²	66.1	8%	0.079	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	144.6	167.2	-68.7	178.6	0	0	0	110.2	V1046 I1062 S1091 F1092 S1190 V1224	V1046-L1192 HydrophobicContact CG1-CD1 3.49Å; V1046-L1192 VanDerWaalsContact CG1-CD1 3.49Å; I1062-L1192 HydrophobicContact CD1-CD1 3.73Å; I1062-L1192 HydrophobicContact CD1-CG 4.1Å; S1091-L1192 CarbonylContact C-O 3.59Å; S1091-L1192 WeakPolarHBondContact CA-O 3.26Å; S1091-L1192 WeakPolarHBondContact CB-O 3.39Å; F1092-L1192 HydrophobicContact CB-CB 4.24Å; F1092-L1192 PolarHBondContact N-O 3.29Å; F1092-L1192 VanDerWaalsContact N-O 3.15Å; F1092-L1192 PolarHBondContact O-N 2.8Å; S1190-L1192 PolarHBondContact O-N 2.94Å; L1192-V1224 HydrophobicContact CD1-CG1 4.22Å; L1192-V1224 HydrophobicContact CD1-CG2 3.63Å; L1192-V1224 HydrophobicContact CD2-CG2 3.75Å; L1192-V1224 HydrophobicContact CG-CG2 4.37Å
1193	V	68	Low	57.9	Low	34 Å²	34	57.4 Å²	57.4	21%	0.206	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-81.2	133.7	176.5	-171.7	0	0	0	0	108.4	L1005 I1010 I1195 F1196	L1005-V1193 HydrophobicContact CD2-CG1 4.37Å; I1010-V1193 HydrophobicContact CD1-CG2 4.09Å; I1010-V1193 HydrophobicContact CG2-CG2 4.43Å; V1193-I1195 HydrophobicContact CG1-CB 4.32Å; V1193-I1195 PolarHBondContact O-N 2.67Å; V1193-F1196 WeakPolarHBondContact O-CE2 3.43Å; V1193-F1196 WeakPolarHBondContact O-CZ 3.42Å
1194	P	73.8	Confident	60.6	Low	0 Å²	0	55.5 Å²	55.5	0%	0	34%	0.341	C	S	.	.	S	Bend	trans	-74.7	20.8	-178.4	31.9	-37.5	0	0	0	114.5	I1078 L1079 L1089 R1090 F1092	I1078-P1194 WeakPolarHBondContact CA-O 3.21Å; L1079-P1194 PolarHBondContact N-O 3.39Å; L1079-P1194 VanDerWaalsContact N-O 3.13Å; L1079-P1194 WeakPolarHBondContact O-CB 3.31Å; L1089-P1194 HydrophobicContact CD1-CB 3.83Å; L1089-P1194 HydrophobicContact CD1-CG 3.57Å; L1089-P1194 HydrophobicContact CG-CB 4.42Å; L1089-P1194 HydrophobicContact CG-CG 3.66Å; R1090-P1194 WeakPolarHBondContact O-CB 3.35Å; R1090-P1194 VanDerWaalsContact O-CG 3.31Å; R1090-P1194 WeakPolarHBondContact O-CG 3.36Å; F1092-P1194 HydrophobicContact CD2-CB 4.41Å; F1092-P1194 HydrophobicContact CE2-CB 3.88Å
1195	I	74.2	Confident	63.3	Low	23 Å²	23	53.5 Å²	53.5	12%	0.118	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	115.9	-176.1	-52.4	-173.5	0	0	0	107.6	F1022 A1076 I1078 L1089 V1193	F1022-I1195 HydrophobicContact CD2-CD1 3.36Å; F1022-I1195 HydrophobicContact CE2-CD1 3.6Å; F1022-I1195 HydrophobicContact CG-CD1 4.42Å; A1076-I1195 HydrophobicContact CB-CG2 4.43Å; I1078-I1195 HydrophobicContact CD1-CD1 4.14Å; I1078-I1195 HydrophobicContact CD1-CG1 4.17Å; I1078-I1195 HydrophobicContact CD1-CG2 4.29Å; I1078-I1195 HydrophobicContact CG1-CB 4.39Å; I1078-I1195 HydrophobicContact CG1-CG1 4.07Å; I1078-I1195 HydrophobicContact CG1-CG2 4.04Å; L1089-I1195 HydrophobicContact CD2-CD1 4.34Å; V1193-I1195 HydrophobicContact CG1-CB 4.32Å; V1193-I1195 PolarHBondContact O-N 2.67Å
1196	F	75.2	Confident	65.5	Low	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	111.3	-171.8	-59.6	-98.1	0	0	0	108.5	A1076 L1077 L1079 V1193 F1219 Q1222 V1224 I1226	A1076-F1196 CarbonylContact C-O 3.57Å; A1076-F1196 VanDerWaalsContact CA-O 3.25Å; A1076-F1196 WeakPolarHBondContact CA-O 3.46Å; L1077-F1196 HydrophobicContact CB-CB 4.48Å; L1077-F1196 PolarHBondContact N-O 3.22Å; L1077-F1196 PolarHBondContact O-N 3.47Å; L1079-F1196 HydrophobicContact CD1-CE2 3.94Å; L1079-F1196 HydrophobicContact CG-CE2 4.42Å; V1193-F1196 WeakPolarHBondContact O-CE2 3.43Å; V1193-F1196 WeakPolarHBondContact O-CZ 3.42Å; F1196-F1219 HydrophobicContact CB-CD1 3.67Å; F1196-F1219 HydrophobicContact CB-CD2 4.26Å; F1196-F1219 HydrophobicContact CB-CE1 3.33Å; F1196-F1219 HydrophobicContact CB-CE2 3.97Å; F1196-F1219 HydrophobicContact CB-CG 4.13Å; F1196-F1219 HydrophobicContact CB-CZ 3.5Å; F1196-F1219 HydrophobicContact CD1-CD1 4.48Å; F1196-F1219 HydrophobicContact CD1-CD2 4.06Å; F1196-F1219 HydrophobicContact CD1-CE2 4.35Å; F1196-F1219 HydrophobicContact CD1-CG 4.14Å; F1196-F1219 HydrophobicContact CG-CD2 4.42Å; F1196-F1219 HydrophobicContact CG-CE1 4.41Å; F1196-F1219 HydrophobicContact CG-CE2 4.29Å; F1196-F1219 HydrophobicContact CG-CZ 4.28Å; F1196-Q1222 VanDerWaalsContact CE1-OE1 3.31Å; F1196-V1224 HydrophobicContact CE1-CB 4.33Å; F1196-V1224 HydrophobicContact CE1-CG1 3.97Å; F1196-V1224 HydrophobicContact CE1-CG2 4.41Å; F1196-I1226 HydrophobicContact CD1-CD1 3.75Å; F1196-I1226 HydrophobicContact CD2-CD1 3.66Å; F1196-I1226 HydrophobicContact CE1-CD1 3.74Å; F1196-I1226 HydrophobicContact CE1-CG1 4.46Å; F1196-I1226 HydrophobicContact CE2-CD1 3.64Å; F1196-I1226 HydrophobicContact CG-CD1 3.73Å; F1196-I1226 HydrophobicContact CZ-CD1 3.68Å
1197	P	73.7	Confident	67.6	Low	13 Å²	13	50.3 Å²	50.3	8%	0.084	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	142.2	179.3	30.6	-35.4	0	0	0	110	L1018 N1075 I1199 F1219	L1018-P1197 HydrophobicContact CD1-CB 4.19Å; L1018-P1197 HydrophobicContact CD1-CG 3.81Å; N1075-P1197 WeakPolarHBondContact O-CA 3.23Å; P1197-I1199 HydrophobicContact CB-CD1 4.26Å; P1197-I1199 HydrophobicContact CB-CG1 4.25Å; P1197-I1199 PolarHBondContact O-N 3.47Å; P1197-F1219 WeakPolarHBondContact O-CD1 3.39Å; P1197-F1219 WeakPolarHBondContact O-CE1 3.31Å
1198	L	76.4	Confident	69.9	Low	6 Å²	6	49 Å²	49	3%	0.031	28%	0.281	C	S	.	.	S	Bend	trans	-76.9	33.2	178.8	-64.1	-179.9	0	0	0	113.3	L1072 L1073 N1075 L1077 F1219 I1243	L1072-L1198 HydrophobicContact CD1-CD1 3.82Å; L1072-L1198 HydrophobicContact CD1-CD2 4.34Å; L1073-L1198 WeakPolarHBondContact O-CD1 3.34Å; N1075-L1198 PolarHBondContact O-N 3.22Å; L1077-L1198 HydrophobicContact CB-CD2 4.46Å; L1198-F1219 HydrophobicContact CD2-CE1 4.09Å; L1198-F1219 HydrophobicContact CD2-CZ 4.29Å; L1198-I1243 HydrophobicContact CD2-CG1 4.42Å; L1198-I1243 HydrophobicContact CD2-CG2 4.21Å
1199	I	72.8	Confident	71.5	Confident	58 Å²	58	52.8 Å²	52.8	30%	0.297	28%	0.278	S	S	.	.	S	Bend	trans	-105.6	127.5	-177.6	-53.2	172	0	0	0	108.5	P1197 K1221 T1250	P1197-I1199 HydrophobicContact CB-CD1 4.26Å; P1197-I1199 HydrophobicContact CB-CG1 4.25Å; P1197-I1199 PolarHBondContact O-N 3.47Å; I1199-K1221 HydrophobicContact CG2-CD 4.32Å; I1199-K1221 VanDerWaalsContact CG2-NZ 3.3Å; I1199-T1250 HydrophobicContact CG2-CG2 4.33Å
1200	D	73.7	Confident	73.1	Confident	25 Å²	25	53 Å²	53	13%	0.134	29%	0.29	C	S	.	.	S	Bend	trans	55.4	51	-172.4	-54.2	-63.6	0	0	0	112.3	M1220 K1221 Q1251	D1200-M1220 HydrophobicContact CB-CB 4.07Å; D1200-M1220 VanDerWaalsContact O-CB 3.3Å; D1200-M1220 WeakPolarHBondContact O-CB 3.41Å; D1200-M1220 WeakPolarHBondContact O-CG 3.45Å; D1200-M1220 PolarHBondContact O-N 3.11Å; D1200-K1221 HydrophobicContact CB-CG 4.5Å; D1200-K1221 VanDerWaalsContact OD2-CD 3.3Å; D1200-K1221 WeakPolarHBondContact OD2-CD 3.18Å; D1200-K1221 WeakPolarHBondContact OD2-CE 3.45Å; D1200-K1221 IonicContact OD2-NZ 3.17Å; D1200-K1221 PolarHBondContact OD2-NZ 3.05Å; D1200-Q1251 PolarHBondContact OD1-NE2 2.84Å
1201	V	79.2	Confident	74.3	Confident	5 Å²	5	53 Å²	53	3%	0.03	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	137	-179.6	178.3	0	0	0	0	111.1	I1217 V1218 F1219 I1243 S1247	V1201-I1217 HydrophobicContact CG1-CG2 3.48Å; V1201-I1217 VanDerWaalsContact CG1-CG2 3.48Å; V1201-V1218 VanDerWaalsContact CA-O 3.3Å; V1201-V1218 WeakPolarHBondContact CA-O 3.31Å; V1201-F1219 HydrophobicContact CG1-CE1 4.3Å; V1201-F1219 HydrophobicContact CG1-CZ 4.46Å; V1201-F1219 HydrophobicContact CG2-CD1 3.26Å; V1201-F1219 HydrophobicContact CG2-CE1 3.43Å; V1201-F1219 VanDerWaalsContact CG2-CE1 3.43Å; V1201-F1219 HydrophobicContact CG2-CG 4.07Å; V1201-F1219 HydrophobicContact CG2-CZ 4.35Å; V1201-I1243 HydrophobicContact CG1-CG2 3.82Å; V1201-S1247 WeakPolarHBondContact O-CB 3.3Å
1202	F	81.4	Confident	75.1	Confident	115 Å²	115	51.3 Å²	51.3	50%	0.504	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.1	171.9	-68.6	-99.7	0	0	0	109.3	V1218 M1220	F1202-V1218 HydrophobicContact CB-CB 4.45Å; F1202-V1218 PolarHBondContact N-O 3.3Å; F1202-V1218 PolarHBondContact O-N 3.29Å; F1202-M1220 HydrophobicContact CD2-CE 3.42Å; F1202-M1220 VanDerWaalsContact CD2-CE 3.42Å; F1202-M1220 HydrophobicContact CD2-CG 3.84Å; F1202-M1220 HydrophobicContact CE2-CE 3.65Å; F1202-M1220 HydrophobicContact CE2-CG 3.84Å; F1202-M1220 HydrophobicContact CG-CE 4.16Å
1203	T	85.6	Confident	75.9	Confident	25 Å²	25	51.3 Å²	51.3	15%	0.153	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	152.8	169.9	56.9	0	0	0	0	111.7	N1216 I1217 S1240 I1243 Q1244	T1203-N1216 VanDerWaalsContact CA-O 3.23Å; T1203-N1216 WeakPolarHBondContact CA-O 3.37Å; T1203-I1217 HydrophobicContact CG2-CG1 4.22Å; T1203-I1217 HydrophobicContact CG2-CG2 4.23Å; T1203-S1240 PolarHBondContact OG1-OG 2.88Å; T1203-I1243 HydrophobicContact CG2-CB 3.75Å; T1203-I1243 HydrophobicContact CG2-CD1 3.93Å; T1203-I1243 HydrophobicContact CG2-CG1 4.46Å; T1203-I1243 HydrophobicContact CG2-CG2 3.45Å; T1203-I1243 VanDerWaalsContact CG2-CG2 3.45Å; T1203-Q1244 WeakPolarHBondContact OG1-CG 3.42Å; T1203-Q1244 PolarHBondContact OG1-NE2 2.83Å
1204	S	84.4	Confident	76.7	Confident	62 Å²	62	50.9 Å²	50.9	43%	0.434	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	132.7	158.9	62.9	0	0	0	0	110.2	G1206 N1216	S1204-G1206 PolarHBondContact O-N 3.27Å; S1204-N1216 PolarHBondContact N-O 3.44Å; S1204-N1216 PolarHBondContact O-N 3.08Å; S1204-N1216 PolarHBondContact O-ND2 2.69Å; S1204-N1216 WeakPolarHBondContact OG-CB 3.38Å; S1204-N1216 PolarHBondContact OG-ND2 2.85Å
1205	C	81.8	Confident	77.3	Confident	63 Å²	63	50.9 Å²	50.9	43%	0.426	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	111.7	162.1	-68.1	0	0	0	0	107.3	R1236	C1205-R1236 PolarHBondContact SG-NE 3.46Å
1206	G	71.6	Confident	77.9	Confident	13 Å²	13	51 Å²	51	13%	0.134	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	169.3	176.2	0	0	0	0	0	111.7	S1204 L1214	S1204-G1206 PolarHBondContact O-N 3.27Å; G1206-L1214 WeakPolarHBondContact CA-O 3.46Å; G1206-L1214 PolarHBondContact N-O 3.12Å
1207	E	73	Confident	78.4	Confident	173 Å²	173	51 Å²	51	81%	0.808	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.2	150.5	172.3	-62.4	-179.4	162.4	0	0	111.1	F1209 L1214	E1207-F1209 PolarHBondContact O-N 2.95Å; E1207-L1214 VanDerWaalsContact O-CB 3.23Å; E1207-L1214 WeakPolarHBondContact O-CB 3.31Å
1208	K	74.2	Confident	78.9	Confident	115 Å²	115	51.8 Å²	51.8	50%	0.5	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	118.6	-179.5	-168.8	174.7	172.6	151	0	109.7	G1210 G1211 D1212 H1213	K1208-G1210 VanDerWaalsContact CE-O 3.3Å; K1208-G1210 WeakPolarHBondContact CE-O 3.17Å; K1208-G1210 PolarHBondContact O-N 3.18Å; K1208-G1211 WeakPolarHBondContact CE-O 3.48Å; K1208-G1211 PolarHBondContact NZ-O 3.34Å; K1208-D1212 CarbonylContact C-O 3.56Å; K1208-D1212 VanDerWaalsContact CG-O 3.26Å; K1208-D1212 WeakPolarHBondContact CG-O 2.93Å; K1208-H1213 WeakPolarHBondContact CE-NE2 3.36Å; K1208-H1213 PolarHBondContact NZ-CE1 2.93Å; K1208-H1213 PolarHBondContact NZ-NE2 3.12Å
1209	F	63.6	Low	79.2	Confident	150 Å²	150	51.7 Å²	51.7	66%	0.658	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	84.5	-174.5	-148.9	-94.4	0	0	0	109.8	E1207 G1211 D1212 L1229	E1207-F1209 PolarHBondContact O-N 2.95Å; F1209-G1211 PolarHBondContact O-N 3.35Å; F1209-D1212 PolarHBondContact N-O 2.89Å; F1209-D1212 PolarHBondContact O-N 3Å; F1209-L1229 HydrophobicContact CB-CD2 4.01Å
1210	G	74.2	Confident	79.3	Confident	69 Å²	69	53.6 Å²	53.6	71%	0.711	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	-117.3	-172.6	0	0	0	0	0	111.7	K1208	K1208-G1210 VanDerWaalsContact CE-O 3.3Å; K1208-G1210 WeakPolarHBondContact CE-O 3.17Å; K1208-G1210 PolarHBondContact O-N 3.18Å
1211	G	75.4	Confident	79.1	Confident	51 Å²	51	58.8 Å²	58.8	53%	0.526	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-25.2	176.8	0	0	0	0	0	114	K1208 F1209	K1208-G1211 WeakPolarHBondContact CE-O 3.48Å; K1208-G1211 PolarHBondContact NZ-O 3.34Å; F1209-G1211 PolarHBondContact O-N 3.35Å
1212	D	79.3	Confident	78.6	Confident	62 Å²	62	60.7 Å²	60.7	33%	0.332	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	150.8	-163.4	-60.3	-50.7	0	0	0	113.5	K1208 F1209 L1229 F1230 S1231	K1208-D1212 CarbonylContact C-O 3.56Å; K1208-D1212 VanDerWaalsContact CG-O 3.26Å; K1208-D1212 WeakPolarHBondContact CG-O 2.93Å; F1209-D1212 PolarHBondContact N-O 2.89Å; F1209-D1212 PolarHBondContact O-N 3Å; D1212-L1229 HydrophobicContact CB-CB 4.18Å; D1212-L1229 HydrophobicContact CB-CD2 4.1Å; D1212-F1230 CarbonylContact C-O 3.57Å; D1212-F1230 WeakPolarHBondContact CA-O 3.47Å; D1212-S1231 WeakPolarHBondContact OD1-CA 3.44Å
1213	H	83	Confident	78.3	Confident	16 Å²	16	58.3 Å²	58.3	7%	0.074	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	116.9	-174.4	-61.1	-106.9	0	0	0	110	K1208 F1230 E1233 R1236	K1208-H1213 WeakPolarHBondContact CE-NE2 3.36Å; K1208-H1213 PolarHBondContact NZ-CE1 2.93Å; K1208-H1213 PolarHBondContact NZ-NE2 3.12Å; H1213-F1230 PolarHBondContact N-O 2.94Å; H1213-F1230 PolarHBondContact O-N 3.49Å; H1213-E1233 IonicContact CE1-OE2 2.87Å; H1213-E1233 PolarHBondContact CE1-OE2 3.28Å; H1213-E1233 IonicContact ND1-OE2 2.85Å; H1213-E1233 PolarHBondContact ND1-OE2 3.37Å; H1213-R1236 HydrophobicContact CB-CB 4.1Å; H1213-R1236 HydrophobicContact CB-CG 4.37Å
1214	L	84.6	Confident	77.8	Confident	25 Å²	25	57.1 Å²	57.1	13%	0.131	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	134.6	-173.6	-171.4	70.7	0	0	0	112.4	G1206 E1207 R1227 L1228 L1229 R1236	G1206-L1214 WeakPolarHBondContact CA-O 3.46Å; G1206-L1214 PolarHBondContact N-O 3.12Å; E1207-L1214 VanDerWaalsContact O-CB 3.23Å; E1207-L1214 WeakPolarHBondContact O-CB 3.31Å; L1214-R1227 HydrophobicContact CD1-CB 3.99Å; L1214-L1228 CarbonylContact C-O 3.58Å; L1214-L1228 WeakPolarHBondContact CA-O 3.4Å; L1214-L1229 HydrophobicContact CB-CD2 4.28Å; L1214-L1229 HydrophobicContact CD1-CD2 3.6Å; L1214-L1229 HydrophobicContact CD1-CG 4.31Å; L1214-R1236 WeakPolarHBondContact O-CD 3.33Å
1215	L	86.5	Confident	77.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120.8	167	-174.9	60.6	0	0	0	110.1	I1217 R1227 L1228 F1230 R1236 W1239 I1243	L1215-I1217 HydrophobicContact CD2-CD1 4.22Å; L1215-I1217 HydrophobicContact CD2-CG1 4.31Å; L1215-I1217 HydrophobicContact CG-CD1 4.45Å; L1215-I1217 HydrophobicContact CG-CG1 4.06Å; L1215-R1227 CarbonylContact O-C 3.58Å; L1215-R1227 WeakPolarHBondContact O-CA 3.48Å; L1215-L1228 PolarHBondContact N-O 2.98Å; L1215-L1228 PolarHBondContact O-N 3.13Å; L1215-F1230 HydrophobicContact CB-CD2 4.37Å; L1215-F1230 HydrophobicContact CB-CE2 3.8Å; L1215-F1230 HydrophobicContact CD2-CE2 4.1Å; L1215-F1230 HydrophobicContact CD2-CZ 4.39Å; L1215-R1236 HydrophobicContact CB-CG 3.86Å; L1215-W1239 HydrophobicContact CD2-CB 3.66Å; L1215-I1243 HydrophobicContact CD2-CD1 4.38Å
1216	N	86.2	Confident	77.6	Confident	24 Å²	24	52.2 Å²	52.2	13%	0.128	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	138.7	170	-57.9	-66	0	0	0	109.7	T1203 S1204 L1225 I1226 R1227	T1203-N1216 VanDerWaalsContact CA-O 3.23Å; T1203-N1216 WeakPolarHBondContact CA-O 3.37Å; S1204-N1216 PolarHBondContact N-O 3.44Å; S1204-N1216 PolarHBondContact O-N 3.08Å; S1204-N1216 PolarHBondContact O-ND2 2.69Å; S1204-N1216 WeakPolarHBondContact OG-CB 3.38Å; S1204-N1216 PolarHBondContact OG-ND2 2.85Å; N1216-L1225 HydrophobicContact CB-CD1 3.82Å; N1216-I1226 CarbonylContact C-O 3.41Å; N1216-R1227 WeakPolarHBondContact OD1-CG 3.38Å
1217	I	86.7	Confident	78	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	109.4	179.7	-46.1	174.8	0	0	0	108.4	L1077 V1201 T1203 L1215 F1219 I1226 L1228 I1243	L1077-I1217 HydrophobicContact CD2-CD1 3.81Å; V1201-I1217 HydrophobicContact CG1-CG2 3.48Å; V1201-I1217 VanDerWaalsContact CG1-CG2 3.48Å; T1203-I1217 HydrophobicContact CG2-CG1 4.22Å; T1203-I1217 HydrophobicContact CG2-CG2 4.23Å; L1215-I1217 HydrophobicContact CD2-CD1 4.22Å; L1215-I1217 HydrophobicContact CD2-CG1 4.31Å; L1215-I1217 HydrophobicContact CG-CD1 4.45Å; L1215-I1217 HydrophobicContact CG-CG1 4.06Å; I1217-F1219 HydrophobicContact CB-CE2 4Å; I1217-F1219 HydrophobicContact CG2-CD2 4.19Å; I1217-F1219 HydrophobicContact CG2-CE1 4.49Å; I1217-F1219 HydrophobicContact CG2-CE2 3.36Å; I1217-F1219 HydrophobicContact CG2-CZ 3.55Å; I1217-I1226 HydrophobicContact CB-CB 4.47Å; I1217-I1226 PolarHBondContact N-O 3.09Å; I1217-I1226 PolarHBondContact O-N 3.19Å; I1217-L1228 HydrophobicContact CD1-CD1 3.72Å; I1217-L1228 HydrophobicContact CD1-CG 4.28Å; I1217-I1243 HydrophobicContact CD1-CD1 3.76Å; I1217-I1243 HydrophobicContact CG1-CD1 4.27Å
1218	V	84	Confident	78.4	Confident	31 Å²	31	46.3 Å²	46.3	19%	0.188	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	115.9	-176.7	179.9	0	0	0	0	110.1	L1049 V1201 F1202 M1220 V1224 L1225	L1049-V1218 HydrophobicContact CD1-CG1 4.15Å; V1201-V1218 VanDerWaalsContact CA-O 3.3Å; V1201-V1218 WeakPolarHBondContact CA-O 3.31Å; F1202-V1218 HydrophobicContact CB-CB 4.45Å; F1202-V1218 PolarHBondContact N-O 3.3Å; F1202-V1218 PolarHBondContact O-N 3.29Å; V1218-M1220 HydrophobicContact CG1-CE 4.11Å; V1218-M1220 HydrophobicContact CG1-SD 4.16Å; V1218-V1224 CarbonylContact C-O 3.59Å; V1218-V1224 WeakPolarHBondContact CA-O 3.4Å; V1218-L1225 HydrophobicContact CG2-CB 4.3Å; V1218-L1225 HydrophobicContact CG2-CD1 3.74Å
1219	F	81.9	Confident	78.6	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	100.7	177.8	-65.7	-92.6	0	0	0	110	L1077 F1196 P1197 L1198 V1201 I1217 K1221 Q1222 T1223 V1224 I1226	L1077-F1219 HydrophobicContact CB-CZ 4.13Å; L1077-F1219 HydrophobicContact CD2-CE2 4.29Å; L1077-F1219 HydrophobicContact CD2-CZ 4.02Å; F1196-F1219 HydrophobicContact CB-CD1 3.67Å; F1196-F1219 HydrophobicContact CB-CD2 4.26Å; F1196-F1219 HydrophobicContact CB-CE1 3.33Å; F1196-F1219 HydrophobicContact CB-CE2 3.97Å; F1196-F1219 HydrophobicContact CB-CG 4.13Å; F1196-F1219 HydrophobicContact CB-CZ 3.5Å; F1196-F1219 HydrophobicContact CD1-CD1 4.48Å; F1196-F1219 HydrophobicContact CD1-CD2 4.06Å; F1196-F1219 HydrophobicContact CD1-CE2 4.35Å; F1196-F1219 HydrophobicContact CD1-CG 4.14Å; F1196-F1219 HydrophobicContact CG-CD2 4.42Å; F1196-F1219 HydrophobicContact CG-CE1 4.41Å; F1196-F1219 HydrophobicContact CG-CE2 4.29Å; F1196-F1219 HydrophobicContact CG-CZ 4.28Å; P1197-F1219 WeakPolarHBondContact O-CD1 3.39Å; P1197-F1219 WeakPolarHBondContact O-CE1 3.31Å; L1198-F1219 HydrophobicContact CD2-CE1 4.09Å; L1198-F1219 HydrophobicContact CD2-CZ 4.29Å; V1201-F1219 HydrophobicContact CG1-CE1 4.3Å; V1201-F1219 HydrophobicContact CG1-CZ 4.46Å; V1201-F1219 HydrophobicContact CG2-CD1 3.26Å; V1201-F1219 HydrophobicContact CG2-CE1 3.43Å; V1201-F1219 VanDerWaalsContact CG2-CE1 3.43Å; V1201-F1219 HydrophobicContact CG2-CG 4.07Å; V1201-F1219 HydrophobicContact CG2-CZ 4.35Å; I1217-F1219 HydrophobicContact CB-CE2 4Å; I1217-F1219 HydrophobicContact CG2-CD2 4.19Å; I1217-F1219 HydrophobicContact CG2-CE1 4.49Å; I1217-F1219 HydrophobicContact CG2-CE2 3.36Å; I1217-F1219 HydrophobicContact CG2-CZ 3.55Å; F1219-K1221 PolarHBondContact O-N 3.48Å; F1219-Q1222 HydrophobicContact CB-CB 4.44Å; F1219-Q1222 PolarHBondContact O-N 2.89Å; F1219-T1223 PolarHBondContact O-N 3.05Å; F1219-V1224 PolarHBondContact N-O 3.12Å; F1219-V1224 PolarHBondContact O-N 3.25Å; F1219-I1226 HydrophobicContact CD2-CD1 3.96Å; F1219-I1226 HydrophobicContact CD2-CG1 4.07Å; F1219-I1226 HydrophobicContact CE2-CB 4.41Å; F1219-I1226 HydrophobicContact CE2-CD1 3.51Å; F1219-I1226 HydrophobicContact CE2-CG1 3.89Å; F1219-I1226 HydrophobicContact CZ-CD1 4.38Å
1220	M	75.2	Confident	79.2	Confident	97 Å²	97	35.2 Å²	35.2	48%	0.478	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-63.9	-46	-173.3	-66.8	-66	-176.9	0	0	112.3	D1200 F1202 V1218 Q1222 T1223	D1200-M1220 HydrophobicContact CB-CB 4.07Å; D1200-M1220 VanDerWaalsContact O-CB 3.3Å; D1200-M1220 WeakPolarHBondContact O-CB 3.41Å; D1200-M1220 WeakPolarHBondContact O-CG 3.45Å; D1200-M1220 PolarHBondContact O-N 3.11Å; F1202-M1220 HydrophobicContact CD2-CE 3.42Å; F1202-M1220 VanDerWaalsContact CD2-CE 3.42Å; F1202-M1220 HydrophobicContact CD2-CG 3.84Å; F1202-M1220 HydrophobicContact CE2-CE 3.65Å; F1202-M1220 HydrophobicContact CE2-CG 3.84Å; F1202-M1220 HydrophobicContact CG-CE 4.16Å; V1218-M1220 HydrophobicContact CG1-CE 4.11Å; V1218-M1220 HydrophobicContact CG1-SD 4.16Å; M1220-Q1222 PolarHBondContact O-N 2.88Å; M1220-Q1222 VanDerWaalsContact O-N 3.15Å; M1220-T1223 PolarHBondContact O-N 3.45Å; M1220-T1223 VanDerWaalsContact O-N 3.09Å
1221	K	70	Confident	79.3	Confident	135 Å²	135	36.1 Å²	36.1	59%	0.587	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-59.4	-25.9	179.8	-90.3	173.2	166.5	138.2	0	114.5	I1199 D1200 F1219	I1199-K1221 HydrophobicContact CG2-CD 4.32Å; I1199-K1221 VanDerWaalsContact CG2-NZ 3.3Å; D1200-K1221 HydrophobicContact CB-CG 4.5Å; D1200-K1221 VanDerWaalsContact OD2-CD 3.3Å; D1200-K1221 WeakPolarHBondContact OD2-CD 3.18Å; D1200-K1221 WeakPolarHBondContact OD2-CE 3.45Å; D1200-K1221 IonicContact OD2-NZ 3.17Å; D1200-K1221 PolarHBondContact OD2-NZ 3.05Å; F1219-K1221 PolarHBondContact O-N 3.48Å
1222	Q	69.1	Low	79.4	Confident	44 Å²	44	38.7 Å²	38.7	21%	0.206	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-104.9	-8.5	178.4	-62.5	-172.1	-0.3	0	0	112.9	F1196 F1219 M1220 V1224	F1196-Q1222 VanDerWaalsContact CE1-OE1 3.31Å; F1219-Q1222 HydrophobicContact CB-CB 4.44Å; F1219-Q1222 PolarHBondContact O-N 2.89Å; M1220-Q1222 PolarHBondContact O-N 2.88Å; M1220-Q1222 VanDerWaalsContact O-N 3.15Å; Q1222-V1224 HydrophobicContact CB-CG2 4.15Å
1223	T	74.7	Confident	79.6	Confident	66 Å²	66	39.1 Å²	39.1	41%	0.405	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	52.2	-172.9	56.9	0	0	0	0	112.9	L1049 F1219 M1220	L1049-T1223 PolarHBondContact N-O 3.3Å; L1049-T1223 WeakPolarHBondContact O-CB 3.45Å; F1219-T1223 PolarHBondContact O-N 3.05Å; M1220-T1223 PolarHBondContact O-N 3.45Å; M1220-T1223 VanDerWaalsContact O-N 3.09Å
1224	V	74.4	Confident	79.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.8	-176.5	176.6	0	0	0	0	111.2	V1046 D1047 L1192 F1196 V1218 F1219 Q1222 I1226	V1046-V1224 HydrophobicContact CG1-CG1 3.39Å; D1047-V1224 WeakPolarHBondContact O-CA 3.38Å; L1192-V1224 HydrophobicContact CD1-CG1 4.22Å; L1192-V1224 HydrophobicContact CD1-CG2 3.63Å; L1192-V1224 HydrophobicContact CD2-CG2 3.75Å; L1192-V1224 HydrophobicContact CG-CG2 4.37Å; F1196-V1224 HydrophobicContact CE1-CB 4.33Å; F1196-V1224 HydrophobicContact CE1-CG1 3.97Å; F1196-V1224 HydrophobicContact CE1-CG2 4.41Å; V1218-V1224 CarbonylContact C-O 3.59Å; V1218-V1224 WeakPolarHBondContact CA-O 3.4Å; F1219-V1224 PolarHBondContact N-O 3.12Å; F1219-V1224 PolarHBondContact O-N 3.25Å; Q1222-V1224 HydrophobicContact CB-CG2 4.15Å; V1224-I1226 HydrophobicContact CG1-CG1 3.87Å
1225	L	81.4	Confident	79.1	Confident	21 Å²	21	44.5 Å²	44.5	11%	0.11	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.5	163.5	163.4	61.6	0	0	0	109.2	V1046 D1047 L1049 N1216 V1218 R1227	V1046-L1225 CarbonylContact C-O 3.58Å; V1046-L1225 WeakPolarHBondContact CA-O 3.49Å; D1047-L1225 HydrophobicContact CB-CB 4.36Å; D1047-L1225 PolarHBondContact N-O 2.89Å; D1047-L1225 PolarHBondContact O-N 2.85Å; L1049-L1225 HydrophobicContact CD2-CB 4.47Å; N1216-L1225 HydrophobicContact CB-CD1 3.82Å; V1218-L1225 HydrophobicContact CG2-CB 4.3Å; V1218-L1225 HydrophobicContact CG2-CD1 3.74Å; L1225-R1227 HydrophobicContact CD1-CG 4.31Å; L1225-R1227 HydrophobicContact CG-CG 4.34Å
1226	I	79.9	Confident	78.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	137.4	169.8	-52.7	-172.4	0	0	0	108.1	V1044 T1045 L1077 L1079 F1196 N1216 I1217 F1219 V1224 L1228	V1044-I1226 HydrophobicContact CG1-CG2 3.51Å; T1045-I1226 WeakPolarHBondContact O-CA 3.13Å; L1077-I1226 HydrophobicContact CD2-CD1 4.15Å; L1079-I1226 HydrophobicContact CD1-CD1 4.13Å; L1079-I1226 HydrophobicContact CD1-CG2 4.35Å; F1196-I1226 HydrophobicContact CD1-CD1 3.75Å; F1196-I1226 HydrophobicContact CD2-CD1 3.66Å; F1196-I1226 HydrophobicContact CE1-CD1 3.74Å; F1196-I1226 HydrophobicContact CE1-CG1 4.46Å; F1196-I1226 HydrophobicContact CE2-CD1 3.64Å; F1196-I1226 HydrophobicContact CG-CD1 3.73Å; F1196-I1226 HydrophobicContact CZ-CD1 3.68Å; N1216-I1226 CarbonylContact C-O 3.41Å; I1217-I1226 HydrophobicContact CB-CB 4.47Å; I1217-I1226 PolarHBondContact N-O 3.09Å; I1217-I1226 PolarHBondContact O-N 3.19Å; F1219-I1226 HydrophobicContact CD2-CD1 3.96Å; F1219-I1226 HydrophobicContact CD2-CG1 4.07Å; F1219-I1226 HydrophobicContact CE2-CB 4.41Å; F1219-I1226 HydrophobicContact CE2-CD1 3.51Å; F1219-I1226 HydrophobicContact CE2-CG1 3.89Å; F1219-I1226 HydrophobicContact CZ-CD1 4.38Å; V1224-I1226 HydrophobicContact CG1-CG1 3.87Å; I1226-L1228 HydrophobicContact CG2-CD2 4.18Å
1227	R	80.4	Confident	78.8	Confident	62 Å²	62	49 Å²	49	23%	0.234	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	138.9	169.7	-50.1	-172.7	-175.5	81.8	1.8	110.2	V1044 T1045 D1047 L1214 L1215 N1216 L1225	V1044-R1227 WeakPolarHBondContact CA-O 3.41Å; T1045-R1227 PolarHBondContact O-N 3.03Å; T1045-R1227 WeakPolarHBondContact OG1-CB 3.5Å; T1045-R1227 WeakPolarHBondContact OG1-CD 3.28Å; T1045-R1227 VanDerWaalsContact OG1-CG 3.26Å; T1045-R1227 WeakPolarHBondContact OG1-CG 3.29Å; T1045-R1227 PolarHBondContact OG1-NH1 3.35Å; D1047-R1227 IonicContact OD1-NH1 3.66Å; D1047-R1227 IonicContact OD2-CZ 3.68Å; D1047-R1227 IonicContact OD2-NH1 3.19Å; D1047-R1227 PolarHBondContact OD2-NH1 3.2Å; D1047-R1227 IonicContact OD2-NH2 2.59Å; D1047-R1227 PolarHBondContact OD2-NH2 2.86Å; L1214-R1227 HydrophobicContact CD1-CB 3.99Å; L1215-R1227 CarbonylContact O-C 3.58Å; L1215-R1227 WeakPolarHBondContact O-CA 3.48Å; N1216-R1227 WeakPolarHBondContact OD1-CG 3.38Å; L1225-R1227 HydrophobicContact CD1-CG 4.31Å; L1225-R1227 HydrophobicContact CG-CG 4.34Å
1228	L	81.3	Confident	78.6	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	141.2	176.3	-57.6	179.1	0	0	0	110	A1042 V1044 A1070 L1079 L1214 L1215 I1217 I1226 F1230 W1239	A1042-L1228 HydrophobicContact CB-CD2 4.23Å; V1044-L1228 HydrophobicContact CB-CD2 4.44Å; V1044-L1228 HydrophobicContact CG1-CD2 3.97Å; V1044-L1228 HydrophobicContact CG2-CD2 3.72Å; A1070-L1228 HydrophobicContact CB-CD2 4.32Å; L1079-L1228 HydrophobicContact CD2-CD2 4.47Å; L1214-L1228 CarbonylContact C-O 3.58Å; L1214-L1228 WeakPolarHBondContact CA-O 3.4Å; L1215-L1228 PolarHBondContact N-O 2.98Å; L1215-L1228 PolarHBondContact O-N 3.13Å; I1217-L1228 HydrophobicContact CD1-CD1 3.72Å; I1217-L1228 HydrophobicContact CD1-CG 4.28Å; I1226-L1228 HydrophobicContact CG2-CD2 4.18Å; L1228-F1230 HydrophobicContact CB-CE2 3.77Å; L1228-F1230 HydrophobicContact CB-CZ 4.37Å; L1228-F1230 HydrophobicContact CD1-CE2 4.45Å; L1228-F1230 HydrophobicContact CD1-CZ 4.35Å; L1228-W1239 HydrophobicContact CD1-CE3 3.8Å; L1228-W1239 HydrophobicContact CD1-CH2 4.5Å; L1228-W1239 HydrophobicContact CD1-CZ3 3.49Å; L1228-W1239 VanDerWaalsContact CD1-CZ3 3.49Å
1229	L	78.2	Confident	78.6	Confident	28 Å²	28	51.3 Å²	51.3	15%	0.147	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	142.3	172.4	-69.1	174.6	0	0	0	110.9	E1043 F1209 D1212 L1214	E1043-L1229 HydrophobicContact CB-CD1 4.13Å; F1209-L1229 HydrophobicContact CB-CD2 4.01Å; D1212-L1229 HydrophobicContact CB-CB 4.18Å; D1212-L1229 HydrophobicContact CB-CD2 4.1Å; L1214-L1229 HydrophobicContact CB-CD2 4.28Å; L1214-L1229 HydrophobicContact CD1-CD2 3.6Å; L1214-L1229 HydrophobicContact CD1-CG 4.31Å
1230	F	77.1	Confident	78.7	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135.9	177.7	-66	-98.2	0	0	0	111	V1039 D1212 H1213 L1215 L1228 K1232 E1235 R1236 W1239	V1039-F1230 HydrophobicContact CG2-CD1 4.01Å; V1039-F1230 HydrophobicContact CG2-CE1 3.5Å; V1039-F1230 HydrophobicContact CG2-CZ 4.21Å; D1212-F1230 CarbonylContact C-O 3.57Å; D1212-F1230 WeakPolarHBondContact CA-O 3.47Å; H1213-F1230 PolarHBondContact N-O 2.94Å; H1213-F1230 PolarHBondContact O-N 3.49Å; L1215-F1230 HydrophobicContact CB-CD2 4.37Å; L1215-F1230 HydrophobicContact CB-CE2 3.8Å; L1215-F1230 HydrophobicContact CD2-CE2 4.1Å; L1215-F1230 HydrophobicContact CD2-CZ 4.39Å; L1228-F1230 HydrophobicContact CB-CE2 3.77Å; L1228-F1230 HydrophobicContact CB-CZ 4.37Å; L1228-F1230 HydrophobicContact CD1-CE2 4.45Å; L1228-F1230 HydrophobicContact CD1-CZ 4.35Å; F1230-K1232 VanDerWaalsContact C-N 3.27Å; F1230-K1232 PolarHBondContact O-N 3.01Å; F1230-E1235 HydrophobicContact CD1-CB 3.88Å; F1230-R1236 HydrophobicContact CB-CB 4Å; F1230-R1236 HydrophobicContact CD2-CB 3.8Å; F1230-R1236 HydrophobicContact CD2-CG 3.8Å; F1230-R1236 HydrophobicContact CE2-CB 4.45Å; F1230-R1236 HydrophobicContact CE2-CG 4.25Å; F1230-R1236 HydrophobicContact CG-CB 3.89Å; F1230-R1236 HydrophobicContact CG-CG 4.41Å; F1230-W1239 HydrophobicContact CE1-CB 4.48Å; F1230-W1239 AromaticContact CE1-CD1 3.7Å; F1230-W1239 AromaticContact CE1-CD2 3.7Å; F1230-W1239 HydrophobicContact CE1-CD2 3.7Å; F1230-W1239 AromaticContact CE1-CE2 3.68Å; F1230-W1239 HydrophobicContact CE1-CE3 4.34Å; F1230-W1239 AromaticContact CE1-CG 3.74Å; F1230-W1239 HydrophobicContact CE1-CG 3.74Å; F1230-W1239 HydrophobicContact CE1-CZ2 4.36Å; F1230-W1239 AromaticContact CE1-NE1 3.61Å; F1230-W1239 HydrophobicContact CZ-CB 4.05Å; F1230-W1239 AromaticContact CZ-CD2 3.42Å; F1230-W1239 HydrophobicContact CZ-CD2 3.42Å; F1230-W1239 VanDerWaalsContact CZ-CD2 3.42Å; F1230-W1239 AromaticContact CZ-CE2 3.87Å; F1230-W1239 AromaticContact CZ-CE3 3.67Å; F1230-W1239 HydrophobicContact CZ-CE3 3.67Å; F1230-W1239 AromaticContact CZ-CG 3.6Å; F1230-W1239 HydrophobicContact CZ-CG 3.6Å; F1230-W1239 HydrophobicContact CZ-CZ3 4.31Å
1231	S	76.7	Confident	79.1	Confident	87 Å²	87	49.2 Å²	49.2	61%	0.608	25%	0.254	S	S	*	.	S	Bend	trans	-77.1	-10	178.3	56.4	0	0	0	0	114.2	D1212	D1212-S1231 WeakPolarHBondContact OD1-CA 3.44Å
1232	K	77.2	Confident	79.6	Confident	106 Å²	106	44.8 Å²	44.8	46%	0.461	23%	0.233	S	C	.	.	S	Bend	trans	-127.7	142.2	171.6	-51.8	-160.9	-164	91.3	0	112.1	F1230 E1235 R1236	F1230-K1232 VanDerWaalsContact C-N 3.27Å; F1230-K1232 PolarHBondContact O-N 3.01Å; K1232-E1235 HydrophobicContact CB-CB 4.38Å; K1232-E1235 HydrophobicContact CB-CG 4.09Å; K1232-E1235 IonicContact NZ-OE1 2.66Å; K1232-E1235 PolarHBondContact NZ-OE1 2.76Å; K1232-R1236 PolarHBondContact O-N 2.88Å
1233	E	82.1	Confident	80.2	Confident	71 Å²	71	42.7 Å²	42.7	33%	0.332	22%	0.223	S	C	.	.	H	α-helix	trans	-56.8	-48.9	172.5	-179.9	98	-150.4	0	0	111	H1213 E1235 R1236 Q1237	H1213-E1233 IonicContact CE1-OE2 2.87Å; H1213-E1233 PolarHBondContact CE1-OE2 3.28Å; H1213-E1233 IonicContact ND1-OE2 2.85Å; H1213-E1233 PolarHBondContact ND1-OE2 3.37Å; E1233-E1235 VanDerWaalsContact C-N 3.31Å; E1233-E1235 PolarHBondContact O-N 3.07Å; E1233-R1236 WeakPolarHBondContact O-CB 3.49Å; E1233-R1236 PolarHBondContact O-N 3.06Å; E1233-R1236 VanDerWaalsContact O-N 3.12Å; E1233-R1236 IonicContact OE1-CZ 3.49Å; E1233-R1236 IonicContact OE1-NH1 3.71Å; E1233-R1236 IonicContact OE1-NH2 2.62Å; E1233-R1236 PolarHBondContact OE1-NH2 2.87Å; E1233-Q1237 HydrophobicContact CG-CG 4.21Å; E1233-Q1237 VanDerWaalsContact CG-NE2 3.31Å; E1233-Q1237 WeakPolarHBondContact O-CG 3.44Å; E1233-Q1237 PolarHBondContact O-N 2.95Å; E1233-Q1237 PolarHBondContact OE1-NE2 3.17Å
1234	D	80.1	Confident	80.4	Confident	101 Å²	101	44 Å²	44	54%	0.54	23%	0.225	S	C	.	.	H	α-helix	trans	-59.8	-40.6	-174.9	-42	-36.5	0	0	0	111.8	Q1237 N1238	D1234-Q1237 PolarHBondContact O-N 3Å; D1234-N1238 WeakPolarHBondContact O-CB 3.4Å; D1234-N1238 PolarHBondContact O-N 3.45Å; D1234-N1238 PolarHBondContact O-ND2 2.85Å
1235	E	77.3	Confident	80.5	Confident	53 Å²	53	50.8 Å²	50.8	25%	0.248	26%	0.257	C	S	.	.	H	α-helix	trans	-64.9	-44	178	-66.9	172.4	-167.2	0	0	110.6	W1037 F1230 K1232 E1233 W1239	W1037-E1235 HydrophobicContact CZ3-CG 4.35Å; F1230-E1235 HydrophobicContact CD1-CB 3.88Å; K1232-E1235 HydrophobicContact CB-CB 4.38Å; K1232-E1235 HydrophobicContact CB-CG 4.09Å; K1232-E1235 IonicContact NZ-OE1 2.66Å; K1232-E1235 PolarHBondContact NZ-OE1 2.76Å; E1233-E1235 VanDerWaalsContact C-N 3.31Å; E1233-E1235 PolarHBondContact O-N 3.07Å; E1235-W1239 PolarHBondContact O-N 3.44Å; E1235-W1239 VanDerWaalsContact O-N 3.14Å
1236	R	83.7	Confident	79.8	Confident	19 Å²	19	50.7 Å²	50.7	7%	0.072	26%	0.256	C	S	.	.	H	α-helix	trans	-62.2	-44.4	173.4	-169.1	-144.7	53.9	-152.1	-5.9	111.9	C1205 H1213 L1214 L1215 F1230 K1232 E1233 W1239 S1240	C1205-R1236 PolarHBondContact SG-NE 3.46Å; H1213-R1236 HydrophobicContact CB-CB 4.1Å; H1213-R1236 HydrophobicContact CB-CG 4.37Å; L1214-R1236 WeakPolarHBondContact O-CD 3.33Å; L1215-R1236 HydrophobicContact CB-CG 3.86Å; F1230-R1236 HydrophobicContact CB-CB 4Å; F1230-R1236 HydrophobicContact CD2-CB 3.8Å; F1230-R1236 HydrophobicContact CD2-CG 3.8Å; F1230-R1236 HydrophobicContact CE2-CB 4.45Å; F1230-R1236 HydrophobicContact CE2-CG 4.25Å; F1230-R1236 HydrophobicContact CG-CB 3.89Å; F1230-R1236 HydrophobicContact CG-CG 4.41Å; K1232-R1236 PolarHBondContact O-N 2.88Å; E1233-R1236 WeakPolarHBondContact O-CB 3.49Å; E1233-R1236 PolarHBondContact O-N 3.06Å; E1233-R1236 VanDerWaalsContact O-N 3.12Å; E1233-R1236 IonicContact OE1-CZ 3.49Å; E1233-R1236 IonicContact OE1-NH1 3.71Å; E1233-R1236 IonicContact OE1-NH2 2.62Å; E1233-R1236 PolarHBondContact OE1-NH2 2.87Å; R1236-W1239 PolarHBondContact O-N 3.42Å; R1236-S1240 PolarHBondContact O-N 3.46Å
1237	Q	83.3	Confident	79.1	Confident	98 Å²	98	51.9 Å²	51.9	46%	0.458	27%	0.265	S	S	.	.	H	α-helix	trans	-64.1	-44.8	-179.1	-72	-171.4	13	0	0	111.4	E1233 D1234 W1239 S1240 A1241	E1233-Q1237 HydrophobicContact CG-CG 4.21Å; E1233-Q1237 VanDerWaalsContact CG-NE2 3.31Å; E1233-Q1237 WeakPolarHBondContact O-CG 3.44Å; E1233-Q1237 PolarHBondContact O-N 2.95Å; E1233-Q1237 PolarHBondContact OE1-NE2 3.17Å; D1234-Q1237 PolarHBondContact O-N 3Å; Q1237-W1239 PolarHBondContact O-N 3.06Å; Q1237-S1240 PolarHBondContact O-N 2.91Å; Q1237-S1240 VanDerWaalsContact O-N 3.17Å; Q1237-A1241 PolarHBondContact O-N 2.83Å
1238	N	82.1	Confident	77.6	Confident	79 Å²	79	53.9 Å²	53.9	42%	0.422	28%	0.283	S	S	.	.	H	α-helix	trans	-60.5	-41.9	175.9	-78.5	-64.9	0	0	0	112.5	W1037 D1234 Y1242	W1037-N1238 HydrophobicContact CH2-CB 3.59Å; W1037-N1238 HydrophobicContact CZ2-CB 3.48Å; W1037-N1238 VanDerWaalsContact CZ2-CB 3.48Å; W1037-N1238 HydrophobicContact CZ3-CB 4.35Å; D1234-N1238 WeakPolarHBondContact O-CB 3.4Å; D1234-N1238 PolarHBondContact O-N 3.45Å; D1234-N1238 PolarHBondContact O-ND2 2.85Å; N1238-Y1242 VanDerWaalsContact O-CB 3.31Å; N1238-Y1242 WeakPolarHBondContact O-CB 3.4Å; N1238-Y1242 PolarHBondContact O-N 3.44Å
1239	W	84	Confident	75.7	Confident	2 Å²	2	59 Å²	59	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-63.6	-41.8	173.4	-81	54.2	0	0	0	112.3	W1037 V1039 A1070 L1072 L1077 L1215 L1228 F1230 E1235 R1236 Q1237 I1243	W1037-W1239 HydrophobicContact CB-CD2 4.47Å; W1037-W1239 HydrophobicContact CB-CZ2 3.48Å; W1037-W1239 VanDerWaalsContact CB-CZ2 3.48Å; W1037-W1239 AromaticContact CD2-CD1 3.9Å; W1037-W1239 AromaticContact CD2-NE1 3.67Å; W1037-W1239 AromaticContact CE3-NE1 3.75Å; W1037-W1239 AromaticContact CG-CD1 3.88Å; W1037-W1239 AromaticContact CG-NE1 3.4Å; V1039-W1239 HydrophobicContact CB-CZ2 4.46Å; V1039-W1239 HydrophobicContact CG2-CH2 4.06Å; V1039-W1239 HydrophobicContact CG2-CZ2 3.6Å; A1070-W1239 HydrophobicContact CB-CH2 4.15Å; L1072-W1239 HydrophobicContact CB-CD2 4.17Å; L1072-W1239 HydrophobicContact CB-CE3 3.8Å; L1072-W1239 HydrophobicContact CB-CH2 3.6Å; L1072-W1239 HydrophobicContact CB-CZ2 3.97Å; L1072-W1239 HydrophobicContact CB-CZ3 3.52Å; L1072-W1239 HydrophobicContact CD2-CB 4.11Å; L1072-W1239 HydrophobicContact CD2-CD2 3.54Å; L1072-W1239 HydrophobicContact CD2-CE3 3.53Å; L1072-W1239 HydrophobicContact CD2-CG 3.82Å; L1072-W1239 HydrophobicContact CD2-CZ3 4.18Å; L1072-W1239 HydrophobicContact CG-CE3 4.22Å; L1072-W1239 HydrophobicContact CG-CZ3 4.4Å; L1077-W1239 HydrophobicContact CD1-CZ3 3.99Å; L1215-W1239 HydrophobicContact CD2-CB 3.66Å; L1228-W1239 HydrophobicContact CD1-CE3 3.8Å; L1228-W1239 HydrophobicContact CD1-CH2 4.5Å; L1228-W1239 HydrophobicContact CD1-CZ3 3.49Å; L1228-W1239 VanDerWaalsContact CD1-CZ3 3.49Å; F1230-W1239 HydrophobicContact CE1-CB 4.48Å; F1230-W1239 AromaticContact CE1-CD1 3.7Å; F1230-W1239 AromaticContact CE1-CD2 3.7Å; F1230-W1239 HydrophobicContact CE1-CD2 3.7Å; F1230-W1239 AromaticContact CE1-CE2 3.68Å; F1230-W1239 HydrophobicContact CE1-CE3 4.34Å; F1230-W1239 AromaticContact CE1-CG 3.74Å; F1230-W1239 HydrophobicContact CE1-CG 3.74Å; F1230-W1239 HydrophobicContact CE1-CZ2 4.36Å; F1230-W1239 AromaticContact CE1-NE1 3.61Å; F1230-W1239 HydrophobicContact CZ-CB 4.05Å; F1230-W1239 AromaticContact CZ-CD2 3.42Å; F1230-W1239 HydrophobicContact CZ-CD2 3.42Å; F1230-W1239 VanDerWaalsContact CZ-CD2 3.42Å; F1230-W1239 AromaticContact CZ-CE2 3.87Å; F1230-W1239 AromaticContact CZ-CE3 3.67Å; F1230-W1239 HydrophobicContact CZ-CE3 3.67Å; F1230-W1239 AromaticContact CZ-CG 3.6Å; F1230-W1239 HydrophobicContact CZ-CG 3.6Å; F1230-W1239 HydrophobicContact CZ-CZ3 4.31Å; E1235-W1239 PolarHBondContact O-N 3.44Å; E1235-W1239 VanDerWaalsContact O-N 3.14Å; R1236-W1239 PolarHBondContact O-N 3.42Å; Q1237-W1239 PolarHBondContact O-N 3.06Å; W1239-I1243 WeakPolarHBondContact O-CD1 3.3Å; W1239-I1243 VanDerWaalsContact O-CG1 3.31Å; W1239-I1243 WeakPolarHBondContact O-CG1 3.31Å; W1239-I1243 PolarHBondContact O-N 3.36Å; W1239-I1243 VanDerWaalsContact O-N 3.1Å
1240	S	84.4	Confident	73.7	Confident	5 Å²	5	60.4 Å²	60.4	4%	0.035	33%	0.325	C	S	.	.	H	α-helix	trans	-62.9	-46	179.2	-168.1	0	0	0	0	111.7	T1203 R1236 Q1237 Q1244	T1203-S1240 PolarHBondContact OG1-OG 2.88Å; R1236-S1240 PolarHBondContact O-N 3.46Å; Q1237-S1240 PolarHBondContact O-N 2.91Å; Q1237-S1240 VanDerWaalsContact O-N 3.17Å; S1240-Q1244 WeakPolarHBondContact O-CB 3.34Å; S1240-Q1244 WeakPolarHBondContact O-CG 3.41Å; S1240-Q1244 PolarHBondContact O-N 2.83Å; S1240-Q1244 PolarHBondContact OG-NE2 2.78Å
1241	A	83.8	Confident	71.7	Confident	52 Å²	52	64.6 Å²	64.6	43%	0.43	35%	0.345	S	S	.	.	H	α-helix	trans	-62	-48.3	177.6	0	0	0	0	0	111.6	Q1237 I1243 Q1244 E1245	Q1237-A1241 PolarHBondContact O-N 2.83Å; A1241-I1243 VanDerWaalsContact C-N 3.33Å; A1241-I1243 PolarHBondContact O-N 3.22Å; A1241-Q1244 PolarHBondContact O-N 3.37Å; A1241-Q1244 VanDerWaalsContact O-N 3.12Å; A1241-E1245 WeakPolarHBondContact O-CB 3.45Å; A1241-E1245 PolarHBondContact O-N 3.25Å
1242	Y	80.3	Confident	69.7	Low	41 Å²	41	64 Å²	64	16%	0.161	34%	0.341	C	S	.	.	H	α-helix	trans	-60.7	-38.3	-179.2	-172.1	-93.6	0	0	0	113.6	H1036 L1072 H1074 N1238 N1246	H1036-Y1242 PolarHBondContact CD2-OH 2.96Å; H1036-Y1242 PolarHBondContact NE2-OH 3.19Å; L1072-Y1242 HydrophobicContact CD1-CD1 4.36Å; L1072-Y1242 HydrophobicContact CD2-CD1 3.85Å; L1072-Y1242 HydrophobicContact CG-CD1 3.98Å; L1072-Y1242 HydrophobicContact CG-CE1 4.27Å; H1074-Y1242 WeakPolarHBondContact CA-OH 3.27Å; H1074-Y1242 PolarHBondContact N-OH 3.48Å; N1238-Y1242 VanDerWaalsContact O-CB 3.31Å; N1238-Y1242 WeakPolarHBondContact O-CB 3.4Å; N1238-Y1242 PolarHBondContact O-N 3.44Å; Y1242-N1246 PolarHBondContact O-N 2.73Å; Y1242-N1246 PolarHBondContact O-ND2 2.81Å
1243	I	80.9	Confident	67.6	Low	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-72.8	-40	175.7	-63	163	0	0	0	110.5	L1072 L1198 V1201 T1203 L1215 I1217 W1239 A1241 N1246 S1247	L1072-I1243 HydrophobicContact CD1-CD1 4.03Å; L1072-I1243 HydrophobicContact CD1-CG1 3.7Å; L1072-I1243 HydrophobicContact CD2-CD1 4.09Å; L1072-I1243 HydrophobicContact CD2-CG1 3.93Å; L1072-I1243 HydrophobicContact CG-CG1 4.48Å; L1198-I1243 HydrophobicContact CD2-CG1 4.42Å; L1198-I1243 HydrophobicContact CD2-CG2 4.21Å; V1201-I1243 HydrophobicContact CG1-CG2 3.82Å; T1203-I1243 HydrophobicContact CG2-CB 3.75Å; T1203-I1243 HydrophobicContact CG2-CD1 3.93Å; T1203-I1243 HydrophobicContact CG2-CG1 4.46Å; T1203-I1243 HydrophobicContact CG2-CG2 3.45Å; T1203-I1243 VanDerWaalsContact CG2-CG2 3.45Å; L1215-I1243 HydrophobicContact CD2-CD1 4.38Å; I1217-I1243 HydrophobicContact CD1-CD1 3.76Å; I1217-I1243 HydrophobicContact CG1-CD1 4.27Å; W1239-I1243 WeakPolarHBondContact O-CD1 3.3Å; W1239-I1243 VanDerWaalsContact O-CG1 3.31Å; W1239-I1243 WeakPolarHBondContact O-CG1 3.31Å; W1239-I1243 PolarHBondContact O-N 3.36Å; W1239-I1243 VanDerWaalsContact O-N 3.1Å; A1241-I1243 VanDerWaalsContact C-N 3.33Å; A1241-I1243 PolarHBondContact O-N 3.22Å; I1243-N1246 PolarHBondContact O-N 3.45Å; I1243-S1247 WeakPolarHBondContact O-CB 3.38Å; I1243-S1247 PolarHBondContact O-N 2.79Å; I1243-S1247 PolarHBondContact O-OG 2.94Å; I1243-S1247 VanDerWaalsContact O-OG 3.1Å
1244	Q	80.6	Confident	65.3	Low	93 Å²	93	69.2 Å²	69.2	44%	0.435	37%	0.374	S	S	.	.	H	α-helix	trans	-60.5	-47.8	177.5	-75.8	167.9	2.2	0	0	111.2	T1203 S1240 A1241 N1246 S1247	T1203-Q1244 WeakPolarHBondContact OG1-CG 3.42Å; T1203-Q1244 PolarHBondContact OG1-NE2 2.83Å; S1240-Q1244 WeakPolarHBondContact O-CB 3.34Å; S1240-Q1244 WeakPolarHBondContact O-CG 3.41Å; S1240-Q1244 PolarHBondContact O-N 2.83Å; S1240-Q1244 PolarHBondContact OG-NE2 2.78Å; A1241-Q1244 PolarHBondContact O-N 3.37Å; A1241-Q1244 VanDerWaalsContact O-N 3.12Å; Q1244-N1246 PolarHBondContact O-N 2.96Å; Q1244-S1247 PolarHBondContact O-N 3.45Å; Q1244-S1247 PolarHBondContact O-OG 2.95Å
1245	E	75.6	Confident	63	Low	144 Å²	144	73.4 Å²	73.4	67%	0.673	38%	0.382	S	S	*	.	H	α-helix	trans	-55.3	-48.3	176.4	-172.1	177.4	-165.7	0	0	112.4	A1241	A1241-E1245 WeakPolarHBondContact O-CB 3.45Å; A1241-E1245 PolarHBondContact O-N 3.25Å
1246	N	67.4	Low	60.8	Low	18 Å²	18	79.4 Å²	79.4	10%	0.096	41%	0.41	C	S	.	.	H	α-helix	trans	-75.2	-32.9	-177.5	-78	-73.2	0	0	0	114.1	H1074 Y1242 I1243 Q1244 V1248 T1249	H1074-N1246 PolarHBondContact CE1-OD1 2.86Å; H1074-N1246 PolarHBondContact ND1-OD1 3.48Å; H1074-N1246 PolarHBondContact O-OD1 2.87Å; Y1242-N1246 PolarHBondContact O-N 2.73Å; Y1242-N1246 PolarHBondContact O-ND2 2.81Å; I1243-N1246 PolarHBondContact O-N 3.45Å; Q1244-N1246 PolarHBondContact O-N 2.96Å; N1246-V1248 VanDerWaalsContact C-N 3.26Å; N1246-V1248 PolarHBondContact O-N 3.27Å; N1246-T1249 PolarHBondContact O-OG1 3.24Å
1247	S	64	Low	58.3	Low	26 Å²	26	89.7 Å²	89.7	18%	0.182	45%	0.449	C	S	.	.	H	α-helix	trans	-67	-18.7	-172.1	64.3	0	0	0	0	115.6	V1201 I1243 Q1244 T1249	V1201-S1247 WeakPolarHBondContact O-CB 3.3Å; I1243-S1247 WeakPolarHBondContact O-CB 3.38Å; I1243-S1247 PolarHBondContact O-N 2.79Å; I1243-S1247 PolarHBondContact O-OG 2.94Å; I1243-S1247 VanDerWaalsContact O-OG 3.1Å; Q1244-S1247 PolarHBondContact O-N 3.45Å; Q1244-S1247 PolarHBondContact O-OG 2.95Å; S1247-T1249 VanDerWaalsContact C-N 3.33Å; S1247-T1249 PolarHBondContact O-N 2.89Å
1248	V	49.8	Very low	55.7	Low	103 Å²	103	90.4 Å²	90.4	62%	0.624	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-18.6	-174.9	175.8	0	0	0	0	113.1	N1246 T1250	N1246-V1248 VanDerWaalsContact C-N 3.26Å; N1246-V1248 PolarHBondContact O-N 3.27Å; V1248-T1250 VanDerWaalsContact C-N 3.26Å; V1248-T1250 PolarHBondContact O-N 2.96Å
1249	T	42	Very low	53.2	Low	108 Å²	108	91.2 Å²	91.2	66%	0.663	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	7.1	-161.3	54.9	0	0	0	0	117.3	N1246 S1247	N1246-T1249 PolarHBondContact O-OG1 3.24Å; S1247-T1249 VanDerWaalsContact C-N 3.33Å; S1247-T1249 PolarHBondContact O-N 2.89Å
1250	T	35.6	Very low	50.6	Low	59 Å²	59	97.9 Å²	97.9	36%	0.362	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	-27.1	-178.8	-37.1	0	0	0	0	115.5	I1199 V1248	I1199-T1250 HydrophobicContact CG2-CG2 4.33Å; V1248-T1250 VanDerWaalsContact C-N 3.26Å; V1248-T1250 PolarHBondContact O-N 2.96Å
1251	Q	34.8	Very low	48	Very low	92 Å²	92	101.1 Å²	101.1	43%	0.43	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-6.4	-173.1	-65.9	-165.6	17.4	0	0	115.5	D1200	D1200-Q1251 PolarHBondContact OD1-NE2 2.84Å
1252	S	34.2	Very low	45.4	Very low	75 Å²	75	101.9 Å²	101.9	52%	0.524	52%	0.516	S	S	.	.	S	Bend	trans	-78.2	-31.6	-178.1	-159.1	0	0	0	0	113.3
1253	I	33.2	Very low	42.9	Very low	144 Å²	144	102.9 Å²	102.9	74%	0.738	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-36.7	-171.6	-61.9	176.6	0	0	0	112.4
1254	D	34.1	Very low	40.4	Very low	141 Å²	141	108.1 Å²	108.1	75%	0.754	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-12.6	-177.6	-82.8	-39.8	0	0	0	114.6
1255	R	31.9	Very low	37.9	Very low	190 Å²	190	108.1 Å²	108.1	72%	0.717	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-14	-170.8	-89.4	-177.9	165.2	135.1	-3.3	116.3
1256	Q	32	Very low	35.7	Very low	178 Å²	178	106.1 Å²	106.1	83%	0.832	59%	0.593	S	S	*	*	S	Bend	trans	-92.9	-1.5	-177.4	-72.8	-171.9	-22.1	0	0	115.3
1257	R	29.7	Very low	33.9	Very low	235 Å²	235	110 Å²	110	89%	0.887	63%	0.628	S	S	*	*	S	Bend	trans	-102	28.4	-173.3	-153.5	175.2	-80	-169.7	-4.3	115
1258	V	29.9	Very low	32.3	Very low	113 Å²	113	113 Å²	113	69%	0.685	65%	0.654	S	S	*	*			trans	-131.7	117.4	-179.5	179.7	0	0	0	0	111.9
1259	L	30.2	Very low	31.5	Very low	96 Å²	96	113 Å²	113	50%	0.503	66%	0.659	S	S	.	*			trans	170.4	-168	148.4	-93.5	160.9	0	0	0	110.2	P1280 T1281 I1282 G1283	L1259-P1280 CarbonylContact O-C 3.53Å; L1259-P1280 WeakPolarHBondContact O-CA 3.49Å; L1259-T1281 CarbonylContact C-O 3.52Å; L1259-T1281 PolarHBondContact O-N 3.41Å; L1259-I1282 VanDerWaalsContact CB-C 3.41Å; L1259-I1282 WeakPolarHBondContact CB-O 3.28Å; L1259-I1282 WeakPolarHBondContact CD1-O 3.17Å; L1259-G1283 VanDerWaalsContact CD1-CA 3.46Å
1260	K	28.8	Very low	31.1	Very low	142 Å²	142	113.4 Å²	113.4	62%	0.617	67%	0.666	S	S	*	*			trans	-139.8	134.8	-175.2	-66.3	-161.8	167.4	-136.1	0	114.1	N1278 R1279 P1280 T1281	K1260-N1278 PolarHBondContact NZ-O 3.42Å; K1260-R1279 WeakPolarHBondContact CD-O 3.46Å; K1260-R1279 WeakPolarHBondContact CE-O 3.45Å; K1260-R1279 WeakPolarHBondContact CG-O 3.49Å; K1260-R1279 PolarHBondContact NZ-O 3.42Å; K1260-P1280 VanDerWaalsContact CA-C 3.43Å; K1260-T1281 CarbonylContact C-O 3.59Å; K1260-T1281 VanDerWaalsContact CA-O 3.3Å; K1260-T1281 WeakPolarHBondContact CA-O 3.5Å; K1260-T1281 PolarHBondContact N-O 2.81Å
1261	P	30.1	Very low	31	Very low	74 Å²	74	115.7 Å²	115.7	48%	0.481	68%	0.684	S	S	.	*				-153.9	169.1	97.2	40.2	-21.9	0	0	0	121.7	R1279 P1280 T1281	P1261-R1279 PolarHBondContact O-NE 2.83Å; P1261-R1279 PolarHBondContact O-NH2 3.27Å; P1261-P1280 CarbonylContact C-O 3.57Å; P1261-T1281 VanDerWaalsContact CD-O 3.27Å; P1261-T1281 WeakPolarHBondContact CD-O 3.24Å
1262	S	28.5	Very low	31	Very low	68 Å²	68	116.3 Å²	116.3	48%	0.476	70%	0.696	S	S	.	*			trans	-44.4	173.9	152.9	-50	0	0	0	0	116.6	R1279	S1262-R1279 VanDerWaalsContact CA-CZ 3.46Å; S1262-R1279 VanDerWaalsContact CA-NE 3.34Å; S1262-R1279 PolarHBondContact O-NH2 3.41Å
1263	A	28.2	Very low	30.9	Very low	61 Å²	61	118 Å²	118	50%	0.504	71%	0.709	S	S	.	*			cis	-146.6	169.3	11	0	0	0	0	0	112.1	R1279	A1263-R1279 VanDerWaalsContact C-NH1 3.27Å; A1263-R1279 PolarHBondContact O-NH1 2.82Å
1264	S	28.2	Very low	30.9	Very low	110 Å²	110	116.6 Å²	116.6	77%	0.769	71%	0.711	S	S	*	*				73.2	144.7	101.2	69.2	0	0	0	0	118.3
1265	A	28.4	Very low	30.8	Very low	94 Å²	94	114.6 Å²	114.6	78%	0.777	71%	0.708	S	S	*	*			cis	-177.1	178.3	-14.5	0	0	0	0	0	112.3
1266	A	28.3	Very low	30.7	Very low	102 Å²	102	111.1 Å²	111.1	84%	0.843	71%	0.708	S	S	*	*			trans	77.1	147.6	153.8	0	0	0	0	0	118.5
1267	A	29.4	Very low	30.6	Very low	99 Å²	99	110 Å²	110	82%	0.818	70%	0.703	S	S	*	*			cis	-158.7	171.9	-20.8	0	0	0	0	0	106.8
1268	A	31.6	Very low	30.5	Very low	89 Å²	89	103 Å²	103	74%	0.736	68%	0.684	S	S	*	*			cis	-157.8	176	15.5	0	0	0	0	0	108.3
1269	S	31.6	Very low	30.4	Very low	104 Å²	104	103.2 Å²	103.2	73%	0.727	67%	0.672	S	S	*	*			cis	-159.2	147.8	0.9	26.7	0	0	0	0	111.4
1270	S	34	Very low	30.5	Very low	115 Å²	115	102.4 Å²	102.4	80%	0.804	67%	0.672	S	S	*	*			trans	73	159	167.2	87	0	0	0	0	116.4
1271	S	34.6	Very low	30.3	Very low	107 Å²	107	98.9 Å²	98.9	75%	0.748	66%	0.663	S	S	*	*			cis	-175.2	158.4	-25.3	-97.7	0	0	0	0	110.2
1272	P	34.1	Very low	30	Very low	105 Å²	105	102.2 Å²	102.2	68%	0.682	68%	0.675	S	S	*	*			cis	-139.2	175	-41	39.2	-21.9	0	0	0	113.9
1273	S	33.2	Very low	29.9	Very low	112 Å²	112	101.2 Å²	101.2	78%	0.783	68%	0.676	S	S	*	*			trans	61.9	130.2	167.2	54.6	0	0	0	0	118.2
1274	S	32.2	Very low	29.6	Very low	114 Å²	114	106 Å²	106	80%	0.797	69%	0.691	S	S	*	*			cis	-179.2	167.7	-0.1	40.8	0	0	0	0	107.7
1275	S	31.8	Very low	29.4	Very low	99 Å²	99	106.6 Å²	106.6	69%	0.692	69%	0.69	S	S	*	*			cis	177.3	163.2	-5.7	46.9	0	0	0	0	106.5
1276	T	30.9	Very low	29.2	Very low	116 Å²	116	106.7 Å²	106.7	71%	0.712	69%	0.686	S	S	*	*			cis	-176.4	159.2	-6.2	26.4	0	0	0	0	106.7
1277	Q	29.3	Very low	29	Very low	155 Å²	155	110.5 Å²	110.5	72%	0.724	69%	0.686	S	S	*	*			cis	-166.6	155.6	-23.5	-117.9	-177.6	12.3	0	0	112
1278	N	28	Very low	28.8	Very low	89 Å²	89	111 Å²	111	48%	0.476	68%	0.683	S	S	.	*			trans	79	102.8	140.4	-62.7	-13.9	0	0	0	126.3	K1260	K1260-N1278 PolarHBondContact NZ-O 3.42Å
1279	R	26.3	Very low	28.5	Very low	117 Å²	117	113.5 Å²	113.5	44%	0.442	68%	0.683	S	S	.	*				71.1	144.5	116	-78.4	-168.5	63.7	164.9	-12.3	125.2	K1260 P1261 S1262 A1263	K1260-R1279 WeakPolarHBondContact CD-O 3.46Å; K1260-R1279 WeakPolarHBondContact CE-O 3.45Å; K1260-R1279 WeakPolarHBondContact CG-O 3.49Å; K1260-R1279 PolarHBondContact NZ-O 3.42Å; P1261-R1279 PolarHBondContact O-NE 2.83Å; P1261-R1279 PolarHBondContact O-NH2 3.27Å; S1262-R1279 VanDerWaalsContact CA-CZ 3.46Å; S1262-R1279 VanDerWaalsContact CA-NE 3.34Å; S1262-R1279 PolarHBondContact O-NH2 3.41Å; A1263-R1279 VanDerWaalsContact C-NH1 3.27Å; A1263-R1279 PolarHBondContact O-NH1 2.82Å
1280	P	32	Very low	28.3	Very low	79 Å²	79	115.3 Å²	115.3	51%	0.513	68%	0.683	S	S	.	*			trans	-116.6	-171	-177.9	46.3	-34.8	0	0	0	115.6	L1259 K1260 P1261	L1259-P1280 CarbonylContact O-C 3.53Å; L1259-P1280 WeakPolarHBondContact O-CA 3.49Å; K1260-P1280 VanDerWaalsContact CA-C 3.43Å; P1261-P1280 CarbonylContact C-O 3.57Å
1281	T	25.6	Very low	27.8	Very low	68 Å²	68	114 Å²	114	42%	0.417	67%	0.674	S	S	.	*			trans	121	127.8	160.2	-60.9	0	0	0	0	119.7	L1259 K1260 P1261	L1259-T1281 CarbonylContact C-O 3.52Å; L1259-T1281 PolarHBondContact O-N 3.41Å; K1260-T1281 CarbonylContact C-O 3.59Å; K1260-T1281 VanDerWaalsContact CA-O 3.3Å; K1260-T1281 WeakPolarHBondContact CA-O 3.5Å; K1260-T1281 PolarHBondContact N-O 2.81Å; P1261-T1281 VanDerWaalsContact CD-O 3.27Å; P1261-T1281 WeakPolarHBondContact CD-O 3.24Å
1282	I	24.6	Very low	27.3	Very low	143 Å²	143	117.6 Å²	117.6	73%	0.733	68%	0.677	S	S	*	*			trans	60.8	136	157.5	-68.3	164.7	0	0	0	123.8	L1259	L1259-I1282 VanDerWaalsContact CB-C 3.41Å; L1259-I1282 WeakPolarHBondContact CB-O 3.28Å; L1259-I1282 WeakPolarHBondContact CD1-O 3.17Å
1283	G	24.6	Very low	26.9	Very low	48 Å²	48	119.1 Å²	119.1	50%	0.495	68%	0.684	S	S	.	*			trans	162.5	143.5	147.5	0	0	0	0	0	117.6	L1259	L1259-G1283 VanDerWaalsContact CD1-CA 3.46Å
1284	I	23.1	Very low	26.6	Very low	160 Å²	160	119.1 Å²	119.1	82%	0.821	68%	0.684	S	S	*	*			trans	-105.7	171.3	-171.9	-40.9	175	0	0	0	111.3
1285	T	24.7	Very low	26.5	Very low	123 Å²	123	116.9 Å²	116.9	76%	0.755	68%	0.679	S	S	*	*			trans	89	119.6	157.5	70	0	0	0	0	121.2
1286	S	23.4	Very low	26.4	Very low	97 Å²	97	120.2 Å²	120.2	68%	0.678	69%	0.689	S	S	*	*			trans	42.3	118.6	136.4	62	0	0	0	0	123.1
1287	E	24	Very low	26.1	Very low	181 Å²	181	120.5 Å²	120.5	85%	0.846	69%	0.691	S	S	*	*				68.8	137.9	129.2	-61.4	-168.3	154.2	0	0	122.8
1288	S	25.2	Very low	26.1	Very low	109 Å²	109	118.6 Å²	118.6	76%	0.762	69%	0.692	S	S	*	*			trans	69.4	155.2	161	87	0	0	0	0	116.3
1289	L	25.6	Very low	26	Very low	142 Å²	142	120.1 Å²	120.1	74%	0.743	70%	0.704	S	S	*	*			cis	-157.5	172.8	-22.6	-108.4	168.3	0	0	0	106.1
1290	I	26.7	Very low	26.1	Very low	142 Å²	142	118.7 Å²	118.7	73%	0.728	72%	0.718	S	S	*	*			trans	30.7	132.4	146.3	-62.6	160.7	0	0	0	118.7
1291	S	24.6	Very low	26	Very low	87 Å²	87	122.1 Å²	122.1	61%	0.608	73%	0.732	S	S	*	*			cis	172.9	141.6	-4.8	-90.8	0	0	0	0	108.3
1292	K	24.1	Very low	26.2	Very low	184 Å²	184	126.2 Å²	126.2	80%	0.8	75%	0.746	S	S	*	*			trans	59.3	149.5	143.9	-61.8	174.1	179.4	176.7	0	122.3
1293	T	25.1	Very low	26.4	Very low	137 Å²	137	124.3 Å²	124.3	84%	0.84	74%	0.741	S	S	*	*			trans	68.7	148.1	152.1	35.9	0	0	0	0	118.3
1294	S	27.2	Very low	26.5	Very low	112 Å²	112	126.8 Å²	126.8	78%	0.783	75%	0.751	S	S	*	*			cis	-165.4	153.9	0.2	41.9	0	0	0	0	113.4
1295	G	28.8	Very low	26.6	Very low	67 Å²	67	124.9 Å²	124.9	69%	0.691	75%	0.746	S	S	*	*			trans	88.3	153.8	157.7	0	0	0	0	0	116.9
1296	N	30.1	Very low	26.9	Very low	169 Å²	169	126.5 Å²	126.5	90%	0.904	75%	0.749	S	S	*	*			cis	-148.9	155.7	-5.9	-93.5	-13.2	0	0	0	111.4
1297	T	25.7	Very low	26.9	Very low	121 Å²	121	127.8 Å²	127.8	74%	0.742	75%	0.753	S	S	*	*			trans	-82.7	154.5	172	50.3	0	0	0	0	112.3
1298	P	29.8	Very low	27.1	Very low	116 Å²	116	124.1 Å²	124.1	75%	0.753	74%	0.744	S	S	*	*				-135.2	139.9	89.6	12.2	11.2	0	0	0	113.1
1299	T	25.7	Very low	27.1	Very low	120 Å²	120	127.2 Å²	127.2	74%	0.736	75%	0.747	S	S	*	*				77.4	138.4	61.8	66.2	0	0	0	0	116.8
1300	A	27.4	Very low	27.3	Very low	88 Å²	88	124.8 Å²	124.8	73%	0.727	74%	0.74	S	S	*	*			trans	71	153.4	161.7	0	0	0	0	0	118
1301	D	30.1	Very low	27.2	Very low	150 Å²	150	123 Å²	123	80%	0.802	74%	0.74	S	S	*	*			cis	-169.4	-174.4	-30.1	-109.9	-58.6	0	0	0	107.7
1302	E	29.1	Very low	27.2	Very low	154 Å²	154	124 Å²	124	72%	0.72	74%	0.743	S	S	*	*			cis	-153.6	173.6	8	-141	-161.2	131.5	0	0	111.8
1303	V	28.6	Very low	27.4	Very low	103 Å²	103	123.3 Å²	123.3	62%	0.624	74%	0.742	S	S	*	*			trans	10.7	137.1	137.6	165.3	0	0	0	0	119.5	V1305	V1303-V1305 HydrophobicContact CG1-CG2 4.49Å
1304	S	28	Very low	27.4	Very low	101 Å²	101	122.9 Å²	122.9	71%	0.706	74%	0.735	S	S	*	*				-161.1	152.1	56.2	14.8	0	0	0	0	114.2
1305	V	25.7	Very low	27.3	Very low	119 Å²	119	123.5 Å²	123.5	72%	0.721	73%	0.729	S	S	*	*				49.1	132.8	83.8	-139.7	0	0	0	0	112.7	V1303	V1303-V1305 HydrophobicContact CG1-CG2 4.49Å
1306	I	29.4	Very low	27.1	Very low	157 Å²	157	128.2 Å²	128.2	81%	0.805	73%	0.73	S	S	*	*			cis	-151.9	152.8	39.6	-33.8	179.1	0	0	0	113.3
1307	T	24.3	Very low	26.9	Very low	125 Å²	125	126.3 Å²	126.3	77%	0.767	73%	0.725	S	S	*	*			trans	-79.5	-162.6	166.6	0.6	0	0	0	0	112.1
1308	P	28	Very low	26.8	Very low	103 Å²	103	124.9 Å²	124.9	67%	0.669	72%	0.72	S	S	*	*			cis	-137.9	164.3	-25.2	33.4	-13.6	0	0	0	117
1309	Q	25.2	Very low	26.5	Very low	174 Å²	174	129.6 Å²	129.6	81%	0.813	73%	0.729	S	S	*	*			trans	60.9	-165.9	147.9	-72.1	-150.1	37.7	0	0	118.2
1310	P	29.9	Very low	26.4	Very low	91 Å²	91	127.4 Å²	127.4	59%	0.591	73%	0.73	S	S	*	*				-133.1	-175.9	-81.8	42.9	-28.1	0	0	0	115.5
1311	S	24.8	Very low	26.3	Very low	104 Å²	104	132.8 Å²	132.8	73%	0.727	74%	0.737	S	S	*	*			trans	68.5	165.9	153.6	78.9	0	0	0	0	115.8
1312	T	25	Very low	26	Very low	110 Å²	110	132.9 Å²	132.9	68%	0.675	74%	0.737	S	S	*	*			cis	-161.4	179.3	-27.3	19.7	0	0	0	0	106.6
1313	Q	28.6	Very low	26	Very low	168 Å²	168	130.8 Å²	130.8	79%	0.785	74%	0.737	S	S	*	*			trans	69.4	157.4	160.8	-71.9	160.6	-4.9	0	0	117
1314	D	25.1	Very low	25.7	Very low	129 Å²	129	131 Å²	131	69%	0.69	74%	0.738	S	S	*	*			cis	-159.1	161.2	-44.6	-122.6	-37.4	0	0	0	111.5
1315	L	24.1	Very low	25.7	Very low	125 Å²	125	132.4 Å²	132.4	65%	0.654	74%	0.743	S	S	*	*			trans	39.5	132.8	146.8	-69.6	165.2	0	0	0	123.2
1316	K	24.1	Very low	25.7	Very low	166 Å²	166	131.2 Å²	131.2	72%	0.722	74%	0.74	S	S	*	*				89	147.9	129.7	-81.7	169	-179	170.2	0	121.6
1317	T	25.4	Very low	25.6	Very low	129 Å²	129	128.4 Å²	128.4	79%	0.791	73%	0.734	S	S	*	*			trans	66.9	144.7	149.4	44.6	0	0	0	0	118.5
1318	S	24.2	Very low	25.7	Very low	91 Å²	91	128.2 Å²	128.2	64%	0.636	73%	0.733	S	S	*	*			cis	-175.8	152.8	-16.5	45.5	0	0	0	0	111.5
1319	F	23.2	Very low	25.7	Very low	214 Å²	214	129.1 Å²	129.1	94%	0.939	74%	0.737	S	S	*	*			trans	57	106.9	146.8	-78.5	-135.5	0	0	0	119.7
1320	G	24.1	Very low	25.8	Very low	75 Å²	75	126 Å²	126	77%	0.773	73%	0.73	S	S	*	*				96.9	159.6	100.1	0	0	0	0	0	121.9
1321	K	25.2	Very low	25.6	Very low	201 Å²	201	130.4 Å²	130.4	87%	0.874	74%	0.74	S	S	*	*			trans	73.2	95.1	165.9	-70.1	-173.4	173.7	-178.6	0	120.9
1322	L	24.3	Very low	25.7	Very low	151 Å²	151	131.5 Å²	131.5	79%	0.791	74%	0.738	S	S	*	*				11.7	133.6	110.7	-148.8	80.9	0	0	0	118.1	T1324	L1322-T1324 HydrophobicContact CD2-CG2 4.09Å
1323	P	28.1	Very low	25.7	Very low	111 Å²	111	131.4 Å²	131.4	72%	0.721	73%	0.733	S	S	*	*				-123.5	142.6	99.6	0.6	21.3	0	0	0	112.3
1324	T	24.1	Very low	25.6	Very low	106 Å²	106	130.9 Å²	130.9	65%	0.65	73%	0.728	S	S	*	*				48	130.8	82.4	73.5	0	0	0	0	113.9	L1322	L1322-T1324 HydrophobicContact CD2-CG2 4.09Å
1325	T	26.9	Very low	25.5	Very low	132 Å²	132	130.4 Å²	130.4	81%	0.81	73%	0.73	S	S	*	*			cis	-155.5	166.7	39.2	41.8	0	0	0	0	110.9
1326	S	26.6	Very low	25.5	Very low	94 Å²	94	130.5 Å²	130.5	66%	0.657	74%	0.736	S	S	*	*			cis	-175.1	-174.2	-13.3	53.9	0	0	0	0	109.4
1327	S	26.9	Very low	25.4	Very low	97 Å²	97	132.8 Å²	132.8	68%	0.678	74%	0.741	S	S	*	*			trans	62.1	127.9	150.6	46.1	0	0	0	0	119.8
1328	T	26.8	Very low	25.7	Very low	121 Å²	121	131.8 Å²	131.8	74%	0.742	74%	0.737	S	S	*	*			cis	-160.8	158.8	3.7	-5.9	0	0	0	0	112.3
1329	T	26.3	Very low	25.7	Very low	122 Å²	122	131.7 Å²	131.7	75%	0.748	74%	0.736	S	S	*	*			trans	55.4	120.4	155.8	48.2	0	0	0	0	119.2
1330	T	27.1	Very low	25.7	Very low	110 Å²	110	128.8 Å²	128.8	68%	0.675	73%	0.731	S	S	*	*			cis	-154.4	139.7	0.3	34.1	0	0	0	0	112
1331	K	27.6	Very low	25.7	Very low	182 Å²	182	132.8 Å²	132.8	79%	0.791	73%	0.733	S	S	*	*			trans	48.4	135.3	137.3	-57.9	178	-178.5	177.8	0	119.5
1332	N	26.5	Very low	25.6	Very low	128 Å²	128	130 Å²	130	68%	0.684	73%	0.727	S	S	*	*			cis	-167.3	164.8	-2.4	-119	21.6	0	0	0	109.9
1333	D	24.6	Very low	25.5	Very low	107 Å²	107	128.2 Å²	128.2	57%	0.572	73%	0.728	S	S	*	*			trans	14.9	145.9	134	-67	-13.8	0	0	0	120.9
1334	K	25.4	Very low	25.5	Very low	157 Å²	157	131.3 Å²	131.3	68%	0.683	73%	0.73	S	S	*	*			cis	-172.8	147	1	-113.9	163.2	-168	140.9	0	111.3
1335	T	23.4	Very low	25.5	Very low	120 Å²	120	133.2 Å²	133.2	74%	0.736	74%	0.736	S	S	*	*			trans	32.7	132.3	143.3	62.8	0	0	0	0	122.8
1336	T	24.2	Very low	25.6	Very low	127 Å²	127	132.7 Å²	132.7	78%	0.779	73%	0.728	S	S	*	*			trans	109.9	127.1	141.9	-40.9	0	0	0	0	118.5
1337	Y	22.8	Very low	25.6	Very low	213 Å²	213	135.4 Å²	135.4	84%	0.835	73%	0.733	S	S	*	*			trans	-34.5	172.8	156.9	-67.9	-82	0	0	0	118.4
1338	P	32.4	Very low	25.5	Very low	108 Å²	108	135.4 Å²	135.4	70%	0.701	73%	0.734	S	S	*	*			cis	-137.1	-170.6	-3.1	24	1.9	0	0	0	116.1
1339	S	23.5	Very low	25.5	Very low	89 Å²	89	135.3 Å²	135.3	62%	0.622	74%	0.738	S	S	*	*			trans	87.2	115	143	22.1	0	0	0	0	122
1340	D	23.6	Very low	25.5	Very low	153 Å²	153	132 Å²	132	82%	0.818	73%	0.728	S	S	*	*				80.6	144.9	129.2	-52.1	-17.3	0	0	0	123.6
1341	I	23.2	Very low	25.4	Very low	159 Å²	159	134.5 Å²	134.5	82%	0.815	73%	0.732	S	S	*	*			trans	86.6	123.3	166.9	-55.4	170.5	0	0	0	118.3
1342	N	22.9	Very low	25.4	Very low	142 Å²	142	134.2 Å²	134.2	76%	0.759	73%	0.733	S	S	*	*			trans	-28.3	148	162	-38.1	-32.8	0	0	0	114.9
1343	S	23.4	Very low	25.4	Very low	115 Å²	115	131.8 Å²	131.8	80%	0.804	73%	0.727	S	S	*	*				-164.8	-168.5	55.4	-94.7	0	0	0	0	112.9
1344	F	26.2	Very low	25.7	Very low	176 Å²	176	130.2 Å²	130.2	77%	0.772	72%	0.721	S	S	*	*			trans	-31.8	144.8	165.5	-88.9	-115.5	0	0	0	114.2	L1346	F1344-L1346 HydrophobicContact CD1-CD1 3.97Å; F1344-L1346 HydrophobicContact CE1-CD1 4.22Å
1345	D	25.8	Very low	26	Very low	145 Å²	145	126 Å²	126	78%	0.775	71%	0.708	S	S	*	*				-153	172.1	79.8	-111.2	-34.6	0	0	0	117.7
1346	L	27.4	Very low	26.5	Very low	122 Å²	122	125.7 Å²	125.7	64%	0.639	70%	0.697	S	S	*	*			trans	-68.3	173.3	168.1	-67.7	71.2	0	0	0	110.3	F1344	F1344-L1346 HydrophobicContact CD1-CD1 3.97Å; F1344-L1346 HydrophobicContact CE1-CD1 4.22Å
1347	I	26.8	Very low	27.1	Very low	150 Å²	150	123.7 Å²	123.7	77%	0.769	68%	0.684	S	S	*	*			cis	-164	166.7	23	-145.8	152.7	0	0	0	109.5
1348	S	24.9	Very low	28	Very low	98 Å²	98	118.2 Å²	118.2	69%	0.685	67%	0.669	S	S	*	*				159.9	143.3	121.7	-164.3	0	0	0	0	115.2
1349	S	26.9	Very low	28.5	Very low	118 Å²	118	119.8 Å²	119.8	83%	0.825	67%	0.665	S	S	*	*			trans	58.6	128.4	166.3	62.4	0	0	0	0	118.5
1350	G	26.1	Very low	29.3	Very low	52 Å²	52	119.3 Å²	119.3	54%	0.536	66%	0.655	S	S	.	*			cis	161.9	-29.4	-6.7	0	0	0	0	0	115.1
1351	E	26.9	Very low	30.3	Very low	163 Å²	163	116.4 Å²	116.4	76%	0.762	64%	0.637	S	S	*	*	S	Bend	trans	-111.6	-16.4	-163.3	-60.1	-175.4	132.9	0	0	115.1	T1354 V1355	E1351-T1354 PolarHBondContact O-OG1 2.85Å; E1351-T1354 VanDerWaalsContact O-OG1 3.09Å; E1351-V1355 WeakPolarHBondContact O-CG2 3.09Å
1352	E	27.4	Very low	32	Very low	176 Å²	176	113 Å²	113	82%	0.822	62%	0.623	S	S	*	*	H	α-helix	trans	-84.9	-25.1	-178.5	-64.6	-161.5	135.5	0	0	113.8	F1356	E1352-F1356 PolarHBondContact O-N 3.07Å; E1352-F1356 VanDerWaalsContact O-N 3.14Å
1353	S	26.6	Very low	32.9	Very low	78 Å²	78	108.6 Å²	108.6	55%	0.545	61%	0.607	S	S	.	*	H	α-helix	trans	-74.3	-38	179.7	56.6	0	0	0	0	112.5	F1356 V1357	S1353-F1356 PolarHBondContact O-N 3.06Å; S1353-V1357 WeakPolarHBondContact O-CG2 3.31Å; S1353-V1357 PolarHBondContact O-N 3.33Å
1354	T	29.1	Very low	33.7	Very low	74 Å²	74	108.1 Å²	108.1	45%	0.454	59%	0.593	S	S	.	*	H	α-helix	trans	-61.5	-47.6	173.5	50.7	0	0	0	0	110.5	E1351 F1356 V1357 D1358	E1351-T1354 PolarHBondContact O-OG1 2.85Å; E1351-T1354 VanDerWaalsContact O-OG1 3.09Å; T1354-F1356 PolarHBondContact O-N 2.9Å; T1354-V1357 PolarHBondContact O-N 3.03Å; T1354-V1357 VanDerWaalsContact O-N 3.14Å; T1354-D1358 WeakPolarHBondContact O-CB 3.24Å; T1354-D1358 PolarHBondContact O-N 3.49Å
1355	V	32.7	Very low	34.9	Very low	68 Å²	68	104.2 Å²	104.2	41%	0.412	58%	0.58	S	S	.	*	H	α-helix	trans	-61.3	-29.9	176.2	173.9	0	0	0	0	112.8	E1351 K1359	E1351-V1355 WeakPolarHBondContact O-CG2 3.09Å; V1355-K1359 HydrophobicContact CG1-CD 4.24Å; V1355-K1359 WeakPolarHBondContact O-CB 3.18Å; V1355-K1359 VanDerWaalsContact O-CD 3.26Å; V1355-K1359 WeakPolarHBondContact O-CD 3.4Å; V1355-K1359 WeakPolarHBondContact O-CG 3.46Å; V1355-K1359 PolarHBondContact O-N 3.17Å
1356	F	34.1	Very low	36.2	Very low	114 Å²	114	103 Å²	103	50%	0.5	57%	0.57	S	S	.	*	H	α-helix	trans	-75.9	-44.7	172.5	-176.8	-98.1	0	0	0	112.2	E1352 S1353 T1354 K1359 L1360	E1352-F1356 PolarHBondContact O-N 3.07Å; E1352-F1356 VanDerWaalsContact O-N 3.14Å; S1353-F1356 PolarHBondContact O-N 3.06Å; T1354-F1356 PolarHBondContact O-N 2.9Å; F1356-K1359 PolarHBondContact O-N 3.48Å; F1356-L1360 WeakPolarHBondContact O-CB 3.4Å; F1356-L1360 PolarHBondContact O-N 2.81Å
1357	V	36.6	Very low	37	Very low	84 Å²	84	102.4 Å²	102.4	51%	0.509	57%	0.567	S	S	.	*	H	α-helix	trans	-62.2	-44.8	176.5	170	0	0	0	0	110.9	S1353 T1354 K1359 L1360 Q1361	S1353-V1357 WeakPolarHBondContact O-CG2 3.31Å; S1353-V1357 PolarHBondContact O-N 3.33Å; T1354-V1357 PolarHBondContact O-N 3.03Å; T1354-V1357 VanDerWaalsContact O-N 3.14Å; V1357-K1359 VanDerWaalsContact C-N 3.31Å; V1357-K1359 PolarHBondContact O-N 3.38Å; V1357-L1360 PolarHBondContact O-N 3.27Å; V1357-L1360 VanDerWaalsContact O-N 3.16Å; V1357-Q1361 WeakPolarHBondContact O-CB 3.47Å; V1357-Q1361 PolarHBondContact O-N 3.08Å
1358	D	42.3	Very low	38	Very low	99 Å²	99	99.1 Å²	99.1	53%	0.529	55%	0.55	S	S	.	*	H	α-helix	trans	-61.4	-38.3	176	-74.8	-27.9	0	0	0	111.8	T1354 T1362	T1354-D1358 WeakPolarHBondContact O-CB 3.24Å; T1354-D1358 PolarHBondContact O-N 3.49Å; D1358-T1362 WeakPolarHBondContact O-CB 3.4Å; D1358-T1362 PolarHBondContact O-N 3.38Å; D1358-T1362 PolarHBondContact O-OG1 2.91Å
1359	K	42.2	Very low	39.5	Very low	140 Å²	140	96.2 Å²	96.2	61%	0.609	54%	0.536	S	S	*	.	H	α-helix	trans	-70	-37.6	174.8	-75.7	169.1	-172.2	165.2	0	112.3	V1355 F1356 V1357 A1363	V1355-K1359 HydrophobicContact CG1-CD 4.24Å; V1355-K1359 WeakPolarHBondContact O-CB 3.18Å; V1355-K1359 VanDerWaalsContact O-CD 3.26Å; V1355-K1359 WeakPolarHBondContact O-CD 3.4Å; V1355-K1359 WeakPolarHBondContact O-CG 3.46Å; V1355-K1359 PolarHBondContact O-N 3.17Å; F1356-K1359 PolarHBondContact O-N 3.48Å; V1357-K1359 VanDerWaalsContact C-N 3.31Å; V1357-K1359 PolarHBondContact O-N 3.38Å; K1359-A1363 WeakPolarHBondContact O-CB 3.43Å; K1359-A1363 PolarHBondContact O-N 3.11Å
1360	L	39.3	Very low	40.7	Very low	79 Å²	79	95.5 Å²	95.5	41%	0.414	52%	0.519	S	S	.	.	H	α-helix	trans	-67.5	-45.8	175.3	-161.4	78.4	0	0	0	110.9	F1356 V1357 A1363 M1364	F1356-L1360 WeakPolarHBondContact O-CB 3.4Å; F1356-L1360 PolarHBondContact O-N 2.81Å; V1357-L1360 PolarHBondContact O-N 3.27Å; V1357-L1360 VanDerWaalsContact O-N 3.16Å; L1360-A1363 PolarHBondContact O-N 2.75Å; L1360-M1364 WeakPolarHBondContact O-CB 3.2Å; L1360-M1364 WeakPolarHBondContact O-CG 3.37Å; L1360-M1364 PolarHBondContact O-N 3.06Å
1361	Q	45.5	Very low	41.5	Very low	93 Å²	93	95.8 Å²	95.8	44%	0.435	51%	0.511	S	S	.	.	H	α-helix	trans	-62.3	-41.6	175.7	-167.9	71.3	-5.7	0	0	111.1	V1357 M1364 N1365	V1357-Q1361 WeakPolarHBondContact O-CB 3.47Å; V1357-Q1361 PolarHBondContact O-N 3.08Å; Q1361-M1364 PolarHBondContact O-N 3.34Å; Q1361-N1365 VanDerWaalsContact O-CB 3.28Å; Q1361-N1365 WeakPolarHBondContact O-CB 3.2Å; Q1361-N1365 PolarHBondContact O-N 3.04Å; Q1361-N1365 PolarHBondContact O-ND2 3.46Å
1362	T	58.4	Low	42.9	Very low	87 Å²	87	92.7 Å²	92.7	53%	0.534	49%	0.492	S	S	.	.	H	α-helix	trans	-61.4	-49.3	172.9	-60.5	0	0	0	0	110.9	D1358 M1364 N1365 E1366	D1358-T1362 WeakPolarHBondContact O-CB 3.4Å; D1358-T1362 PolarHBondContact O-N 3.38Å; D1358-T1362 PolarHBondContact O-OG1 2.91Å; T1362-M1364 VanDerWaalsContact C-N 3.33Å; T1362-M1364 PolarHBondContact O-N 3.03Å; T1362-N1365 PolarHBondContact O-N 3.37Å; T1362-E1366 VanDerWaalsContact O-CB 3.29Å; T1362-E1366 WeakPolarHBondContact O-CB 3.34Å; T1362-E1366 PolarHBondContact O-N 3.37Å
1363	A	42.1	Very low	44.5	Very low	50 Å²	50	88.6 Å²	88.6	41%	0.413	47%	0.473	S	S	.	.	H	α-helix	trans	-64.8	-34.7	178.6	0	0	0	0	0	112.9	K1359 L1360 L1367	K1359-A1363 WeakPolarHBondContact O-CB 3.43Å; K1359-A1363 PolarHBondContact O-N 3.11Å; L1360-A1363 PolarHBondContact O-N 2.75Å; A1363-L1367 WeakPolarHBondContact O-CB 3.34Å; A1363-L1367 PolarHBondContact O-N 3.23Å
1364	M	39.7	Very low	45.6	Very low	105 Å²	105	89.5 Å²	89.5	52%	0.517	47%	0.471	S	S	.	.	H	α-helix	trans	-70	-41.8	173.7	-75.5	-179.7	61.6	0	0	111.9	L1360 Q1361 T1362 L1367 L1368	L1360-M1364 WeakPolarHBondContact O-CB 3.2Å; L1360-M1364 WeakPolarHBondContact O-CG 3.37Å; L1360-M1364 PolarHBondContact O-N 3.06Å; Q1361-M1364 PolarHBondContact O-N 3.34Å; T1362-M1364 VanDerWaalsContact C-N 3.33Å; T1362-M1364 PolarHBondContact O-N 3.03Å; M1364-L1367 PolarHBondContact O-N 2.95Å; M1364-L1368 VanDerWaalsContact O-CB 3.31Å; M1364-L1368 WeakPolarHBondContact O-CB 3.3Å; M1364-L1368 PolarHBondContact O-N 2.93Å
1365	N	51.8	Low	46.3	Very low	93 Å²	93	88.7 Å²	88.7	50%	0.497	46%	0.463	S	S	.	.	H	α-helix	trans	-65.1	-37.9	173.9	-75	-25.8	0	0	0	112.1	Q1361 T1362 L1368 G1369	Q1361-N1365 VanDerWaalsContact O-CB 3.28Å; Q1361-N1365 WeakPolarHBondContact O-CB 3.2Å; Q1361-N1365 PolarHBondContact O-N 3.04Å; Q1361-N1365 PolarHBondContact O-ND2 3.46Å; T1362-N1365 PolarHBondContact O-N 3.37Å; N1365-L1368 PolarHBondContact O-N 2.99Å; N1365-G1369 PolarHBondContact O-N 3.35Å
1366	E	54.5	Low	47.5	Very low	121 Å²	121	86.2 Å²	86.2	57%	0.565	45%	0.449	S	S	*	.	H	α-helix	trans	-66	-44.3	175.2	-173.1	173.9	-158.9	0	0	111.1	T1362 G1369 Q1370	T1362-E1366 VanDerWaalsContact O-CB 3.29Å; T1362-E1366 WeakPolarHBondContact O-CB 3.34Å; T1362-E1366 PolarHBondContact O-N 3.37Å; E1366-G1369 PolarHBondContact O-N 3.37Å; E1366-Q1370 WeakPolarHBondContact O-CG 3.37Å; E1366-Q1370 PolarHBondContact O-N 3.05Å
1367	L	42.3	Very low	48.6	Very low	108 Å²	108	87 Å²	87	57%	0.565	45%	0.454	S	S	*	.	H	α-helix	trans	-64.8	-38.1	173.8	-170.6	70.6	0	0	0	112.2	A1363 M1364 T1371	A1363-L1367 WeakPolarHBondContact O-CB 3.34Å; A1363-L1367 PolarHBondContact O-N 3.23Å; M1364-L1367 PolarHBondContact O-N 2.95Å; L1367-T1371 WeakPolarHBondContact O-CB 3.32Å; L1367-T1371 PolarHBondContact O-N 2.82Å; L1367-T1371 PolarHBondContact O-OG1 2.94Å
1368	L	48.7	Very low	48.9	Very low	82 Å²	82	90.2 Å²	90.2	43%	0.429	46%	0.461	S	S	.	.	H	α-helix	trans	-67.1	-39.2	174.8	-159	78.9	0	0	0	111.1	M1364 N1365 T1371 R1372	M1364-L1368 VanDerWaalsContact O-CB 3.31Å; M1364-L1368 WeakPolarHBondContact O-CB 3.3Å; M1364-L1368 PolarHBondContact O-N 2.93Å; N1365-L1368 PolarHBondContact O-N 2.99Å; L1368-T1371 PolarHBondContact O-N 3.21Å; L1368-R1372 WeakPolarHBondContact O-CB 3.29Å; L1368-R1372 WeakPolarHBondContact O-CG 3.25Å; L1368-R1372 PolarHBondContact O-N 3.4Å
1369	G	56.2	Low	48.8	Very low	37 Å²	37	90.9 Å²	90.9	38%	0.381	46%	0.457	S	S	.	.	H	α-helix	trans	-63.1	-48.7	173.9	0	0	0	0	0	112.4	N1365 E1366 T1371 R1372 Q1373	N1365-G1369 PolarHBondContact O-N 3.35Å; E1366-G1369 PolarHBondContact O-N 3.37Å; G1369-T1371 VanDerWaalsContact C-N 3.31Å; G1369-T1371 PolarHBondContact O-N 3.34Å; G1369-R1372 PolarHBondContact O-N 3.12Å; G1369-Q1373 WeakPolarHBondContact O-CB 3.31Å; G1369-Q1373 PolarHBondContact O-N 3.42Å
1370	Q	51.3	Low	49.1	Very low	102 Å²	102	91.7 Å²	91.7	48%	0.477	47%	0.468	S	S	.	.	H	α-helix	trans	-58.6	-42.6	172.8	-71.2	174	19	0	0	111.2	E1366 Q1373 I1374	E1366-Q1370 WeakPolarHBondContact O-CG 3.37Å; E1366-Q1370 PolarHBondContact O-N 3.05Å; Q1370-Q1373 PolarHBondContact O-N 3.12Å; Q1370-I1374 WeakPolarHBondContact O-CB 3.21Å; Q1370-I1374 WeakPolarHBondContact O-CD1 3.3Å; Q1370-I1374 VanDerWaalsContact O-CG1 3.24Å; Q1370-I1374 WeakPolarHBondContact O-CG1 3.42Å; Q1370-I1374 PolarHBondContact O-N 3.32Å
1371	T	44.8	Very low	49.6	Very low	58 Å²	58	90.8 Å²	90.8	36%	0.356	46%	0.463	S	S	.	.	H	α-helix	trans	-65	-45.9	178.1	-57	0	0	0	0	111.9	L1367 L1368 G1369 Q1373 I1374 I1375	L1367-T1371 WeakPolarHBondContact O-CB 3.32Å; L1367-T1371 PolarHBondContact O-N 2.82Å; L1367-T1371 PolarHBondContact O-OG1 2.94Å; L1368-T1371 PolarHBondContact O-N 3.21Å; G1369-T1371 VanDerWaalsContact C-N 3.31Å; G1369-T1371 PolarHBondContact O-N 3.34Å; T1371-Q1373 VanDerWaalsContact C-N 3.34Å; T1371-Q1373 PolarHBondContact O-N 3.11Å; T1371-I1374 PolarHBondContact O-N 2.95Å; T1371-I1375 HydrophobicContact CG2-CD1 4.11Å; T1371-I1375 VanDerWaalsContact O-CG1 3.29Å; T1371-I1375 WeakPolarHBondContact O-CG1 3.24Å; T1371-I1375 PolarHBondContact O-N 3.42Å
1372	R	55.5	Low	50.6	Low	98 Å²	98	88.7 Å²	88.7	37%	0.37	46%	0.458	S	S	.	.	H	α-helix	trans	-61.1	-41.9	174.5	-75.1	-178.3	-177.9	-138	3.8	111.5	L1368 G1369 I1375 C1376 L1386	L1368-R1372 WeakPolarHBondContact O-CB 3.29Å; L1368-R1372 WeakPolarHBondContact O-CG 3.25Å; L1368-R1372 PolarHBondContact O-N 3.4Å; G1369-R1372 PolarHBondContact O-N 3.12Å; R1372-I1375 PolarHBondContact O-N 3.19Å; R1372-C1376 PolarHBondContact O-N 3.02Å; R1372-C1376 PolarHBondContact O-SG 2.87Å; R1372-L1386 HydrophobicContact CB-CD2 3.93Å; R1372-L1386 HydrophobicContact CG-CD2 4.11Å; R1372-L1386 WeakPolarHBondContact O-CD2 3.39Å
1373	Q	60.2	Low	50.8	Low	90 Å²	90	91.7 Å²	91.7	42%	0.421	46%	0.464	S	S	.	.	H	α-helix	trans	-66.3	-43	178.3	-177.3	150	-21.2	0	0	112	G1369 Q1370 T1371 I1375 C1376 E1377	G1369-Q1373 WeakPolarHBondContact O-CB 3.31Å; G1369-Q1373 PolarHBondContact O-N 3.42Å; Q1370-Q1373 PolarHBondContact O-N 3.12Å; T1371-Q1373 VanDerWaalsContact C-N 3.34Å; T1371-Q1373 PolarHBondContact O-N 3.11Å; Q1373-I1375 VanDerWaalsContact C-N 3.27Å; Q1373-I1375 PolarHBondContact O-N 3.02Å; Q1373-C1376 PolarHBondContact O-N 3.24Å; Q1373-E1377 HydrophobicContact CG-CG 4.17Å; Q1373-E1377 WeakPolarHBondContact CG-OE1 3.33Å; Q1373-E1377 PolarHBondContact NE2-OE1 3.38Å; Q1373-E1377 WeakPolarHBondContact O-CB 3.39Å; Q1373-E1377 WeakPolarHBondContact O-CG 3.39Å; Q1373-E1377 PolarHBondContact O-N 3.49Å
1374	I	50.5	Low	51.9	Low	98 Å²	98	96.4 Å²	96.4	50%	0.503	48%	0.478	S	S	.	.	H	α-helix	trans	-59.7	-36.7	172.2	-70.3	163.7	0	0	0	111.3	Q1370 T1371 K1378	Q1370-I1374 WeakPolarHBondContact O-CB 3.21Å; Q1370-I1374 WeakPolarHBondContact O-CD1 3.3Å; Q1370-I1374 VanDerWaalsContact O-CG1 3.24Å; Q1370-I1374 WeakPolarHBondContact O-CG1 3.42Å; Q1370-I1374 PolarHBondContact O-N 3.32Å; T1371-I1374 PolarHBondContact O-N 2.95Å; I1374-K1378 WeakPolarHBondContact O-CB 3.44Å; I1374-K1378 PolarHBondContact O-N 3.08Å
1375	I	44.3	Very low	52.5	Low	56 Å²	56	96.8 Å²	96.8	29%	0.287	48%	0.478	S	S	.	.	H	α-helix	trans	-67	-48.4	175.8	-69.4	163.9	0	0	0	110.9	T1371 R1372 Q1373 K1378 Y1379 L1386	T1371-I1375 HydrophobicContact CG2-CD1 4.11Å; T1371-I1375 VanDerWaalsContact O-CG1 3.29Å; T1371-I1375 WeakPolarHBondContact O-CG1 3.24Å; T1371-I1375 PolarHBondContact O-N 3.42Å; R1372-I1375 PolarHBondContact O-N 3.19Å; Q1373-I1375 VanDerWaalsContact C-N 3.27Å; Q1373-I1375 PolarHBondContact O-N 3.02Å; I1375-K1378 PolarHBondContact O-N 3.49Å; I1375-Y1379 HydrophobicContact CG2-CD2 4.2Å; I1375-Y1379 WeakPolarHBondContact O-CD2 3.47Å; I1375-Y1379 PolarHBondContact O-N 3.04Å; I1375-Y1379 VanDerWaalsContact O-N 3.09Å; I1375-L1386 HydrophobicContact CB-CD2 4.09Å; I1375-L1386 HydrophobicContact CG2-CD1 3.78Å; I1375-L1386 HydrophobicContact CG2-CD2 3.88Å; I1375-L1386 HydrophobicContact CG2-CG 4.47Å
1376	C	57.7	Low	52.6	Low	17 Å²	17	93.2 Å²	93.2	12%	0.115	46%	0.459	C	S	.	.	H	α-helix	trans	-58.5	-50	175.7	-71.3	0	0	0	0	112.2	R1372 Q1373 K1378 N1380 I1381	R1372-C1376 PolarHBondContact O-N 3.02Å; R1372-C1376 PolarHBondContact O-SG 2.87Å; Q1373-C1376 PolarHBondContact O-N 3.24Å; C1376-K1378 PolarHBondContact O-N 2.87Å; C1376-N1380 VanDerWaalsContact O-CA 3.24Å; C1376-N1380 WeakPolarHBondContact O-CA 3.35Å; C1376-N1380 PolarHBondContact O-N 3.33Å; C1376-I1381 VanDerWaalsContact CA-O 3.28Å; C1376-I1381 WeakPolarHBondContact CA-O 3.4Å; C1376-I1381 VanDerWaalsContact CB-O 3.25Å; C1376-I1381 WeakPolarHBondContact CB-O 3.39Å; C1376-I1381 PolarHBondContact O-N 3Å; C1376-I1381 PolarHBondContact SG-O 3.5Å
1377	E	56.2	Low	52.6	Low	131 Å²	131	88.7 Å²	88.7	61%	0.612	44%	0.442	S	S	*	.	H	α-helix	trans	-67.9	-33.9	-177.6	-71.1	172.4	179.2	0	0	113.1	Q1373	Q1373-E1377 HydrophobicContact CG-CG 4.17Å; Q1373-E1377 WeakPolarHBondContact CG-OE1 3.33Å; Q1373-E1377 PolarHBondContact NE2-OE1 3.38Å; Q1373-E1377 WeakPolarHBondContact O-CB 3.39Å; Q1373-E1377 WeakPolarHBondContact O-CG 3.39Å; Q1373-E1377 PolarHBondContact O-N 3.49Å
1378	K	43.8	Very low	53.1	Low	151 Å²	151	88.2 Å²	88.2	66%	0.657	44%	0.44	S	S	*	.	H	α-helix	trans	-85.4	-28	-175.7	-173.1	173.9	179.4	178.4	0	114.1	I1374 I1375 C1376	I1374-K1378 WeakPolarHBondContact O-CB 3.44Å; I1374-K1378 PolarHBondContact O-N 3.08Å; I1375-K1378 PolarHBondContact O-N 3.49Å; C1376-K1378 PolarHBondContact O-N 2.87Å
1379	Y	39.2	Very low	52.9	Low	113 Å²	113	88 Å²	88	44%	0.443	45%	0.45	S	S	.	.	H	α-helix	trans	-112	-0.1	-179.2	-62.8	-66.8	0	0	0	113.7	I1375 I1381 Y1412	I1375-Y1379 HydrophobicContact CG2-CD2 4.2Å; I1375-Y1379 WeakPolarHBondContact O-CD2 3.47Å; I1375-Y1379 PolarHBondContact O-N 3.04Å; I1375-Y1379 VanDerWaalsContact O-N 3.09Å; Y1379-I1381 HydrophobicContact CG-CD1 4.43Å; Y1379-I1381 PolarHBondContact O-N 2.87Å; Y1379-Y1412 PolarHBondContact OH-OH 3.19Å
1380	N	48.7	Very low	52.1	Low	157 Å²	157	90.2 Å²	90.2	84%	0.84	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	29.9	-178	-151.2	52.3	0	0	0	113.5	C1376	C1376-N1380 VanDerWaalsContact O-CA 3.24Å; C1376-N1380 WeakPolarHBondContact O-CA 3.35Å; C1376-N1380 PolarHBondContact O-N 3.33Å
1381	I	50.8	Low	51.5	Low	59 Å²	59	91.1 Å²	91.1	30%	0.303	46%	0.46	S	S	.	.			trans	-92	131.4	-179.6	-58.6	172.2	0	0	0	108.4	C1376 Y1379 E1385 L1386	C1376-I1381 VanDerWaalsContact CA-O 3.28Å; C1376-I1381 WeakPolarHBondContact CA-O 3.4Å; C1376-I1381 VanDerWaalsContact CB-O 3.25Å; C1376-I1381 WeakPolarHBondContact CB-O 3.39Å; C1376-I1381 PolarHBondContact O-N 3Å; C1376-I1381 PolarHBondContact SG-O 3.5Å; Y1379-I1381 HydrophobicContact CG-CD1 4.43Å; Y1379-I1381 PolarHBondContact O-N 2.87Å; I1381-E1385 HydrophobicContact CG2-CB 3.53Å; I1381-L1386 HydrophobicContact CG2-CB 4.28Å
1382	S	66	Low	50.9	Low	49 Å²	49	96.7 Å²	96.7	34%	0.343	48%	0.482	S	S	.	.			trans	-64.4	159.4	177.7	68.7	0	0	0	0	112.4	E1384 E1385 L1386	S1382-E1384 PolarHBondContact O-N 3.11Å; S1382-E1385 WeakPolarHBondContact CB-OE2 3.08Å; S1382-E1385 PolarHBondContact N-OE2 2.98Å; S1382-E1385 PolarHBondContact O-N 3.45Å; S1382-E1385 WeakPolarHBondContact OG-CB 2.99Å; S1382-E1385 VanDerWaalsContact OG-CD 3.31Å; S1382-E1385 VanDerWaalsContact OG-CG 3.26Å; S1382-E1385 WeakPolarHBondContact OG-CG 3.2Å; S1382-E1385 PolarHBondContact OG-N 3.44Å; S1382-E1385 PolarHBondContact OG-OE2 3.22Å; S1382-L1386 WeakPolarHBondContact O-CB 3.44Å; S1382-L1386 PolarHBondContact O-N 3.07Å
1383	K	62.5	Low	49.8	Very low	150 Å²	150	95.6 Å²	95.6	65%	0.652	49%	0.489	S	S	*	.	H	α-helix	trans	-62.9	-23.6	174.2	-76.4	-176.6	175.6	177.6	0	112.6	A1387	K1383-A1387 VanDerWaalsContact O-CB 3.24Å; K1383-A1387 WeakPolarHBondContact O-CB 3.23Å; K1383-A1387 PolarHBondContact O-N 3.42Å
1384	E	64.3	Low	48.3	Very low	150 Å²	150	98.9 Å²	98.9	70%	0.701	51%	0.51	S	S	*	.	H	α-helix	trans	-83.2	-43	179.1	-66	178	142.1	0	0	111.3	S1382 L1386 A1387 N1388	S1382-E1384 PolarHBondContact O-N 3.11Å; E1384-L1386 VanDerWaalsContact C-N 3.34Å; E1384-L1386 PolarHBondContact O-N 3.14Å; E1384-A1387 PolarHBondContact O-N 2.87Å; E1384-N1388 WeakPolarHBondContact O-CB 3.36Å; E1384-N1388 PolarHBondContact O-N 2.89Å; E1384-N1388 PolarHBondContact O-ND2 2.92Å; E1384-N1388 PolarHBondContact O-OD1 2.82Å
1385	E	53.6	Low	47.6	Very low	112 Å²	112	100.3 Å²	100.3	52%	0.523	52%	0.518	S	S	.	.	H	α-helix	trans	-60.8	-42.3	170.2	-71.6	160	124	0	0	111.7	I1381 S1382 A1387 N1388 A1389	I1381-E1385 HydrophobicContact CG2-CB 3.53Å; S1382-E1385 WeakPolarHBondContact CB-OE2 3.08Å; S1382-E1385 PolarHBondContact N-OE2 2.98Å; S1382-E1385 PolarHBondContact O-N 3.45Å; S1382-E1385 WeakPolarHBondContact OG-CB 2.99Å; S1382-E1385 VanDerWaalsContact OG-CD 3.31Å; S1382-E1385 VanDerWaalsContact OG-CG 3.26Å; S1382-E1385 WeakPolarHBondContact OG-CG 3.2Å; S1382-E1385 PolarHBondContact OG-N 3.44Å; S1382-E1385 PolarHBondContact OG-OE2 3.22Å; E1385-A1387 VanDerWaalsContact C-N 3.33Å; E1385-A1387 PolarHBondContact O-N 3.27Å; E1385-N1388 PolarHBondContact O-N 3.13Å; E1385-A1389 VanDerWaalsContact O-CB 3.3Å; E1385-A1389 WeakPolarHBondContact O-CB 3.35Å; E1385-A1389 PolarHBondContact O-N 3.32Å
1386	L	54.3	Low	46.9	Very low	19 Å²	19	103 Å²	103	10%	0.099	54%	0.537	C	S	.	.	H	α-helix	trans	-67.4	-32.3	174.9	-177	59.7	0	0	0	112.4	R1372 I1375 I1381 S1382 E1384 M1390	R1372-L1386 HydrophobicContact CB-CD2 3.93Å; R1372-L1386 HydrophobicContact CG-CD2 4.11Å; R1372-L1386 WeakPolarHBondContact O-CD2 3.39Å; I1375-L1386 HydrophobicContact CB-CD2 4.09Å; I1375-L1386 HydrophobicContact CG2-CD1 3.78Å; I1375-L1386 HydrophobicContact CG2-CD2 3.88Å; I1375-L1386 HydrophobicContact CG2-CG 4.47Å; I1381-L1386 HydrophobicContact CG2-CB 4.28Å; S1382-L1386 WeakPolarHBondContact O-CB 3.44Å; S1382-L1386 PolarHBondContact O-N 3.07Å; E1384-L1386 VanDerWaalsContact C-N 3.34Å; E1384-L1386 PolarHBondContact O-N 3.14Å; L1386-M1390 HydrophobicContact CD1-CG 4.49Å; L1386-M1390 HydrophobicContact CD1-SD 4.38Å; L1386-M1390 HydrophobicContact CG-SD 4.47Å; L1386-M1390 WeakPolarHBondContact O-CB 3.21Å; L1386-M1390 WeakPolarHBondContact O-CG 3.21Å; L1386-M1390 PolarHBondContact O-N 2.77Å
1387	A	54.1	Low	45.6	Very low	26 Å²	26	109.8 Å²	109.8	22%	0.215	57%	0.572	C	S	.	*	H	α-helix	trans	-70.5	-43.9	173.3	0	0	0	0	0	111.4	K1383 E1384 E1385 M1390 N1391	K1383-A1387 VanDerWaalsContact O-CB 3.24Å; K1383-A1387 WeakPolarHBondContact O-CB 3.23Å; K1383-A1387 PolarHBondContact O-N 3.42Å; E1384-A1387 PolarHBondContact O-N 2.87Å; E1385-A1387 VanDerWaalsContact C-N 3.33Å; E1385-A1387 PolarHBondContact O-N 3.27Å; A1387-M1390 CarbonylContact O-C 3.59Å; A1387-M1390 WeakPolarHBondContact O-CA 3.41Å; A1387-M1390 PolarHBondContact O-N 3.18Å; A1387-N1391 WeakPolarHBondContact O-CB 3.49Å; A1387-N1391 PolarHBondContact O-N 3.4Å; A1387-N1391 PolarHBondContact O-ND2 2.96Å; A1387-N1391 PolarHBondContact O-OD1 2.76Å
1388	N	53.5	Low	44.6	Very low	97 Å²	97	108 Å²	108	52%	0.519	57%	0.567	S	S	.	*	H	α-helix	trans	-63.7	-46.7	179.1	-65.8	-19.3	0	0	0	111	E1384 E1385 M1390 N1391 E1392	E1384-N1388 WeakPolarHBondContact O-CB 3.36Å; E1384-N1388 PolarHBondContact O-N 2.89Å; E1384-N1388 PolarHBondContact O-ND2 2.92Å; E1384-N1388 PolarHBondContact O-OD1 2.82Å; E1385-N1388 PolarHBondContact O-N 3.13Å; N1388-M1390 PolarHBondContact O-N 3.16Å; N1388-M1390 VanDerWaalsContact O-N 3.07Å; N1388-N1391 PolarHBondContact O-N 3.27Å; N1388-E1392 PolarHBondContact O-N 2.76Å
1389	A	43.5	Very low	44	Very low	77 Å²	77	105.4 Å²	105.4	64%	0.636	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-7.7	173.5	0	0	0	0	0	114.4	E1385	E1385-A1389 VanDerWaalsContact O-CB 3.3Å; E1385-A1389 WeakPolarHBondContact O-CB 3.35Å; E1385-A1389 PolarHBondContact O-N 3.32Å
1390	M	39.3	Very low	43.7	Very low	85 Å²	85	107 Å²	107	42%	0.419	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.4	-2.5	170.5	-71.4	-172.7	75.1	0	0	113.4	L1386 A1387 N1388	L1386-M1390 HydrophobicContact CD1-CG 4.49Å; L1386-M1390 HydrophobicContact CD1-SD 4.38Å; L1386-M1390 HydrophobicContact CG-SD 4.47Å; L1386-M1390 WeakPolarHBondContact O-CB 3.21Å; L1386-M1390 WeakPolarHBondContact O-CG 3.21Å; L1386-M1390 PolarHBondContact O-N 2.77Å; A1387-M1390 CarbonylContact O-C 3.59Å; A1387-M1390 WeakPolarHBondContact O-CA 3.41Å; A1387-M1390 PolarHBondContact O-N 3.18Å; N1388-M1390 PolarHBondContact O-N 3.16Å; N1388-M1390 VanDerWaalsContact O-N 3.07Å
1391	N	39.6	Very low	43.1	Very low	121 Å²	121	103.2 Å²	103.2	65%	0.647	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	-9	-179.7	-71.6	-19.4	0	0	0	112.8	A1387 N1388 S1393	A1387-N1391 WeakPolarHBondContact O-CB 3.49Å; A1387-N1391 PolarHBondContact O-N 3.4Å; A1387-N1391 PolarHBondContact O-ND2 2.96Å; A1387-N1391 PolarHBondContact O-OD1 2.76Å; N1388-N1391 PolarHBondContact O-N 3.27Å; N1391-S1393 PolarHBondContact O-N 3.28Å
1392	E	32.1	Very low	42.2	Very low	174 Å²	174	104.4 Å²	104.4	81%	0.813	57%	0.566	S	S	*	*	S	Bend	trans	-85.7	30	177.5	-67.9	-175.2	149.5	0	0	113.6	N1388	N1388-E1392 PolarHBondContact O-N 2.76Å
1393	S	31.5	Very low	40.7	Very low	75 Å²	75	103.7 Å²	103.7	52%	0.524	57%	0.567	S	S	.	*			trans	-134.7	98.6	177.3	64.9	0	0	0	0	112.4	N1391 D1395	N1391-S1393 PolarHBondContact O-N 3.28Å; S1393-D1395 PolarHBondContact O-N 3.4Å
1394	D	29	Very low	39.6	Very low	159 Å²	159	101.1 Å²	101.1	85%	0.85	56%	0.555	S	S	*	*			trans	-71.7	99	170.2	-67.9	-60	0	0	0	110.9
1395	D	36.4	Very low	38.4	Very low	128 Å²	128	98.2 Å²	98.2	68%	0.684	54%	0.544	S	S	*	.			trans	-179.2	78.1	153.5	-100.5	-27.5	0	0	0	109.5	S1393 D1397 I1399	S1393-D1395 PolarHBondContact O-N 3.4Å; D1395-D1397 PolarHBondContact O-N 2.8Å; D1395-I1399 WeakPolarHBondContact O-CG1 3.29Å
1396	V	28.7	Very low	37.8	Very low	114 Å²	114	96.7 Å²	96.7	69%	0.691	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-75.1	-30.7	-158	-179.2	0	0	0	0	114.7
1397	D	31.1	Very low	37.2	Very low	158 Å²	158	100.5 Å²	100.5	85%	0.845	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-81.9	-18.5	-175.8	-72.2	-57.7	0	0	0	114.2	D1395 I1399	D1395-D1397 PolarHBondContact O-N 2.8Å; D1397-I1399 VanDerWaalsContact C-N 3.29Å; D1397-I1399 PolarHBondContact O-N 3.35Å
1398	D	34.2	Very low	36.5	Very low	93 Å²	93	106.2 Å²	106.2	50%	0.497	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-90	5.6	-174	-158	8.9	0	0	0	113.3	K1404	D1398-K1404 IonicContact OD1-NZ 3.86Å; D1398-K1404 PolarHBondContact OD1-NZ 3.27Å; D1398-K1404 IonicContact OD2-NZ 3.99Å; D1398-K1404 PolarHBondContact OD2-NZ 3.49Å
1399	I	31.8	Very low	35.9	Very low	97 Å²	97	106.6 Å²	106.6	50%	0.497	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-85.8	-21.4	-172.3	-64	177.1	0	0	0	112.8	D1395 D1397 N1401	D1395-I1399 WeakPolarHBondContact O-CG1 3.29Å; D1397-I1399 VanDerWaalsContact C-N 3.29Å; D1397-I1399 PolarHBondContact O-N 3.35Å; I1399-N1401 PolarHBondContact O-N 3.46Å; I1399-N1401 VanDerWaalsContact O-N 3.16Å
1400	L	31.9	Very low	35.8	Very low	148 Å²	148	107.8 Å²	107.8	78%	0.775	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-78.2	7.6	-174.7	-75.9	171.4	0	0	0	115.3	P1402	L1400-P1402 WeakPolarHBondContact O-CD 3.37Å
1401	N	36.2	Very low	35.9	Very low	77 Å²	77	110.6 Å²	110.6	41%	0.412	58%	0.582	S	S	.	*			trans	-86.7	107.7	-177.5	-168	-37.7	0	0	0	112.2	I1399 G1403 K1404 I1405	I1399-N1401 PolarHBondContact O-N 3.46Å; I1399-N1401 VanDerWaalsContact O-N 3.16Å; N1401-G1403 PolarHBondContact O-N 3.41Å; N1401-G1403 VanDerWaalsContact O-N 3.16Å; N1401-G1403 WeakPolarHBondContact OD1-CA 3.49Å; N1401-G1403 PolarHBondContact OD1-N 2.91Å; N1401-K1404 HydrophobicContact CB-CB 4.29Å; N1401-K1404 HydrophobicContact CB-CD 4.15Å; N1401-K1404 HydrophobicContact CB-CG 4.11Å; N1401-K1404 PolarHBondContact O-N 3.01Å; N1401-K1404 PolarHBondContact OD1-N 3.34Å; N1401-I1405 PolarHBondContact O-N 2.97Å
1402	P	32.5	Very low	35.9	Very low	83 Å²	83	110 Å²	110	54%	0.539	57%	0.572	S	S	.	*	H	α-helix	trans	-64.1	-23.2	-180	27.4	-35.5	0	0	0	112.7	L1400 I1405 L1406	L1400-P1402 WeakPolarHBondContact O-CD 3.37Å; P1402-I1405 PolarHBondContact O-N 3.11Å; P1402-L1406 WeakPolarHBondContact O-CB 3.49Å; P1402-L1406 PolarHBondContact O-N 3.39Å
1403	G	34.2	Very low	36.2	Very low	35 Å²	35	109.3 Å²	109.3	36%	0.361	57%	0.566	S	S	.	*	H	α-helix	trans	-64.6	-36.5	171.9	0	0	0	0	0	112.8	N1401 L1407	N1401-G1403 PolarHBondContact O-N 3.41Å; N1401-G1403 VanDerWaalsContact O-N 3.16Å; N1401-G1403 WeakPolarHBondContact OD1-CA 3.49Å; N1401-G1403 PolarHBondContact OD1-N 2.91Å; G1403-L1407 WeakPolarHBondContact O-CB 3.24Å; G1403-L1407 PolarHBondContact O-N 3.08Å
1404	K	40.7	Very low	36.6	Very low	95 Å²	95	107.8 Å²	107.8	41%	0.413	56%	0.558	S	S	.	*	H	α-helix	trans	-71.3	-39.9	175	-72.5	-177.7	176	173.1	0	112.1	D1398 N1401 L1407 F1408	D1398-K1404 IonicContact OD1-NZ 3.86Å; D1398-K1404 PolarHBondContact OD1-NZ 3.27Å; D1398-K1404 IonicContact OD2-NZ 3.99Å; D1398-K1404 PolarHBondContact OD2-NZ 3.49Å; N1401-K1404 HydrophobicContact CB-CB 4.29Å; N1401-K1404 HydrophobicContact CB-CD 4.15Å; N1401-K1404 HydrophobicContact CB-CG 4.11Å; N1401-K1404 PolarHBondContact O-N 3.01Å; N1401-K1404 PolarHBondContact OD1-N 3.34Å; K1404-L1407 CarbonylContact O-C 3.59Å; K1404-L1407 WeakPolarHBondContact O-CB 3.22Å; K1404-L1407 PolarHBondContact O-N 3.26Å; K1404-F1408 PolarHBondContact O-N 2.58Å
1405	I	39	Very low	37	Very low	90 Å²	90	108.4 Å²	108.4	46%	0.462	55%	0.553	S	S	.	*	H	α-helix	trans	-62.7	-43.6	174.2	-64.8	169.4	0	0	0	110.4	N1401 P1402 F1408 Q1409	N1401-I1405 PolarHBondContact O-N 2.97Å; P1402-I1405 PolarHBondContact O-N 3.11Å; I1405-F1408 PolarHBondContact O-N 2.97Å; I1405-Q1409 PolarHBondContact O-N 3.14Å
1406	L	39.7	Very low	37	Very low	79 Å²	79	104.3 Å²	104.3	41%	0.414	53%	0.534	S	S	.	.	H	α-helix	trans	-63.6	-41.6	174.3	-161.4	75.3	0	0	0	111.3	P1402 F1408 Q1409 I1410	P1402-L1406 WeakPolarHBondContact O-CB 3.49Å; P1402-L1406 PolarHBondContact O-N 3.39Å; L1406-F1408 VanDerWaalsContact C-N 3.33Å; L1406-F1408 PolarHBondContact O-N 3.45Å; L1406-Q1409 PolarHBondContact O-N 3.25Å; L1406-I1410 HydrophobicContact CD2-CD1 4.43Å; L1406-I1410 HydrophobicContact CG-CD1 4.05Å; L1406-I1410 WeakPolarHBondContact O-CB 3.46Å; L1406-I1410 WeakPolarHBondContact O-CD1 3.39Å; L1406-I1410 WeakPolarHBondContact O-CG1 3.49Å; L1406-I1410 PolarHBondContact O-N 2.85Å
1407	L	41.8	Very low	37.4	Very low	99 Å²	99	104.9 Å²	104.9	52%	0.518	53%	0.525	S	S	.	.	H	α-helix	trans	-60.9	-39.2	173.4	-121.6	81.6	0	0	0	112.4	G1403 K1404 I1410 K1411	G1403-L1407 WeakPolarHBondContact O-CB 3.24Å; G1403-L1407 PolarHBondContact O-N 3.08Å; K1404-L1407 CarbonylContact O-C 3.59Å; K1404-L1407 WeakPolarHBondContact O-CB 3.22Å; K1404-L1407 PolarHBondContact O-N 3.26Å; L1407-I1410 PolarHBondContact O-N 3.23Å; L1407-K1411 VanDerWaalsContact O-CB 3.3Å; L1407-K1411 WeakPolarHBondContact O-CB 3.21Å; L1407-K1411 WeakPolarHBondContact O-CG 3.15Å; L1407-K1411 PolarHBondContact O-N 3.03Å
1408	F	40.7	Very low	37.7	Very low	146 Å²	146	98.6 Å²	98.6	64%	0.64	49%	0.491	S	S	*	.	H	α-helix	trans	-66.8	-45.7	177.3	-175	-90.9	0	0	0	111	K1404 I1405 L1406 I1410 K1411 Y1412	K1404-F1408 PolarHBondContact O-N 2.58Å; I1405-F1408 PolarHBondContact O-N 2.97Å; L1406-F1408 VanDerWaalsContact C-N 3.33Å; L1406-F1408 PolarHBondContact O-N 3.45Å; F1408-I1410 VanDerWaalsContact C-N 3.34Å; F1408-I1410 PolarHBondContact O-N 2.87Å; F1408-K1411 PolarHBondContact O-N 3.39Å; F1408-Y1412 VanDerWaalsContact O-CB 3.25Å; F1408-Y1412 WeakPolarHBondContact O-CB 3.25Å; F1408-Y1412 PolarHBondContact O-N 3.07Å
1409	Q	39.7	Very low	37.7	Very low	106 Å²	106	99.9 Å²	99.9	50%	0.495	50%	0.498	S	S	.	.	H	α-helix	trans	-60.7	-41.5	174	-71.5	-176.7	-7.5	0	0	112	I1405 L1406 Y1412 F1413	I1405-Q1409 PolarHBondContact O-N 3.14Å; L1406-Q1409 PolarHBondContact O-N 3.25Å; Q1409-Y1412 PolarHBondContact O-N 2.93Å; Q1409-F1413 WeakPolarHBondContact O-CB 3.48Å; Q1409-F1413 PolarHBondContact O-N 3.43Å
1410	I	41.5	Very low	37.8	Very low	101 Å²	101	99.1 Å²	99.1	52%	0.518	49%	0.494	S	S	.	.	H	α-helix	trans	-65.7	-46.4	175.9	-70.4	164.7	0	0	0	111.3	L1406 L1407 F1408 Y1412 F1413 A1414	L1406-I1410 HydrophobicContact CD2-CD1 4.43Å; L1406-I1410 HydrophobicContact CG-CD1 4.05Å; L1406-I1410 WeakPolarHBondContact O-CB 3.46Å; L1406-I1410 WeakPolarHBondContact O-CD1 3.39Å; L1406-I1410 WeakPolarHBondContact O-CG1 3.49Å; L1406-I1410 PolarHBondContact O-N 2.85Å; L1407-I1410 PolarHBondContact O-N 3.23Å; F1408-I1410 VanDerWaalsContact C-N 3.34Å; F1408-I1410 PolarHBondContact O-N 2.87Å; I1410-Y1412 VanDerWaalsContact C-N 3.34Å; I1410-Y1412 PolarHBondContact O-N 2.82Å; I1410-F1413 PolarHBondContact O-N 2.89Å; I1410-A1414 WeakPolarHBondContact O-CB 3.37Å; I1410-A1414 PolarHBondContact O-N 3Å
1411	K	41.1	Very low	37.8	Very low	144 Å²	144	94.4 Å²	94.4	63%	0.626	47%	0.471	S	S	*	.	H	α-helix	trans	-63.2	-39	176.3	-79.1	-177.6	174.8	-173.8	0	111.8	L1407 F1408 A1414 K1415	L1407-K1411 VanDerWaalsContact O-CB 3.3Å; L1407-K1411 WeakPolarHBondContact O-CB 3.21Å; L1407-K1411 WeakPolarHBondContact O-CG 3.15Å; L1407-K1411 PolarHBondContact O-N 3.03Å; F1408-K1411 PolarHBondContact O-N 3.39Å; K1411-A1414 PolarHBondContact O-N 3.44Å; K1411-K1415 WeakPolarHBondContact O-CB 3.3Å; K1411-K1415 PolarHBondContact O-N 3.26Å
1412	Y	40.7	Very low	37.6	Very low	109 Å²	109	98.3 Å²	98.3	43%	0.427	48%	0.48	S	S	.	.	H	α-helix	trans	-67.1	-45.3	175.7	-170.6	-91.2	0	0	0	111.3	Y1379 F1408 Q1409 I1410 A1414 K1415 C1416	Y1379-Y1412 PolarHBondContact OH-OH 3.19Å; F1408-Y1412 VanDerWaalsContact O-CB 3.25Å; F1408-Y1412 WeakPolarHBondContact O-CB 3.25Å; F1408-Y1412 PolarHBondContact O-N 3.07Å; Q1409-Y1412 PolarHBondContact O-N 2.93Å; I1410-Y1412 VanDerWaalsContact C-N 3.34Å; I1410-Y1412 PolarHBondContact O-N 2.82Å; Y1412-A1414 VanDerWaalsContact C-N 3.33Å; Y1412-A1414 PolarHBondContact O-N 3.3Å; Y1412-K1415 PolarHBondContact O-N 3.14Å; Y1412-C1416 WeakPolarHBondContact O-CB 3.29Å; Y1412-C1416 PolarHBondContact O-N 3.07Å; Y1412-C1416 PolarHBondContact O-SG 3.16Å; Y1412-C1416 VanDerWaalsContact O-SG 3.39Å
1413	F	38.5	Very low	37.4	Very low	160 Å²	160	99.3 Å²	99.3	70%	0.702	49%	0.485	S	S	*	.	H	α-helix	trans	-60.4	-40.7	173.1	-110.7	-87.6	0	0	0	112.4	Q1409 I1410 Y1417	Q1409-F1413 WeakPolarHBondContact O-CB 3.48Å; Q1409-F1413 PolarHBondContact O-N 3.43Å; I1410-F1413 PolarHBondContact O-N 2.89Å; F1413-Y1417 WeakPolarHBondContact O-CB 3.34Å; F1413-Y1417 PolarHBondContact O-N 3.3Å
1414	A	39.7	Very low	37.2	Very low	43 Å²	43	102.5 Å²	102.5	36%	0.355	49%	0.493	S	S	.	.	H	α-helix	trans	-64.5	-44.6	174.4	0	0	0	0	0	111.7	I1410 K1411 Y1412 C1416 Y1417 N1418	I1410-A1414 WeakPolarHBondContact O-CB 3.37Å; I1410-A1414 PolarHBondContact O-N 3Å; K1411-A1414 PolarHBondContact O-N 3.44Å; Y1412-A1414 VanDerWaalsContact C-N 3.33Å; Y1412-A1414 PolarHBondContact O-N 3.3Å; A1414-C1416 PolarHBondContact O-N 3.42Å; A1414-Y1417 PolarHBondContact O-N 2.86Å; A1414-Y1417 VanDerWaalsContact O-N 3.16Å; A1414-N1418 PolarHBondContact O-N 3.07Å; A1414-N1418 PolarHBondContact O-OD1 3.21Å
1415	K	37.9	Very low	36.6	Very low	171 Å²	171	101.6 Å²	101.6	74%	0.743	50%	0.503	S	S	*	.	H	α-helix	trans	-63.9	-40.3	177.9	-155.4	170.6	-172.1	179.1	0	111.6	K1411 Y1412 L1419	K1411-K1415 WeakPolarHBondContact O-CB 3.3Å; K1411-K1415 PolarHBondContact O-N 3.26Å; Y1412-K1415 PolarHBondContact O-N 3.14Å; K1415-L1419 WeakPolarHBondContact O-CB 3.13Å; K1415-L1419 PolarHBondContact O-N 2.91Å
1416	C	35.4	Very low	36.1	Very low	43 Å²	43	103 Å²	103	29%	0.291	52%	0.518	S	S	.	.	H	α-helix	trans	-67.8	-37.6	171.4	-69	0	0	0	0	112.9	Y1412 A1414 L1419 I1420	Y1412-C1416 WeakPolarHBondContact O-CB 3.29Å; Y1412-C1416 PolarHBondContact O-N 3.07Å; Y1412-C1416 PolarHBondContact O-SG 3.16Å; Y1412-C1416 VanDerWaalsContact O-SG 3.39Å; A1414-C1416 PolarHBondContact O-N 3.42Å; C1416-L1419 PolarHBondContact O-N 3.16Å; C1416-I1420 WeakPolarHBondContact O-CB 3.24Å; C1416-I1420 WeakPolarHBondContact O-CD1 3.24Å; C1416-I1420 WeakPolarHBondContact O-CG1 3.48Å; C1416-I1420 PolarHBondContact O-N 3.49Å
1417	Y	36.7	Very low	35.6	Very low	126 Å²	126	107.7 Å²	107.7	49%	0.494	54%	0.538	S	S	.	.	H	α-helix	trans	-63.5	-49.1	176.8	176.5	-95.4	0	0	0	110.9	F1413 A1414 L1419 I1420 T1421	F1413-Y1417 WeakPolarHBondContact O-CB 3.34Å; F1413-Y1417 PolarHBondContact O-N 3.3Å; A1414-Y1417 PolarHBondContact O-N 2.86Å; A1414-Y1417 VanDerWaalsContact O-N 3.16Å; Y1417-L1419 VanDerWaalsContact C-N 3.33Å; Y1417-L1419 PolarHBondContact O-N 3.5Å; Y1417-I1420 CarbonylContact O-C 3.35Å; Y1417-I1420 PolarHBondContact O-N 2.72Å; Y1417-I1420 VanDerWaalsContact O-N 3.08Å; Y1417-T1421 HydrophobicContact CE1-CG2 4.2Å; Y1417-T1421 HydrophobicContact CE2-CG2 4.47Å; Y1417-T1421 PolarHBondContact O-N 3.3Å; Y1417-T1421 PolarHBondContact O-OG1 3.16Å; Y1417-T1421 VanDerWaalsContact O-OG1 3.05Å
1418	N	37.4	Very low	34.9	Very low	25 Å²	25	107 Å²	107	13%	0.134	54%	0.54	C	S	.	.	H	α-helix	trans	-62.1	-39.4	176	-67.6	33.4	0	0	0	111.6	D266 A1414 I1420 T1421 R1422	D266-N1418 PolarHBondContact OD1-ND2 2.81Å; D266-N1418 WeakPolarHBondContact OD2-CB 3.46Å; D266-N1418 PolarHBondContact OD2-ND2 2.99Å; A1414-N1418 PolarHBondContact O-N 3.07Å; A1414-N1418 PolarHBondContact O-OD1 3.21Å; N1418-I1420 VanDerWaalsContact C-N 3.3Å; N1418-I1420 PolarHBondContact O-N 2.98Å; N1418-T1421 VanDerWaalsContact CA-OG1 3.3Å; N1418-T1421 WeakPolarHBondContact CA-OG1 3.42Å; N1418-T1421 PolarHBondContact O-N 3.46Å; N1418-T1421 PolarHBondContact O-OG1 2.89Å; N1418-R1422 WeakPolarHBondContact O-CB 3.41Å; N1418-R1422 VanDerWaalsContact O-CG 3.27Å; N1418-R1422 WeakPolarHBondContact O-CG 3.28Å; N1418-R1422 PolarHBondContact O-N 3.37Å
1419	L	34.9	Very low	34.4	Very low	121 Å²	121	102.9 Å²	102.9	63%	0.634	53%	0.529	S	S	*	.	H	α-helix	trans	-63.5	-35.2	173.8	-163.7	71.9	0	0	0	112.4	K1415 C1416 Y1417 T1423	K1415-L1419 WeakPolarHBondContact O-CB 3.13Å; K1415-L1419 PolarHBondContact O-N 2.91Å; C1416-L1419 PolarHBondContact O-N 3.16Å; Y1417-L1419 VanDerWaalsContact C-N 3.33Å; Y1417-L1419 PolarHBondContact O-N 3.5Å; L1419-T1423 WeakPolarHBondContact O-CG2 3.37Å; L1419-T1423 PolarHBondContact O-N 3.33Å; L1419-T1423 PolarHBondContact O-OG1 2.84Å
1420	I	34.1	Very low	34.2	Very low	81 Å²	81	103.6 Å²	103.6	42%	0.415	54%	0.541	S	S	.	.	H	α-helix	trans	-78.8	-28.5	177.5	-71	165.8	0	0	0	112.3	C1416 Y1417 N1418 T1423 L1424	C1416-I1420 WeakPolarHBondContact O-CB 3.24Å; C1416-I1420 WeakPolarHBondContact O-CD1 3.24Å; C1416-I1420 WeakPolarHBondContact O-CG1 3.48Å; C1416-I1420 PolarHBondContact O-N 3.49Å; Y1417-I1420 CarbonylContact O-C 3.35Å; Y1417-I1420 PolarHBondContact O-N 2.72Å; Y1417-I1420 VanDerWaalsContact O-N 3.08Å; N1418-I1420 VanDerWaalsContact C-N 3.3Å; N1418-I1420 PolarHBondContact O-N 2.98Å; I1420-T1423 WeakPolarHBondContact CA-OG1 3.35Å; I1420-T1423 PolarHBondContact O-OG1 2.81Å; I1420-L1424 WeakPolarHBondContact O-CD1 3.35Å; I1420-L1424 WeakPolarHBondContact O-CG 3.13Å
1421	T	32.2	Very low	33.8	Very low	49 Å²	49	102 Å²	102	30%	0.301	54%	0.539	S	S	.	.	H	α-helix	trans	-80.9	-39.3	174.5	42.5	0	0	0	0	112.5	Y1417 N1418 T1423 L1424	Y1417-T1421 HydrophobicContact CE1-CG2 4.2Å; Y1417-T1421 HydrophobicContact CE2-CG2 4.47Å; Y1417-T1421 PolarHBondContact O-N 3.3Å; Y1417-T1421 PolarHBondContact O-OG1 3.16Å; Y1417-T1421 VanDerWaalsContact O-OG1 3.05Å; N1418-T1421 VanDerWaalsContact CA-OG1 3.3Å; N1418-T1421 WeakPolarHBondContact CA-OG1 3.42Å; N1418-T1421 PolarHBondContact O-N 3.46Å; N1418-T1421 PolarHBondContact O-OG1 2.89Å; T1421-T1423 PolarHBondContact O-N 3.33Å; T1421-L1424 PolarHBondContact O-N 2.76Å; T1421-L1424 VanDerWaalsContact O-N 3.16Å
1422	R	31.8	Very low	33.4	Very low	158 Å²	158	99.8 Å²	99.8	60%	0.596	53%	0.529	S	S	*	.	H	α-helix	trans	-61.8	-29.9	174.1	-70.7	177.4	-171.4	-145.7	2.6	112.8	G264 D266 N1418 L1424	G264-R1422 PolarHBondContact O-NH2 3.28Å; D266-R1422 IonicContact OD1-CZ 2.7Å; D266-R1422 IonicContact OD1-NE 3.45Å; D266-R1422 PolarHBondContact OD1-NE 3.4Å; D266-R1422 IonicContact OD1-NH2 2.86Å; D266-R1422 PolarHBondContact OD1-NH2 3.02Å; D266-R1422 IonicContact OD2-NE 3.37Å; N1418-R1422 WeakPolarHBondContact O-CB 3.41Å; N1418-R1422 VanDerWaalsContact O-CG 3.27Å; N1418-R1422 WeakPolarHBondContact O-CG 3.28Å; N1418-R1422 PolarHBondContact O-N 3.37Å; R1422-L1424 VanDerWaalsContact C-N 3.28Å; R1422-L1424 PolarHBondContact O-N 3.23Å
1423	T	28.9	Very low	33	Very low	104 Å²	104	99.4 Å²	99.4	64%	0.638	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	9.8	177.1	46.4	0	0	0	0	114.9	L1419 I1420 T1421	L1419-T1423 WeakPolarHBondContact O-CG2 3.37Å; L1419-T1423 PolarHBondContact O-N 3.33Å; L1419-T1423 PolarHBondContact O-OG1 2.84Å; I1420-T1423 WeakPolarHBondContact CA-OG1 3.35Å; I1420-T1423 PolarHBondContact O-OG1 2.81Å; T1421-T1423 PolarHBondContact O-N 3.33Å
1424	L	28.2	Very low	33	Very low	103 Å²	103	96.7 Å²	96.7	54%	0.539	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	9.7	-179.6	-72.6	172.9	0	0	0	114.9	I1420 T1421 R1422	I1420-L1424 WeakPolarHBondContact O-CD1 3.35Å; I1420-L1424 WeakPolarHBondContact O-CG 3.13Å; T1421-L1424 PolarHBondContact O-N 2.76Å; T1421-L1424 VanDerWaalsContact O-N 3.16Å; R1422-L1424 VanDerWaalsContact C-N 3.28Å; R1422-L1424 PolarHBondContact O-N 3.23Å
1425	A	29.9	Very low	32.9	Very low	75 Å²	75	97.9 Å²	97.9	62%	0.62	53%	0.525	S	S	*	.	S	Bend	trans	-81.6	150.2	165.6	0	0	0	0	0	111.2
1426	P	28.3	Very low	32.6	Very low	121 Å²	121	93.3 Å²	93.3	79%	0.786	51%	0.508	S	S	*	.	S	Bend	trans	-78.7	140.9	-172.7	30.6	-34.9	0	0	0	113.9
1427	Q	28.5	Very low	32.6	Very low	177 Å²	177	96.3 Å²	96.3	83%	0.827	52%	0.518	S	S	*	.			trans	79	91.9	172.3	-48.8	-73.5	53.3	0	0	117.3
1428	P	27.6	Very low	32.7	Very low	85 Å²	85	95.1 Å²	95.1	55%	0.552	52%	0.52	S	S	*	.			trans	-72.9	150.8	146.6	33.4	-32.8	0	0	0	110.3	F1432	P1428-F1432 HydrophobicContact CB-CD1 4.48Å
1429	S	30	Very low	32.6	Very low	59 Å²	59	98.8 Å²	98.8	41%	0.413	54%	0.536	S	S	.	.			trans	-75	155.4	176.9	59.9	0	0	0	0	112.2	S1431 F1432	S1429-S1431 PolarHBondContact O-N 3Å; S1429-S1431 PolarHBondContact OG-OG 3.32Å; S1429-F1432 PolarHBondContact O-N 3.23Å; S1429-F1432 WeakPolarHBondContact OG-CB 3.41Å; S1429-F1432 PolarHBondContact OG-N 2.92Å
1430	T	34.2	Very low	32.4	Very low	121 Å²	121	98.9 Å²	98.9	74%	0.742	54%	0.536	S	S	*	.	H	α-helix	trans	-70.3	-15.4	174.7	49	0	0	0	0	113.4
1431	S	33.9	Very low	32.3	Very low	68 Å²	68	101.7 Å²	101.7	48%	0.476	55%	0.548	S	S	.	.	H	α-helix	trans	-73.1	-43.8	170.4	50	0	0	0	0	111.6	S1429 L1433 N1434 Q1435	S1429-S1431 PolarHBondContact O-N 3Å; S1429-S1431 PolarHBondContact OG-OG 3.32Å; S1431-L1433 PolarHBondContact O-N 2.89Å; S1431-N1434 PolarHBondContact O-N 2.65Å; S1431-N1434 VanDerWaalsContact O-N 3.09Å; S1431-Q1435 PolarHBondContact O-N 3.45Å
1432	F	33	Very low	32.3	Very low	97 Å²	97	103.2 Å²	103.2	43%	0.425	56%	0.56	S	S	.	*	H	α-helix	trans	-63.1	-38.5	-178.1	-173.1	-108.9	0	0	0	112.7	P1428 S1429 N1434 Q1435 I1436	P1428-F1432 HydrophobicContact CB-CD1 4.48Å; S1429-F1432 PolarHBondContact O-N 3.23Å; S1429-F1432 WeakPolarHBondContact OG-CB 3.41Å; S1429-F1432 PolarHBondContact OG-N 2.92Å; F1432-N1434 VanDerWaalsContact C-N 3.34Å; F1432-Q1435 PolarHBondContact O-N 3.27Å; F1432-I1436 HydrophobicContact CD1-CD1 3.82Å; F1432-I1436 HydrophobicContact CE1-CD1 3.43Å; F1432-I1436 VanDerWaalsContact CE1-CD1 3.43Å; F1432-I1436 HydrophobicContact CE2-CD1 4.43Å; F1432-I1436 HydrophobicContact CG-CD1 4.47Å; F1432-I1436 HydrophobicContact CZ-CD1 3.78Å; F1432-I1436 WeakPolarHBondContact O-CG1 3.35Å; F1432-I1436 PolarHBondContact O-N 3.5Å
1433	L	32.8	Very low	32.3	Very low	100 Å²	100	101.7 Å²	101.7	52%	0.524	56%	0.563	S	S	.	*	H	α-helix	trans	-67.4	-33.2	173.9	-70	176.4	0	0	0	112.9	S1431 Q1437	S1431-L1433 PolarHBondContact O-N 2.89Å; L1433-Q1437 PolarHBondContact O-N 2.98Å
1434	N	38.6	Very low	32.3	Very low	104 Å²	104	103.1 Å²	103.1	56%	0.556	57%	0.566	S	S	*	*	H	α-helix	trans	-73.3	-43.2	173.9	-71.1	-1.3	0	0	0	111.3	S1431 F1432 I1436 Q1437 D1438	S1431-N1434 PolarHBondContact O-N 2.65Å; S1431-N1434 VanDerWaalsContact O-N 3.09Å; F1432-N1434 VanDerWaalsContact C-N 3.34Å; N1434-I1436 VanDerWaalsContact C-N 3.26Å; N1434-I1436 PolarHBondContact O-N 3.19Å; N1434-Q1437 CarbonylContact O-C 3.52Å; N1434-Q1437 WeakPolarHBondContact O-CA 3.29Å; N1434-Q1437 WeakPolarHBondContact O-CB 3.32Å; N1434-Q1437 PolarHBondContact O-N 3.04Å; N1434-D1438 WeakPolarHBondContact O-CB 3.44Å; N1434-D1438 VanDerWaalsContact O-CG 3.24Å; N1434-D1438 PolarHBondContact O-N 2.81Å
1435	Q	36.1	Very low	32.4	Very low	67 Å²	67	105 Å²	105	31%	0.313	58%	0.577	S	S	.	*	H	α-helix	trans	-60.4	-34.1	173.8	-84.1	176.2	-20.6	0	0	112.6	D127 S1431 F1432 H1439	D127-Q1435 PolarHBondContact OD2-NE2 2.83Å; S1431-Q1435 PolarHBondContact O-N 3.45Å; F1432-Q1435 PolarHBondContact O-N 3.27Å; Q1435-H1439 VanDerWaalsContact O-CB 3.28Å; Q1435-H1439 WeakPolarHBondContact O-CB 3.46Å; Q1435-H1439 PolarHBondContact O-N 2.83Å
1436	I	32.5	Very low	32.4	Very low	75 Å²	75	109.2 Å²	109.2	39%	0.385	58%	0.581	S	S	.	*	H	α-helix	trans	-69.9	-40.7	172.2	-73.1	172.8	0	0	0	111.3	F1432 N1434 H1439 L1440	F1432-I1436 HydrophobicContact CD1-CD1 3.82Å; F1432-I1436 HydrophobicContact CE1-CD1 3.43Å; F1432-I1436 VanDerWaalsContact CE1-CD1 3.43Å; F1432-I1436 HydrophobicContact CE2-CD1 4.43Å; F1432-I1436 HydrophobicContact CG-CD1 4.47Å; F1432-I1436 HydrophobicContact CZ-CD1 3.78Å; F1432-I1436 WeakPolarHBondContact O-CG1 3.35Å; F1432-I1436 PolarHBondContact O-N 3.5Å; N1434-I1436 VanDerWaalsContact C-N 3.26Å; N1434-I1436 PolarHBondContact O-N 3.19Å; I1436-H1439 PolarHBondContact O-N 3.39Å; I1436-L1440 HydrophobicContact CG2-CD1 3.93Å; I1436-L1440 WeakPolarHBondContact O-CD1 3.35Å; I1436-L1440 PolarHBondContact O-N 3.13Å
1437	Q	36	Very low	32.5	Very low	107 Å²	107	109.5 Å²	109.5	50%	0.5	58%	0.576	S	S	.	*	H	α-helix	trans	-60.1	-50.2	173.3	-170.1	72.4	31.9	0	0	110.7	L1433 N1434 H1439 L1440 E1441	L1433-Q1437 PolarHBondContact O-N 2.98Å; N1434-Q1437 CarbonylContact O-C 3.52Å; N1434-Q1437 WeakPolarHBondContact O-CA 3.29Å; N1434-Q1437 WeakPolarHBondContact O-CB 3.32Å; N1434-Q1437 PolarHBondContact O-N 3.04Å; Q1437-H1439 PolarHBondContact O-N 3.29Å; Q1437-L1440 PolarHBondContact O-N 3.1Å; Q1437-E1441 PolarHBondContact NE2-OE1 2.9Å; Q1437-E1441 WeakPolarHBondContact O-CB 3.35Å; Q1437-E1441 WeakPolarHBondContact O-CG 3.42Å; Q1437-E1441 PolarHBondContact O-N 3.1Å
1438	D	37.9	Very low	32.7	Very low	101 Å²	101	107.1 Å²	107.1	54%	0.54	57%	0.565	S	S	.	*	H	α-helix	trans	-63.2	-37.8	178.8	-64.9	-29.3	0	0	0	111.7	N1434 E1441 S1442	N1434-D1438 WeakPolarHBondContact O-CB 3.44Å; N1434-D1438 VanDerWaalsContact O-CG 3.24Å; N1434-D1438 PolarHBondContact O-N 2.81Å; D1438-E1441 CarbonylContact O-C 3.54Å; D1438-E1441 PolarHBondContact O-N 3.39Å; D1438-S1442 WeakPolarHBondContact O-CB 3.2Å; D1438-S1442 PolarHBondContact O-N 3.49Å; D1438-S1442 VanDerWaalsContact O-N 3.09Å
1439	H	35.1	Very low	32.9	Very low	102 Å²	102	109.5 Å²	109.5	47%	0.472	57%	0.569	S	S	.	*	H	α-helix	trans	-70.3	-33.7	175.1	-99.2	-61	0	0	0	113.5	Q1435 I1436 Q1437 S1442	Q1435-H1439 VanDerWaalsContact O-CB 3.28Å; Q1435-H1439 WeakPolarHBondContact O-CB 3.46Å; Q1435-H1439 PolarHBondContact O-N 2.83Å; I1436-H1439 PolarHBondContact O-N 3.39Å; Q1437-H1439 PolarHBondContact O-N 3.29Å; H1439-S1442 PolarHBondContact O-N 3.13Å
1440	L	31.6	Very low	33.1	Very low	122 Å²	122	113.4 Å²	113.4	64%	0.639	58%	0.58	S	S	*	*	H	α-helix	trans	-72.3	-33.2	171.6	-91.9	81.4	0	0	0	111.8	I1436 Q1437 S1442	I1436-L1440 HydrophobicContact CG2-CD1 3.93Å; I1436-L1440 WeakPolarHBondContact O-CD1 3.35Å; I1436-L1440 PolarHBondContact O-N 3.13Å; Q1437-L1440 PolarHBondContact O-N 3.1Å; L1440-S1442 PolarHBondContact O-N 3.38Å
1441	E	31.6	Very low	32.9	Very low	141 Å²	141	112.3 Å²	112.3	66%	0.659	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-1.7	175.4	-69.1	-177.9	-161.3	0	0	113.3	Q1437 D1438	Q1437-E1441 PolarHBondContact NE2-OE1 2.9Å; Q1437-E1441 WeakPolarHBondContact O-CB 3.35Å; Q1437-E1441 WeakPolarHBondContact O-CG 3.42Å; Q1437-E1441 PolarHBondContact O-N 3.1Å; D1438-E1441 CarbonylContact O-C 3.54Å; D1438-E1441 PolarHBondContact O-N 3.39Å
1442	S	32.6	Very low	32.8	Very low	81 Å²	81	113.2 Å²	113.2	57%	0.566	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-3.1	-174.5	179.7	0	0	0	0	115.8	D1438 H1439 L1440	D1438-S1442 WeakPolarHBondContact O-CB 3.2Å; D1438-S1442 PolarHBondContact O-N 3.49Å; D1438-S1442 VanDerWaalsContact O-N 3.09Å; H1439-S1442 PolarHBondContact O-N 3.13Å; L1440-S1442 PolarHBondContact O-N 3.38Å
1443	I	29.9	Very low	33	Very low	126 Å²	126	113 Å²	113	65%	0.646	57%	0.568	S	S	*	*	S	Bend	trans	-117.1	80.8	-169.7	-52.7	-176.4	0	0	0	113.1
1444	N	30.7	Very low	32.8	Very low	133 Å²	133	113.3 Å²	113.3	71%	0.711	57%	0.57	S	S	*	*			trans	51.3	72.5	152.2	-71.8	-23.2	0	0	0	119.9	K1446	N1444-K1446 VanDerWaalsContact C-N 3.27Å; N1444-K1446 PolarHBondContact O-N 2.99Å
1445	D	29.2	Very low	32.4	Very low	143 Å²	143	114.6 Å²	114.6	77%	0.765	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn		49	8	112	-75.2	0.4	0	0	0	123.2
1446	K	31.2	Very low	32.1	Very low	163 Å²	163	119 Å²	119	71%	0.709	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.7	-61.4	172	-73.4	-172.7	179.5	173.7	0	113.5	N1444 H1448 Q1449 E1450	N1444-K1446 VanDerWaalsContact C-N 3.27Å; N1444-K1446 PolarHBondContact O-N 2.99Å; K1446-H1448 PolarHBondContact O-N 2.95Å; K1446-Q1449 WeakPolarHBondContact O-CB 3.37Å; K1446-Q1449 PolarHBondContact O-N 2.89Å; K1446-E1450 PolarHBondContact O-N 3.33Å
1447	D	29.5	Very low	31.9	Very low	127 Å²	127	122.4 Å²	122.4	68%	0.679	60%	0.602	S	S	*	*	H	α-helix	trans	-68.2	-25.1	-172.7	-47.9	-26.6	0	0	0	110.7	Q1449 E1450 L1451	D1447-Q1449 VanDerWaalsContact C-N 3.31Å; D1447-Q1449 PolarHBondContact O-N 2.92Å; D1447-E1450 PolarHBondContact O-N 3.37Å; D1447-L1451 WeakPolarHBondContact O-CB 3.09Å; D1447-L1451 PolarHBondContact O-N 3.18Å
1448	H	31.9	Very low	31.6	Very low	128 Å²	128	127 Å²	127	59%	0.593	62%	0.621	S	S	*	*	H	α-helix	trans	-67.1	-26.9	172.2	-129.3	-52.9	0	0	0	113.6	K1446 E1452	K1446-H1448 PolarHBondContact O-N 2.95Å; H1448-E1452 VanDerWaalsContact O-CB 3.23Å; H1448-E1452 WeakPolarHBondContact O-CB 3.5Å; H1448-E1452 PolarHBondContact O-N 3.13Å; H1448-E1452 VanDerWaalsContact O-N 3.08Å
1449	Q	32.6	Very low	31.1	Very low	135 Å²	135	130.3 Å²	130.3	63%	0.631	63%	0.63	S	S	*	*	H	α-helix	trans	-78.2	-42.3	173.3	-74.5	-169.9	-14.6	0	0	111.8	K1446 D1447 E1452 I1453	K1446-Q1449 WeakPolarHBondContact O-CB 3.37Å; K1446-Q1449 PolarHBondContact O-N 2.89Å; D1447-Q1449 VanDerWaalsContact C-N 3.31Å; D1447-Q1449 PolarHBondContact O-N 2.92Å; Q1449-E1452 PolarHBondContact O-N 3.32Å; Q1449-I1453 VanDerWaalsContact O-CB 3.3Å; Q1449-I1453 WeakPolarHBondContact O-CB 3.4Å; Q1449-I1453 WeakPolarHBondContact O-CD1 3.17Å; Q1449-I1453 WeakPolarHBondContact O-CG1 3.49Å; Q1449-I1453 PolarHBondContact O-N 3.47Å
1450	E	33.3	Very low	30.5	Very low	141 Å²	141	136.5 Å²	136.5	66%	0.659	65%	0.65	S	S	*	*	H	α-helix	trans	-64.6	-43.2	174.8	-70.7	-161.3	151.8	0	0	111.6	K1446 D1447 E1452 I1453 L1454	K1446-E1450 PolarHBondContact O-N 3.33Å; D1447-E1450 PolarHBondContact O-N 3.37Å; E1450-E1452 PolarHBondContact O-N 2.91Å; E1450-I1453 PolarHBondContact O-N 3.5Å; E1450-L1454 WeakPolarHBondContact O-CB 3.42Å; E1450-L1454 VanDerWaalsContact O-CG 3.32Å; E1450-L1454 WeakPolarHBondContact O-CG 3.04Å; E1450-L1454 PolarHBondContact O-N 3.36Å
1451	L	31.6	Very low	30.2	Very low	98 Å²	98	139.6 Å²	139.6	51%	0.513	66%	0.661	S	S	.	*	H	α-helix	trans	-66.2	-36.9	177.4	-159	74.8	0	0	0	112	D1447 M1455	D1447-L1451 WeakPolarHBondContact O-CB 3.09Å; D1447-L1451 PolarHBondContact O-N 3.18Å; L1451-M1455 WeakPolarHBondContact O-CB 3.4Å; L1451-M1455 WeakPolarHBondContact O-CG 2.97Å; L1451-M1455 PolarHBondContact O-N 2.84Å
1452	E	31.3	Very low	29.9	Very low	87 Å²	87	137.8 Å²	137.8	41%	0.407	66%	0.663	S	S	.	*	H	α-helix	trans	-74.2	-32.4	174.7	-152.5	-169.6	-173	0	0	112.5	H1448 Q1449 E1450 M1455 R1456	H1448-E1452 VanDerWaalsContact O-CB 3.23Å; H1448-E1452 WeakPolarHBondContact O-CB 3.5Å; H1448-E1452 PolarHBondContact O-N 3.13Å; H1448-E1452 VanDerWaalsContact O-N 3.08Å; Q1449-E1452 PolarHBondContact O-N 3.32Å; E1450-E1452 PolarHBondContact O-N 2.91Å; E1452-M1455 PolarHBondContact O-N 3.35Å; E1452-R1456 HydrophobicContact CG-CG 4.26Å; E1452-R1456 WeakPolarHBondContact O-CB 3.41Å; E1452-R1456 WeakPolarHBondContact O-CD 3.21Å; E1452-R1456 WeakPolarHBondContact O-CG 3.35Å; E1452-R1456 PolarHBondContact O-N 2.92Å; E1452-R1456 IonicContact OE1-CZ 3.14Å; E1452-R1456 IonicContact OE1-NE 3.63Å; E1452-R1456 PolarHBondContact OE1-NE 2.75Å; E1452-R1456 IonicContact OE1-NH2 3.94Å; E1452-R1456 PolarHBondContact OE1-NH2 3.05Å; E1452-R1456 IonicContact OE2-CZ 2.87Å; E1452-R1456 IonicContact OE2-NE 3.73Å; E1452-R1456 PolarHBondContact OE2-NE 2.67Å; E1452-R1456 IonicContact OE2-NH1 2.74Å; E1452-R1456 IonicContact OE2-NH2 3Å; E1452-R1456 PolarHBondContact OE2-NH2 2.88Å
1453	I	35.8	Very low	29.4	Very low	91 Å²	91	138.9 Å²	138.9	47%	0.467	67%	0.671	S	S	.	*	H	α-helix	trans	-64.9	-45.8	171.8	-73.6	165.2	0	0	0	110.1	Q1449 E1450 M1455 R1456 Q1457	Q1449-I1453 VanDerWaalsContact O-CB 3.3Å; Q1449-I1453 WeakPolarHBondContact O-CB 3.4Å; Q1449-I1453 WeakPolarHBondContact O-CD1 3.17Å; Q1449-I1453 WeakPolarHBondContact O-CG1 3.49Å; Q1449-I1453 PolarHBondContact O-N 3.47Å; E1450-I1453 PolarHBondContact O-N 3.5Å; I1453-M1455 PolarHBondContact O-N 2.98Å; I1453-R1456 PolarHBondContact O-N 3.37Å; I1453-Q1457 HydrophobicContact CG2-CG 4.4Å; I1453-Q1457 WeakPolarHBondContact O-CB 3.31Å; I1453-Q1457 WeakPolarHBondContact O-CG 3.4Å; I1453-Q1457 PolarHBondContact O-N 2.7Å
1454	L	29.6	Very low	29.2	Very low	107 Å²	107	140.4 Å²	140.4	56%	0.56	68%	0.68	S	S	*	*	H	α-helix	trans	-62.4	-41.5	175.4	-72.6	166.5	0	0	0	112.1	E1450 K1458	E1450-L1454 WeakPolarHBondContact O-CB 3.42Å; E1450-L1454 VanDerWaalsContact O-CG 3.32Å; E1450-L1454 WeakPolarHBondContact O-CG 3.04Å; E1450-L1454 PolarHBondContact O-N 3.36Å; L1454-K1458 PolarHBondContact O-N 2.85Å
1455	M	30.2	Very low	28.9	Very low	132 Å²	132	137.6 Å²	137.6	65%	0.65	67%	0.671	S	S	*	*	H	α-helix	trans	-77.1	-18	176.2	-70.7	-142.4	-76.1	0	0	114.5	L1451 E1452 I1453	L1451-M1455 WeakPolarHBondContact O-CB 3.4Å; L1451-M1455 WeakPolarHBondContact O-CG 2.97Å; L1451-M1455 PolarHBondContact O-N 2.84Å; E1452-M1455 PolarHBondContact O-N 3.35Å; I1453-M1455 PolarHBondContact O-N 2.98Å
1456	R	29.5	Very low	28.7	Very low	158 Å²	158	141.8 Å²	141.8	60%	0.596	68%	0.676	S	S	*	*	H	α-helix	trans	-85.4	-33.6	169.8	-74	169.6	178	-165.5	5.1	112.1	E1452 I1453 K1459	E1452-R1456 HydrophobicContact CG-CG 4.26Å; E1452-R1456 WeakPolarHBondContact O-CB 3.41Å; E1452-R1456 WeakPolarHBondContact O-CD 3.21Å; E1452-R1456 WeakPolarHBondContact O-CG 3.35Å; E1452-R1456 PolarHBondContact O-N 2.92Å; E1452-R1456 IonicContact OE1-CZ 3.14Å; E1452-R1456 IonicContact OE1-NE 3.63Å; E1452-R1456 PolarHBondContact OE1-NE 2.75Å; E1452-R1456 IonicContact OE1-NH2 3.94Å; E1452-R1456 PolarHBondContact OE1-NH2 3.05Å; E1452-R1456 IonicContact OE2-CZ 2.87Å; E1452-R1456 IonicContact OE2-NE 3.73Å; E1452-R1456 PolarHBondContact OE2-NE 2.67Å; E1452-R1456 IonicContact OE2-NH1 2.74Å; E1452-R1456 IonicContact OE2-NH2 3Å; E1452-R1456 PolarHBondContact OE2-NH2 2.88Å; I1453-R1456 PolarHBondContact O-N 3.37Å; R1456-K1459 PolarHBondContact O-N 2.85Å
1457	Q	29.3	Very low	28.5	Very low	147 Å²	147	138.8 Å²	138.8	69%	0.687	67%	0.671	S	S	*	*	H	α-helix	trans	-66.8	-35.5	176.6	-79.7	-179.4	-8.6	0	0	112.6	I1453 K1459	I1453-Q1457 HydrophobicContact CG2-CG 4.4Å; I1453-Q1457 WeakPolarHBondContact O-CB 3.31Å; I1453-Q1457 WeakPolarHBondContact O-CG 3.4Å; I1453-Q1457 PolarHBondContact O-N 2.7Å; Q1457-K1459 PolarHBondContact O-N 3.05Å; Q1457-K1459 VanDerWaalsContact O-N 3.17Å
1458	K	29.5	Very low	28.2	Very low	203 Å²	203	141.4 Å²	141.4	88%	0.883	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	22.2	177.8	-141.5	168.7	-170.2	171.6	0	114.6	L1454	L1454-K1458 PolarHBondContact O-N 2.85Å
1459	K	26.1	Very low	27.9	Very low	171 Å²	171	138.7 Å²	138.7	74%	0.743	69%	0.686	S	S	*	*			trans	-124.7	38	-170.5	-154.3	-179.3	-179.9	-178.4	0	114.5	R1456 Q1457	R1456-K1459 PolarHBondContact O-N 2.85Å; Q1457-K1459 PolarHBondContact O-N 3.05Å; Q1457-K1459 VanDerWaalsContact O-N 3.17Å
1460	R	23.5	Very low	27.5	Very low	233 Å²	233	141.5 Å²	141.5	88%	0.879	69%	0.692	S	S	*	*			trans	-140.8	90.9	172.7	-78.6	-170	170.9	175.2	-1.8	113.5
1461	Q	25.8	Very low	27.2	Very low	186 Å²	186	143.5 Å²	143.5	87%	0.869	71%	0.707	S	S	*	*			trans	163.5	93.9	153	-94	168.5	1.8	0	0	105.4
1462	S	24.1	Very low	26.8	Very low	103 Å²	103	148.2 Å²	148.2	72%	0.72	73%	0.726	S	S	*	*				67	132.7	85	67	0	0	0	0	112.6
1463	S	23.2	Very low	26.6	Very low	105 Å²	105	148.8 Å²	148.8	73%	0.734	74%	0.74	S	S	*	*			cis	-168.6	163.5	11.2	13.5	0	0	0	0	108.4
1464	L	24.2	Very low	26	Very low	158 Å²	158	152.5 Å²	152.5	83%	0.827	76%	0.76	S	S	*	*			cis	-153.4	-177.1	9	-121.4	160.6	0	0	0	110.9
1465	S	24.5	Very low	25.7	Very low	74 Å²	74	152.5 Å²	152.5	52%	0.517	77%	0.769	S	S	.	*			trans	-40.5	167.1	-178.8	52.6	0	0	0	0	118.1
1466	W	26.4	Very low	25.6	Very low	230 Å²	230	157 Å²	157	87%	0.871	78%	0.778	S	S	*	*			cis	-147.7	156	34.9	-68.1	68	0	0	0	112.3
1467	T	25.8	Very low	25.4	Very low	100 Å²	100	156.9 Å²	156.9	61%	0.613	79%	0.79	S	S	*	*			cis	-161	164.2	-19.9	26.1	0	0	0	0	107.4
1468	E	23.6	Very low	25.3	Very low	182 Å²	182	155.1 Å²	155.1	85%	0.85	79%	0.791	S	S	*	*			trans	-62.4	167.4	176.7	-67.1	88.6	158	0	0	114.5
1469	G	26.7	Very low	24.9	Very low	71 Å²	71	151.2 Å²	151.2	73%	0.732	78%	0.784	S	S	*	*			trans	162.2	-1.9	172.2	0	0	0	0	0	118.3
1470	Y	23.8	Very low	24.8	Very low	194 Å²	194	150.5 Å²	150.5	76%	0.761	79%	0.787	S	S	*	*	S	Bend	trans	-142.1	15.2	-172.7	-117.6	-85.3	0	0	0	116.9
1471	L	25.7	Very low	24.8	Very low	183 Å²	183	146.6 Å²	146.6	96%	0.958	78%	0.784	S	S	*	*	S	Bend	trans	-131.7	33.2	-179.5	-89.7	172.3	0	0	0	113.7
1472	E	25.2	Very low	24.7	Very low	198 Å²	198	144.1 Å²	144.1	93%	0.925	78%	0.781	S	S	*	*	S	Bend	trans	-131.2	13.5	-177	-153.2	167.1	-144.2	0	0	114.1
1473	S	25.9	Very low	24.8	Very low	99 Å²	99	142.9 Å²	142.9	69%	0.692	79%	0.785	S	S	*	*	S	Bend	trans	-104	-19.3	-175.2	55.9	0	0	0	0	116.1
1474	L	24.1	Very low	24.8	Very low	168 Å²	168	148.9 Å²	148.9	88%	0.88	79%	0.791	S	S	*	*	S	Bend	trans	-146.2	57.7	-170.7	-72.4	177.2	0	0	0	115
1475	S	23.7	Very low	24.8	Very low	107 Å²	107	147 Å²	147	75%	0.748	78%	0.782	S	S	*	*			trans	-156.4	151.8	151.4	79.3	0	0	0	0	112.4
1476	R	26.4	Very low	24.9	Very low	226 Å²	226	154.2 Å²	154.2	85%	0.853	80%	0.798	S	S	*	*			trans	64.1	93.3	172.5	-58.5	-178.8	174	-165.9	-5.2	117.9
1477	N	25.7	Very low	24.8	Very low	157 Å²	157	148.8 Å²	148.8	84%	0.84	79%	0.79	S	S	*	*				170.3	125.2	105.2	-87.5	-23.8	0	0	0	113.6
1478	P	26.5	Very low	24.7	Very low	109 Å²	109	151.4 Å²	151.4	71%	0.708	80%	0.798	S	S	*	*			trans	-97.3	162.9	155.8	37.9	-31.5	0	0	0	112.1
1479	V	22.4	Very low	24.8	Very low	122 Å²	122	145.6 Å²	145.6	74%	0.739	79%	0.788	S	S	*	*			trans	64.6	113.4	164	-145.1	0	0	0	0	118.7
1480	L	24.2	Very low	24.5	Very low	155 Å²	155	147.2 Å²	147.2	81%	0.812	79%	0.788	S	S	*	*				171.3	88	111.8	-90	173.6	0	0	0	115.2
1481	N	23.4	Very low	24.5	Very low	152 Å²	152	142.7 Å²	142.7	81%	0.813	78%	0.78	S	S	*	*				59.9	163.2	129.8	-148.9	3.7	0	0	0	122.9
1482	V	23.9	Very low	24.3	Very low	134 Å²	134	142 Å²	142	81%	0.812	77%	0.772	S	S	*	*			trans	74.4	86.6	170.1	-164.8	0	0	0	0	116.5
1483	G	24.8	Very low	24.2	Very low	77 Å²	77	136.8 Å²	136.8	79%	0.794	76%	0.758	S	S	*	*			trans	-142.3	-24.9	173	0	0	0	0	0	117.1
1484	R	23.6	Very low	24.1	Very low	231 Å²	231	138.4 Å²	138.4	87%	0.872	75%	0.754	S	S	*	*			trans	62	136.3	175.9	-96.6	-178.8	177.2	145.8	1	118.7
1485	N	25.1	Very low	24.1	Very low	119 Å²	119	135.6 Å²	135.6	64%	0.636	73%	0.732	S	S	*	*			trans	78.2	106.7	150.9	-66.5	-27.4	0	0	0	120.5
1486	R	25.1	Very low	24	Very low	224 Å²	224	134.2 Å²	134.2	85%	0.845	72%	0.723	S	S	*	*			trans	78.5	145.3	130.9	-61.6	175.2	-174	-169.8	-1.1	116.5
1487	V	24.5	Very low	23.9	Very low	116 Å²	116	135.2 Å²	135.2	70%	0.703	73%	0.727	S	S	*	*			cis	-143.2	136.9	2.4	102.5	0	0	0	0	111.8
1488	I	23.9	Very low	23.8	Very low	155 Å²	155	136.8 Å²	136.8	80%	0.795	73%	0.726	S	S	*	*			trans	24	127.3	143	-54.5	168.5	0	0	0	117.7
1489	G	25.5	Very low	23.6	Very low	61 Å²	61	138.2 Å²	138.2	63%	0.629	73%	0.728	S	S	*	*			trans	140	100.3	145.7	0	0	0	0	0	114.2
1490	S	22.2	Very low	23.7	Very low	104 Å²	104	138 Å²	138	73%	0.727	73%	0.727	S	S	*	*			cis	65	122.7	10.3	-24.5	0	0	0	0	112.7
1491	T	22.4	Very low	23.7	Very low	99 Å²	99	137.8 Å²	137.8	61%	0.607	73%	0.725	S	S	*	*			cis	-148.2	-167.3	5.7	43.3	0	0	0	0	108.8
1492	E	22.5	Very low	23.8	Very low	168 Å²	168	137.1 Å²	137.1	79%	0.785	72%	0.721	S	S	*	*			trans	42.5	140.3	131.8	-73.8	134.2	-148.9	0	0	120.5
1493	S	23.2	Very low	24	Very low	89 Å²	89	134.5 Å²	134.5	62%	0.622	71%	0.713	S	S	*	*			cis	-178.6	-176.2	-3.5	-168	0	0	0	0	106
1494	E	23.3	Very low	24.1	Very low	133 Å²	133	138.7 Å²	138.7	62%	0.621	72%	0.717	S	S	*	*			trans	65	159.8	147.2	-78.5	174.4	-139.7	0	0	118.7
1495	R	23.5	Very low	24.6	Very low	109 Å²	109	132.4 Å²	132.4	41%	0.411	71%	0.706	S	S	.	*			cis	-148.1	149.1	-25.6	-132.3	160.6	-175	142.5	-7	105.8	T723 G724	T723-R1495 HydrophobicContact CG2-CG 4.49Å; T723-R1495 PolarHBondContact O-NH2 2.89Å; G724-R1495 VanDerWaalsContact C-NH2 3.35Å; G724-R1495 VanDerWaalsContact CA-NH2 3.28Å
1496	S	22.4	Very low	24.7	Very low	79 Å²	79	133.6 Å²	133.6	55%	0.552	71%	0.712	S	S	*	*			trans	4.5	120.6	151.4	58.8	0	0	0	0	118.5
1497	R	24.3	Very low	24.9	Very low	247 Å²	247	129.2 Å²	129.2	93%	0.932	71%	0.706	S	S	*	*			trans	-152.9	115.8	139.7	-113.1	161	-138.3	-173.1	4.7	112.7
1498	F	22.7	Very low	25.1	Very low	189 Å²	189	127.8 Å²	127.8	83%	0.829	70%	0.701	S	S	*	*			trans	-61.4	141	149.6	-103.3	-108.2	0	0	0	109.1
1499	N	23.7	Very low	25.3	Very low	139 Å²	139	125.4 Å²	125.4	74%	0.743	69%	0.685	S	S	*	*			trans	162.8	126.8	142.2	-80.3	-10.1	0	0	0	106.1
1500	V	23.7	Very low	25.3	Very low	119 Å²	119	124.8 Å²	124.8	72%	0.721	67%	0.674	S	S	*	*				66.5	141.3	59.9	-178.6	0	0	0	0	110.6
1501	I	24.9	Very low	25.6	Very low	149 Å²	149	124.5 Å²	124.5	76%	0.764	66%	0.663	S	S	*	*			trans	89.1	120.3	-168.3	-56.3	170.4	0	0	0	112
1502	D	24.9	Very low	25.8	Very low	138 Å²	138	125.7 Å²	125.7	74%	0.738	66%	0.662	S	S	*	*			cis	-166.1	-175.6	-14.1	-123.2	-42	0	0	0	113.4
1503	A	27.6	Very low	26	Very low	79 Å²	79	121.7 Å²	121.7	65%	0.653	65%	0.652	S	S	*	*			trans	76.3	76	147.7	0	0	0	0	0	120.6
1504	L	27	Very low	26.1	Very low	165 Å²	165	122.7 Å²	122.7	86%	0.864	66%	0.659	S	S	*	*				63.1	163.6	118.2	-85.9	78.1	0	0	0	121.8
1505	P	34.8	Very low	26.6	Very low	100 Å²	100	121.7 Å²	121.7	65%	0.649	67%	0.665	S	S	*	*			trans	-116.3	-163.3	-167.9	37.5	-18.8	0	0	0	112.9
1506	D	27.2	Very low	26.7	Very low	143 Å²	143	123.4 Å²	123.4	77%	0.765	68%	0.682	S	S	*	*				-174.1	154.8	114.3	-91.2	-21.9	0	0	0	116
1507	D	29.5	Very low	26.9	Very low	133 Å²	133	126.4 Å²	126.4	71%	0.711	69%	0.691	S	S	*	*			trans	44.7	88.4	154.9	-82.1	-45.7	0	0	0	126.3
1508	S	27.6	Very low	27	Very low	85 Å²	85	121.4 Å²	121.4	59%	0.594	69%	0.688	S	S	*	*				64.4	149	91.6	94.9	0	0	0	0	126.2
1509	K	27.9	Very low	27.4	Very low	105 Å²	105	115.7 Å²	115.7	46%	0.457	68%	0.682	S	S	.	*			trans	89.4	89.3	145.6	-71	161.8	-164	-79.9	0	124.5	G28 F30 K31	G28-K1509 WeakPolarHBondContact O-CG 3.17Å; G28-K1509 PolarHBondContact O-NZ 3.39Å; F30-K1509 CarbonylContact C-O 3.53Å; K31-K1509 PolarHBondContact N-O 3.34Å
1510	A	27.2	Very low	27.6	Very low	49 Å²	49	112.4 Å²	112.4	41%	0.405	67%	0.67	S	S	.	*				67	-171.3	117.3	0	0	0	0	0	120	L29 K31	L29-A1510 HydrophobicContact CD2-CB 4.41Å; K31-A1510 WeakPolarHBondContact CA-O 3.27Å; K31-A1510 WeakPolarHBondContact CB-O 3.14Å; K31-A1510 PolarHBondContact N-O 2.86Å
1511	I	26.9	Very low	27.8	Very low	98 Å²	98	111.4 Å²	111.4	50%	0.503	66%	0.66	S	S	.	*				-153.8	176.3	-56.3	-95.4	164.4	0	0	0	108.7	L29 F30 K31	L29-I1511 HydrophobicContact CD2-CB 3.99Å; L29-I1511 HydrophobicContact CD2-CD1 3.87Å; L29-I1511 HydrophobicContact CD2-CG2 3.88Å; F30-I1511 HydrophobicContact CD1-CB 4.4Å; F30-I1511 HydrophobicContact CD1-CG2 4.46Å; F30-I1511 HydrophobicContact CE1-CG2 4.22Å; K31-I1511 WeakPolarHBondContact CB-O 3.45Å; K31-I1511 WeakPolarHBondContact CD-O 3.24Å; K31-I1511 WeakPolarHBondContact CE-O 3.3Å; K31-I1511 WeakPolarHBondContact CG-O 3.14Å
1512	Q	27	Very low	28	Very low	123 Å²	123	108 Å²	108	58%	0.575	65%	0.65	S	S	*	*			trans	103.2	138.6	149.5	-129.3	178.3	27.4	0	0	122.8	F30 K31	F30-Q1512 HydrophobicContact CD1-CB 4.38Å; F30-Q1512 HydrophobicContact CE1-CB 4.01Å; F30-Q1512 VanDerWaalsContact CE1-CD 3.46Å; F30-Q1512 HydrophobicContact CE1-CG 4.11Å; F30-Q1512 VanDerWaalsContact CE1-OE1 3.3Å; K31-Q1512 PolarHBondContact NZ-O 3.24Å
1513	S	26.8	Very low	28.1	Very low	84 Å²	84	108.7 Å²	108.7	59%	0.587	65%	0.649	S	S	*	*			trans	51.7	115.2	158	54.3	0	0	0	0	119.4
1514	S	25.4	Very low	28.1	Very low	110 Å²	110	114.2 Å²	114.2	77%	0.769	65%	0.653	S	S	*	*			cis	68.4	155.2	29.7	-31.3	0	0	0	0	114.6
1515	P	33.9	Very low	28.2	Very low	113 Å²	113	110.6 Å²	110.6	73%	0.734	64%	0.641	S	S	*	*				-128	-172.5	-82.9	38.7	-22.8	0	0	0	112.1
1516	N	26.1	Very low	27.8	Very low	145 Å²	145	115.5 Å²	115.5	78%	0.775	65%	0.647	S	S	*	*			trans	-177.1	147.2	147.5	-105	-30.7	0	0	0	118.8
1517	L	26.5	Very low	27.8	Very low	141 Å²	141	114 Å²	114	74%	0.738	64%	0.638	S	S	*	*			trans	65.9	124	140	-68.2	165.1	0	0	0	124.5
1518	V	27	Very low	27.6	Very low	143 Å²	143	114.6 Å²	114.6	87%	0.867	64%	0.636	S	S	*	*			trans	65.2	140	145.3	-177.7	0	0	0	0	116.9
1519	G	29.8	Very low	27.5	Very low	69 Å²	69	116.6 Å²	116.6	71%	0.711	64%	0.639	S	S	*	*			cis	168.6	-177.3	2.7	0	0	0	0	0	107.9
1520	S	28.1	Very low	27.5	Very low	70 Å²	70	118.7 Å²	118.7	49%	0.49	65%	0.65	S	S	.	*			cis	-166.2	171.4	-12.7	55.6	0	0	0	0	109.8	L656	L656-S1520 WeakPolarHBondContact CD1-O 3.49Å
1521	D	28.7	Very low	27.5	Very low	97 Å²	97	119.3 Å²	119.3	52%	0.519	65%	0.647	S	S	.	*			trans	72.8	97.5	154.9	-49.7	-42.6	0	0	0	123	Q657	Q657-D1521 VanDerWaalsContact CD-O 3.3Å; Q657-D1521 PolarHBondContact NE2-O 2.94Å; Q657-D1521 PolarHBondContact OE1-O 3.24Å
1522	S	27.5	Very low	27.7	Very low	77 Å²	77	119.8 Å²	119.8	54%	0.538	65%	0.645	S	S	.	*				69.7	119	114.3	-56.4	0	0	0	0	123.4
1523	E	27.5	Very low	27.8	Very low	153 Å²	153	119.2 Å²	119.2	72%	0.715	64%	0.638	S	S	*	*				73.5	161.9	123	-69.2	-159.1	111.8	0	0	122.5
1524	R	28.9	Very low	27.9	Very low	196 Å²	196	120.7 Å²	120.7	74%	0.74	63%	0.633	S	S	*	*			cis	176.3	143.3	-32.4	179.6	-178.3	175.9	-165.4	-0.7	109.8
1525	S	27.4	Very low	28	Very low	89 Å²	89	120.4 Å²	120.4	62%	0.622	63%	0.631	S	S	*	*			trans	62.1	177.4	164.2	67.8	0	0	0	0	114.5
1526	R	27.2	Very low	27.5	Very low	203 Å²	203	123.7 Å²	123.7	77%	0.766	63%	0.634	S	S	*	*			cis	-143.3	134	14	-148.4	142.3	177.8	172.9	-1.9	109.2
1527	I	26.7	Very low	27.4	Very low	112 Å²	112	126.1 Å²	126.1	57%	0.574	63%	0.632	S	S	*	*				51.8	126.9	94	-41.6	174.4	0	0	0	111.5	I1529	I1527-I1529 HydrophobicContact CG2-CD1 3.74Å; I1527-I1529 HydrophobicContact CG2-CG1 4Å
1528	E	25	Very low	27.3	Very low	145 Å²	145	130 Å²	130	68%	0.678	64%	0.637	S	S	*	*				-163.9	125.7	84.1	-117.7	60.6	-126.7	0	0	107.6
1529	I	26.9	Very low	27.2	Very low	127 Å²	127	128.8 Å²	128.8	65%	0.651	64%	0.635	S	S	*	*				69	122	76.4	-61.5	171.5	0	0	0	114.8	I1527	I1527-I1529 HydrophobicContact CG2-CD1 3.74Å; I1527-I1529 HydrophobicContact CG2-CG1 4Å
1530	Q	27.5	Very low	27	Very low	148 Å²	148	136.7 Å²	136.7	69%	0.692	64%	0.644	S	S	*	*				-171.6	177.5	128.1	-99.7	178.8	37	0	0	112.4
1531	D	27.7	Very low	26.7	Very low	63 Å²	63	142.3 Å²	142.3	34%	0.337	66%	0.659	S	S	.	*				-133.8	-159.8	-127	-152.7	-7.3	0	0	0	110.4	S1149 S1151	S1149-D1531 WeakPolarHBondContact CB-OD1 3.43Å; S1149-D1531 PolarHBondContact OG-OD1 2.86Å; S1151-D1531 PolarHBondContact OG-O 2.63Å
1532	K	29.5	Very low	26.4	Very low	108 Å²	108	142.5 Å²	142.5	47%	0.47	67%	0.668	S	S	.	*			cis	-176.9	145.8	18.4	-142.9	156.9	-165.3	104	0	110.5	S1149 C1150 S1151	S1149-K1532 VanDerWaalsContact CB-CA 3.46Å; S1149-K1532 WeakPolarHBondContact OG-CA 3.46Å; C1150-K1532 CarbonylContact O-C 3.6Å; C1150-K1532 WeakPolarHBondContact O-CA 3.39Å; C1150-K1532 PolarHBondContact O-N 2.87Å; C1150-K1532 VanDerWaalsContact O-O 3.08Å; S1151-K1532 WeakPolarHBondContact CA-O 3.41Å; S1151-K1532 PolarHBondContact OG-N 2.92Å; S1151-K1532 PolarHBondContact OG-O 3.15Å
1533	R	29.5	Very low	26.2	Very low	110 Å²	110	146.1 Å²	146.1	42%	0.415	68%	0.677	S	S	.	*			trans	104.9	133.9	166.5	-49.6	-128.2	-176.9	88.5	-7.9	120	S1149 C1150 S1151 N1753	S1149-R1533 PolarHBondContact OG-N 2.99Å; C1150-R1533 CarbonylContact C-O 3.35Å; C1150-R1533 WeakPolarHBondContact CA-O 3.36Å; C1150-R1533 WeakPolarHBondContact CB-O 3.44Å; C1150-R1533 PolarHBondContact O-N 3.06Å; S1151-R1533 PolarHBondContact N-O 3.37Å; R1533-N1753 PolarHBondContact NH1-O 3.16Å; R1533-N1753 PolarHBondContact NH2-O 2.92Å
1534	K	28.9	Very low	25.9	Very low	115 Å²	115	143.6 Å²	143.6	50%	0.5	68%	0.682	S	S	.	*			trans	-137.3	147.3	-151.3	-161.3	173.3	-167.9	160.2	0	113.8	I1147 S1148 C1150	I1147-K1534 PolarHBondContact O-NZ 2.89Å; S1148-K1534 WeakPolarHBondContact O-CD 3.33Å; S1148-K1534 WeakPolarHBondContact O-CE 3.47Å; S1148-K1534 PolarHBondContact O-NZ 3.18Å; C1150-K1534 HydrophobicContact CB-CB 4.41Å
1535	S	27.3	Very low	25.9	Very low	104 Å²	104	137.4 Å²	137.4	73%	0.727	68%	0.679	S	S	*	*			trans	64.7	124.5	157.8	-171	0	0	0	0	121.1
1536	K	24.7	Very low	25.9	Very low	183 Å²	183	137.8 Å²	137.8	80%	0.796	68%	0.679	S	S	*	*				-169.7	131.6	118.7	-105.7	163.5	-174.8	170.3	0	115
1537	R	24.1	Very low	25.6	Very low	195 Å²	195	133.9 Å²	133.9	74%	0.736	68%	0.678	S	S	*	*			trans	51.6	134.8	142.5	-69.5	177.5	173.2	-178.6	-0.7	122.5
1538	R	23.8	Very low	25.4	Very low	222 Å²	222	130.9 Å²	130.9	84%	0.838	67%	0.667	S	S	*	*			trans	46	127.5	136.1	-59.4	175	174.2	173.6	-3.9	118.1
1539	S	24.7	Very low	25.4	Very low	118 Å²	118	129.3 Å²	129.3	83%	0.825	66%	0.663	S	S	*	*			cis	-152.4	151.1	31	-164.5	0	0	0	0	111.6
1540	R	25.5	Very low	25.3	Very low	236 Å²	236	128.3 Å²	128.3	89%	0.891	66%	0.659	S	S	*	*			trans	-75.1	140.7	-173.4	-76.3	-178	172.7	162.6	-2.9	112.5
1541	K	22.2	Very low	25.2	Very low	187 Å²	187	126.1 Å²	126.1	81%	0.813	65%	0.651	S	S	*	*			trans	-132.4	155.8	-174.8	-176.4	-175.6	-177	-176.2	0	107.5
1542	S	22.3	Very low	25.1	Very low	102 Å²	102	130.8 Å²	130.8	71%	0.713	67%	0.669	S	S	*	*			trans	62.3	132.9	176.2	29	0	0	0	0	115.3
1543	E	22	Very low	25.2	Very low	153 Å²	153	128.8 Å²	128.8	72%	0.715	67%	0.666	S	S	*	*				62.4	72.8	55.4	-66	-157.9	149	0	0	114.6	K1007	K1007-E1543 IonicContact NZ-OE1 3.56Å; K1007-E1543 IonicContact NZ-OE2 3.89Å; K1007-E1543 PolarHBondContact NZ-OE2 3.2Å
1544	A	21.9	Very low	25.1	Very low	99 Å²	99	126 Å²	126	82%	0.818	66%	0.657	S	S	*	*			trans	-164.4	140.7	155.4	0	0	0	0	0	111.4
1545	G	28.7	Very low	24.9	Very low	66 Å²	66	122.7 Å²	122.7	68%	0.68	64%	0.643	S	S	*	*			trans	-87	-177	144.7	0	0	0	0	0	109.3
1546	P	27.5	Very low	25.1	Very low	97 Å²	97	121 Å²	121	63%	0.63	63%	0.626	S	S	*	*			cis	-149.9	-179	49.7	40.9	-20.6	0	0	0	116.6
1547	V	21.2	Very low	25.3	Very low	121 Å²	121	116.6 Å²	116.6	73%	0.733	61%	0.61	S	S	*	*			trans	29.8	111.4	143.9	179	0	0	0	0	118.4
1548	S	22.9	Very low	25.5	Very low	50 Å²	50	107.5 Å²	107.5	35%	0.35	58%	0.577	S	S	.	*				179.7	111.7	122.2	36.2	0	0	0	0	112.8	S395	S395-S1548 PolarHBondContact N-OG 2.91Å; S395-S1548 WeakPolarHBondContact OG-CB 3.44Å; S395-S1548 PolarHBondContact OG-OG 3.2Å
1549	N	25.6	Very low	25.8	Very low	111 Å²	111	102 Å²	102	59%	0.594	56%	0.563	S	S	*	*			trans	-179.3	152.8	134.5	-89	-6.5	0	0	0	111	S395 G396	S395-N1549 WeakPolarHBondContact CA-OD1 3.36Å; G396-N1549 WeakPolarHBondContact CA-OD1 3.36Å; G396-N1549 PolarHBondContact N-OD1 3.18Å
1550	L	24	Very low	26.1	Very low	107 Å²	107	98.7 Å²	98.7	56%	0.56	54%	0.536	S	S	*	.			trans	-101.1	101.2	-180	-75.9	163.8	0	0	0	108.4
1551	D	24.5	Very low	26.3	Very low	101 Å²	101	90.6 Å²	90.6	54%	0.54	51%	0.508	S	S	.	.			trans	-110	143.2	-167.5	-174.1	25	0	0	0	111.5	F930 T1553	F930-D1551 WeakPolarHBondContact CE1-O 3.41Å; F930-D1551 WeakPolarHBondContact CZ-O 3.45Å; D1551-T1553 PolarHBondContact O-N 2.88Å; D1551-T1553 WeakPolarHBondContact OD2-CG2 3.36Å; D1551-T1553 PolarHBondContact OD2-OG1 3.11Å
1552	F	25.4	Very low	26.8	Very low	162 Å²	162	84.4 Å²	84.4	71%	0.711	48%	0.482	S	S	*	.	S	Bend	trans	-81.8	14	-169.5	-84.6	-106.8	0	0	0	113.8	F930 F1554	F930-F1552 VanDerWaalsContact CE2-C 3.42Å; F930-F1552 WeakPolarHBondContact CE2-O 3.45Å; F930-F1552 VanDerWaalsContact CZ-C 3.41Å; F1552-F1554 PolarHBondContact O-N 3.02Å
1553	T	31.7	Very low	27.2	Very low	65 Å²	65	85.1 Å²	85.1	40%	0.399	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	9.1	-164.9	48.1	0	0	0	0	116.1	D1551 N1557	D1551-T1553 PolarHBondContact O-N 2.88Å; D1551-T1553 WeakPolarHBondContact OD2-CG2 3.36Å; D1551-T1553 PolarHBondContact OD2-OG1 3.11Å; T1553-N1557 PolarHBondContact O-ND2 2.59Å
1554	F	27.4	Very low	27.5	Very low	51 Å²	51	83.1 Å²	83.1	22%	0.224	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-41.7	-176.8	-156.6	-141.9	0	0	0	111.5	K929 F930 F1552 D1556 N1557 L1558	K929-F1554 HydrophobicContact CB-CD1 3.84Å; K929-F1554 HydrophobicContact CB-CE1 4.3Å; K929-F1554 HydrophobicContact CD-CB 4.05Å; K929-F1554 HydrophobicContact CD-CD1 3.37Å; K929-F1554 HydrophobicContact CD-CD2 4Å; K929-F1554 HydrophobicContact CD-CE1 3.76Å; K929-F1554 HydrophobicContact CD-CE2 4.32Å; K929-F1554 HydrophobicContact CD-CG 3.48Å; K929-F1554 VanDerWaalsContact CD-CG 3.48Å; K929-F1554 HydrophobicContact CD-CZ 4.21Å; K929-F1554 WeakPolarHBondContact CD-O 3.23Å; K929-F1554 VanDerWaalsContact CE-CD2 3.45Å; K929-F1554 VanDerWaalsContact CE-CE2 3.41Å; K929-F1554 VanDerWaalsContact CE-CG 3.49Å; K929-F1554 VanDerWaalsContact CE-CZ 3.45Å; K929-F1554 WeakPolarHBondContact CE-O 3.32Å; K929-F1554 HydrophobicContact CG-CD1 3.39Å; K929-F1554 HydrophobicContact CG-CE1 3.51Å; K929-F1554 HydrophobicContact CG-CG 4.07Å; K929-F1554 HydrophobicContact CG-CZ 4.27Å; K929-F1554 PolarHBondContact NZ-O 3.27Å; K929-F1554 WeakPolarHBondContact O-CD1 3.44Å; K929-F1554 VanDerWaalsContact O-CE1 3.31Å; K929-F1554 WeakPolarHBondContact O-CE1 3.43Å; F930-F1554 HydrophobicContact CD1-CB 4.19Å; F930-F1554 HydrophobicContact CD2-CB 3.96Å; F930-F1554 HydrophobicContact CE1-CB 3.61Å; F930-F1554 HydrophobicContact CE2-CB 3.35Å; F930-F1554 HydrophobicContact CG-CB 4.35Å; F930-F1554 HydrophobicContact CZ-CB 3.16Å; F930-F1554 HydrophobicContact CZ-CG 4.44Å; F1552-F1554 PolarHBondContact O-N 3.02Å; F1554-D1556 PolarHBondContact O-N 3.4Å; F1554-N1557 WeakPolarHBondContact O-CA 3.33Å; F1554-N1557 WeakPolarHBondContact O-CB 3.42Å; F1554-N1557 PolarHBondContact O-N 2.73Å; F1554-N1557 VanDerWaalsContact O-N 3.09Å; F1554-L1558 PolarHBondContact O-N 2.69Å
1555	F	26.1	Very low	28.1	Very low	47 Å²	47	82.7 Å²	82.7	21%	0.206	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-48.9	-174.8	-89.9	-64	0	0	0	113.3	Q924 T925 R926 K929 F930 N1557 L1558	Q924-F1555 VanDerWaalsContact O-CD1 3.25Å; Q924-F1555 WeakPolarHBondContact O-CD1 3.47Å; Q924-F1555 VanDerWaalsContact O-CE1 3.29Å; Q924-F1555 WeakPolarHBondContact O-CE1 3.2Å; T925-F1555 VanDerWaalsContact O-CE1 3.25Å; T925-F1555 WeakPolarHBondContact O-CE1 3.48Å; R926-F1555 WeakPolarHBondContact O-CE2 3.43Å; R926-F1555 WeakPolarHBondContact O-CZ 2.99Å; K929-F1555 HydrophobicContact CB-CD1 3.68Å; K929-F1555 HydrophobicContact CB-CE1 3.38Å; K929-F1555 HydrophobicContact CB-CE2 4.35Å; K929-F1555 HydrophobicContact CB-CG 4.26Å; K929-F1555 HydrophobicContact CB-CZ 3.73Å; K929-F1555 VanDerWaalsContact N-CZ 3.33Å; F930-F1555 HydrophobicContact CB-CE2 4.12Å; F930-F1555 AromaticContact CD2-CD2 3.64Å; F930-F1555 HydrophobicContact CD2-CD2 3.64Å; F930-F1555 AromaticContact CD2-CE2 3.82Å; F930-F1555 HydrophobicContact CD2-CE2 3.82Å; F930-F1555 HydrophobicContact CE2-CD2 4.3Å; F930-F1555 HydrophobicContact CG-CE2 4.46Å; F1555-N1557 VanDerWaalsContact C-N 3.29Å; F1555-N1557 PolarHBondContact O-N 3.06Å; F1555-L1558 WeakPolarHBondContact O-CA 3.28Å; F1555-L1558 PolarHBondContact O-N 3.16Å
1556	D	30.2	Very low	28.3	Very low	69 Å²	69	84.8 Å²	84.8	37%	0.369	45%	0.45	S	S	.	.	H	α-helix	trans	-56.3	-44.3	175.8	-46.8	-79.8	0	0	0	111.4	F1554 L1558 L1559 N1560	F1554-D1556 PolarHBondContact O-N 3.4Å; D1556-L1558 PolarHBondContact O-N 3.42Å; D1556-L1559 PolarHBondContact O-N 3.35Å; D1556-L1559 VanDerWaalsContact O-N 3.15Å; D1556-N1560 WeakPolarHBondContact O-CB 3.22Å; D1556-N1560 VanDerWaalsContact O-CG 3.23Å; D1556-N1560 PolarHBondContact O-N 2.82Å; D1556-N1560 PolarHBondContact O-ND2 3.14Å
1557	N	30	Very low	28.6	Very low	89 Å²	89	82 Å²	82	48%	0.476	44%	0.436	S	S	.	.	H	α-helix	trans	-65	-8.5	177.6	-89.2	-71.6	0	0	0	114.8	K929 T1553 F1554 F1555	K929-N1557 PolarHBondContact NZ-O 2.99Å; T1553-N1557 PolarHBondContact O-ND2 2.59Å; F1554-N1557 WeakPolarHBondContact O-CA 3.33Å; F1554-N1557 WeakPolarHBondContact O-CB 3.42Å; F1554-N1557 PolarHBondContact O-N 2.73Å; F1554-N1557 VanDerWaalsContact O-N 3.09Å; F1555-N1557 VanDerWaalsContact C-N 3.29Å; F1555-N1557 PolarHBondContact O-N 3.06Å
1558	L	28.4	Very low	29.1	Very low	5 Å²	5	80.1 Å²	80.1	3%	0.026	43%	0.426	C	S	.	.	H	α-helix	trans	-75.5	-67.3	162.8	141.2	-172.7	0	0	0	110.1	V913 V920 L923 Q924 K929 F1554 F1555 D1556 N1560 K1561	V913-L1558 HydrophobicContact CB-CD1 4.34Å; V913-L1558 HydrophobicContact CG1-CD1 3.57Å; V913-L1558 HydrophobicContact CG2-CD1 3.73Å; V920-L1558 HydrophobicContact CB-CD1 4.28Å; V920-L1558 HydrophobicContact CB-CG 4.18Å; V920-L1558 HydrophobicContact CG1-CB 4.18Å; V920-L1558 HydrophobicContact CG1-CD1 4.4Å; V920-L1558 HydrophobicContact CG1-CG 3.87Å; V920-L1558 VanDerWaalsContact CG1-O 3.25Å; V920-L1558 WeakPolarHBondContact CG1-O 3.37Å; V920-L1558 HydrophobicContact CG2-CD1 3.98Å; V920-L1558 HydrophobicContact CG2-CG 4.33Å; V920-L1558 VanDerWaalsContact O-CD2 3.29Å; V920-L1558 WeakPolarHBondContact O-CD2 3.41Å; V920-L1558 WeakPolarHBondContact O-CG 3.28Å; L923-L1558 HydrophobicContact CB-CD1 4.4Å; L923-L1558 HydrophobicContact CB-CD2 3.72Å; L923-L1558 HydrophobicContact CD1-CD1 4.49Å; Q924-L1558 HydrophobicContact CB-CD2 4Å; Q924-L1558 HydrophobicContact CG-CD2 3.96Å; Q924-L1558 HydrophobicContact CG-CG 4.49Å; Q924-L1558 VanDerWaalsContact NE2-CG 3.33Å; Q924-L1558 PolarHBondContact NE2-O 3.49Å; Q924-L1558 VanDerWaalsContact NE2-O 3.17Å; K929-L1558 HydrophobicContact CD-CB 4.35Å; K929-L1558 HydrophobicContact CD-CD2 3.45Å; K929-L1558 VanDerWaalsContact CD-CD2 3.45Å; K929-L1558 HydrophobicContact CD-CG 4.36Å; K929-L1558 HydrophobicContact CG-CD2 3.65Å; F1554-L1558 PolarHBondContact O-N 2.69Å; F1555-L1558 WeakPolarHBondContact O-CA 3.28Å; F1555-L1558 PolarHBondContact O-N 3.16Å; D1556-L1558 PolarHBondContact O-N 3.42Å; L1558-N1560 VanDerWaalsContact C-N 3.31Å; L1558-N1560 PolarHBondContact O-N 3.21Å; L1558-K1561 HydrophobicContact CB-CB 4.25Å; L1558-K1561 WeakPolarHBondContact O-CB 3.29Å; L1558-K1561 PolarHBondContact O-N 3.23Å
1559	L	29.3	Very low	29.7	Very low	105 Å²	105	81.7 Å²	81.7	55%	0.55	43%	0.433	S	S	.	.	H	α-helix	trans	-54.6	-49.5	-178.1	-90.2	165.9	0	0	0	110.7	Q924 D1556 K1561 E1562 L1563	Q924-L1559 VanDerWaalsContact CD-CA 3.47Å; Q924-L1559 HydrophobicContact CG-CG 4.01Å; D1556-L1559 PolarHBondContact O-N 3.35Å; D1556-L1559 VanDerWaalsContact O-N 3.15Å; L1559-K1561 PolarHBondContact O-N 3.24Å; L1559-E1562 PolarHBondContact O-N 3.14Å; L1559-L1563 WeakPolarHBondContact O-CB 3.44Å; L1559-L1563 PolarHBondContact O-N 2.96Å
1560	N	30.5	Very low	30.2	Very low	49 Å²	49	82 Å²	82	26%	0.262	43%	0.429	S	S	.	.	H	α-helix	trans	-57	-18.6	175.3	-69.4	-22.4	0	0	0	112.9	D1556 L1558 I1564	D1556-N1560 WeakPolarHBondContact O-CB 3.22Å; D1556-N1560 VanDerWaalsContact O-CG 3.23Å; D1556-N1560 PolarHBondContact O-N 2.82Å; D1556-N1560 PolarHBondContact O-ND2 3.14Å; L1558-N1560 VanDerWaalsContact C-N 3.31Å; L1558-N1560 PolarHBondContact O-N 3.21Å; N1560-I1564 HydrophobicContact CB-CD1 4.02Å; N1560-I1564 WeakPolarHBondContact O-CA 3.4Å; N1560-I1564 WeakPolarHBondContact O-CB 3.36Å; N1560-I1564 VanDerWaalsContact O-CD1 3.22Å; N1560-I1564 WeakPolarHBondContact O-CD1 3.49Å; N1560-I1564 WeakPolarHBondContact O-CG1 3.24Å; N1560-I1564 PolarHBondContact O-N 3.17Å
1561	K	31.6	Very low	30.8	Very low	67 Å²	67	79.1 Å²	79.1	29%	0.291	42%	0.421	S	S	.	.	H	α-helix	trans	-79.6	-48	-178.2	-140.5	-179.8	-171.7	-174.7	0	113.2	V913 V920 L1558 L1559 I1564 T1565	V913-K1561 HydrophobicContact CG1-CD 3.73Å; V920-K1561 HydrophobicContact CG1-CB 4.39Å; L1558-K1561 HydrophobicContact CB-CB 4.25Å; L1558-K1561 WeakPolarHBondContact O-CB 3.29Å; L1558-K1561 PolarHBondContact O-N 3.23Å; L1559-K1561 PolarHBondContact O-N 3.24Å; K1561-I1564 PolarHBondContact O-N 3.29Å; K1561-T1565 PolarHBondContact O-N 2.87Å; K1561-T1565 PolarHBondContact O-OG1 2.77Å
1562	E	32.2	Very low	31.3	Very low	57 Å²	57	82.1 Å²	82.1	27%	0.266	43%	0.43	S	S	.	.	H	α-helix	trans	-74.2	-36	171.1	-94.8	-177.6	152.3	0	0	111.4	P917 V920 P921 L1559 I1564 T1565 M1566	P917-E1562 HydrophobicContact CB-CG 4.29Å; P917-E1562 VanDerWaalsContact O-OE1 3.11Å; V920-E1562 HydrophobicContact CB-CG 3.93Å; V920-E1562 HydrophobicContact CG1-CB 3.78Å; V920-E1562 HydrophobicContact CG1-CG 3.66Å; V920-E1562 HydrophobicContact CG2-CG 4.31Å; P921-E1562 WeakPolarHBondContact CD-OE2 3.41Å; P921-E1562 WeakPolarHBondContact CG-OE2 3.48Å; L1559-E1562 PolarHBondContact O-N 3.14Å; E1562-I1564 VanDerWaalsContact C-N 3.26Å; E1562-I1564 PolarHBondContact O-N 2.83Å; E1562-T1565 WeakPolarHBondContact CA-OG1 3.36Å; E1562-T1565 PolarHBondContact O-N 3.45Å; E1562-T1565 PolarHBondContact O-OG1 2.93Å; E1562-M1566 WeakPolarHBondContact O-CB 3.48Å; E1562-M1566 WeakPolarHBondContact O-CG 3.29Å; E1562-M1566 PolarHBondContact O-N 3.28Å
1563	L	29.8	Very low	31.9	Very low	116 Å²	116	77.4 Å²	77.4	61%	0.607	42%	0.417	S	S	*	.	H	α-helix	trans	-67	-25.1	173.8	-151.5	77.9	0	0	0	112.1	L1559 A1567	L1559-L1563 WeakPolarHBondContact O-CB 3.44Å; L1559-L1563 PolarHBondContact O-N 2.96Å; L1563-A1567 WeakPolarHBondContact O-CA 3.45Å; L1563-A1567 WeakPolarHBondContact O-CB 3.42Å; L1563-A1567 PolarHBondContact O-N 3.43Å
1564	I	29.6	Very low	32.2	Very low	112 Å²	112	77.1 Å²	77.1	57%	0.574	42%	0.415	S	S	*	.	H	α-helix	trans	-87	-25.7	171.1	-69	166.4	0	0	0	113.1	N1560 K1561 E1562 M1566 A1567 P1568	N1560-I1564 HydrophobicContact CB-CD1 4.02Å; N1560-I1564 WeakPolarHBondContact O-CA 3.4Å; N1560-I1564 WeakPolarHBondContact O-CB 3.36Å; N1560-I1564 VanDerWaalsContact O-CD1 3.22Å; N1560-I1564 WeakPolarHBondContact O-CD1 3.49Å; N1560-I1564 WeakPolarHBondContact O-CG1 3.24Å; N1560-I1564 PolarHBondContact O-N 3.17Å; K1561-I1564 PolarHBondContact O-N 3.29Å; E1562-I1564 VanDerWaalsContact C-N 3.26Å; E1562-I1564 PolarHBondContact O-N 2.83Å; I1564-M1566 VanDerWaalsContact C-N 3.34Å; I1564-A1567 PolarHBondContact O-N 3.11Å; I1564-P1568 WeakPolarHBondContact O-CD 3.5Å
1565	T	32.7	Very low	32.5	Very low	90 Å²	90	80.6 Å²	80.6	55%	0.552	43%	0.433	S	S	*	.	H	α-helix	trans	-72	-33.6	166	47.9	0	0	0	0	111.6	K1561 E1562 P1568	K1561-T1565 PolarHBondContact O-N 2.87Å; K1561-T1565 PolarHBondContact O-OG1 2.77Å; E1562-T1565 WeakPolarHBondContact CA-OG1 3.36Å; E1562-T1565 PolarHBondContact O-N 3.45Å; E1562-T1565 PolarHBondContact O-OG1 2.93Å; T1565-P1568 WeakPolarHBondContact O-CD 3.33Å
1566	M	32.9	Very low	32.9	Very low	109 Å²	109	81.5 Å²	81.5	54%	0.537	44%	0.444	S	S	.	.	H	α-helix	trans	-73.3	-33.4	167.9	-69.1	-68.4	-89.3	0	0	111.5	E1562 I1564 V1569 F1570	E1562-M1566 WeakPolarHBondContact O-CB 3.48Å; E1562-M1566 WeakPolarHBondContact O-CG 3.29Å; E1562-M1566 PolarHBondContact O-N 3.28Å; I1564-M1566 VanDerWaalsContact C-N 3.34Å; M1566-V1569 CarbonylContact O-C 3.35Å; M1566-V1569 WeakPolarHBondContact O-CA 3.45Å; M1566-V1569 WeakPolarHBondContact O-CB 3.44Å; M1566-V1569 PolarHBondContact O-N 3.35Å; M1566-F1570 WeakPolarHBondContact O-CB 3.47Å; M1566-F1570 PolarHBondContact O-N 2.98Å
1567	A	34.7	Very low	33	Very low	39 Å²	39	82.5 Å²	82.5	32%	0.322	45%	0.45	S	S	.	.	H	α-helix	trans	-51.5	-45.3	-174.5	0	0	0	0	0	115.6	L1563 I1564 V1569 A1571	L1563-A1567 WeakPolarHBondContact O-CA 3.45Å; L1563-A1567 WeakPolarHBondContact O-CB 3.42Å; L1563-A1567 PolarHBondContact O-N 3.43Å; I1564-A1567 PolarHBondContact O-N 3.11Å; A1567-V1569 VanDerWaalsContact C-N 3.26Å; A1567-V1569 PolarHBondContact O-N 3.21Å; A1567-A1571 WeakPolarHBondContact O-CA 3.09Å; A1567-A1571 WeakPolarHBondContact O-CB 3.47Å; A1567-A1571 PolarHBondContact O-N 3.32Å
1568	P	31.1	Very low	33.1	Very low	81 Å²	81	80.6 Å²	80.6	53%	0.526	44%	0.443	S	S	.	.	H	α-helix	trans	-74.5	-16	177.6	30.8	-36.9	0	0	0	113.2	I1564 T1565 K1572	I1564-P1568 WeakPolarHBondContact O-CD 3.5Å; T1565-P1568 WeakPolarHBondContact O-CD 3.33Å; P1568-K1572 VanDerWaalsContact O-CB 3.25Å; P1568-K1572 WeakPolarHBondContact O-CB 3.41Å; P1568-K1572 VanDerWaalsContact O-CG 3.28Å; P1568-K1572 WeakPolarHBondContact O-CG 3.34Å; P1568-K1572 PolarHBondContact O-N 3.47Å
1569	V	36	Very low	33.2	Very low	84 Å²	84	87.7 Å²	87.7	51%	0.509	47%	0.473	S	S	.	.	H	α-helix	trans	-85.7	-54.3	172.4	-176.5	0	0	0	0	109.3	M1566 A1567 A1571 K1572 S1573	M1566-V1569 CarbonylContact O-C 3.35Å; M1566-V1569 WeakPolarHBondContact O-CA 3.45Å; M1566-V1569 WeakPolarHBondContact O-CB 3.44Å; M1566-V1569 PolarHBondContact O-N 3.35Å; A1567-V1569 VanDerWaalsContact C-N 3.26Å; A1567-V1569 PolarHBondContact O-N 3.21Å; V1569-A1571 VanDerWaalsContact C-N 3.32Å; V1569-A1571 PolarHBondContact O-N 3.24Å; V1569-K1572 CarbonylContact O-C 3.58Å; V1569-K1572 WeakPolarHBondContact O-CA 3.44Å; V1569-K1572 WeakPolarHBondContact O-CB 3.28Å; V1569-K1572 PolarHBondContact O-N 3.41Å; V1569-S1573 PolarHBondContact O-N 2.9Å; V1569-S1573 PolarHBondContact O-OG 2.8Å
1570	F	35.7	Very low	33.2	Very low	116 Å²	116	87.2 Å²	87.2	51%	0.509	47%	0.471	S	S	.	.	H	α-helix	trans	-59.5	-38.5	175.2	-157.6	-89.7	0	0	0	111.8	M1566 S1573 V1574	M1566-F1570 WeakPolarHBondContact O-CB 3.47Å; M1566-F1570 PolarHBondContact O-N 2.98Å; F1570-S1573 PolarHBondContact O-N 3.03Å; F1570-V1574 HydrophobicContact CD1-CG2 3.85Å; F1570-V1574 HydrophobicContact CE1-CG2 3.79Å; F1570-V1574 WeakPolarHBondContact O-CB 3.17Å; F1570-V1574 WeakPolarHBondContact O-CG2 3.04Å; F1570-V1574 PolarHBondContact O-N 3.32Å
1571	A	36.4	Very low	33.1	Very low	47 Å²	47	89.4 Å²	89.4	39%	0.388	49%	0.486	S	S	.	.	H	α-helix	trans	-80.5	-17.3	171.7	0	0	0	0	0	113.4	A1567 V1569 M1575	A1567-A1571 WeakPolarHBondContact O-CA 3.09Å; A1567-A1571 WeakPolarHBondContact O-CB 3.47Å; A1567-A1571 PolarHBondContact O-N 3.32Å; V1569-A1571 VanDerWaalsContact C-N 3.32Å; V1569-A1571 PolarHBondContact O-N 3.24Å; A1571-M1575 WeakPolarHBondContact O-CA 3.2Å; A1571-M1575 WeakPolarHBondContact O-CB 3.4Å; A1571-M1575 VanDerWaalsContact O-CG 3.24Å; A1571-M1575 WeakPolarHBondContact O-CG 3.26Å; A1571-M1575 PolarHBondContact O-N 3.07Å
1572	K	36.8	Very low	33	Very low	165 Å²	165	93 Å²	93	72%	0.717	50%	0.504	S	S	*	.	H	α-helix	trans	-71.8	-44	162.3	-96.1	-177	172.9	-174.9	0	110.7	P1568 V1569 C1576	P1568-K1572 VanDerWaalsContact O-CB 3.25Å; P1568-K1572 WeakPolarHBondContact O-CB 3.41Å; P1568-K1572 VanDerWaalsContact O-CG 3.28Å; P1568-K1572 WeakPolarHBondContact O-CG 3.34Å; P1568-K1572 PolarHBondContact O-N 3.47Å; V1569-K1572 CarbonylContact O-C 3.58Å; V1569-K1572 WeakPolarHBondContact O-CA 3.44Å; V1569-K1572 WeakPolarHBondContact O-CB 3.28Å; V1569-K1572 PolarHBondContact O-N 3.41Å; K1572-C1576 WeakPolarHBondContact O-CB 3.46Å; K1572-C1576 PolarHBondContact O-N 3.1Å
1573	S	37.1	Very low	32.7	Very low	63 Å²	63	97.6 Å²	97.6	44%	0.441	53%	0.525	S	S	.	.	H	α-helix	trans	-65.5	-45.4	175.8	-57.5	0	0	0	0	111.4	V1569 F1570 C1576 L1577	V1569-S1573 PolarHBondContact O-N 2.9Å; V1569-S1573 PolarHBondContact O-OG 2.8Å; F1570-S1573 PolarHBondContact O-N 3.03Å; S1573-C1576 WeakPolarHBondContact O-CB 3.46Å; S1573-C1576 PolarHBondContact O-N 3.43Å; S1573-L1577 WeakPolarHBondContact O-CB 3.38Å; S1573-L1577 WeakPolarHBondContact O-CG 3.36Å; S1573-L1577 PolarHBondContact O-N 3.4Å
1574	V	37.1	Very low	32.4	Very low	59 Å²	59	100 Å²	100	36%	0.358	54%	0.538	S	S	.	.	H	α-helix	trans	-71.1	-35.2	176	171.4	0	0	0	0	111.7	F1570 C1576 C1578	F1570-V1574 HydrophobicContact CD1-CG2 3.85Å; F1570-V1574 HydrophobicContact CE1-CG2 3.79Å; F1570-V1574 WeakPolarHBondContact O-CB 3.17Å; F1570-V1574 WeakPolarHBondContact O-CG2 3.04Å; F1570-V1574 PolarHBondContact O-N 3.32Å; V1574-C1576 VanDerWaalsContact C-N 3.32Å; V1574-C1578 WeakPolarHBondContact O-CA 3.46Å; V1574-C1578 WeakPolarHBondContact O-CB 3.14Å; V1574-C1578 PolarHBondContact O-N 2.91Å; V1574-C1578 PolarHBondContact O-SG 3.42Å
1575	M	34.6	Very low	32.2	Very low	123 Å²	123	102.4 Å²	102.4	61%	0.606	55%	0.552	S	S	*	*	H	α-helix	trans	-77.7	-14.5	169.2	-70	-145.5	-60.4	0	0	113.9	A1571 K1579	A1571-M1575 WeakPolarHBondContact O-CA 3.2Å; A1571-M1575 WeakPolarHBondContact O-CB 3.4Å; A1571-M1575 VanDerWaalsContact O-CG 3.24Å; A1571-M1575 WeakPolarHBondContact O-CG 3.26Å; A1571-M1575 PolarHBondContact O-N 3.07Å; M1575-K1579 VanDerWaalsContact O-CB 3.24Å; M1575-K1579 WeakPolarHBondContact O-CB 3.44Å; M1575-K1579 WeakPolarHBondContact O-CD 3.41Å; M1575-K1579 WeakPolarHBondContact O-CG 3.47Å; M1575-K1579 PolarHBondContact O-N 3.11Å; M1575-K1579 VanDerWaalsContact O-N 3.16Å
1576	C	34.2	Very low	31.8	Very low	66 Å²	66	102.8 Å²	102.8	45%	0.446	56%	0.558	S	S	.	*	H	α-helix	trans	-75.7	-51.5	167.1	-163.9	0	0	0	0	109.1	K1572 S1573 V1574 C1578 K1579 L1580	K1572-C1576 WeakPolarHBondContact O-CB 3.46Å; K1572-C1576 PolarHBondContact O-N 3.1Å; S1573-C1576 WeakPolarHBondContact O-CB 3.46Å; S1573-C1576 PolarHBondContact O-N 3.43Å; V1574-C1576 VanDerWaalsContact C-N 3.32Å; C1576-C1578 PolarHBondContact O-N 2.73Å; C1576-K1579 CarbonylContact O-C 3.55Å; C1576-K1579 PolarHBondContact O-N 3.08Å; C1576-K1579 VanDerWaalsContact O-N 3.07Å; C1576-L1580 VanDerWaalsContact O-CG 3.3Å; C1576-L1580 WeakPolarHBondContact O-CG 3.2Å; C1576-L1580 PolarHBondContact O-N 2.98Å
1577	L	33.4	Very low	31.4	Very low	91 Å²	91	103.4 Å²	103.4	48%	0.476	57%	0.57	S	S	.	*	H	α-helix	trans	-57.6	-48.8	173.6	-73	162.8	0	0	0	111.7	S1573 K1579 L1580 T1581	S1573-L1577 WeakPolarHBondContact O-CB 3.38Å; S1573-L1577 WeakPolarHBondContact O-CG 3.36Å; S1573-L1577 PolarHBondContact O-N 3.4Å; L1577-K1579 VanDerWaalsContact C-N 3.27Å; L1577-K1579 PolarHBondContact O-N 2.99Å; L1577-L1580 CarbonylContact O-C 3.42Å; L1577-L1580 WeakPolarHBondContact O-CA 3.35Å; L1577-L1580 WeakPolarHBondContact O-CB 3.21Å; L1577-L1580 PolarHBondContact O-N 3.09Å; L1577-T1581 WeakPolarHBondContact O-CG2 3.41Å; L1577-T1581 PolarHBondContact O-N 2.85Å; L1577-T1581 PolarHBondContact O-OG1 3.26Å
1578	C	30.7	Very low	30.9	Very low	49 Å²	49	108.1 Å²	108.1	33%	0.331	59%	0.59	S	S	.	*	H	α-helix	trans	-65.3	-25.5	175.1	-70.3	0	0	0	0	113.2	V1574 C1576 T1581 H1582	V1574-C1578 WeakPolarHBondContact O-CA 3.46Å; V1574-C1578 WeakPolarHBondContact O-CB 3.14Å; V1574-C1578 PolarHBondContact O-N 2.91Å; V1574-C1578 PolarHBondContact O-SG 3.42Å; C1576-C1578 PolarHBondContact O-N 2.73Å; C1578-T1581 WeakPolarHBondContact CA-OG1 3.19Å; C1578-H1582 WeakPolarHBondContact O-CB 3.31Å; C1578-H1582 PolarHBondContact O-CD2 2.83Å; C1578-H1582 VanDerWaalsContact O-CG 3.31Å; C1578-H1582 PolarHBondContact O-N 3.13Å
1579	K	31.3	Very low	30.7	Very low	154 Å²	154	111.6 Å²	111.6	67%	0.67	60%	0.604	S	S	*	*	H	α-helix	trans	-78.4	-25.9	169.4	-79.7	178.1	176.7	-168	0	112.9	M1575 C1576 L1577	M1575-K1579 VanDerWaalsContact O-CB 3.24Å; M1575-K1579 WeakPolarHBondContact O-CB 3.44Å; M1575-K1579 WeakPolarHBondContact O-CD 3.41Å; M1575-K1579 WeakPolarHBondContact O-CG 3.47Å; M1575-K1579 PolarHBondContact O-N 3.11Å; M1575-K1579 VanDerWaalsContact O-N 3.16Å; C1576-K1579 CarbonylContact O-C 3.55Å; C1576-K1579 PolarHBondContact O-N 3.08Å; C1576-K1579 VanDerWaalsContact O-N 3.07Å; L1577-K1579 VanDerWaalsContact C-N 3.27Å; L1577-K1579 PolarHBondContact O-N 2.99Å
1580	L	29.2	Very low	30.2	Very low	94 Å²	94	116 Å²	116	49%	0.492	62%	0.624	S	S	.	*	H	α-helix	trans	-79.2	-19.4	170.9	-67.5	163.1	0	0	0	112.4	C1576 L1577	C1576-L1580 VanDerWaalsContact O-CG 3.3Å; C1576-L1580 WeakPolarHBondContact O-CG 3.2Å; C1576-L1580 PolarHBondContact O-N 2.98Å; L1577-L1580 CarbonylContact O-C 3.42Å; L1577-L1580 WeakPolarHBondContact O-CA 3.35Å; L1577-L1580 WeakPolarHBondContact O-CB 3.21Å; L1577-L1580 PolarHBondContact O-N 3.09Å
1581	T	28.7	Very low	29.6	Very low	96 Å²	96	118.7 Å²	118.7	59%	0.589	64%	0.642	S	S	*	*	S	Bend	trans	-108.5	4.8	174.5	67.5	0	0	0	0	114.4	L1577 C1578	L1577-T1581 WeakPolarHBondContact O-CG2 3.41Å; L1577-T1581 PolarHBondContact O-N 2.85Å; L1577-T1581 PolarHBondContact O-OG1 3.26Å; C1578-T1581 WeakPolarHBondContact CA-OG1 3.19Å
1582	H	28.6	Very low	29	Very low	143 Å²	143	126.1 Å²	126.1	66%	0.662	67%	0.666	S	S	*	*			trans	-128.9	38.7	172.3	-62.6	-54.4	0	0	0	111.9	C1578	C1578-H1582 WeakPolarHBondContact O-CB 3.31Å; C1578-H1582 PolarHBondContact O-CD2 2.83Å; C1578-H1582 VanDerWaalsContact O-CG 3.31Å; C1578-H1582 PolarHBondContact O-N 3.13Å
1583	Q	26.2	Very low	28.5	Very low	153 Å²	153	127.2 Å²	127.2	72%	0.715	67%	0.674	S	S	*	*	S	Bend	trans	-94.7	130.5	140.1	-69.3	-171.5	-66.9	0	0	106.9	L1585	Q1583-L1585 PolarHBondContact O-N 3.25Å
1584	D	24.3	Very low	27.8	Very low	165 Å²	165	129.7 Å²	129.7	88%	0.882	69%	0.691	S	S	*	*			trans	-69.6	98.2	-173.1	-62.8	-65.9	0	0	0	111.9
1585	L	24.3	Very low	27.2	Very low	164 Å²	164	132 Å²	132	86%	0.859	71%	0.71	S	S	*	*			trans	-103.8	91.1	167.7	-82.8	161	0	0	0	108.9	Q1583	Q1583-L1585 PolarHBondContact O-N 3.25Å
1586	S	25.1	Very low	26.7	Very low	97 Å²	97	133.7 Å²	133.7	68%	0.678	72%	0.722	S	S	*	*			trans	-57.7	133.4	172.7	-177.5	0	0	0	0	110.2	N1588	S1586-N1588 VanDerWaalsContact C-N 3.26Å; S1586-N1588 PolarHBondContact O-N 2.77Å
1587	P	23.8	Very low	26.2	Very low	122 Å²	122	135.3 Å²	135.3	79%	0.792	73%	0.733	S	S	*	*	S	Bend	trans	-77.9	71.2	-176.7	33.1	-36.4	0	0	0	112.1
1588	N	25.1	Very low	25.7	Very low	138 Å²	138	142.3 Å²	142.3	74%	0.738	75%	0.753	S	S	*	*			trans	-156.9	151.8	163.5	-92.1	-50	0	0	0	109.5	S1586	S1586-N1588 VanDerWaalsContact C-N 3.26Å; S1586-N1588 PolarHBondContact O-N 2.77Å
1589	N	25.7	Very low	25.3	Very low	155 Å²	155	149 Å²	149	83%	0.829	78%	0.777	S	S	*	*			trans	69.5	80	-179.2	-54.1	-22.5	0	0	0	116.9
1590	L	26.1	Very low	24.9	Very low	175 Å²	175	146.3 Å²	146.3	92%	0.916	78%	0.778	S	S	*	*			trans	-163.5	48.3	137.6	-110.6	173.4	0	0	0	113.2
1591	L	23.4	Very low	24.6	Very low	173 Å²	173	149.2 Å²	149.2	91%	0.906	79%	0.793	S	S	*	*			trans	-132.7	80	171.2	-94.9	176.4	0	0	0	111.2
1592	K	24.4	Very low	24.3	Very low	204 Å²	204	149.2 Å²	149.2	89%	0.887	80%	0.797	S	S	*	*			trans	173.4	114.9	155.7	-100.5	157.4	-175.3	176.2	0	109.7
1593	E	24.3	Very low	24.3	Very low	187 Å²	187	152.7 Å²	152.7	87%	0.874	80%	0.804	S	S	*	*				-176.5	160.9	120	-106.8	-173	-170.1	0	0	113.7
1594	S	24.4	Very low	24.5	Very low	115 Å²	115	151.4 Å²	151.4	80%	0.804	81%	0.809	S	S	*	*			trans	62.4	68.1	165.9	69.1	0	0	0	0	118.6	N1596	S1594-N1596 PolarHBondContact O-N 2.79Å
1595	S	24.4	Very low	24.6	Very low	109 Å²	109	147.2 Å²	147.2	76%	0.762	79%	0.792	S	S	*	*			trans	-58.8	128.6	150.4	55.3	0	0	0	0	111.6
1596	N	23.2	Very low	24.5	Very low	158 Å²	158	146.5 Å²	146.5	85%	0.845	79%	0.788	S	S	*	*			trans	-171	157.7	146	-107.8	-48.6	0	0	0	114.8	S1594	S1594-N1596 PolarHBondContact O-N 2.79Å
1597	S	24.1	Very low	24.4	Very low	99 Å²	99	149.6 Å²	149.6	69%	0.692	79%	0.792	S	S	*	*			trans	46.1	101.9	172.3	48.6	0	0	0	0	117
1598	R	22.1	Very low	24.3	Very low	238 Å²	238	149.7 Å²	149.7	90%	0.898	78%	0.784	S	S	*	*				53.2	136.7	62.5	-53.9	-173.6	177.2	-170.7	-0.1	115.3
1599	K	23.7	Very low	24.1	Very low	191 Å²	191	149.9 Å²	149.9	83%	0.83	79%	0.785	S	S	*	*			trans	96.7	83.5	159	-62.6	179.9	177.7	178.1	0	119.5
1600	S	22	Very low	24	Very low	97 Å²	97	146 Å²	146	68%	0.678	77%	0.771	S	S	*	*				56.8	141.7	104.1	70.2	0	0	0	0	122.1
1601	L	22.6	Very low	23.8	Very low	155 Å²	155	145.4 Å²	145.4	81%	0.812	76%	0.763	S	S	*	*			trans	137.9	104.6	134.1	-80.9	155.7	0	0	0	115.6
1602	S	22.9	Very low	23.7	Very low	96 Å²	96	143.5 Å²	143.5	67%	0.671	75%	0.752	S	S	*	*			trans	57.1	115.3	133.7	62.2	0	0	0	0	122.4
1603	R	28.8	Very low	23.6	Very low	216 Å²	216	140 Å²	140	82%	0.815	74%	0.739	S	S	*	*				24.3	145.1	102.4	-108.3	-165.2	175.7	178.4	2.1	117.7
1604	P	29.2	Very low	23.4	Very low	126 Å²	126	140.7 Å²	140.7	82%	0.818	73%	0.733	S	S	*	*				-141	168.1	61	39.4	-23	0	0	0	117.7
1605	S	26.3	Very low	23.3	Very low	76 Å²	76	140.3 Å²	140.3	53%	0.531	73%	0.727	S	S	.	*			trans	-79.5	168.3	169.6	-32.9	0	0	0	0	112.8
1606	I	22.7	Very low	23.1	Very low	150 Å²	150	144.3 Å²	144.3	77%	0.769	73%	0.73	S	S	*	*			trans	-168	122.5	135.9	-93.9	143.9	0	0	0	105.5
1607	Q	22.4	Very low	23.1	Very low	162 Å²	162	141.7 Å²	141.7	76%	0.757	73%	0.731	S	S	*	*			cis	97.9	149.3	36.7	-165.2	-158.1	-13.8	0	0	112
1608	I	22.5	Very low	23	Very low	123 Å²	123	140.4 Å²	140.4	63%	0.631	73%	0.733	S	S	*	*			trans	99.4	99.7	161.6	-54.4	174.9	0	0	0	116.3
1609	D	21.7	Very low	23.1	Very low	142 Å²	142	136.4 Å²	136.4	76%	0.759	73%	0.729	S	S	*	*				49.9	150.9	126.3	-62.7	-39.7	0	0	0	123.1
1610	S	22.8	Very low	23.1	Very low	75 Å²	75	134.3 Å²	134.3	52%	0.524	73%	0.726	S	S	.	*			cis	-177.5	-173.8	-15	57.1	0	0	0	0	110.7
1611	Q	22.3	Very low	23.1	Very low	161 Å²	161	138.2 Å²	138.2	75%	0.752	73%	0.733	S	S	*	*			trans	81.7	120.2	143.9	-81.2	172.8	71.9	0	0	122.5
1612	I	20.9	Very low	23.2	Very low	133 Å²	133	136.5 Å²	136.5	68%	0.682	73%	0.733	S	S	*	*				100.1	88.7	127	-67.8	168.1	0	0	0	121.4
1613	H	22.3	Very low	23.4	Very low	130 Å²	130	137.3 Å²	137.3	60%	0.602	74%	0.736	S	S	*	*				57.1	133	99.4	-128.2	-38	0	0	0	123.2
1614	W	20.5	Very low	23.1	Very low	202 Å²	202	133.1 Å²	133.1	77%	0.765	73%	0.734	S	S	*	*			trans	72.8	158.5	160.3	-41.5	109.1	0	0	0	117.3
1615	T	21.2	Very low	22.8	Very low	108 Å²	108	132.8 Å²	132.8	66%	0.663	74%	0.735	S	S	*	*			cis	-167	154.2	-23.3	27.9	0	0	0	0	111.9
1616	K	21.3	Very low	22.7	Very low	192 Å²	192	132.4 Å²	132.4	84%	0.835	74%	0.743	S	S	*	*			trans	58.2	122	142.7	-80.2	-171.1	170.6	-173.4	0	121.8
1617	A	22.2	Very low	22.7	Very low	104 Å²	104	130.3 Å²	130.3	86%	0.86	74%	0.741	S	S	*	*				73.3	151.5	120.3	0	0	0	0	0	120.5
1618	G	23.6	Very low	22.7	Very low	72 Å²	72	128.1 Å²	128.1	74%	0.742	74%	0.739	S	S	*	*			trans	145.2	80.4	166.6	0	0	0	0	0	113.6
1619	D	22.5	Very low	22.7	Very low	153 Å²	153	129.8 Å²	129.8	82%	0.818	75%	0.745	S	S	*	*			trans	-58.5	151.9	159	-48.2	-100.3	0	0	0	110.5
1620	I	23.9	Very low	22.7	Very low	148 Å²	148	131.4 Å²	131.4	76%	0.759	75%	0.748	S	S	*	*				171.9	113.5	125.2	-87.1	155.3	0	0	0	111
1621	E	23	Very low	22.8	Very low	178 Å²	178	133.1 Å²	133.1	83%	0.832	76%	0.755	S	S	*	*			trans	46.6	123.1	138.5	-48.9	-173.8	127.5	0	0	122.4
1622	C	24.1	Very low	23	Very low	119 Å²	119	134 Å²	134	80%	0.804	76%	0.759	S	S	*	*			trans	-41.7	158.5	143.6	-71.9	0	0	0	0	112.7
1623	P	27.9	Very low	23.4	Very low	113 Å²	113	134.9 Å²	134.9	73%	0.734	77%	0.765	S	S	*	*				-161.6	156.2	56.8	43.8	-21.6	0	0	0	121.7
1624	V	22.7	Very low	23.7	Very low	129 Å²	129	136.8 Å²	136.8	78%	0.782	77%	0.774	S	S	*	*			trans	69.2	140	131.6	168.4	0	0	0	0	122.1
1625	S	22.4	Very low	23.9	Very low	118 Å²	118	132 Å²	132	83%	0.825	76%	0.76	S	S	*	*			trans	82.3	152.1	156.3	70.3	0	0	0	0	120
1626	G	23.8	Very low	24.5	Very low	68 Å²	68	134.2 Å²	134.2	70%	0.701	77%	0.773	S	S	*	*			trans	83.8	110.7	-166.8	0	0	0	0	0	110.7
1627	S	21.9	Very low	24.7	Very low	106 Å²	106	132.5 Å²	132.5	74%	0.741	76%	0.761	S	S	*	*			cis	66.8	135.8	33.4	89.4	0	0	0	0	114.4
1628	T	22.8	Very low	24.9	Very low	117 Å²	117	133.1 Å²	133.1	72%	0.718	76%	0.755	S	S	*	*			trans	59.1	145.4	178.6	56.5	0	0	0	0	114.4
1629	E	22.7	Very low	24.9	Very low	158 Å²	158	138.1 Å²	138.1	74%	0.738	76%	0.763	S	S	*	*			cis	-166	-177.9	-17.7	-113.5	153.1	-179.7	0	0	105.1
1630	E	23	Very low	25.3	Very low	176 Å²	176	135.2 Å²	135.2	82%	0.822	76%	0.761	S	S	*	*			trans	18.6	129.7	152.1	-53.6	174.4	168	0	0	119.3
1631	V	24.5	Very low	25.4	Very low	111 Å²	111	135.5 Å²	135.5	67%	0.673	76%	0.764	S	S	*	*				175	122.7	84.2	161.3	0	0	0	0	106.2
1632	E	25.4	Very low	25.5	Very low	180 Å²	180	132.1 Å²	132.1	84%	0.841	76%	0.76	S	S	*	*				62.9	-177.8	106.2	-43.9	-164.6	119.5	0	0	117.6
1633	D	30.2	Very low	25.6	Very low	150 Å²	150	134 Å²	134	80%	0.802	76%	0.76	S	S	*	*			trans	62.5	100.6	-172.5	-61.7	-16	0	0	0	115.4
1634	E	27.5	Very low	25.6	Very low	170 Å²	170	135.3 Å²	135.3	79%	0.794	76%	0.759	S	S	*	*			cis	68	147.9	25.8	-169.1	55.3	-99.6	0	0	114.8
1635	E	24.9	Very low	25.7	Very low	103 Å²	103	135.6 Å²	135.6	48%	0.481	76%	0.757	S	S	.	*			trans	64.6	58.2	171.3	-79.6	-167.9	158.5	0	0	120.8	R1637	E1635-R1637 VanDerWaalsContact C-CB 3.44Å; E1635-R1637 HydrophobicContact CB-CB 4.18Å; E1635-R1637 VanDerWaalsContact CD-CZ 3.42Å; E1635-R1637 HydrophobicContact CG-CB 4.39Å; E1635-R1637 HydrophobicContact CG-CG 4.3Å; E1635-R1637 WeakPolarHBondContact O-CB 3.48Å; E1635-R1637 IonicContact OE1-CZ 3.89Å; E1635-R1637 IonicContact OE1-NE 2.67Å; E1635-R1637 IonicContact OE1-NH1 3.63Å; E1635-R1637 PolarHBondContact OE1-NH1 2.94Å; E1635-R1637 IonicContact OE1-NH2 2.63Å; E1635-R1637 PolarHBondContact OE1-NH2 3.18Å; E1635-R1637 IonicContact OE2-CZ 3.2Å; E1635-R1637 IonicContact OE2-NH1 2.72Å; E1635-R1637 PolarHBondContact OE2-NH1 2.65Å
1636	V	33.3	Very low	25.9	Very low	154 Å²	154	137.1 Å²	137.1	93%	0.933	76%	0.755	S	S	*	*			trans	-125.4	67.7	137	-170.7	0	0	0	0	109.1
1637	R	25.5	Very low	25.9	Very low	156 Å²	156	138.2 Å²	138.2	59%	0.589	75%	0.752	S	S	*	*				71.1	93.9	53.2	-155.4	-175.4	-174.1	136.5	31.9	113.9	E1635	E1635-R1637 VanDerWaalsContact C-CB 3.44Å; E1635-R1637 HydrophobicContact CB-CB 4.18Å; E1635-R1637 VanDerWaalsContact CD-CZ 3.42Å; E1635-R1637 HydrophobicContact CG-CB 4.39Å; E1635-R1637 HydrophobicContact CG-CG 4.3Å; E1635-R1637 WeakPolarHBondContact O-CB 3.48Å; E1635-R1637 IonicContact OE1-CZ 3.89Å; E1635-R1637 IonicContact OE1-NE 2.67Å; E1635-R1637 IonicContact OE1-NH1 3.63Å; E1635-R1637 PolarHBondContact OE1-NH1 2.94Å; E1635-R1637 IonicContact OE1-NH2 2.63Å; E1635-R1637 PolarHBondContact OE1-NH2 3.18Å; E1635-R1637 IonicContact OE2-CZ 3.2Å; E1635-R1637 IonicContact OE2-NH1 2.72Å; E1635-R1637 PolarHBondContact OE2-NH1 2.65Å
1638	T	26.4	Very low	26	Very low	117 Å²	117	138.9 Å²	138.9	72%	0.718	76%	0.755	S	S	*	*			trans	49.7	111.2	149.7	62.8	0	0	0	0	120
1639	L	25.1	Very low	26.1	Very low	177 Å²	177	137.5 Å²	137.5	93%	0.927	75%	0.75	S	S	*	*			trans	-168.5	150.1	136.5	-105.9	156.2	0	0	0	111.3
1640	A	29.8	Very low	26.1	Very low	92 Å²	92	138.3 Å²	138.3	76%	0.76	75%	0.754	S	S	*	*			trans	47.3	96.6	178.7	0	0	0	0	0	116.5
1641	N	25.6	Very low	26.1	Very low	153 Å²	153	135.3 Å²	135.3	82%	0.818	75%	0.748	S	S	*	*			cis	64.6	124.6	16.3	-93.6	-7.6	0	0	0	117.8
1642	S	25.8	Very low	26.1	Very low	107 Å²	107	135.3 Å²	135.3	75%	0.748	75%	0.748	S	S	*	*			trans	87.8	148.8	154.8	-55.3	0	0	0	0	120.5
1643	I	26	Very low	26	Very low	158 Å²	158	133.4 Å²	133.4	81%	0.81	74%	0.744	S	S	*	*			trans	81.1	131.7	177.2	-55.1	175.1	0	0	0	114
1644	I	29.3	Very low	25.7	Very low	141 Å²	141	131.2 Å²	131.2	72%	0.723	74%	0.736	S	S	*	*			cis	-167.1	128.8	-29.6	-122.1	159.9	0	0	0	106.1
1645	D	25	Very low	25.5	Very low	136 Å²	136	129 Å²	129	73%	0.727	73%	0.729	S	S	*	*				59.5	107.6	75.6	-98.4	-10.7	0	0	0	113.6
1646	L	25.7	Very low	25.5	Very low	149 Å²	149	133.4 Å²	133.4	78%	0.78	74%	0.741	S	S	*	*				171.3	137.3	78.7	-84	139.3	0	0	0	106.4
1647	S	24.2	Very low	25.1	Very low	92 Å²	92	132 Å²	132	64%	0.643	73%	0.727	S	S	*	*				85.4	135.8	65.4	95.1	0	0	0	0	116.3
1648	C	23.4	Very low	25.1	Very low	119 Å²	119	130.2 Å²	130.2	80%	0.804	73%	0.73	S	S	*	*			trans	69	172.1	171.2	-66	0	0	0	0	118.4
1649	S	24.2	Very low	25.2	Very low	89 Å²	89	130.3 Å²	130.3	62%	0.622	73%	0.731	S	S	*	*				178	148.5	-64.8	58.9	0	0	0	0	112.5
1650	Q	24.3	Very low	25.2	Very low	175 Å²	175	128.9 Å²	128.9	82%	0.818	72%	0.723	S	S	*	*			trans	81	162.3	162.2	-52.4	-172.2	17.7	0	0	120.5
1651	T	23.2	Very low	24.9	Very low	112 Å²	112	128.7 Å²	128.7	69%	0.687	72%	0.716	S	S	*	*			trans	77.7	95.5	152.4	36.5	0	0	0	0	122.2
1652	T	22.8	Very low	25.1	Very low	111 Å²	111	127 Å²	127	68%	0.681	71%	0.711	S	S	*	*				55.6	143.5	115	55.8	0	0	0	0	123
1653	D	23.9	Very low	25.1	Very low	140 Å²	140	129.6 Å²	129.6	75%	0.749	71%	0.712	S	S	*	*			trans	72.3	147.1	149.3	-62.5	-6	0	0	0	118.6
1654	T	23.9	Very low	25.1	Very low	105 Å²	105	131.1 Å²	131.1	64%	0.644	72%	0.715	S	S	*	*			cis	-166.1	157.7	-25.4	33.4	0	0	0	0	110.7
1655	L	23.8	Very low	24.9	Very low	123 Å²	123	129.3 Å²	129.3	64%	0.644	72%	0.715	S	S	*	*			trans	67.2	127.6	138.1	-76.4	166.2	0	0	0	122.4
1656	R	24.7	Very low	25	Very low	196 Å²	196	130.9 Å²	130.9	74%	0.74	72%	0.724	S	S	*	*			trans	82.7	160.6	136.7	-64.9	170.4	166.1	145.8	-0.2	119
1657	L	25.6	Very low	25	Very low	123 Å²	123	127.5 Å²	127.5	64%	0.644	72%	0.717	S	S	*	*			cis	-147.8	123.4	-4.5	-138.1	43.9	0	0	0	104.1
1658	D	25.8	Very low	24.9	Very low	120 Å²	120	130.2 Å²	130.2	64%	0.642	72%	0.723	S	S	*	*				89.7	135.1	82.5	-80.7	27	0	0	0	115.3
1659	T	26.8	Very low	24.9	Very low	119 Å²	119	131.6 Å²	131.6	73%	0.73	72%	0.717	S	S	*	*			trans	72.2	149.1	140	64.6	0	0	0	0	119.6
1660	L	25.4	Very low	24.9	Very low	146 Å²	146	132.1 Å²	132.1	76%	0.764	72%	0.721	S	S	*	*			cis	-157.9	158.4	-5.9	-113.8	160.1	0	0	0	110.1
1661	S	25	Very low	24.9	Very low	88 Å²	88	126.8 Å²	126.8	62%	0.615	71%	0.713	S	S	*	*			trans	5.7	159.3	151.3	-51.4	0	0	0	0	121.4
1662	T	28.1	Very low	25	Very low	117 Å²	117	130.1 Å²	130.1	72%	0.718	72%	0.718	S	S	*	*			cis	-164.8	161.3	39.1	-32.1	0	0	0	0	112.7
1663	E	26.3	Very low	25.1	Very low	162 Å²	162	132.4 Å²	132.4	76%	0.757	73%	0.726	S	S	*	*			trans	-14.3	139.8	160.3	-57	160.4	-166.8	0	0	118.8
1664	Q	25.5	Very low	25.2	Very low	190 Å²	190	131.3 Å²	131.3	89%	0.888	72%	0.72	S	S	*	*				-170.7	164.9	103	-101.2	170.3	18	0	0	113.6
1665	S	26.5	Very low	25.2	Very low	103 Å²	103	131.6 Å²	131.6	72%	0.72	73%	0.726	S	S	*	*			trans	-100.8	144.9	-178.5	54.3	0	0	0	0	112.4
1666	D	26.5	Very low	25.5	Very low	170 Å²	170	129.2 Å²	129.2	91%	0.909	72%	0.724	S	S	*	*			trans	-166	179.3	149	-109.9	-28.1	0	0	0	113.3
1667	A	25.1	Very low	25.5	Very low	77 Å²	77	127.1 Å²	127.1	64%	0.636	73%	0.728	S	S	*	*			trans	-11.3	135.5	173.1	0	0	0	0	0	118.7
1668	I	22.9	Very low	25.6	Very low	150 Å²	150	127.8 Å²	127.8	77%	0.769	73%	0.732	S	S	*	*				61.2	129.2	61.7	-52.6	171.8	0	0	0	112.5
1669	H	24	Very low	25.8	Very low	147 Å²	147	127 Å²	127	68%	0.681	74%	0.736	S	S	*	*			trans	64.5	153.1	-175.3	-71.2	-74.1	0	0	0	115.8	D1684	H1669-D1684 IonicContact CE1-OD2 3.97Å; H1669-D1684 PolarHBondContact CE1-OD2 3.35Å; H1669-D1684 VanDerWaalsContact CE1-OD2 3.28Å; H1669-D1684 IonicContact ND1-OD2 2.62Å; H1669-D1684 PolarHBondContact ND1-OD2 3.5Å
1670	S	23.4	Very low	25.9	Very low	100 Å²	100	128.2 Å²	128.2	70%	0.699	74%	0.738	S	S	*	*			cis	-175.3	172.3	-35.4	47.6	0	0	0	0	107.2
1671	G	24.8	Very low	26.2	Very low	64 Å²	64	130.1 Å²	130.1	66%	0.66	74%	0.743	S	S	*	*			trans	110.6	126.7	-178.4	0	0	0	0	0	111.9
1672	F	24.6	Very low	26.5	Very low	182 Å²	182	131.8 Å²	131.8	80%	0.798	75%	0.745	S	S	*	*			cis	57	88.8	16.7	-94.7	-76.4	0	0	0	113.5	L1674	F1672-L1674 HydrophobicContact CD1-CG 4.45Å
1673	D	24.5	Very low	26.5	Very low	158 Å²	158	132.9 Å²	132.9	85%	0.845	75%	0.746	S	S	*	*			trans	-149.3	91	172.1	-163.3	24.8	0	0	0	104.5
1674	L	26.3	Very low	26.6	Very low	117 Å²	117	129.4 Å²	129.4	61%	0.613	73%	0.732	S	S	*	*				62.6	67.4	50.8	-62.7	178.3	0	0	0	114.3	F1672 A1676	F1672-L1674 HydrophobicContact CD1-CG 4.45Å; L1674-A1676 VanDerWaalsContact C-N 3.35Å; L1674-A1676 PolarHBondContact O-N 2.93Å
1675	S	24.4	Very low	26.9	Very low	112 Å²	112	123.9 Å²	123.9	78%	0.783	71%	0.714	S	S	*	*				-61.9	106.9	121	56.8	0	0	0	0	106.5
1676	A	29.2	Very low	27.2	Very low	72 Å²	72	123.2 Å²	123.2	60%	0.595	71%	0.706	S	S	*	*				57.7	125.4	65.6	0	0	0	0	0	110.3	L1674	L1674-A1676 VanDerWaalsContact C-N 3.35Å; L1674-A1676 PolarHBondContact O-N 2.93Å
1677	D	25	Very low	27.3	Very low	152 Å²	152	117.9 Å²	117.9	81%	0.813	69%	0.686	S	S	*	*	S	Bend	cis	-95.1	128.1	29.7	-65.9	-48.5	0	0	0	117.7
1678	N	28.1	Very low	27.6	Very low	138 Å²	138	117.1 Å²	117.1	74%	0.738	68%	0.679	S	S	*	*	S	Bend	trans	77.2	122.8	151.7	-56.1	-44.5	0	0	0	123.2
1679	S	29.7	Very low	28.2	Very low	104 Å²	104	115 Å²	115	73%	0.727	67%	0.666	S	S	*	*			trans	66.4	87.6	144.8	57.4	0	0	0	0	121.4
1680	D	28.1	Very low	28.6	Very low	144 Å²	144	113.7 Å²	113.7	77%	0.77	66%	0.664	S	S	*	*				27.5	119.4	118.9	-41.2	-30.7	0	0	0	120.5
1681	Q	31.6	Very low	29	Very low	186 Å²	186	113.3 Å²	113.3	87%	0.869	66%	0.657	S	S	*	*				-172.1	98.7	126.4	-105.1	165.5	36.7	0	0	114.6
1682	D	31.1	Very low	29.8	Very low	123 Å²	123	112.9 Å²	112.9	66%	0.658	64%	0.643	S	S	*	*			trans	40.3	76.8	142.4	-55.3	-12.1	0	0	0	121.3	D1684 S1685	D1682-D1684 PolarHBondContact O-N 2.85Å; D1682-S1685 WeakPolarHBondContact O-CB 3.44Å; D1682-S1685 PolarHBondContact O-N 3.19Å; D1682-S1685 PolarHBondContact O-OG 2.79Å
1683	L	29.3	Very low	30.4	Very low	140 Å²	140	107.6 Å²	107.6	73%	0.733	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-21.1	160.4	-90.8	153.6	0	0	0	114.2	S1685 V1686	L1683-S1685 PolarHBondContact O-N 2.99Å; L1683-V1686 PolarHBondContact O-N 3.32Å; L1683-V1686 VanDerWaalsContact O-N 3.15Å
1684	D	28.2	Very low	30.8	Very low	89 Å²	89	104.9 Å²	104.9	48%	0.476	61%	0.613	S	S	.	*	H	α-helix	trans	-62.3	-22.7	176.5	-78.6	-14.4	0	0	0	112.5	H1669 D1682 V1686 A1688	H1669-D1684 IonicContact CE1-OD2 3.97Å; H1669-D1684 PolarHBondContact CE1-OD2 3.35Å; H1669-D1684 VanDerWaalsContact CE1-OD2 3.28Å; H1669-D1684 IonicContact ND1-OD2 2.62Å; H1669-D1684 PolarHBondContact ND1-OD2 3.5Å; D1682-D1684 PolarHBondContact O-N 2.85Å; D1684-V1686 VanDerWaalsContact C-N 3.34Å; D1684-V1686 PolarHBondContact O-N 3.41Å; D1684-A1688 VanDerWaalsContact O-CB 3.28Å; D1684-A1688 WeakPolarHBondContact O-CB 3.48Å; D1684-A1688 PolarHBondContact O-N 3.28Å
1685	S	32.2	Very low	31.1	Very low	73 Å²	73	103.8 Å²	103.8	51%	0.51	61%	0.607	S	S	.	*	H	α-helix	trans	-61.3	-38.3	173.9	63	0	0	0	0	113	D1682 L1683 Q1689	D1682-S1685 WeakPolarHBondContact O-CB 3.44Å; D1682-S1685 PolarHBondContact O-N 3.19Å; D1682-S1685 PolarHBondContact O-OG 2.79Å; L1683-S1685 PolarHBondContact O-N 2.99Å; S1685-Q1689 WeakPolarHBondContact O-CB 3.42Å; S1685-Q1689 PolarHBondContact O-N 2.85Å
1686	V	32.1	Very low	31.8	Very low	90 Å²	90	102.4 Å²	102.4	55%	0.545	59%	0.588	S	S	.	*	H	α-helix	trans	-75.6	-38.5	-177.8	-177.8	0	0	0	0	110.9	L1683 D1684 Q1689 L1690	L1683-V1686 PolarHBondContact O-N 3.32Å; L1683-V1686 VanDerWaalsContact O-N 3.15Å; D1684-V1686 VanDerWaalsContact C-N 3.34Å; D1684-V1686 PolarHBondContact O-N 3.41Å; V1686-Q1689 PolarHBondContact O-N 2.97Å; V1686-L1690 PolarHBondContact O-N 3.49Å
1687	A	28.7	Very low	32	Very low	58 Å²	58	104.2 Å²	104.2	48%	0.479	59%	0.588	S	S	.	*	H	α-helix	trans	-66.1	-42	173.4	0	0	0	0	0	111.6	L1690 V1691	A1687-L1690 PolarHBondContact O-N 3.45Å; A1687-V1691 WeakPolarHBondContact O-CG2 3.4Å; A1687-V1691 PolarHBondContact O-N 3.38Å
1688	A	32.1	Very low	32.3	Very low	61 Å²	61	98.9 Å²	98.9	50%	0.504	57%	0.565	S	S	.	*	H	α-helix	trans	-63.4	-41.8	174.3	0	0	0	0	0	112.2	D1684 V1691 S1692	D1684-A1688 VanDerWaalsContact O-CB 3.28Å; D1684-A1688 WeakPolarHBondContact O-CB 3.48Å; D1684-A1688 PolarHBondContact O-N 3.28Å; A1688-V1691 PolarHBondContact O-N 2.87Å; A1688-S1692 VanDerWaalsContact O-CB 3.25Å; A1688-S1692 WeakPolarHBondContact O-CB 3.38Å; A1688-S1692 PolarHBondContact O-N 2.83Å
1689	Q	35.5	Very low	32.5	Very low	105 Å²	105	97.6 Å²	97.6	49%	0.491	55%	0.553	S	S	.	*	H	α-helix	trans	-64.4	-44.1	175.9	-168.7	65	47.7	0	0	111.4	S1685 V1686 V1691 S1692 D1693	S1685-Q1689 WeakPolarHBondContact O-CB 3.42Å; S1685-Q1689 PolarHBondContact O-N 2.85Å; V1686-Q1689 PolarHBondContact O-N 2.97Å; Q1689-V1691 VanDerWaalsContact C-N 3.35Å; Q1689-V1691 PolarHBondContact O-N 3.44Å; Q1689-S1692 PolarHBondContact O-N 2.79Å; Q1689-D1693 PolarHBondContact NE2-OD1 2.95Å; Q1689-D1693 WeakPolarHBondContact O-CB 3.28Å; Q1689-D1693 VanDerWaalsContact O-CG 3.24Å; Q1689-D1693 PolarHBondContact O-N 3.4Å
1690	L	31.8	Very low	32.8	Very low	120 Å²	120	96.6 Å²	96.6	63%	0.628	54%	0.539	S	S	*	.	H	α-helix	trans	-62.8	-40.6	178.5	-138.3	79.2	0	0	0	112.3	V1686 A1687 V1694	V1686-L1690 PolarHBondContact O-N 3.49Å; A1687-L1690 PolarHBondContact O-N 3.45Å; L1690-V1694 WeakPolarHBondContact O-CB 3.37Å; L1690-V1694 VanDerWaalsContact O-CG2 3.28Å; L1690-V1694 WeakPolarHBondContact O-CG2 3.35Å; L1690-V1694 PolarHBondContact O-N 3.01Å; L1690-V1694 VanDerWaalsContact O-N 3.08Å
1691	V	32.3	Very low	32.9	Very low	91 Å²	91	97 Å²	97	55%	0.552	53%	0.531	S	S	*	.	H	α-helix	trans	-69.6	-38.2	175.5	170.5	0	0	0	0	111.3	A1687 A1688 Q1689 L1695	A1687-V1691 WeakPolarHBondContact O-CG2 3.4Å; A1687-V1691 PolarHBondContact O-N 3.38Å; A1688-V1691 PolarHBondContact O-N 2.87Å; Q1689-V1691 VanDerWaalsContact C-N 3.35Å; Q1689-V1691 PolarHBondContact O-N 3.44Å; V1691-L1695 HydrophobicContact CG1-CD1 4.02Å; V1691-L1695 WeakPolarHBondContact O-CB 3.32Å; V1691-L1695 PolarHBondContact O-N 2.96Å
1692	S	40.2	Very low	32.7	Very low	55 Å²	55	94.6 Å²	94.6	39%	0.385	52%	0.518	S	S	.	.	H	α-helix	trans	-66.1	-44.3	175.1	-169.1	0	0	0	0	111.5	A1688 Q1689 V1694 L1695 E1696	A1688-S1692 VanDerWaalsContact O-CB 3.25Å; A1688-S1692 WeakPolarHBondContact O-CB 3.38Å; A1688-S1692 PolarHBondContact O-N 2.83Å; Q1689-S1692 PolarHBondContact O-N 2.79Å; S1692-V1694 VanDerWaalsContact C-N 3.33Å; S1692-V1694 PolarHBondContact O-N 3.18Å; S1692-L1695 CarbonylContact O-C 3.54Å; S1692-L1695 PolarHBondContact O-N 2.79Å; S1692-E1696 WeakPolarHBondContact O-CB 3.48Å; S1692-E1696 PolarHBondContact O-N 2.94Å
1693	D	37.5	Very low	32.7	Very low	72 Å²	72	92.2 Å²	92.2	39%	0.385	51%	0.511	S	S	.	.	H	α-helix	trans	-66.2	-35.9	179.1	-69.7	-15	0	0	0	111.5	Q1689 N1697	Q1689-D1693 PolarHBondContact NE2-OD1 2.95Å; Q1689-D1693 WeakPolarHBondContact O-CB 3.28Å; Q1689-D1693 VanDerWaalsContact O-CG 3.24Å; Q1689-D1693 PolarHBondContact O-N 3.4Å; D1693-N1697 VanDerWaalsContact O-CB 3.27Å; D1693-N1697 WeakPolarHBondContact O-CB 3.3Å; D1693-N1697 PolarHBondContact O-N 3.45Å; D1693-N1697 PolarHBondContact O-ND2 3.04Å
1694	V	32.7	Very low	32.6	Very low	101 Å²	101	91.5 Å²	91.5	61%	0.612	51%	0.508	S	S	*	.	H	α-helix	trans	-67.2	-40.7	172	168.7	0	0	0	0	111.3	L1690 S1692 A1698	L1690-V1694 WeakPolarHBondContact O-CB 3.37Å; L1690-V1694 VanDerWaalsContact O-CG2 3.28Å; L1690-V1694 WeakPolarHBondContact O-CG2 3.35Å; L1690-V1694 PolarHBondContact O-N 3.01Å; L1690-V1694 VanDerWaalsContact O-N 3.08Å; S1692-V1694 VanDerWaalsContact C-N 3.33Å; S1692-V1694 PolarHBondContact O-N 3.18Å; V1694-A1698 VanDerWaalsContact O-CB 3.3Å; V1694-A1698 WeakPolarHBondContact O-CB 3.35Å; V1694-A1698 PolarHBondContact O-N 3.46Å
1695	L	33.3	Very low	32.6	Very low	94 Å²	94	95 Å²	95	49%	0.492	52%	0.521	S	S	.	.	H	α-helix	trans	-71.1	-34.4	175.7	-86.1	162.7	0	0	0	113.2	V1691 S1692 A1698 K1699	V1691-L1695 HydrophobicContact CG1-CD1 4.02Å; V1691-L1695 WeakPolarHBondContact O-CB 3.32Å; V1691-L1695 PolarHBondContact O-N 2.96Å; S1692-L1695 CarbonylContact O-C 3.54Å; S1692-L1695 PolarHBondContact O-N 2.79Å; L1695-A1698 PolarHBondContact O-N 3.42Å; L1695-K1699 WeakPolarHBondContact O-CB 3.27Å; L1695-K1699 VanDerWaalsContact O-CG 3.28Å; L1695-K1699 WeakPolarHBondContact O-CG 3.47Å; L1695-K1699 PolarHBondContact O-N 2.77Å
1696	E	38.4	Very low	32.2	Very low	82 Å²	82	97.7 Å²	97.7	38%	0.383	53%	0.528	S	S	.	.	H	α-helix	trans	-76.4	-36.5	179.1	-147.4	66.2	-162.8	0	0	110.9	S1692 K1699 N1700	S1692-E1696 WeakPolarHBondContact O-CB 3.48Å; S1692-E1696 PolarHBondContact O-N 2.94Å; E1696-K1699 PolarHBondContact O-N 3.21Å; E1696-K1699 IonicContact OE1-NZ 3.49Å; E1696-K1699 WeakPolarHBondContact OE2-CD 3.41Å; E1696-K1699 WeakPolarHBondContact OE2-CE 3.38Å; E1696-K1699 IonicContact OE2-NZ 2.83Å; E1696-K1699 PolarHBondContact OE2-NZ 3.42Å; E1696-N1700 WeakPolarHBondContact O-CB 3.31Å; E1696-N1700 PolarHBondContact O-N 2.97Å; E1696-N1700 PolarHBondContact O-ND2 3.08Å
1697	N	35	Very low	31.8	Very low	110 Å²	110	98.9 Å²	98.9	59%	0.588	54%	0.536	S	S	*	.	H	α-helix	trans	-65.2	-39.3	167.5	-79.3	-63.5	0	0	0	111.7	D1693 N1700 Y1701	D1693-N1697 VanDerWaalsContact O-CB 3.27Å; D1693-N1697 WeakPolarHBondContact O-CB 3.3Å; D1693-N1697 PolarHBondContact O-N 3.45Å; D1693-N1697 PolarHBondContact O-ND2 3.04Å; N1697-N1700 PolarHBondContact O-N 3.45Å; N1697-Y1701 VanDerWaalsContact O-CB 3.31Å; N1697-Y1701 WeakPolarHBondContact O-CB 3.05Å; N1697-Y1701 PolarHBondContact O-N 3.47Å
1698	A	30.7	Very low	31.6	Very low	40 Å²	40	105.8 Å²	105.8	33%	0.331	56%	0.555	S	S	.	*	H	α-helix	trans	-63.7	-44.6	173.1	0	0	0	0	0	112.2	V1694 L1695 N1700 Y1701 F1702	V1694-A1698 VanDerWaalsContact O-CB 3.3Å; V1694-A1698 WeakPolarHBondContact O-CB 3.35Å; V1694-A1698 PolarHBondContact O-N 3.46Å; L1695-A1698 PolarHBondContact O-N 3.42Å; A1698-N1700 PolarHBondContact O-N 3.15Å; A1698-Y1701 PolarHBondContact O-N 3.37Å; A1698-F1702 WeakPolarHBondContact O-CD2 3.41Å; A1698-F1702 PolarHBondContact O-N 2.73Å
1699	K	32.8	Very low	31.2	Very low	112 Å²	112	108.6 Å²	108.6	49%	0.487	57%	0.571	S	S	.	*	H	α-helix	trans	-58.6	-46.8	173	-74.2	172.1	-158.4	162	0	111.2	L1695 E1696 Y1701 F1702 S1703	L1695-K1699 WeakPolarHBondContact O-CB 3.27Å; L1695-K1699 VanDerWaalsContact O-CG 3.28Å; L1695-K1699 WeakPolarHBondContact O-CG 3.47Å; L1695-K1699 PolarHBondContact O-N 2.77Å; E1696-K1699 PolarHBondContact O-N 3.21Å; E1696-K1699 IonicContact OE1-NZ 3.49Å; E1696-K1699 WeakPolarHBondContact OE2-CD 3.41Å; E1696-K1699 WeakPolarHBondContact OE2-CE 3.38Å; E1696-K1699 IonicContact OE2-NZ 2.83Å; E1696-K1699 PolarHBondContact OE2-NZ 3.42Å; K1699-Y1701 VanDerWaalsContact C-N 3.33Å; K1699-Y1701 PolarHBondContact O-N 2.64Å; K1699-F1702 PolarHBondContact O-N 2.83Å; K1699-S1703 WeakPolarHBondContact O-CB 3.28Å; K1699-S1703 PolarHBondContact O-N 2.79Å
1700	N	34.6	Very low	30.6	Very low	83 Å²	83	110.9 Å²	110.9	44%	0.444	59%	0.586	S	S	.	*	H	α-helix	trans	-66.4	-33.6	178.8	-78.1	-48.1	0	0	0	112.5	E1696 N1697 A1698 N1704	E1696-N1700 WeakPolarHBondContact O-CB 3.31Å; E1696-N1700 PolarHBondContact O-N 2.97Å; E1696-N1700 PolarHBondContact O-ND2 3.08Å; N1697-N1700 PolarHBondContact O-N 3.45Å; A1698-N1700 PolarHBondContact O-N 3.15Å; N1700-N1704 WeakPolarHBondContact O-CB 3.49Å; N1700-N1704 PolarHBondContact O-N 2.9Å; N1700-N1704 PolarHBondContact O-ND2 3.2Å
1701	Y	31.2	Very low	30.3	Very low	153 Å²	153	113.1 Å²	113.1	60%	0.6	60%	0.599	S	S	*	*	H	α-helix	trans	-65.7	-49.1	173.6	-170.8	-98.8	0	0	0	111.9	N1697 A1698 K1699	N1697-Y1701 VanDerWaalsContact O-CB 3.31Å; N1697-Y1701 WeakPolarHBondContact O-CB 3.05Å; N1697-Y1701 PolarHBondContact O-N 3.47Å; A1698-Y1701 PolarHBondContact O-N 3.37Å; K1699-Y1701 VanDerWaalsContact C-N 3.33Å; K1699-Y1701 PolarHBondContact O-N 2.64Å
1702	F	28.1	Very low	30.1	Very low	134 Å²	134	113.5 Å²	113.5	59%	0.588	61%	0.612	S	S	*	*	H	α-helix	trans	-75.6	-29.4	179.8	-77.4	-71.9	0	0	0	114	A1698 K1699 I1706	A1698-F1702 WeakPolarHBondContact O-CD2 3.41Å; A1698-F1702 PolarHBondContact O-N 2.73Å; K1699-F1702 PolarHBondContact O-N 2.83Å; F1702-I1706 WeakPolarHBondContact O-CG1 3.46Å
1703	S	29.3	Very low	29.4	Very low	74 Å²	74	118.2 Å²	118.2	52%	0.517	63%	0.628	S	S	.	*	H	α-helix	trans	-72.8	-42.5	178.3	-169.8	0	0	0	0	112.1	K1699 H1705 I1706 T1707	K1699-S1703 WeakPolarHBondContact O-CB 3.28Å; K1699-S1703 PolarHBondContact O-N 2.79Å; S1703-H1705 VanDerWaalsContact C-N 3.3Å; S1703-H1705 PolarHBondContact O-N 2.95Å; S1703-I1706 PolarHBondContact O-N 3.45Å; S1703-T1707 PolarHBondContact O-OG1 3.33Å
1704	N	27.9	Very low	28.7	Very low	124 Å²	124	123.5 Å²	123.5	66%	0.663	65%	0.65	S	S	*	*	H	α-helix	trans	-75.1	-13.3	-178.8	-74	-65.1	0	0	0	114.4	N1700	N1700-N1704 WeakPolarHBondContact O-CB 3.49Å; N1700-N1704 PolarHBondContact O-N 2.9Å; N1700-N1704 PolarHBondContact O-ND2 3.2Å
1705	H	27.5	Very low	28.5	Very low	162 Å²	162	126 Å²	126	75%	0.75	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	1.3	177.1	-107.2	-78.7	0	0	0	115	S1703	S1703-H1705 VanDerWaalsContact C-N 3.3Å; S1703-H1705 PolarHBondContact O-N 2.95Å
1706	I	24.2	Very low	28	Very low	131 Å²	131	126.9 Å²	126.9	67%	0.672	66%	0.662	S	S	*	*	S	Bend	trans	-128.1	54.6	178.8	-48.3	176.8	0	0	0	110.7	F1702 S1703	F1702-I1706 WeakPolarHBondContact O-CG1 3.46Å; S1703-I1706 PolarHBondContact O-N 3.45Å
1707	T	23.9	Very low	27.2	Very low	114 Å²	114	128.8 Å²	128.8	70%	0.699	68%	0.679	S	S	*	*			trans	-160.8	68	167.3	28.9	0	0	0	0	113.6	S1703	S1703-T1707 PolarHBondContact O-OG1 3.33Å
1708	K	24.2	Very low	26.7	Very low	203 Å²	203	130.1 Å²	130.1	88%	0.883	69%	0.687	S	S	*	*	S	Bend	trans	-169.5	126.6	157.5	-106.6	146.2	-172.7	173	0	111.7
1709	S	24.5	Very low	26.4	Very low	120 Å²	120	134 Å²	134	84%	0.839	71%	0.706	S	S	*	*			trans	99.4	42	179	74.9	0	0	0	0	119.2
1710	N	22.7	Very low	25.9	Very low	153 Å²	153	135.6 Å²	135.6	82%	0.818	72%	0.718	S	S	*	*			trans	-95.5	167	137.5	-87.8	-18.3	0	0	0	109.2
1711	D	25.4	Very low	25.4	Very low	167 Å²	167	141.3 Å²	141.3	89%	0.893	73%	0.733	S	S	*	*			trans	68.9	72.3	171	-54.6	-30.1	0	0	0	117.8
1712	A	27.6	Very low	25.1	Very low	99 Å²	99	139.7 Å²	139.7	82%	0.818	74%	0.735	S	S	*	*			trans	-145.4	100.2	150.6	0	0	0	0	0	112.1
1713	E	26.5	Very low	25	Very low	154 Å²	154	138.5 Å²	138.5	72%	0.72	74%	0.744	S	S	*	*			trans	46.2	108.2	160.4	-60.8	-136.6	94.5	0	0	121.7	K1715	E1713-K1715 IonicContact OE1-NZ 3.65Å; E1713-K1715 PolarHBondContact OE1-NZ 3.32Å; E1713-K1715 IonicContact OE2-NZ 2.7Å
1714	Q	23.2	Very low	24.8	Very low	184 Å²	184	138.5 Å²	138.5	86%	0.86	76%	0.755	S	S	*	*			trans	-67.3	122.4	147.1	-59.7	155.4	-19.6	0	0	110.4
1715	K	27.2	Very low	24.7	Very low	153 Å²	153	138.4 Å²	138.4	67%	0.665	76%	0.763	S	S	*	*			trans	-161	101.2	147.2	-91.3	125.1	-168.8	177	0	108.8	E1713	E1713-K1715 IonicContact OE1-NZ 3.65Å; E1713-K1715 PolarHBondContact OE1-NZ 3.32Å; E1713-K1715 IonicContact OE2-NZ 2.7Å
1716	T	23	Very low	24.6	Very low	112 Å²	112	134.3 Å²	134.3	69%	0.687	76%	0.757	S	S	*	*				60.7	102.8	84	67	0	0	0	0	115.4
1717	V	22.5	Very low	24.8	Very low	122 Å²	122	133.9 Å²	133.9	74%	0.739	76%	0.763	S	S	*	*				79.2	139.2	121.6	170.3	0	0	0	0	118.9
1718	N	23.7	Very low	25.1	Very low	139 Å²	139	133.6 Å²	133.6	74%	0.743	77%	0.766	S	S	*	*			trans	83.7	112.3	156.9	-81.1	-8.7	0	0	0	121.8
1719	V	23.9	Very low	25.1	Very low	121 Å²	121	127.8 Å²	127.8	73%	0.733	76%	0.755	S	S	*	*				88	147.9	117.9	171.6	0	0	0	0	118.3
1720	I	23.8	Very low	25.1	Very low	146 Å²	146	127.3 Å²	127.3	75%	0.749	75%	0.748	S	S	*	*			trans	71.8	101.5	-175	-37.3	-164.4	0	0	0	112.5
1721	R	23.6	Very low	25.2	Very low	203 Å²	203	126.1 Å²	126.1	77%	0.766	74%	0.741	S	S	*	*			cis	84.9	140.2	38.1	-166.9	-160.9	143.6	144.1	3	112.1
1722	D	25.3	Very low	25.3	Very low	119 Å²	119	125.8 Å²	125.8	64%	0.636	73%	0.734	S	S	*	*			trans	67.7	146	175.8	-52.2	-44.4	0	0	0	114.3
1723	S	24.5	Very low	25.4	Very low	109 Å²	109	127.9 Å²	127.9	76%	0.762	73%	0.731	S	S	*	*			cis	-171.7	138.1	-18.3	50.7	0	0	0	0	111.3
1724	G	25.7	Very low	25.5	Very low	74 Å²	74	129.1 Å²	129.1	76%	0.763	74%	0.737	S	S	*	*			trans	73	169.6	169.1	0	0	0	0	0	115.5
1725	C	26.1	Very low	25.7	Very low	122 Å²	122	126 Å²	126	82%	0.824	73%	0.727	S	S	*	*			cis	-143.3	142.5	-12.1	-87	0	0	0	0	106.6
1726	A	25.8	Very low	25.9	Very low	76 Å²	76	129.6 Å²	129.6	63%	0.628	74%	0.738	S	S	*	*				58.8	135	70.8	0	0	0	0	0	112.1
1727	P	27	Very low	26.3	Very low	121 Å²	121	131 Å²	131	79%	0.786	73%	0.732	S	S	*	*			cis	-101.4	161.6	37.4	36.8	-37.4	0	0	0	116.1
1728	S	30.7	Very low	26.7	Very low	109 Å²	109	133.5 Å²	133.5	76%	0.762	73%	0.729	S	S	*	*			cis	51.4	127.5	-14.6	-163.5	0	0	0	0	120.4
1729	A	24.3	Very low	27	Very low	81 Å²	81	134.6 Å²	134.6	67%	0.669	73%	0.729	S	S	*	*			trans	71.7	144	-169.7	0	0	0	0	0	112.1
1730	T	24.9	Very low	27.2	Very low	110 Å²	110	137.1 Å²	137.1	68%	0.675	73%	0.733	S	S	*	*			cis	-125.9	167.6	-4.8	42	0	0	0	0	108.4
1731	D	25	Very low	27.7	Very low	128 Å²	128	138.4 Å²	138.4	68%	0.684	74%	0.736	S	S	*	*				46.9	127.8	66.2	-22.9	-66.6	0	0	0	110.1
1732	E	27.4	Very low	28.1	Very low	160 Å²	160	134.8 Å²	134.8	75%	0.748	73%	0.73	S	S	*	*			cis	-152.2	135	44.9	-78.2	159	175.5	0	0	108.1
1733	D	28.7	Very low	28.4	Very low	142 Å²	142	135.1 Å²	135.1	76%	0.759	73%	0.732	S	S	*	*				93.7	147	99.7	-66.8	-4.4	0	0	0	113.2
1734	E	28.3	Very low	28.9	Very low	181 Å²	181	136.3 Å²	136.3	85%	0.846	73%	0.73	S	S	*	*			cis	-129.3	167.4	1	-77.2	-163.7	152.1	0	0	113.4
1735	D	29.1	Very low	29.4	Very low	119 Å²	119	140 Å²	140	64%	0.636	73%	0.732	S	S	*	*			trans	-52	158.9	172.5	-59.2	-52.2	0	0	0	117.3	Y1737	D1735-Y1737 HydrophobicContact CB-CD2 4.22Å
1736	Y	30	Very low	29.9	Very low	227 Å²	227	140.1 Å²	140.1	89%	0.89	73%	0.729	S	S	*	*				-159.9	81.5	111.7	-123.1	-86.9	0	0	0	113.5
1737	Y	31.2	Very low	30.3	Very low	143 Å²	143	143.5 Å²	143.5	56%	0.561	74%	0.736	S	S	*	*			trans	35.2	143.8	132.9	-95.9	-71.4	0	0	0	124.9	D1735	D1735-Y1737 HydrophobicContact CB-CD2 4.22Å
1738	Y	32.4	Very low	30.7	Very low	174 Å²	174	144.7 Å²	144.7	68%	0.682	74%	0.736	S	S	*	*			trans	73.9	136.1	150.6	-65.7	-49	0	0	0	119.8
1739	E	29.8	Very low	30.9	Very low	162 Å²	162	145.8 Å²	145.8	76%	0.757	73%	0.734	S	S	*	*			cis	-152.3	-172.8	-16.8	-156.4	154	-136.4	0	0	110.1
1740	E	28.4	Very low	31.7	Very low	174 Å²	174	149.1 Å²	149.1	81%	0.813	74%	0.735	S	S	*	*			trans	-96.9	-158.6	-164.3	-53.8	-175.2	99.7	0	0	114.3
1741	E	32.3	Very low	32.3	Very low	172 Å²	172	148.3 Å²	148.3	80%	0.804	73%	0.73	S	S	*	*			trans	83.3	148.3	157.9	-53.8	-153.2	149	0	0	120.9
1742	I	32.9	Very low	32.9	Very low	127 Å²	127	146.9 Å²	146.9	65%	0.651	72%	0.722	S	S	*	*			cis	-164.2	154.8	-45.6	-121.1	164.2	0	0	0	110.4
1743	D	31.9	Very low	33.5	Very low	127 Å²	127	140.9 Å²	140.9	68%	0.679	70%	0.695	S	S	*	*			trans	52	134.2	159	-60.3	-4.3	0	0	0	125.6
1744	D	35.5	Very low	33.9	Very low	133 Å²	133	138 Å²	138	71%	0.711	68%	0.68	S	S	*	*				68.4	113.8	128	-62.2	-0.2	0	0	0	126.7
1745	D	35.2	Very low	34.3	Very low	151 Å²	151	134.9 Å²	134.9	81%	0.807	67%	0.665	S	S	*	*				70.2	158.6	124.7	-78.1	-6	0	0	0	126
1746	V	36.8	Very low	34.7	Very low	125 Å²	125	133 Å²	133	76%	0.758	66%	0.658	S	S	*	*			trans	80.3	88.2	165.3	-160.3	0	0	0	0	120.1
1747	D	35	Very low	35	Very low	147 Å²	147	125.5 Å²	125.5	79%	0.786	64%	0.636	S	S	*	*				45.2	160.3	123.2	-67.2	-41.5	0	0	0	125.9
1748	D	35.1	Very low	35.1	Very low	147 Å²	147	125.3 Å²	125.3	79%	0.786	64%	0.64	S	S	*	*			trans	74.6	88.4	158.4	-69.4	-8.8	0	0	0	123.2
1749	D	35.4	Very low	35.2	Very low	131 Å²	131	125.4 Å²	125.4	70%	0.701	65%	0.647	S	S	*	*				85.8	140.2	116.1	-118.9	-12.4	0	0	0	125.1
1750	H	39.6	Very low	35.3	Very low	152 Å²	152	124.6 Å²	124.6	70%	0.704	65%	0.646	S	S	*	*			trans	71.7	111.3	153.6	-77.3	13.7	0	0	0	124.6
1751	V	37.6	Very low	35.4	Very low	92 Å²	92	120.9 Å²	120.9	56%	0.558	64%	0.639	S	S	*	*			trans	78.8	81.4	130.9	-173.4	0	0	0	0	120.5	I1154	I1154-V1751 HydrophobicContact CD1-CG1 3.75Å; I1154-V1751 HydrophobicContact CG1-CG1 3.97Å
1752	N	39.2	Very low	35.4	Very low	98 Å²	98	120.6 Å²	120.6	52%	0.524	64%	0.638	S	S	.	*				67.8	162.6	118.5	-58	-32	0	0	0	125.4	L1153 I1154	L1153-N1752 HydrophobicContact CB-CB 4.43Å; I1154-N1752 HydrophobicContact CD1-CB 3.83Å; I1154-N1752 WeakPolarHBondContact CD1-O 3.39Å; I1154-N1752 HydrophobicContact CG1-CB 3.58Å
1753	N	38.2	Very low	35.4	Very low	34 Å²	34	120.4 Å²	120.4	18%	0.182	64%	0.638	C	S	.	*			trans	81.2	-179.7	156	-81.8	63.4	0	0	0	124.7	S1152 L1153 I1154 R1533	S1152-N1753 VanDerWaalsContact CB-CG 3.4Å; S1152-N1753 WeakPolarHBondContact CB-ND2 3.32Å; S1152-N1753 VanDerWaalsContact CB-OD1 3.28Å; S1152-N1753 WeakPolarHBondContact CB-OD1 3.25Å; L1153-N1753 WeakPolarHBondContact CA-OD1 3.39Å; L1153-N1753 WeakPolarHBondContact CB-OD1 3.28Å; L1153-N1753 PolarHBondContact O-ND2 2.71Å; I1154-N1753 HydrophobicContact CB-CB 3.59Å; I1154-N1753 HydrophobicContact CD1-CB 3.85Å; I1154-N1753 HydrophobicContact CG1-CB 3.67Å; I1154-N1753 WeakPolarHBondContact CG1-OD1 3.48Å; I1154-N1753 HydrophobicContact CG2-CB 4.4Å; I1154-N1753 PolarHBondContact N-ND2 3.28Å; I1154-N1753 PolarHBondContact N-OD1 3.49Å; R1533-N1753 PolarHBondContact NH1-O 3.16Å; R1533-N1753 PolarHBondContact NH2-O 2.92Å
1754	D	37.3	Very low	35.5	Very low	83 Å²	83	121.9 Å²	121.9	44%	0.444	64%	0.641	S	S	.	*				-84.5	156.8	-112.6	-70.5	-41.9	0	0	0	121.1	S1152	S1152-D1754 WeakPolarHBondContact CB-OD1 3.47Å; S1152-D1754 PolarHBondContact OG-OD1 3.32Å
1755	E	38	Very low	35.3	Very low	114 Å²	114	119.9 Å²	119.9	53%	0.533	63%	0.629	S	S	.	*			trans	58.6	138.1	136.9	-73.7	-178.3	174.1	0	0	128.2
1756	T	37.3	Very low	35	Very low	80 Å²	80	119.2 Å²	119.2	49%	0.491	63%	0.626	S	S	.	*			trans	85.9	95.6	137.3	50.1	0	0	0	0	126.1
1757	V	35.4	Very low	34.7	Very low	69 Å²	69	119.3 Å²	119.3	42%	0.418	62%	0.621	S	S	.	*				93.7	146.1	111.8	163.6	0	0	0	0	121.1	R1135	R1135-V1757 PolarHBondContact NH2-O 2.91Å
1758	E	33.7	Very low	34.4	Very low	140 Å²	140	118.6 Å²	118.6	65%	0.654	62%	0.616	S	S	*	*			trans	59.8	150.8	161	-78.8	144.8	-152.8	0	0	122.3	R1135	R1135-E1758 IonicContact NH1-OE2 2.97Å; R1135-E1758 PolarHBondContact NH1-OE2 2.62Å; R1135-E1758 IonicContact NH2-OE2 2.64Å
1759	E	33.7	Very low	34	Very low	176 Å²	176	117.5 Å²	117.5	82%	0.822	62%	0.615	S	S	*	*			cis	-175.5	-166.7	-28.7	-135.2	-178	-153.2	0	0	111.8
1760	I	32.8	Very low	33.6	Very low	144 Å²	144	115.7 Å²	115.7	74%	0.738	61%	0.613	S	S	*	*			trans	102.8	123.7	154.1	-50.7	-179.8	0	0	0	120.9
1761	S	30	Very low	32.9	Very low	97 Å²	97	114.4 Å²	114.4	68%	0.678	62%	0.621	S	S	*	*			trans	60.5	137	159.3	63.6	0	0	0	0	120.6
1762	E	32.3	Very low	32.5	Very low	165 Å²	165	113 Å²	113	77%	0.771	63%	0.625	S	S	*	*			cis	97.9	122.4	21.2	-72.7	-171.8	161.6	0	0	116.4
1763	N	33.2	Very low	31.7	Very low	124 Å²	124	114.5 Å²	114.5	66%	0.663	64%	0.638	S	S	*	*				155.9	151.7	114.7	-87.4	-67.8	0	0	0	117.8
1764	H	34.4	Very low	31.1	Very low	157 Å²	157	120.5 Å²	120.5	73%	0.727	67%	0.668	S	S	*	*			trans	63.1	136.4	164.3	-73.3	-78.3	0	0	0	120.5
1765	I	31.1	Very low	30.4	Very low	92 Å²	92	120.9 Å²	120.9	47%	0.472	68%	0.677	S	S	.	*			cis	119	151.3	8.3	-75.8	166.6	0	0	0	112.8
1766	D	28.9	Very low	29.8	Very low	136 Å²	136	121.3 Å²	121.3	73%	0.727	69%	0.688	S	S	*	*			trans	101	141.7	171.5	-70	-23.1	0	0	0	116.4
1767	I	30.1	Very low	29.1	Very low	128 Å²	128	122 Å²	122	66%	0.656	70%	0.696	S	S	*	*			cis	-162.7	142	3.6	-117.5	168.9	0	0	0	115.8
1768	L	28.1	Very low	28.6	Very low	132 Å²	132	124.8 Å²	124.8	69%	0.691	71%	0.709	S	S	*	*			trans	52.8	124.5	146.4	-58	171.6	0	0	0	127.7
1769	T	27.2	Very low	28.1	Very low	123 Å²	123	124 Å²	124	76%	0.755	71%	0.713	S	S	*	*				70.3	160.8	123.1	64.5	0	0	0	0	123.7
1770	S	26.6	Very low	27.6	Very low	94 Å²	94	121 Å²	121	66%	0.657	71%	0.712	S	S	*	*			cis	-175.2	151.1	-25.7	60.8	0	0	0	0	114.6
1771	S	25	Very low	27.4	Very low	125 Å²	125	120 Å²	120	87%	0.874	71%	0.712	S	S	*	*			trans	60.4	142.6	137.3	-61.5	0	0	0	0	124.9
1772	G	29	Very low	27.2	Very low	63 Å²	63	121 Å²	121	65%	0.649	72%	0.717	S	S	*	*			trans	115	111	155.6	0	0	0	0	0	114.4
1773	T	24	Very low	26.8	Very low	128 Å²	128	122 Å²	122	79%	0.785	72%	0.719	S	S	*	*			cis	78.2	142.4	48.7	70.5	0	0	0	0	115.9
1774	I	25.6	Very low	26.4	Very low	160 Å²	160	125.8 Å²	125.8	82%	0.821	73%	0.73	S	S	*	*			trans	82.4	142.1	176.3	-53.5	165.4	0	0	0	113
1775	S	22.5	Very low	25.9	Very low	92 Å²	92	124.2 Å²	124.2	64%	0.643	73%	0.731	S	S	*	*			cis	-173.1	-173.7	-26.6	-83.6	0	0	0	0	107.6
1776	T	24.8	Very low	25.6	Very low	123 Å²	123	123 Å²	123	76%	0.755	74%	0.741	S	S	*	*			trans	59.2	103.1	153.4	47.9	0	0	0	0	120.4
1777	S	23.2	Very low	25.4	Very low	94 Å²	94	123.5 Å²	123.5	66%	0.657	75%	0.749	S	S	*	*				53.5	167.7	118.3	67.5	0	0	0	0	123.4
1778	D	24.9	Very low	25.3	Very low	128 Å²	128	121.6 Å²	121.6	68%	0.684	75%	0.752	S	S	*	*			trans	75.3	95.2	154.8	-52.1	-46.1	0	0	0	120.9
1779	T	22.7	Very low	25.1	Very low	123 Å²	123	119.7 Å²	119.7	76%	0.755	75%	0.75	S	S	*	*				44.7	143.4	126.7	61.6	0	0	0	0	122.9
1780	S	23.5	Very low	25	Very low	112 Å²	112	120.3 Å²	120.3	78%	0.783	75%	0.747	S	S	*	*			trans	90.7	134.3	150.2	83.2	0	0	0	0	118.5
1781	T	28.7	Very low	25	Very low	123 Å²	123	123.5 Å²	123.5	76%	0.755	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-87	142.2	168.8	51.7	0	0	0	0	110.9
1782	P	24.6	Very low	25.1	Very low	120 Å²	120	123.4 Å²	123.4	78%	0.779	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-103.8	130.9	151.6	2.4	17.9	0	0	0	111.3
1783	K	25.7	Very low	25	Very low	185 Å²	185	127.4 Å²	127.4	80%	0.804	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-74.4	157.3	150.6	-52.9	168	-178.4	175.5	0	107.6
1784	F	23.4	Very low	25.2	Very low	203 Å²	203	125.3 Å²	125.3	89%	0.89	74%	0.741	S	S	*	*			trans	179.5	151.3	138.5	-103	-80.4	0	0	0	109.6
1785	V	24.4	Very low	25.3	Very low	125 Å²	125	122 Å²	122	76%	0.758	73%	0.732	S	S	*	*				-165.8	157.6	-54	105.8	0	0	0	0	110.6
1786	G	25.4	Very low	25.5	Very low	66 Å²	66	124.5 Å²	124.5	68%	0.68	74%	0.738	S	S	*	*			trans	81.8	163.4	159.6	0	0	0	0	0	115.9
1787	V	24.8	Very low	25.6	Very low	147 Å²	147	123.9 Å²	123.9	89%	0.891	73%	0.73	S	S	*	*			cis	-146.7	153.4	-7.1	-152.3	0	0	0	0	104.1
1788	A	26.3	Very low	25.8	Very low	88 Å²	88	126.7 Å²	126.7	73%	0.727	73%	0.732	S	S	*	*			cis	-161.4	172.9	30.2	0	0	0	0	0	108.6
1789	S	25.7	Very low	25.8	Very low	91 Å²	91	124.7 Å²	124.7	64%	0.636	73%	0.728	S	S	*	*			cis	-177.9	155.8	-20.1	49.2	0	0	0	0	109.3
1790	I	24	Very low	25.9	Very low	137 Å²	137	125.1 Å²	125.1	70%	0.703	73%	0.726	S	S	*	*			trans	70	129.4	152.4	-69	157.2	0	0	0	115.6
1791	F	26.4	Very low	26	Very low	160 Å²	160	126.9 Å²	126.9	70%	0.702	72%	0.722	S	S	*	*			cis	-161.8	143.2	-4.3	-114.5	-172.1	0	0	0	107.2
1792	D	27.8	Very low	25.9	Very low	123 Å²	123	127.4 Å²	127.4	66%	0.658	72%	0.719	S	S	*	*				72.4	137	99.2	-63.4	17.2	0	0	0	113.8
1793	D	26.6	Very low	25.9	Very low	148 Å²	148	126.6 Å²	126.6	79%	0.791	71%	0.709	S	S	*	*			cis	-165	176.5	-14.3	-156.1	-8.3	0	0	0	109
1794	A	28.7	Very low	26	Very low	84 Å²	84	125.2 Å²	125.2	69%	0.694	70%	0.703	S	S	*	*			trans	68.1	158.6	150	0	0	0	0	0	119.6
1795	S	26.5	Very low	26.1	Very low	89 Å²	89	122 Å²	122	62%	0.622	70%	0.699	S	S	*	*			cis	-178.8	126.4	-23.9	166.4	0	0	0	0	109.7
1796	L	26.6	Very low	26.2	Very low	146 Å²	146	120.9 Å²	120.9	76%	0.764	70%	0.698	S	S	*	*			trans	61.8	169.3	155.6	-86.3	54.5	0	0	0	116.1
1797	D	27.8	Very low	26.2	Very low	110 Å²	110	122.4 Å²	122.4	59%	0.588	70%	0.698	S	S	*	*			cis	-143.9	158.5	-6.6	-135.9	-18.4	0	0	0	115.2
1798	Q	27	Very low	26.2	Very low	153 Å²	153	122.5 Å²	122.5	72%	0.715	69%	0.692	S	S	*	*			trans	17.6	120.8	143.8	-80.9	167.8	85.6	0	0	122.7
1799	S	25	Very low	26.2	Very low	86 Å²	86	126 Å²	126	60%	0.601	69%	0.692	S	S	*	*				92.3	150.2	112.6	82.6	0	0	0	0	121.7
1800	N	25.3	Very low	26.3	Very low	132 Å²	132	127.8 Å²	127.8	71%	0.706	70%	0.695	S	S	*	*			trans	64.8	144.5	143.6	-66.6	-27.8	0	0	0	118.5
1801	Q	26.3	Very low	26.4	Very low	149 Å²	149	127.3 Å²	127.3	70%	0.696	69%	0.694	S	S	*	*			cis	-159.4	159.3	3.4	-127	168.7	45.7	0	0	111.3
1802	L	25.2	Very low	26.3	Very low	133 Å²	133	126 Å²	126	70%	0.696	69%	0.694	S	S	*	*			trans	33.6	136.1	141.6	-72.6	167.3	0	0	0	122.5
1803	D	25.4	Very low	26.1	Very low	104 Å²	104	127.1 Å²	127.1	56%	0.556	70%	0.699	S	S	*	*				107.8	133.1	121.3	-95.8	-30.1	0	0	0	122.4
1804	K	27.3	Very low	26.1	Very low	156 Å²	156	127 Å²	127	68%	0.678	70%	0.697	S	S	*	*			trans	72.7	106.2	141.9	-72.4	157.4	-168.8	145.2	0	118.3
1805	T	26.3	Very low	25.9	Very low	134 Å²	134	129 Å²	129	82%	0.822	70%	0.696	S	S	*	*				68.9	148.1	80.4	65.7	0	0	0	0	113.8
1806	S	24.7	Very low	25.9	Very low	103 Å²	103	131.2 Å²	131.2	72%	0.72	70%	0.7	S	S	*	*			cis	-150.6	171.9	21.8	58.7	0	0	0	0	114.1
1807	S	26.3	Very low	25.9	Very low	98 Å²	98	131.5 Å²	131.5	69%	0.685	70%	0.703	S	S	*	*			trans	-59.1	159.7	162.6	53.2	0	0	0	0	114.6
1808	I	25.9	Very low	25.7	Very low	149 Å²	149	131.6 Å²	131.6	76%	0.764	71%	0.707	S	S	*	*				-170.2	117.4	130	-96	148.6	0	0	0	106.2
1809	H	25.5	Very low	25.7	Very low	160 Å²	160	131.2 Å²	131.2	74%	0.741	71%	0.709	S	S	*	*				91.6	155.4	67.9	-130.4	-90.3	0	0	0	112.6
1810	D	27.5	Very low	25.6	Very low	129 Å²	129	133.4 Å²	133.4	69%	0.69	71%	0.713	S	S	*	*			trans	74.7	145.6	166.3	-52.6	-20.9	0	0	0	119.5
1811	D	25.4	Very low	25.6	Very low	127 Å²	127	132.8 Å²	132.8	68%	0.679	71%	0.714	S	S	*	*			cis	-167.1	170.8	-36.6	-148.5	-14.4	0	0	0	110.6
1812	L	25.2	Very low	25.6	Very low	133 Å²	133	131.9 Å²	131.9	70%	0.696	72%	0.718	S	S	*	*			trans	68.5	128	160.3	-57.8	157.8	0	0	0	117.6
1813	L	24	Very low	25.7	Very low	147 Å²	147	129.6 Å²	129.6	77%	0.77	72%	0.719	S	S	*	*				73.2	119.8	53.4	-83.8	155.5	0	0	0	115.2
1814	I	25.7	Very low	25.9	Very low	145 Å²	145	130.2 Å²	130.2	74%	0.744	73%	0.729	S	S	*	*				165	132.2	122.5	-87.3	155.2	0	0	0	111.9
1815	D	25.3	Very low	26.1	Very low	127 Å²	127	128.3 Å²	128.3	68%	0.679	73%	0.733	S	S	*	*			trans	42	124.1	158.6	-61.5	-30.5	0	0	0	121.5
1816	N	26.8	Very low	26.3	Very low	134 Å²	134	127.3 Å²	127.3	72%	0.717	73%	0.73	S	S	*	*				78.3	143.8	54.2	-67.7	-48	0	0	0	114.2
1817	D	25.7	Very low	26.4	Very low	153 Å²	153	126.6 Å²	126.6	82%	0.818	73%	0.729	S	S	*	*			trans	67.6	143.5	156.4	-75.9	-2.7	0	0	0	119.7
1818	V	24.8	Very low	26.4	Very low	111 Å²	111	128.5 Å²	128.5	67%	0.673	73%	0.731	S	S	*	*			cis	-171.5	177.4	-13	65.4	0	0	0	0	109.2
1819	I	25.3	Very low	26.4	Very low	146 Å²	146	128.9 Å²	128.9	75%	0.749	73%	0.727	S	S	*	*			trans	75.8	143.4	157.9	-81.4	169.3	0	0	0	117.4
1820	D	24.4	Very low	26.6	Very low	131 Å²	131	129.1 Å²	129.1	70%	0.701	73%	0.73	S	S	*	*			cis	-178.3	-173	-19.7	-160.7	-11.4	0	0	0	108.3
1821	V	25.1	Very low	26.6	Very low	119 Å²	119	127.1 Å²	127.1	72%	0.721	73%	0.727	S	S	*	*			trans	69.2	120.9	140.2	143.3	0	0	0	0	117.5
1822	V	25.4	Very low	26.7	Very low	130 Å²	130	124.3 Å²	124.3	79%	0.788	73%	0.728	S	S	*	*			cis	-150.6	150.8	17	-174.5	0	0	0	0	113.7
1823	A	28	Very low	26.8	Very low	85 Å²	85	125 Å²	125	70%	0.702	73%	0.731	S	S	*	*			trans	-47.4	-165.3	162.7	0	0	0	0	0	118.1
1824	P	30.1	Very low	26.8	Very low	118 Å²	118	123.5 Å²	123.5	77%	0.766	73%	0.727	S	S	*	*			cis	-142.6	168.8	0	39.8	-18.9	0	0	0	120.5
1825	C	30.4	Very low	27.1	Very low	115 Å²	115	123 Å²	123	78%	0.777	73%	0.731	S	S	*	*			trans	-15.7	169.1	148.4	-79.8	0	0	0	0	121.3
1826	P	31.5	Very low	27.1	Very low	114 Å²	114	122.1 Å²	122.1	74%	0.74	74%	0.735	S	S	*	*			cis	-117.1	-166.3	19.6	44.1	-31.8	0	0	0	113.9	I1828	P1826-I1828 HydrophobicContact CB-CD1 4.35Å
1827	A	26.5	Very low	27	Very low	87 Å²	87	123 Å²	123	72%	0.719	74%	0.738	S	S	*	*			cis	-146	164.3	11.5	0	0	0	0	0	111
1828	I	26	Very low	27.1	Very low	139 Å²	139	122.3 Å²	122.3	71%	0.713	74%	0.735	S	S	*	*			cis	97.7	117.2	13.8	-62.7	169.6	0	0	0	115.5	P1826	P1826-I1828 HydrophobicContact CB-CD1 4.35Å
1829	F	27	Very low	27.8	Very low	156 Å²	156	122.2 Å²	122.2	68%	0.684	74%	0.736	S	S	*	*			cis	-174.7	161.9	-18.6	-139.5	-90.2	0	0	0	112
1830	M	28	Very low	27.9	Very low	165 Å²	165	121.4 Å²	121.4	81%	0.813	74%	0.741	S	S	*	*			trans	162.3	122.9	138.9	-88.1	-63.6	98.1	0	0	110
1831	S	28.4	Very low	28.1	Very low	87 Å²	87	120.6 Å²	120.6	61%	0.608	74%	0.741	S	S	*	*			cis	172.5	150.5	-29.9	44	0	0	0	0	105.9
1832	G	27	Very low	28.1	Very low	68 Å²	68	122.5 Å²	122.5	70%	0.701	75%	0.745	S	S	*	*			cis	176.1	168.9	4	0	0	0	0	0	105.7
1833	I	27.8	Very low	28	Very low	148 Å²	148	122.3 Å²	122.3	76%	0.759	74%	0.738	S	S	*	*			cis	-141.7	153.5	31.7	-61.3	177.1	0	0	0	109.2	V120	V120-I1833 HydrophobicContact CG2-CD1 3.79Å
1834	T	24.5	Very low	27.8	Very low	115 Å²	115	124.4 Å²	124.4	71%	0.706	74%	0.742	S	S	*	*			trans	-127	143.3	-170	52.5	0	0	0	0	114
1835	T	30.9	Very low	27.7	Very low	134 Å²	134	124.4 Å²	124.4	82%	0.822	74%	0.741	S	S	*	*			trans	31.4	131.9	140.6	61.3	0	0	0	0	122.5
1836	S	24.7	Very low	27.4	Very low	109 Å²	109	125 Å²	125	76%	0.762	74%	0.741	S	S	*	*			trans	164.8	159.1	136.2	-157.4	0	0	0	0	107.7
1837	I	25.5	Very low	27.3	Very low	153 Å²	153	125.4 Å²	125.4	79%	0.785	74%	0.741	S	S	*	*			cis	-144.1	165.9	25.3	-63	164.1	0	0	0	109.8
1838	D	27.2	Very low	27.1	Very low	138 Å²	138	126.9 Å²	126.9	74%	0.738	74%	0.742	S	S	*	*			trans	-75.4	-156.4	-173.6	-45.3	-91.7	0	0	0	116.6
1839	P	39.8	Very low	27	Very low	109 Å²	109	126.8 Å²	126.8	71%	0.708	74%	0.742	S	S	*	*				-127.7	-179.9	-84.4	39.4	-22.2	0	0	0	114.4
1840	P	27.7	Very low	26.8	Very low	129 Å²	129	126.1 Å²	126.1	84%	0.838	75%	0.745	S	S	*	*			trans	-143.8	139.5	138.4	35.3	-19.9	0	0	0	115.8
1841	T	29.5	Very low	26.6	Very low	115 Å²	115	126 Å²	126	71%	0.706	75%	0.745	S	S	*	*			trans	-120.4	126.7	177	-52.9	0	0	0	0	111.4
1842	I	24.2	Very low	26.5	Very low	158 Å²	158	127.3 Å²	127.3	81%	0.81	75%	0.75	S	S	*	*			trans	-143.4	97.7	163.8	-55.8	-176.2	0	0	0	106.2
1843	I	23.1	Very low	26.4	Very low	127 Å²	127	130.7 Å²	130.7	65%	0.651	75%	0.752	S	S	*	*				63.1	111.8	82.1	-57	164.2	0	0	0	110.4
1844	T	24.7	Very low	26.3	Very low	128 Å²	128	129.2 Å²	129.2	79%	0.785	75%	0.746	S	S	*	*				-158	137.2	83.9	-59	0	0	0	0	112.6
1845	T	27.2	Very low	26.3	Very low	119 Å²	119	130.5 Å²	130.5	73%	0.73	75%	0.748	S	S	*	*			trans	-87.5	143.9	175.7	-36	0	0	0	0	111.6
1846	T	25.3	Very low	26	Very low	128 Å²	128	131.2 Å²	131.2	79%	0.785	75%	0.753	S	S	*	*			trans	-142.2	106	155.3	-35.4	0	0	0	0	112.7
1847	T	27.5	Very low	25.9	Very low	122 Å²	122	131.5 Å²	131.5	75%	0.748	75%	0.75	S	S	*	*			trans	-85.4	129.3	164.1	41.8	0	0	0	0	111.2
1848	T	23.6	Very low	25.8	Very low	118 Å²	118	131.1 Å²	131.1	72%	0.724	75%	0.748	S	S	*	*			trans	-164.2	111	151.3	20.4	0	0	0	0	107.8
1849	N	23.2	Very low	25.6	Very low	136 Å²	136	129.7 Å²	129.7	73%	0.727	75%	0.745	S	S	*	*				68.6	111.1	83.1	-79.5	-20.2	0	0	0	115.6
1850	I	23.8	Very low	24.8	Very low	143 Å²	143	130.1 Å²	130.1	73%	0.733	75%	0.745	S	S	*	*			trans	54.1	111.4	130.9	-49.4	161.7	0	0	0	117.1
1851	I	23.6	Very low	24.6	Very low	161 Å²	161	131.1 Å²	131.1	83%	0.826	74%	0.743	S	S	*	*				-158.8	131.9	116.5	-99.7	152	0	0	0	109.6
1852	T	26.1	Very low	24.3	Very low	115 Å²	115	133.9 Å²	133.9	71%	0.706	75%	0.752	S	S	*	*			trans	-84.5	136.8	171.3	43.4	0	0	0	0	110.4
1853	N	24.7	Very low	24.4	Very low	140 Å²	140	129.3 Å²	129.3	75%	0.749	74%	0.744	S	S	*	*			trans	-159.6	93.4	147.7	-107.8	-33.9	0	0	0	113.5
1854	N	24.8	Very low	24.4	Very low	116 Å²	116	133.8 Å²	133.8	62%	0.62	75%	0.753	S	S	*	*				47.4	133.3	114.2	-58.2	-37.6	0	0	0	120.9
1855	N	24.6	Very low	24.4	Very low	142 Å²	142	134 Å²	134	76%	0.759	75%	0.749	S	S	*	*			trans	73.1	101.2	148.3	-55.6	-18.4	0	0	0	119.3
1856	T	25.9	Very low	24.3	Very low	149 Å²	149	134.1 Å²	134.1	91%	0.914	75%	0.745	S	S	*	*				-155.4	81.9	125.5	0.1	0	0	0	0	112.2
1857	T	23	Very low	24.3	Very low	116 Å²	116	132.4 Å²	132.4	71%	0.712	74%	0.739	S	S	*	*			trans	-69.1	168.3	151.2	-23	0	0	0	0	109.2
1858	I	22.6	Very low	24.2	Very low	145 Å²	145	135.3 Å²	135.3	74%	0.744	74%	0.744	S	S	*	*			trans	73.2	139.8	159.8	-63.6	156.8	0	0	0	115.2
1859	T	23.5	Very low	24.2	Very low	108 Å²	108	138.9 Å²	138.9	66%	0.663	75%	0.75	S	S	*	*			cis	-164	165.6	-27.3	38.7	0	0	0	0	108.8
1860	T	22.8	Very low	24.3	Very low	118 Å²	118	137.4 Å²	137.4	72%	0.724	75%	0.75	S	S	*	*			trans	55.5	131.5	145.1	49.8	0	0	0	0	122.5
1861	N	23.4	Very low	24.3	Very low	149 Å²	149	136.4 Å²	136.4	80%	0.797	75%	0.75	S	S	*	*			trans	15.5	150.7	131.3	-66.3	-5.7	0	0	0	121.5
1862	I	23.7	Very low	24.4	Very low	173 Å²	173	134.8 Å²	134.8	89%	0.887	75%	0.748	S	S	*	*			trans	91.8	121.7	178.8	-53.2	158.1	0	0	0	111.3
1863	G	24.9	Very low	24.4	Very low	63 Å²	63	134 Å²	134	65%	0.649	75%	0.747	S	S	*	*			cis	126.3	137.1	-13.9	0	0	0	0	0	115
1864	R	23.6	Very low	24.5	Very low	221 Å²	221	132.9 Å²	132.9	83%	0.834	75%	0.75	S	S	*	*			trans	83.1	130	177	-70.3	-167.3	178.4	90.7	1	118.5
1865	N	24.5	Very low	24.6	Very low	131 Å²	131	130.5 Å²	130.5	70%	0.701	75%	0.753	S	S	*	*			trans	68.7	147.7	145.3	-66.1	45.9	0	0	0	117.6
1866	D	25.1	Very low	24.7	Very low	122 Å²	122	133.3 Å²	133.3	65%	0.652	76%	0.755	S	S	*	*			cis	-150	152.3	0.8	-133.4	-46	0	0	0	113.2
1867	S	24.6	Very low	24.7	Very low	93 Å²	93	131.6 Å²	131.6	65%	0.65	74%	0.744	S	S	*	*			trans	35.5	146.5	146.3	-65.8	0	0	0	0	123.6
1868	Q	25.8	Very low	24.9	Very low	182 Å²	182	132 Å²	132	85%	0.85	74%	0.742	S	S	*	*			trans	88.1	117.3	168.3	-49.8	-172.1	44.2	0	0	115
1869	K	23.9	Very low	25	Very low	194 Å²	194	129.9 Å²	129.9	84%	0.843	74%	0.74	S	S	*	*			cis	94.8	71.2	41.3	-175.8	-145.4	176.7	-177.7	0	112.9
1870	S	25.1	Very low	25	Very low	105 Å²	105	129.4 Å²	129.4	73%	0.734	74%	0.741	S	S	*	*			trans	-165.8	116.3	154.9	53.6	0	0	0	0	112.9
1871	T	24.8	Very low	25.2	Very low	121 Å²	121	131 Å²	131	74%	0.742	75%	0.745	S	S	*	*			trans	33.9	146.1	131.7	57.6	0	0	0	0	122.6
1872	T	25.5	Very low	25.4	Very low	127 Å²	127	135.8 Å²	135.8	78%	0.779	77%	0.77	S	S	*	*			trans	66.7	151.3	146.4	47.9	0	0	0	0	118.7
1873	S	25	Very low	25.5	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	77%	0.765	S	S	*	*			cis	-177.8	157.2	-21	52.5	0	0	0	0	110.9
1874	S	26.8	Very low	25.6	Very low	116 Å²	116	137.6 Å²	137.6	81%	0.811	77%	0.771	S	S	*	*			trans	47.9	116.1	138.8	-175.7	0	0	0	0	121.4
1875	G	26.5	Very low	25.7	Very low	66 Å²	66	133 Å²	133	68%	0.68	77%	0.767	S	S	*	*			trans	178	117.8	157.6	0	0	0	0	0	108.2
1876	Y	26.7	Very low	25.7	Very low	201 Å²	201	133.1 Å²	133.1	79%	0.788	77%	0.771	S	S	*	*			cis	54.2	130.2	45	-93.5	-79.8	0	0	0	111.7	D1878	Y1876-D1878 HydrophobicContact CD1-CB 4.42Å; Y1876-D1878 HydrophobicContact CE1-CB 4.48Å
1877	V	27.4	Very low	25.8	Very low	114 Å²	114	133.8 Å²	133.8	69%	0.691	78%	0.779	S	S	*	*			cis	-132.4	147.7	21.6	-152.1	0	0	0	0	106.2
1878	D	25.8	Very low	25.8	Very low	124 Å²	124	136.5 Å²	136.5	66%	0.663	79%	0.787	S	S	*	*			cis	64.8	157.7	44.2	-164.9	17	0	0	0	112.3	Y1876	Y1876-D1878 HydrophobicContact CD1-CB 4.42Å; Y1876-D1878 HydrophobicContact CE1-CB 4.48Å
1879	S	25.8	Very low	25.8	Very low	100 Å²	100	133.3 Å²	133.3	70%	0.699	78%	0.783	S	S	*	*			trans	76.9	119.3	-154.7	-24.9	0	0	0	0	112.4
1880	S	24.3	Very low	26	Very low	99 Å²	99	128.6 Å²	128.6	69%	0.692	78%	0.778	S	S	*	*			cis	98.6	142.6	31.8	-64.1	0	0	0	0	113.4
1881	D	25.6	Very low	26.1	Very low	152 Å²	152	130.6 Å²	130.6	81%	0.813	78%	0.782	S	S	*	*			trans	71.3	64.8	162.8	-48.8	-23.2	0	0	0	117.6
1882	D	28.8	Very low	26.2	Very low	248 Å²	248	131.5 Å²	131.5	100%	1.326	79%	0.785	S	S	*	*				-163.4	0	109.3	-97.6	-21.1	0	0	0	111.2

Retrieved 1,882 of 1,882 residues in 2414.9 ms (Link to these results)

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