A0A077Z8K4_TRITR Loading...

Protein kibra

Regulator of the Hippo/SWH (Sav/Wts/Hpo) signaling pathway, a signaling pathway that plays a pivotal role in organ size control and tumor suppression by restricting proliferation and promoting apoptosis. The core of this pathway is composed of a kinase cascade wherein Hippo (Hpo), in complex with its regulatory protein Salvador (Sav), phosphorylates and activates Warts (Wts) in complex with its regulatory protein Mats, which in turn phosphorylates and inactivates the Yorkie (Yki) oncoprotein. Kibra acts synergistically along with Ex and Mer to regulate the Hippo signaling pathway.

AlphaFold DB , UniProt , Accession A0A077Z8K4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,201 aa.

						>A0A077Z8K4_TRITR|A0A077Z8K4
MHSNGLTNGCCSQNAAQLPESADDSSTLVAPVSLAPTTLSLPSVSACSRSQHSTASSDLPLPEGWEIKVDNDGRPYFIDHRSKITTWIDPRDRLTKPSAFSDCVGNELPFGWEQAYDNNVGVYFINHLSATNQLEDPRVQWRALQDAMIREYLQAAQEQMRAKELILKVKKDRRILAEQEFQQLCDVLNKVEDSTTTTTISRGINSVSRSNLGSSSTLTSSSRHDPDLLRSEIRIARQRLARLRREERQVECELKHKQRGYDTLAEIKDRVSSNPEGYTASETYALAREKEHLRVSLAAVDQRKNKLVQDLLRLKSDLQQSATVPESACSSSSIVSNSVGCLAEPPTSNSRCVHSPADRIPKGLPVADIARARLQYQETRHRLHNLQERLALIEEQISPVQMETDRDQITLIQEKEQLLHELRMVCYGEKKPPPEQQAMLEEKMHALEEDLRQALRLTHQEMIERFSLHDERLKIRREIMSIGRVLASLEQYVQTLSASTLSSSSLSTGSSHASSASNLNQDAYWLQYGNGIEVQELVDLRQRIERLAVGCSVPAPPCSSAEPRVEIEKGGSQPAISAAELAHRLSSFSTTADTVCRPLSSAEDNSGTNTRSVSAAVSDESVAGDSGVYDGRKPASTNLGDGLTSAWPTSPIVAVTAQLMVGFDYLIDENKLIVSIERARNLHSLPCVNSITALCVQGTILPCATGDSVDFVTKWSRDVDKPAFKQAFAISISLPEVCNRILQLYLWGLSGASSSRMAVCLGGVQVNFAEFSAQMIRCQWLNVLSSSFFPHSDRLKPPSPEFNSEHDGETTASRSDAKNVVFGPAKLQCSPLEEDAKVSCVDVRESVFNKDNVRQNPREESSDESTIISSRNSTLTSLRGRALGALVDGQNRADEQKANHEAPEVSAEVTSSSRALAAEPKLRLTICSDFDGSAIAESPTGAATSGFSELSRSSSTLSTKVEKETAVGRLVPPAASAAAGRGCQQRSVRLNRSGSDSSVPSTNRTEPFRRNIPERRSLRWKRLGPCRRRAGAKLPYEASSSRRGGLQDVGFCTSLDIDVDLQATRIKLEREEELVDQLQNVVDSLGSWKSGGNKGLPSWIADDETVQSILDRYYTTENPVADSAGRAIDPSDLYQQTARKIVRQSAHRVRRLMAAKGQLPPASNFKSKLNCLLATTAISILPPSEETDAQSLRLNISSEPA
					

Structure Viewer

Loading PAE data...

(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	43	Very low	29.9	Very low	244 Å²	244	138 Å²	138	100%	1.202	83%	0.832	S	S	*	*				0	111.8	0	-72.7	171.9	170.8	0	0	108.5
2	H	28.2	Very low	29.4	Very low	189 Å²	189	134.3 Å²	134.3	88%	0.875	82%	0.817	S	S	*	*			trans	-81	-172.3	152.8	-87.6	-4.9	0	0	0	109
3	S	29.6	Very low	29	Very low	101 Å²	101	136.7 Å²	136.7	71%	0.706	81%	0.814	S	S	*	*			trans	65.6	94.2	164.3	69	0	0	0	0	117.1
4	N	37.6	Very low	28.7	Very low	179 Å²	179	137.6 Å²	137.6	96%	0.957	81%	0.812	S	S	*	*				-70.3	107	112.9	-79.5	-18.1	0	0	0	106.4
5	G	27	Very low	28.4	Very low	57 Å²	57	134.1 Å²	134.1	59%	0.588	81%	0.806	S	S	*	*			trans	-81.4	168.1	167.9	0	0	0	0	0	110.3
6	L	33.2	Very low	28.1	Very low	157 Å²	157	131.1 Å²	131.1	82%	0.822	80%	0.8	S	S	*	*			trans	-161.3	106.7	151.1	-100.2	161.3	0	0	0	107.3
7	T	27.1	Very low	27.9	Very low	103 Å²	103	134.1 Å²	134.1	63%	0.632	80%	0.802	S	S	*	*				44	119.1	127.3	61.7	0	0	0	0	117.7
8	N	31.7	Very low	28.2	Very low	157 Å²	157	135.7 Å²	135.7	84%	0.84	81%	0.805	S	S	*	*				-177.5	152.7	63.3	-97.8	-38.2	0	0	0	113.3
9	G	27	Very low	28.6	Very low	82 Å²	82	134.5 Å²	134.5	85%	0.845	80%	0.802	S	S	*	*				77.4	85.7	128.9	0	0	0	0	0	119.4
10	C	20.2	Very low	28.4	Very low	127 Å²	127	136.9 Å²	136.9	86%	0.858	80%	0.804	S	S	*	*			trans	-106	129.3	157.4	-178.5	0	0	0	0	109.9
11	C	24.3	Very low	28.2	Very low	122 Å²	122	135.5 Å²	135.5	82%	0.824	80%	0.802	S	S	*	*			trans	170.6	151.6	162.8	-100.2	0	0	0	0	107.2
12	S	24.2	Very low	27.2	Very low	94 Å²	94	128 Å²	128	66%	0.657	78%	0.778	S	S	*	*			cis	167.5	135.9	-21.5	-107.6	0	0	0	0	106.7
13	Q	24.7	Very low	26.9	Very low	165 Å²	165	126.1 Å²	126.1	77%	0.771	78%	0.775	S	S	*	*			trans	78	145.4	150.4	-65.1	-179.2	-2.3	0	0	123.5
14	N	24.4	Very low	26.6	Very low	149 Å²	149	128.2 Å²	128.2	80%	0.797	78%	0.778	S	S	*	*			trans	76.8	148.9	154.7	-60.9	-19.9	0	0	0	120
15	A	24.4	Very low	26	Very low	86 Å²	86	124.3 Å²	124.3	71%	0.711	77%	0.765	S	S	*	*			cis	-172.6	162.2	-24.6	0	0	0	0	0	110.7
16	A	23.9	Very low	26.2	Very low	86 Å²	86	126.9 Å²	126.9	71%	0.711	77%	0.774	S	S	*	*			trans	76.5	135.8	144	0	0	0	0	0	123.9
17	Q	23.3	Very low	26	Very low	181 Å²	181	125.5 Å²	125.5	85%	0.846	77%	0.772	S	S	*	*			trans	78.8	143	140.3	-111.8	71.5	-5	0	0	124.7
18	L	33.7	Very low	26.4	Very low	163 Å²	163	128.3 Å²	128.3	85%	0.853	78%	0.782	S	S	*	*			trans	-83.8	147.9	174.7	-69.2	120.9	0	0	0	112.9
19	P	36.8	Very low	26.2	Very low	114 Å²	114	127.4 Å²	127.4	74%	0.74	78%	0.782	S	S	*	*				-130.6	170.4	112.3	39.5	-33.6	0	0	0	112.4
20	E	23.6	Very low	26.5	Very low	182 Å²	182	127.6 Å²	127.6	85%	0.85	78%	0.776	S	S	*	*			cis	106.2	135.1	2.9	-159.2	150.5	-112.8	0	0	118.2
21	S	24.1	Very low	27.7	Very low	108 Å²	108	126.8 Å²	126.8	76%	0.755	77%	0.769	S	S	*	*			trans	53.2	115	168.9	66.5	0	0	0	0	123.6
22	A	23.2	Very low	27.7	Very low	85 Å²	85	127.3 Å²	127.3	70%	0.702	77%	0.768	S	S	*	*				76	132.3	120.4	0	0	0	0	0	123.8
23	D	21.5	Very low	27.8	Very low	150 Å²	150	127.1 Å²	127.1	80%	0.802	77%	0.767	S	S	*	*			trans	72.4	113.9	142.7	-56.3	-16.9	0	0	0	123.6
24	D	23.1	Very low	28	Very low	145 Å²	145	127.5 Å²	127.5	78%	0.775	77%	0.773	S	S	*	*				95.3	115.8	128.7	-99.5	-36.7	0	0	0	123.4
25	S	24.4	Very low	28.1	Very low	98 Å²	98	124.7 Å²	124.7	69%	0.685	77%	0.771	S	S	*	*			trans	63.4	95.9	134	-68.8	0	0	0	0	120.1
26	S	32.1	Very low	29.2	Very low	110 Å²	110	126.3 Å²	126.3	77%	0.769	77%	0.774	S	S	*	*				176.8	122.1	103.9	-77.8	0	0	0	0	114.5
27	T	27.7	Very low	29.3	Very low	128 Å²	128	128.9 Å²	128.9	79%	0.785	78%	0.781	S	S	*	*			trans	45.6	97.7	137.9	-47.7	0	0	0	0	119.4
28	L	35.5	Very low	29.6	Very low	163 Å²	163	126 Å²	126	85%	0.853	78%	0.776	S	S	*	*				-156.7	103.1	122	-92.5	-170.2	0	0	0	111.2
29	V	28.3	Very low	29.3	Very low	137 Å²	137	126 Å²	126	83%	0.83	78%	0.776	S	S	*	*			trans	51.3	113.3	152.5	-164.5	0	0	0	0	119.4
30	A	32.4	Very low	28.9	Very low	87 Å²	87	126 Å²	126	72%	0.719	78%	0.778	S	S	*	*			trans	-102.8	-166	177.6	0	0	0	0	0	111.2
31	P	45.5	Very low	29	Very low	109 Å²	109	125.4 Å²	125.4	71%	0.708	78%	0.78	S	S	*	*			cis	-144.9	-177	-1.5	44.4	-25.5	0	0	0	117.1
32	V	24.9	Very low	29.3	Very low	133 Å²	133	125.9 Å²	125.9	81%	0.806	78%	0.781	S	S	*	*			trans	60	126.7	143.2	166.3	0	0	0	0	118.4
33	S	27.3	Very low	29.5	Very low	91 Å²	91	127.1 Å²	127.1	64%	0.636	78%	0.784	S	S	*	*			cis	-161.4	158.8	24.1	-141.3	0	0	0	0	115.6
34	L	28.9	Very low	30.1	Very low	173 Å²	173	126.5 Å²	126.5	91%	0.906	79%	0.786	S	S	*	*			trans	75.1	145	148.1	-75.2	157.2	0	0	0	121.8
35	A	25.6	Very low	30.4	Very low	90 Å²	90	125.2 Å²	125.2	74%	0.744	79%	0.788	S	S	*	*			trans	-103.4	175.9	-165.3	0	0	0	0	0	112.4
36	P	47	Very low	30.6	Very low	119 Å²	119	125 Å²	125	77%	0.773	79%	0.792	S	S	*	*			trans	-97.4	155.8	-163	37.2	-34.4	0	0	0	115
37	T	27.3	Very low	30	Very low	141 Å²	141	125.4 Å²	125.4	87%	0.865	79%	0.794	S	S	*	*			trans	-148.5	151.9	150.4	-54.2	0	0	0	0	109.4
38	T	28.6	Very low	30	Very low	121 Å²	121	125.4 Å²	125.4	74%	0.742	80%	0.799	S	S	*	*			trans	-72.4	146.4	-163.7	51.8	0	0	0	0	116.5
39	L	28.1	Very low	29.5	Very low	161 Å²	161	128 Å²	128	84%	0.843	80%	0.797	S	S	*	*				177.7	150.2	117.3	-95.2	174	0	0	0	114.4
40	S	27.2	Very low	29.6	Very low	114 Å²	114	126.9 Å²	126.9	80%	0.797	80%	0.796	S	S	*	*			trans	70.2	129.5	164	68.2	0	0	0	0	120.7
41	L	25.6	Very low	29.5	Very low	170 Å²	170	130.4 Å²	130.4	89%	0.89	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-92.4	144.2	170.2	-65.3	93	0	0	0	111.1
42	P	31.4	Very low	29.1	Very low	119 Å²	119	134.1 Å²	134.1	77%	0.773	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-84.1	126.7	162.9	31.9	-29.2	0	0	0	111.2	V44	P42-V44 PolarHBondContact O-N 3.48Å
43	S	26.5	Very low	29.8	Very low	110 Å²	110	132.3 Å²	132.3	77%	0.769	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-74.6	118.5	172.6	-176	0	0	0	0	110.8	S45	S43-S45 PolarHBondContact O-N 2.94Å
44	V	34	Very low	30.6	Very low	137 Å²	137	133.1 Å²	133.1	83%	0.83	80%	0.799	S	S	*	*			trans	-86	91.6	172.9	-85.9	0	0	0	0	110.9	P42 A46	P42-V44 PolarHBondContact O-N 3.48Å; V44-A46 PolarHBondContact O-N 2.89Å
45	S	29.4	Very low	31.6	Very low	118 Å²	118	128.5 Å²	128.5	83%	0.825	79%	0.786	S	S	*	*			trans	-83.1	98.8	162.9	-64.7	0	0	0	0	110	S43	S43-S45 PolarHBondContact O-N 2.94Å
46	A	28.8	Very low	32.8	Very low	93 Å²	93	125 Å²	125	77%	0.769	76%	0.756	S	S	*	*			trans	-122.2	79.3	177.3	0	0	0	0	0	110.9	V44	V44-A46 PolarHBondContact O-N 2.89Å
47	C	20.2	Very low	33.4	Very low	120 Å²	120	122.6 Å²	122.6	81%	0.811	74%	0.742	S	S	*	*			trans	-139.8	154.2	172.8	-85.1	0	0	0	0	111.1
48	S	27.3	Very low	35.2	Very low	127 Å²	127	122.7 Å²	122.7	89%	0.888	74%	0.737	S	S	*	*			trans	57.3	81.1	179.2	57.8	0	0	0	0	117.2
49	R	25.8	Very low	37.2	Very low	218 Å²	218	120.3 Å²	120.3	82%	0.823	72%	0.72	S	S	*	*			trans	-116.2	107.7	149.5	-174.3	69.5	178.8	-173.2	2.4	108.4	Q51	R49-Q51 PolarHBondContact O-N 3.45Å; R49-Q51 VanDerWaalsContact O-N 3.12Å
50	S	29.9	Very low	39.6	Very low	113 Å²	113	117.9 Å²	117.9	79%	0.79	71%	0.713	S	S	*	*			trans	-65	105.2	177.9	34.6	0	0	0	0	111.1	H52	S50-H52 PolarHBondContact O-N 2.95Å
51	Q	31	Very low	42.1	Very low	161 Å²	161	114.9 Å²	114.9	75%	0.752	69%	0.688	S	S	*	*			trans	-95.5	64	176.1	-62.8	-170.2	27.5	0	0	111.3	R49	R49-Q51 PolarHBondContact O-N 3.45Å; R49-Q51 VanDerWaalsContact O-N 3.12Å
52	H	36.1	Very low	44.7	Very low	187 Å²	187	109.5 Å²	109.5	87%	0.866	66%	0.664	S	S	*	*			trans	-135.1	59.1	179	-78.8	-45.2	0	0	0	113.4	S50	S50-H52 PolarHBondContact O-N 2.95Å
53	S	40	Very low	47.2	Very low	95 Å²	95	110.9 Å²	110.9	66%	0.664	66%	0.66	S	S	*	*			trans	-166.9	40.8	163.5	68.8	0	0	0	0	114.4
54	T	43.2	Very low	49.9	Very low	109 Å²	109	106.9 Å²	106.9	67%	0.669	64%	0.635	S	S	*	*	H	α-helix	trans	-84.9	-16.1	-176.8	48.6	0	0	0	0	114.9	S57	T54-S57 PolarHBondContact O-OG 3.48Å
55	A	49.7	Very low	52.5	Low	75 Å²	75	103.5 Å²	103.5	62%	0.62	61%	0.608	S	S	*	*	H	α-helix	trans	-80.1	-41.2	-177.4	0	0	0	0	0	113.7
56	S	52.6	Low	55.4	Low	17 Å²	17	101.2 Å²	101.2	12%	0.119	58%	0.584	C	S	.	*	H	α-helix	trans	-72.8	-27.6	179.5	-61.8	0	0	0	0	112.5	D58 L59 R91 D92 T95	S56-D58 VanDerWaalsContact C-N 3.32Å; S56-D58 PolarHBondContact O-N 3.45Å; S56-L59 PolarHBondContact O-N 3.34Å; S56-R91 WeakPolarHBondContact O-CD 3.33Å; S56-R91 PolarHBondContact O-NH1 2.77Å; S56-D92 PolarHBondContact OG-OD1 2.96Å; S56-T95 PolarHBondContact OG-OG1 2.96Å
57	S	59.1	Low	58.3	Low	68 Å²	68	100.6 Å²	100.6	48%	0.476	57%	0.567	S	S	.	*	H	α-helix	trans	-63.2	-32.1	-177.2	43.9	0	0	0	0	114.3	T54 L59 R91	T54-S57 PolarHBondContact O-OG 3.48Å; S57-L59 VanDerWaalsContact C-N 3.33Å; S57-L59 PolarHBondContact O-N 3.34Å; S57-R91 PolarHBondContact O-NH1 3.38Å
58	D	65.1	Low	61.6	Low	144 Å²	144	98.8 Å²	98.8	77%	0.77	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-15.2	-174.5	-73.9	2.2	0	0	0	114.2	S56	S56-D58 VanDerWaalsContact C-N 3.32Å; S56-D58 PolarHBondContact O-N 3.45Å
59	L	70.2	Confident	64.5	Low	70 Å²	70	97 Å²	97	37%	0.366	53%	0.529	S	S	.	.	S	Bend	trans	-87.7	138.4	175.6	-68.3	172.6	0	0	0	110.9	S56 S57 R91 T95	S56-L59 PolarHBondContact O-N 3.34Å; S57-L59 VanDerWaalsContact C-N 3.33Å; S57-L59 PolarHBondContact O-N 3.34Å; L59-R91 PolarHBondContact O-NE 2.8Å; L59-R91 PolarHBondContact O-NH1 3.33Å; L59-T95 HydrophobicContact CD1-CG2 3.5Å; L59-T95 VanDerWaalsContact CD1-CG2 3.5Å
60	P	77.6	Confident	67.4	Low	110 Å²	110	88.5 Å²	88.5	71%	0.714	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-65.3	145.8	174.1	27.7	-34.1	0	0	0	111.4
61	L	80	Confident	70.1	Confident	52 Å²	52	91.2 Å²	91.2	27%	0.272	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-56.2	142.6	169.4	-80.4	114.6	0	0	0	110.3	W65 I67 F77 P90	L61-W65 HydrophobicContact CB-CB 4.32Å; L61-W65 HydrophobicContact CD2-CB 3.74Å; L61-I67 HydrophobicContact CD1-CG2 4.12Å; L61-I67 HydrophobicContact CD2-CB 4.42Å; L61-F77 HydrophobicContact CD2-CD1 4.17Å; L61-P90 HydrophobicContact CD2-CG 4.5Å
62	P	81	Confident	72.5	Confident	57 Å²	57	90.1 Å²	90.1	37%	0.37	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-61.3	151.9	171.8	-22.2	34.7	0	0	0	112	G64 W65 P90	P62-G64 PolarHBondContact O-N 2.93Å; P62-W65 HydrophobicContact CB-CG 4.43Å; P62-W65 WeakPolarHBondContact O-CB 3.39Å; P62-W65 PolarHBondContact O-N 3.45Å; P62-P90 HydrophobicContact CG-CB 4.12Å; P62-P90 HydrophobicContact CG-CG 4.36Å
63	E	83.2	Confident	74.8	Confident	148 Å²	148	83.7 Å²	83.7	69%	0.692	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	123.3	-177.2	-168.5	-167	-171.7	0	0	111.7	R81	E63-R81 VanDerWaalsContact O-CZ 3.28Å; E63-R81 PolarHBondContact O-NE 3.2Å; E63-R81 PolarHBondContact O-NH1 2.95Å; E63-R81 VanDerWaalsContact O-NH1 3.09Å; E63-R81 IonicContact OE1-NH2 2.66Å; E63-R81 PolarHBondContact OE1-NH2 3.46Å; E63-R81 IonicContact OE2-CZ 3.3Å; E63-R81 IonicContact OE2-NH1 2.76Å; E63-R81 IonicContact OE2-NH2 3.33Å; E63-R81 PolarHBondContact OE2-NH2 3.29Å
64	G	84	Confident	76.8	Confident	25 Å²	25	84 Å²	84	26%	0.258	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.8	-5.9	-174.5	0	0	0	0	0	114.5	P62 H80	P62-G64 PolarHBondContact O-N 2.93Å; G64-H80 WeakPolarHBondContact O-CB 3.25Å; G64-H80 PolarHBondContact O-CD2 3.38Å; G64-H80 PolarHBondContact O-N 2.86Å
65	W	89.2	Confident	78.8	Confident	67 Å²	67	82 Å²	82	25%	0.254	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	136	178.9	-67.3	72.6	0	0	0	112.7	L61 P62 F77 I78 D79 T86 P90	L61-W65 HydrophobicContact CB-CB 4.32Å; L61-W65 HydrophobicContact CD2-CB 3.74Å; P62-W65 HydrophobicContact CB-CG 4.43Å; P62-W65 WeakPolarHBondContact O-CB 3.39Å; P62-W65 PolarHBondContact O-N 3.45Å; W65-F77 HydrophobicContact CE3-CB 4.05Å; W65-F77 HydrophobicContact CZ3-CB 4.1Å; W65-I78 CarbonylContact C-O 3.56Å; W65-I78 VanDerWaalsContact CA-O 3.28Å; W65-I78 WeakPolarHBondContact CA-O 3.44Å; W65-D79 HydrophobicContact CD2-CB 3.92Å; W65-D79 HydrophobicContact CE3-CB 4.07Å; W65-D79 HydrophobicContact CH2-CB 3.9Å; W65-D79 HydrophobicContact CZ2-CB 3.7Å; W65-D79 HydrophobicContact CZ3-CB 4.07Å; W65-T86 HydrophobicContact CH2-CG2 3.95Å; W65-T86 HydrophobicContact CZ3-CG2 3.7Å; W65-P90 HydrophobicContact CB-CG 4.23Å; W65-P90 HydrophobicContact CD2-CB 3.59Å; W65-P90 HydrophobicContact CD2-CG 3.56Å; W65-P90 HydrophobicContact CE3-CB 3.65Å; W65-P90 HydrophobicContact CE3-CG 3.43Å; W65-P90 VanDerWaalsContact CE3-CG 3.43Å; W65-P90 HydrophobicContact CG-CB 4.21Å; W65-P90 HydrophobicContact CG-CG 3.94Å; W65-P90 HydrophobicContact CH2-CB 3.91Å; W65-P90 HydrophobicContact CZ2-CB 3.88Å; W65-P90 HydrophobicContact CZ3-CB 3.8Å; W65-P90 HydrophobicContact CZ3-CG 3.95Å
66	E	88.8	Confident	80.6	Confident	69 Å²	69	81.3 Å²	81.3	32%	0.322	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	145.9	172.7	-175.3	-177	-173.4	0	0	109.4	K68 F77 I78 H80	E66-K68 HydrophobicContact CG-CG 4.3Å; E66-K68 WeakPolarHBondContact OE1-CE 3.47Å; E66-K68 IonicContact OE1-NZ 3.73Å; E66-K68 VanDerWaalsContact OE2-CE 3.27Å; E66-K68 WeakPolarHBondContact OE2-CE 3.38Å; E66-K68 IonicContact OE2-NZ 3.75Å; E66-F77 CarbonylContact O-C 3.28Å; E66-F77 WeakPolarHBondContact O-CA 3.39Å; E66-I78 HydrophobicContact CB-CB 4.41Å; E66-I78 PolarHBondContact N-O 3.07Å; E66-I78 PolarHBondContact O-N 3.37Å; E66-H80 WeakPolarHBondContact CB-NE2 3.38Å; E66-H80 IonicContact OE2-CE1 2.68Å; E66-H80 PolarHBondContact OE2-CE1 3.17Å; E66-H80 VanDerWaalsContact OE2-CE1 3.28Å; E66-H80 IonicContact OE2-NE2 3.28Å; E66-H80 PolarHBondContact OE2-NE2 3.32Å
67	I	89.3	Confident	82.4	Confident	81 Å²	81	81 Å²	81	42%	0.415	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130.5	168.9	-174.7	175.2	0	0	0	108.6	L61 P75 F77	L61-I67 HydrophobicContact CD1-CG2 4.12Å; L61-I67 HydrophobicContact CD2-CB 4.42Å; I67-P75 HydrophobicContact CD1-CB 3.99Å; I67-P75 HydrophobicContact CG1-CB 4.22Å; I67-F77 HydrophobicContact CB-CD1 4.13Å; I67-F77 HydrophobicContact CB-CE1 4.12Å; I67-F77 HydrophobicContact CD1-CE1 3.72Å; I67-F77 HydrophobicContact CD1-CZ 3.98Å; I67-F77 HydrophobicContact CG1-CD1 4.17Å; I67-F77 HydrophobicContact CG1-CE1 3.87Å; I67-F77 HydrophobicContact CG1-CZ 4.34Å
68	K	90.5	Very high	83.8	Confident	82 Å²	82	78.8 Å²	78.8	36%	0.357	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	172.3	171.4	-68.2	-161	-173.7	173.5	0	109.9	E66 P75 Y76 I78	E66-K68 HydrophobicContact CG-CG 4.3Å; E66-K68 WeakPolarHBondContact OE1-CE 3.47Å; E66-K68 IonicContact OE1-NZ 3.73Å; E66-K68 VanDerWaalsContact OE2-CE 3.27Å; E66-K68 WeakPolarHBondContact OE2-CE 3.38Å; E66-K68 IonicContact OE2-NZ 3.75Å; K68-P75 CarbonylContact O-C 3.5Å; K68-P75 VanDerWaalsContact O-CA 3.24Å; K68-P75 WeakPolarHBondContact O-CA 3.38Å; K68-Y76 HydrophobicContact CB-CD1 4.14Å; K68-Y76 HydrophobicContact CB-CD2 4.43Å; K68-Y76 HydrophobicContact CB-CE1 3.57Å; K68-Y76 HydrophobicContact CB-CE2 3.91Å; K68-Y76 VanDerWaalsContact CB-CZ 3.44Å; K68-Y76 PolarHBondContact N-O 2.93Å; K68-Y76 PolarHBondContact O-N 2.78Å; K68-I78 HydrophobicContact CD-CD1 3.7Å; K68-I78 HydrophobicContact CG-CD1 4Å
69	V	88.8	Confident	84.9	Confident	90 Å²	90	72.9 Å²	72.9	55%	0.545	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	139	177.7	-173	0	0	0	0	107.6	G73 R74	V69-G73 VanDerWaalsContact CG1-CA 3.48Å; V69-G73 WeakPolarHBondContact CG1-O 3.27Å; V69-R74 WeakPolarHBondContact CA-O 2.89Å
70	D	86.6	Confident	85.6	Confident	38 Å²	38	74.6 Å²	74.6	20%	0.203	40%	0.4	C	S	.	.			trans	-81.8	-174.4	175.7	71.1	9.8	0	0	0	112.4	D72 G73 R74 Y76 W87	D70-D72 PolarHBondContact O-N 3.38Å; D70-D72 WeakPolarHBondContact OD1-CA 3.27Å; D70-D72 PolarHBondContact OD1-N 2.67Å; D70-G73 PolarHBondContact O-N 2.91Å; D70-G73 PolarHBondContact OD1-N 3.4Å; D70-R74 PolarHBondContact N-O 3.24Å; D70-R74 PolarHBondContact OD1-N 2.88Å; D70-R74 WeakPolarHBondContact OD2-CB 3.4Å; D70-Y76 HydrophobicContact CB-CD1 4.29Å; D70-Y76 HydrophobicContact CB-CE1 4.34Å; D70-W87 HydrophobicContact CB-CH2 4.26Å; D70-W87 VanDerWaalsContact OD2-CH2 3.27Å; D70-W87 WeakPolarHBondContact OD2-CH2 3.47Å
71	N	85.7	Confident	85.9	Confident	171 Å²	171	77 Å²	77	91%	0.914	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-22.1	179.4	-63.4	-16.2	0	0	0	113.2	G73	N71-G73 VanDerWaalsContact C-N 3.34Å
72	D	81.8	Confident	86	Confident	137 Å²	137	76.9 Å²	76.9	73%	0.733	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-0.6	-179	-61.6	-30.6	0	0	0	111.9	D70 R74	D70-D72 PolarHBondContact O-N 3.38Å; D70-D72 WeakPolarHBondContact OD1-CA 3.27Å; D70-D72 PolarHBondContact OD1-N 2.67Å; D72-R74 HydrophobicContact CB-CG 4.41Å
73	G	84.1	Confident	86.4	Confident	52 Å²	52	83 Å²	83	54%	0.536	42%	0.419	S	S	.	.	S	Bend	trans	85.4	8.1	-178.9	0	0	0	0	0	114.6	V69 D70 N71	V69-G73 VanDerWaalsContact CG1-CA 3.48Å; V69-G73 WeakPolarHBondContact CG1-O 3.27Å; D70-G73 PolarHBondContact O-N 2.91Å; D70-G73 PolarHBondContact OD1-N 3.4Å; N71-G73 VanDerWaalsContact C-N 3.34Å
74	R	81.6	Confident	86.5	Confident	103 Å²	103	80.3 Å²	80.3	39%	0.389	41%	0.409	S	S	.	.			trans	-85.5	134.4	179.5	-53.6	-178.8	177.3	-137	1.1	110.9	V69 D70 D72 W87	V69-R74 WeakPolarHBondContact CA-O 2.89Å; D70-R74 PolarHBondContact N-O 3.24Å; D70-R74 PolarHBondContact OD1-N 2.88Å; D70-R74 WeakPolarHBondContact OD2-CB 3.4Å; D72-R74 HydrophobicContact CB-CG 4.41Å; R74-W87 HydrophobicContact CB-CZ3 4.15Å
75	P	85.3	Confident	86.7	Confident	67 Å²	67	83.7 Å²	83.7	44%	0.435	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	139.5	176.9	30.3	-33.3	0	0	0	111.9	I67 K68	I67-P75 HydrophobicContact CD1-CB 3.99Å; I67-P75 HydrophobicContact CG1-CB 4.22Å; K68-P75 CarbonylContact O-C 3.5Å; K68-P75 VanDerWaalsContact O-CA 3.24Å; K68-P75 WeakPolarHBondContact O-CA 3.38Å
76	Y	87.5	Confident	86.5	Confident	60 Å²	60	82.1 Å²	82.1	24%	0.235	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	153.7	169.8	69.5	-85.2	0	0	0	111.1	K68 D70 I78 W87	K68-Y76 HydrophobicContact CB-CD1 4.14Å; K68-Y76 HydrophobicContact CB-CD2 4.43Å; K68-Y76 HydrophobicContact CB-CE1 3.57Å; K68-Y76 HydrophobicContact CB-CE2 3.91Å; K68-Y76 VanDerWaalsContact CB-CZ 3.44Å; K68-Y76 PolarHBondContact N-O 2.93Å; K68-Y76 PolarHBondContact O-N 2.78Å; D70-Y76 HydrophobicContact CB-CD1 4.29Å; D70-Y76 HydrophobicContact CB-CE1 4.34Å; Y76-I78 HydrophobicContact CD2-CD1 4.47Å; Y76-I78 HydrophobicContact CD2-CG1 4.04Å; Y76-I78 HydrophobicContact CE2-CD1 3.76Å; Y76-I78 HydrophobicContact CE2-CG1 3.83Å; Y76-W87 HydrophobicContact CD1-CZ3 4.49Å
77	F	90.6	Very high	86.4	Confident	11 Å²	11	84.8 Å²	84.8	5%	0.048	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	136.6	-171.6	-57.7	-91.1	0	0	0	110.6	L61 W65 E66 I67 T85 T86 I88 D89 P90	L61-F77 HydrophobicContact CD2-CD1 4.17Å; W65-F77 HydrophobicContact CE3-CB 4.05Å; W65-F77 HydrophobicContact CZ3-CB 4.1Å; E66-F77 CarbonylContact O-C 3.28Å; E66-F77 WeakPolarHBondContact O-CA 3.39Å; I67-F77 HydrophobicContact CB-CD1 4.13Å; I67-F77 HydrophobicContact CB-CE1 4.12Å; I67-F77 HydrophobicContact CD1-CE1 3.72Å; I67-F77 HydrophobicContact CD1-CZ 3.98Å; I67-F77 HydrophobicContact CG1-CD1 4.17Å; I67-F77 HydrophobicContact CG1-CE1 3.87Å; I67-F77 HydrophobicContact CG1-CZ 4.34Å; F77-T85 CarbonylContact O-C 2.85Å; F77-T85 WeakPolarHBondContact O-CA 3.34Å; F77-T86 PolarHBondContact N-O 2.97Å; F77-T86 PolarHBondContact O-N 2.7Å; F77-I88 WeakPolarHBondContact CD2-O 3.38Å; F77-D89 HydrophobicContact CD2-CB 4.34Å; F77-D89 HydrophobicContact CE1-CB 3.91Å; F77-D89 VanDerWaalsContact CE2-CA 3.44Å; F77-D89 HydrophobicContact CE2-CB 3.68Å; F77-D89 HydrophobicContact CZ-CB 3.42Å; F77-D89 VanDerWaalsContact CZ-CB 3.42Å; F77-D89 VanDerWaalsContact CZ-CG 3.47Å; F77-P90 HydrophobicContact CD1-CG 4.43Å
78	I	88.5	Confident	86	Confident	21 Å²	21	81.7 Å²	81.7	11%	0.108	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	120.8	-178	-47.9	-175.2	0	0	0	108.4	W65 E66 K68 Y76 T85	W65-I78 CarbonylContact C-O 3.56Å; W65-I78 VanDerWaalsContact CA-O 3.28Å; W65-I78 WeakPolarHBondContact CA-O 3.44Å; E66-I78 HydrophobicContact CB-CB 4.41Å; E66-I78 PolarHBondContact N-O 3.07Å; E66-I78 PolarHBondContact O-N 3.37Å; K68-I78 HydrophobicContact CD-CD1 3.7Å; K68-I78 HydrophobicContact CG-CD1 4Å; Y76-I78 HydrophobicContact CD2-CD1 4.47Å; Y76-I78 HydrophobicContact CD2-CG1 4.04Å; Y76-I78 HydrophobicContact CE2-CD1 3.76Å; Y76-I78 HydrophobicContact CE2-CG1 3.83Å; I78-T85 HydrophobicContact CG1-CG2 4.12Å; I78-T85 HydrophobicContact CG2-CG2 4.28Å
79	D	88.4	Confident	85.6	Confident	19 Å²	19	78.7 Å²	78.7	10%	0.102	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	105.7	165.9	178.7	14.2	0	0	0	109.8	W65 R81 S82 K83 I84	W65-D79 HydrophobicContact CD2-CB 3.92Å; W65-D79 HydrophobicContact CE3-CB 4.07Å; W65-D79 HydrophobicContact CH2-CB 3.9Å; W65-D79 HydrophobicContact CZ2-CB 3.7Å; W65-D79 HydrophobicContact CZ3-CB 4.07Å; D79-R81 PolarHBondContact O-N 2.97Å; D79-R81 VanDerWaalsContact OD1-CB 3.28Å; D79-R81 WeakPolarHBondContact OD1-CB 3.32Å; D79-R81 PolarHBondContact OD1-N 3.44Å; D79-S82 WeakPolarHBondContact CB-OG 3.35Å; D79-S82 VanDerWaalsContact CG-OG 3.23Å; D79-S82 VanDerWaalsContact OD2-CB 3.26Å; D79-S82 WeakPolarHBondContact OD2-CB 3.48Å; D79-S82 PolarHBondContact OD2-N 3.37Å; D79-S82 PolarHBondContact OD2-OG 3.35Å; D79-K83 VanDerWaalsContact O-CA 3.22Å; D79-K83 WeakPolarHBondContact O-CA 3.3Å; D79-K83 PolarHBondContact O-N 2.91Å; D79-I84 PolarHBondContact N-O 3.3Å; D79-I84 PolarHBondContact O-N 2.66Å
80	H	84.3	Confident	85.1	Confident	107 Å²	107	75.1 Å²	75.1	50%	0.495	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.1	177.1	-71.3	-80.1	0	0	0	113.4	G64 E66	G64-H80 WeakPolarHBondContact O-CB 3.25Å; G64-H80 PolarHBondContact O-CD2 3.38Å; G64-H80 PolarHBondContact O-N 2.86Å; E66-H80 WeakPolarHBondContact CB-NE2 3.38Å; E66-H80 IonicContact OE2-CE1 2.68Å; E66-H80 PolarHBondContact OE2-CE1 3.17Å; E66-H80 VanDerWaalsContact OE2-CE1 3.28Å; E66-H80 IonicContact OE2-NE2 3.28Å; E66-H80 PolarHBondContact OE2-NE2 3.32Å
81	R	83.8	Confident	84.7	Confident	159 Å²	159	74.8 Å²	74.8	60%	0.6	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-45.3	179.6	-63.3	176.6	160.9	176.1	-6.9	111.9	E63 D79	E63-R81 VanDerWaalsContact O-CZ 3.28Å; E63-R81 PolarHBondContact O-NE 3.2Å; E63-R81 PolarHBondContact O-NH1 2.95Å; E63-R81 VanDerWaalsContact O-NH1 3.09Å; E63-R81 IonicContact OE1-NH2 2.66Å; E63-R81 PolarHBondContact OE1-NH2 3.46Å; E63-R81 IonicContact OE2-CZ 3.3Å; E63-R81 IonicContact OE2-NH1 2.76Å; E63-R81 IonicContact OE2-NH2 3.33Å; E63-R81 PolarHBondContact OE2-NH2 3.29Å; D79-R81 PolarHBondContact O-N 2.97Å; D79-R81 VanDerWaalsContact OD1-CB 3.28Å; D79-R81 WeakPolarHBondContact OD1-CB 3.32Å; D79-R81 PolarHBondContact OD1-N 3.44Å
82	S	83.9	Confident	84.3	Confident	50 Å²	50	67.2 Å²	67.2	35%	0.35	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-13.9	174.7	62	0	0	0	0	114.1	D79 I84	D79-S82 WeakPolarHBondContact CB-OG 3.35Å; D79-S82 VanDerWaalsContact CG-OG 3.23Å; D79-S82 VanDerWaalsContact OD2-CB 3.26Å; D79-S82 WeakPolarHBondContact OD2-CB 3.48Å; D79-S82 PolarHBondContact OD2-N 3.37Å; D79-S82 PolarHBondContact OD2-OG 3.35Å; S82-I84 VanDerWaalsContact C-N 3.29Å
83	K	87.4	Confident	83.7	Confident	187 Å²	187	69.2 Å²	69.2	81%	0.813	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	35.2	-171.1	-55.4	-178.2	179.3	-179.6	0	113.2	D79	D79-K83 VanDerWaalsContact O-CA 3.22Å; D79-K83 WeakPolarHBondContact O-CA 3.3Å; D79-K83 PolarHBondContact O-N 2.91Å
84	I	85.6	Confident	83	Confident	91 Å²	91	73.9 Å²	73.9	47%	0.467	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	136.4	179.3	-60	174.7	0	0	0	109.4	D79 S82	D79-I84 PolarHBondContact N-O 3.3Å; D79-I84 PolarHBondContact O-N 2.66Å; S82-I84 VanDerWaalsContact C-N 3.29Å
85	T	88.8	Confident	82.4	Confident	95 Å²	95	71.3 Å²	71.3	58%	0.583	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	139.1	169.7	55.1	0	0	0	0	110	F77 I78	F77-T85 CarbonylContact O-C 2.85Å; F77-T85 WeakPolarHBondContact O-CA 3.34Å; I78-T85 HydrophobicContact CG1-CG2 4.12Å; I78-T85 HydrophobicContact CG2-CG2 4.28Å
86	T	84.9	Confident	81.9	Confident	34 Å²	34	71.7 Å²	71.7	21%	0.209	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	140.9	-175	138.2	0	0	0	0	110.4	W65 F77 I88	W65-T86 HydrophobicContact CH2-CG2 3.95Å; W65-T86 HydrophobicContact CZ3-CG2 3.7Å; F77-T86 PolarHBondContact N-O 2.97Å; F77-T86 PolarHBondContact O-N 2.7Å; T86-I88 PolarHBondContact O-N 2.97Å; T86-I88 PolarHBondContact OG1-N 3.31Å; T86-I88 PolarHBondContact OG1-O 3.45Å; T86-I88 VanDerWaalsContact OG1-O 3.08Å
87	W	86.4	Confident	80.9	Confident	125 Å²	125	69.5 Å²	69.5	47%	0.473	33%	0.328	S	S	.	.	S	Bend	trans	-75.7	-10.4	173.5	-62.2	107.8	0	0	0	113.4	D70 R74 Y76	D70-W87 HydrophobicContact CB-CH2 4.26Å; D70-W87 VanDerWaalsContact OD2-CH2 3.27Å; D70-W87 WeakPolarHBondContact OD2-CH2 3.47Å; R74-W87 HydrophobicContact CB-CZ3 4.15Å; Y76-W87 HydrophobicContact CD1-CZ3 4.49Å
88	I	81.6	Confident	79.7	Confident	17 Å²	17	72.8 Å²	72.8	9%	0.087	35%	0.353	C	S	.	.	S	Bend	trans	-93.1	131	-178.1	-37.7	171.6	0	0	0	110	F77 T86 F110 H127 L128	F77-I88 WeakPolarHBondContact CD2-O 3.38Å; T86-I88 PolarHBondContact O-N 2.97Å; T86-I88 PolarHBondContact OG1-N 3.31Å; T86-I88 PolarHBondContact OG1-O 3.45Å; T86-I88 VanDerWaalsContact OG1-O 3.08Å; I88-F110 HydrophobicContact CB-CE2 4.32Å; I88-F110 HydrophobicContact CB-CZ 4.18Å; I88-F110 HydrophobicContact CD1-CE1 4.23Å; I88-F110 HydrophobicContact CD1-CZ 4.16Å; I88-F110 HydrophobicContact CG2-CD2 3.87Å; I88-F110 HydrophobicContact CG2-CE1 4.31Å; I88-F110 HydrophobicContact CG2-CE2 3.24Å; I88-F110 HydrophobicContact CG2-CZ 3.49Å; I88-F110 VanDerWaalsContact CG2-CZ 3.49Å; I88-H127 HydrophobicContact CD1-CB 3.69Å; I88-H127 HydrophobicContact CG1-CB 3.49Å; I88-H127 VanDerWaalsContact CG1-CB 3.49Å; I88-L128 HydrophobicContact CD1-CD2 3.59Å; I88-L128 HydrophobicContact CD1-CG 4.3Å
89	D	81.4	Confident	78.7	Confident	18 Å²	18	73.8 Å²	73.8	10%	0.096	36%	0.364	C	S	.	.			trans	-64	125.9	174.6	-168.6	-29.9	0	0	0	109.6	F77 R91 D92	F77-D89 HydrophobicContact CD2-CB 4.34Å; F77-D89 HydrophobicContact CE1-CB 3.91Å; F77-D89 VanDerWaalsContact CE2-CA 3.44Å; F77-D89 HydrophobicContact CE2-CB 3.68Å; F77-D89 HydrophobicContact CZ-CB 3.42Å; F77-D89 VanDerWaalsContact CZ-CB 3.42Å; F77-D89 VanDerWaalsContact CZ-CG 3.47Å; D89-R91 PolarHBondContact O-N 2.96Å; D89-R91 VanDerWaalsContact O-N 3.13Å; D89-R91 WeakPolarHBondContact OD1-CB 3.46Å; D89-R91 WeakPolarHBondContact OD1-CD 3.45Å; D89-R91 WeakPolarHBondContact OD1-CG 3.46Å; D89-R91 PolarHBondContact OD1-N 3.16Å; D89-R91 IonicContact OD1-NE 3.8Å; D89-R91 IonicContact OD2-NE 2.81Å; D89-D92 HydrophobicContact CB-CB 4.26Å; D89-D92 WeakPolarHBondContact O-CB 3.24Å; D89-D92 PolarHBondContact O-N 2.86Å
90	P	77.8	Confident	77.8	Confident	16 Å²	16	74.2 Å²	74.2	10%	0.104	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-23.9	174.2	27.8	-40	0	0	0	113.5	L61 P62 W65 F77	L61-P90 HydrophobicContact CD2-CG 4.5Å; P62-P90 HydrophobicContact CG-CB 4.12Å; P62-P90 HydrophobicContact CG-CG 4.36Å; W65-P90 HydrophobicContact CB-CG 4.23Å; W65-P90 HydrophobicContact CD2-CB 3.59Å; W65-P90 HydrophobicContact CD2-CG 3.56Å; W65-P90 HydrophobicContact CE3-CB 3.65Å; W65-P90 HydrophobicContact CE3-CG 3.43Å; W65-P90 VanDerWaalsContact CE3-CG 3.43Å; W65-P90 HydrophobicContact CG-CB 4.21Å; W65-P90 HydrophobicContact CG-CG 3.94Å; W65-P90 HydrophobicContact CH2-CB 3.91Å; W65-P90 HydrophobicContact CZ2-CB 3.88Å; W65-P90 HydrophobicContact CZ3-CB 3.8Å; W65-P90 HydrophobicContact CZ3-CG 3.95Å; F77-P90 HydrophobicContact CD1-CG 4.43Å
91	R	79.8	Confident	76.8	Confident	31 Å²	31	72.5 Å²	72.5	12%	0.117	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-28.7	174.5	-53.5	167.5	-151.3	-169.7	-0.1	112.2	S56 S57 L59 D89 R93 L94 T95	S56-R91 WeakPolarHBondContact O-CD 3.33Å; S56-R91 PolarHBondContact O-NH1 2.77Å; S57-R91 PolarHBondContact O-NH1 3.38Å; L59-R91 PolarHBondContact O-NE 2.8Å; L59-R91 PolarHBondContact O-NH1 3.33Å; D89-R91 PolarHBondContact O-N 2.96Å; D89-R91 VanDerWaalsContact O-N 3.13Å; D89-R91 WeakPolarHBondContact OD1-CB 3.46Å; D89-R91 WeakPolarHBondContact OD1-CD 3.45Å; D89-R91 WeakPolarHBondContact OD1-CG 3.46Å; D89-R91 PolarHBondContact OD1-N 3.16Å; D89-R91 IonicContact OD1-NE 3.8Å; D89-R91 IonicContact OD2-NE 2.81Å; R91-R93 PolarHBondContact O-N 3.45Å; R91-R93 VanDerWaalsContact O-N 3.15Å; R91-L94 WeakPolarHBondContact O-CA 3.5Å; R91-L94 VanDerWaalsContact O-CB 3.29Å; R91-L94 WeakPolarHBondContact O-CB 3.47Å; R91-L94 PolarHBondContact O-N 3.39Å; R91-T95 PolarHBondContact O-N 3.1Å; R91-T95 VanDerWaalsContact O-N 3.16Å; R91-T95 PolarHBondContact O-OG1 3.31Å
92	D	76.5	Confident	75.9	Confident	12 Å²	12	66.3 Å²	66.3	6%	0.064	34%	0.344	C	S	.	.	H	α-helix	trans	-63.3	-22.3	-178.5	-79.8	-6.4	0	0	0	112	S56 D89 L94 T95 K96 F110	S56-D92 PolarHBondContact OG-OD1 2.96Å; D89-D92 HydrophobicContact CB-CB 4.26Å; D89-D92 WeakPolarHBondContact O-CB 3.24Å; D89-D92 PolarHBondContact O-N 2.86Å; D92-L94 PolarHBondContact O-N 3.02Å; D92-L94 VanDerWaalsContact O-N 3.11Å; D92-T95 WeakPolarHBondContact CA-OG1 3.5Å; D92-T95 PolarHBondContact O-N 3.34Å; D92-T95 PolarHBondContact OD1-OG1 3.08Å; D92-K96 HydrophobicContact CB-CB 4.3Å; D92-K96 HydrophobicContact CB-CD 3.93Å; D92-K96 HydrophobicContact CB-CG 4.03Å; D92-K96 WeakPolarHBondContact O-CA 3.36Å; D92-K96 WeakPolarHBondContact O-CB 3.24Å; D92-K96 PolarHBondContact O-N 3.38Å; D92-K96 WeakPolarHBondContact OD2-CD 3.46Å; D92-K96 WeakPolarHBondContact OD2-CE 3.38Å; D92-K96 IonicContact OD2-NZ 3.72Å; D92-K96 PolarHBondContact OD2-NZ 3.06Å; D92-F110 VanDerWaalsContact C-CD2 3.47Å; D92-F110 HydrophobicContact CB-CD2 3.74Å; D92-F110 HydrophobicContact CB-CE2 4Å
93	R	69	Low	75	Confident	179 Å²	179	65.2 Å²	65.2	68%	0.675	34%	0.336	S	S	*	.	H	α-helix	trans	-60.7	-17.4	169.2	-67.1	-169.1	175.7	-174.6	0.7	113.7	R91 F110	R91-R93 PolarHBondContact O-N 3.45Å; R91-R93 VanDerWaalsContact O-N 3.15Å; R93-F110 HydrophobicContact CB-CD2 4.41Å; R93-F110 HydrophobicContact CB-CE2 4.2Å; R93-F110 HydrophobicContact CG-CD1 4.41Å; R93-F110 HydrophobicContact CG-CD2 3.77Å; R93-F110 HydrophobicContact CG-CE1 3.95Å; R93-F110 HydrophobicContact CG-CE2 3.22Å; R93-F110 HydrophobicContact CG-CG 4.33Å; R93-F110 HydrophobicContact CG-CZ 3.34Å
94	L	69.8	Low	73.6	Confident	150 Å²	150	59.8 Å²	59.8	79%	0.785	32%	0.318	S	S	*	.	H	α-helix	trans	-111.9	-28.1	-175.8	-147	75.8	0	0	0	112.6	R91 D92	R91-L94 WeakPolarHBondContact O-CA 3.5Å; R91-L94 VanDerWaalsContact O-CB 3.29Å; R91-L94 WeakPolarHBondContact O-CB 3.47Å; R91-L94 PolarHBondContact O-N 3.39Å; D92-L94 PolarHBondContact O-N 3.02Å; D92-L94 VanDerWaalsContact O-N 3.11Å
95	T	68.9	Low	72.5	Confident	48 Å²	48	57.6 Å²	57.6	29%	0.294	32%	0.318	S	S	.	.	H	α-helix	trans	-103.2	-32.8	-178.7	52.5	0	0	0	0	114.1	S56 L59 R91 D92	S56-T95 PolarHBondContact OG-OG1 2.96Å; L59-T95 HydrophobicContact CD1-CG2 3.5Å; L59-T95 VanDerWaalsContact CD1-CG2 3.5Å; R91-T95 PolarHBondContact O-N 3.1Å; R91-T95 VanDerWaalsContact O-N 3.16Å; R91-T95 PolarHBondContact O-OG1 3.31Å; D92-T95 WeakPolarHBondContact CA-OG1 3.5Å; D92-T95 PolarHBondContact O-N 3.34Å; D92-T95 PolarHBondContact OD1-OG1 3.08Å
96	K	74	Confident	71.5	Confident	75 Å²	75	60 Å²	60	33%	0.326	33%	0.327	S	S	.	.	S	Bend	trans	-91.2	150.1	178.6	-70.9	-172.9	179.8	159.3	0	112.4	D92	D92-K96 HydrophobicContact CB-CB 4.3Å; D92-K96 HydrophobicContact CB-CD 3.93Å; D92-K96 HydrophobicContact CB-CG 4.03Å; D92-K96 WeakPolarHBondContact O-CA 3.36Å; D92-K96 WeakPolarHBondContact O-CB 3.24Å; D92-K96 PolarHBondContact O-N 3.38Å; D92-K96 WeakPolarHBondContact OD2-CD 3.46Å; D92-K96 WeakPolarHBondContact OD2-CE 3.38Å; D92-K96 IonicContact OD2-NZ 3.72Å; D92-K96 PolarHBondContact OD2-NZ 3.06Å
97	P	66.6	Low	70.8	Confident	14 Å²	14	63 Å²	63	9%	0.091	34%	0.339	C	S	.	.			trans	-55.2	137.7	171.1	14.4	-24.2	0	0	0	112	D102 C103 P109 F110	P97-D102 HydrophobicContact CB-CB 3.36Å; P97-C103 HydrophobicContact CG-CB 4.24Å; P97-C103 WeakPolarHBondContact CG-SG 3.37Å; P97-P109 CarbonylContact O-C 3.23Å; P97-P109 WeakPolarHBondContact O-CA 3.4Å; P97-P109 WeakPolarHBondContact O-CB 3.44Å; P97-F110 PolarHBondContact O-N 2.94Å
98	S	67	Low	70.5	Confident	81 Å²	81	58 Å²	58	57%	0.566	32%	0.321	S	S	*	.	S	Bend	trans	-81.1	-16.5	-177.3	-50.7	0	0	0	0	113.6
99	A	66.7	Low	70.4	Confident	42 Å²	42	57.4 Å²	57.4	35%	0.347	32%	0.318	S	S	.	.	S	Bend	trans	-147.7	164.6	-178.6	0	0	0	0	0	110.1	S101 D102 C103	A99-S101 VanDerWaalsContact C-N 3.29Å; A99-S101 PolarHBondContact O-N 3.01Å; A99-D102 VanDerWaalsContact O-CB 3.31Å; A99-D102 WeakPolarHBondContact O-CB 3.24Å; A99-D102 PolarHBondContact O-N 3.34Å; A99-C103 PolarHBondContact O-SG 3.04Å; A99-C103 VanDerWaalsContact O-SG 3.42Å
100	F	68.5	Low	70.3	Confident	28 Å²	28	57.8 Å²	57.8	12%	0.123	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-63.6	-33.7	179.3	-76.3	-88.1	0	0	0	113.4	D102 C103 P109 W112 P137 R138 W141	F100-D102 PolarHBondContact O-N 2.93Å; F100-C103 WeakPolarHBondContact O-CB 3.46Å; F100-C103 PolarHBondContact O-N 3.38Å; F100-P109 HydrophobicContact CD1-CG 3.8Å; F100-P109 HydrophobicContact CD2-CG 3.73Å; F100-P109 HydrophobicContact CE1-CG 3.53Å; F100-P109 HydrophobicContact CE2-CG 3.48Å; F100-P109 VanDerWaalsContact CE2-CG 3.48Å; F100-P109 HydrophobicContact CG-CG 3.9Å; F100-P109 HydrophobicContact CZ-CG 3.37Å; F100-W112 AromaticContact CE2-CE2 3.89Å; F100-W112 HydrophobicContact CE2-CZ2 4.26Å; F100-W112 AromaticContact CE2-NE1 3.5Å; F100-W112 AromaticContact CZ-CD1 3.81Å; F100-W112 AromaticContact CZ-CD2 3.96Å; F100-W112 HydrophobicContact CZ-CD2 3.96Å; F100-W112 AromaticContact CZ-CE2 3.56Å; F100-W112 HydrophobicContact CZ-CG 4.06Å; F100-W112 HydrophobicContact CZ-CZ2 4.02Å; F100-W112 AromaticContact CZ-NE1 3.5Å; F100-P137 HydrophobicContact CE1-CB 3.62Å; F100-P137 HydrophobicContact CE1-CG 3.78Å; F100-P137 HydrophobicContact CZ-CB 3.6Å; F100-P137 HydrophobicContact CZ-CG 3.94Å; F100-R138 HydrophobicContact CD1-CG 4.29Å; F100-R138 HydrophobicContact CE1-CG 4.29Å; F100-W141 HydrophobicContact CB-CB 3.95Å; F100-W141 HydrophobicContact CB-CD2 3.55Å; F100-W141 HydrophobicContact CB-CE3 3.99Å; F100-W141 HydrophobicContact CB-CG 3.51Å; F100-W141 HydrophobicContact CD1-CB 4.26Å; F100-W141 AromaticContact CD1-CD1 3.55Å; F100-W141 AromaticContact CD1-CG 3.88Å; F100-W141 HydrophobicContact CD1-CG 3.88Å; F100-W141 AromaticContact CD2-CD1 3.38Å; F100-W141 AromaticContact CD2-CD2 3.83Å; F100-W141 HydrophobicContact CD2-CD2 3.83Å; F100-W141 AromaticContact CD2-CE2 3.33Å; F100-W141 AromaticContact CD2-CG 3.86Å; F100-W141 HydrophobicContact CD2-CG 3.86Å; F100-W141 AromaticContact CD2-CZ2 3.9Å; F100-W141 HydrophobicContact CD2-CZ2 3.9Å; F100-W141 AromaticContact CD2-NE1 3.05Å; F100-W141 AromaticContact CE1-CD1 3.87Å; F100-W141 AromaticContact CE2-CD1 3.69Å; F100-W141 AromaticContact CE2-CE2 3.98Å; F100-W141 AromaticContact CE2-NE1 3.29Å; F100-W141 VanDerWaalsContact CE2-NE1 3.29Å; F100-W141 HydrophobicContact CG-CB 4.15Å; F100-W141 AromaticContact CG-CD1 3.28Å; F100-W141 AromaticContact CG-CD2 3.74Å; F100-W141 HydrophobicContact CG-CD2 3.74Å; F100-W141 AromaticContact CG-CE2 3.77Å; F100-W141 AromaticContact CG-CG 3.45Å; F100-W141 HydrophobicContact CG-CG 3.45Å; F100-W141 VanDerWaalsContact CG-CG 3.45Å; F100-W141 AromaticContact CG-NE1 3.51Å; F100-W141 AromaticContact CZ-CD1 3.92Å; F100-W141 AromaticContact CZ-NE1 3.94Å
101	S	64.6	Low	70.5	Confident	71 Å²	71	57.1 Å²	57.1	50%	0.497	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-62.2	-10.1	173.1	-41.8	0	0	0	0	114.5	A99 R1019 T1053	A99-S101 VanDerWaalsContact C-N 3.29Å; A99-S101 PolarHBondContact O-N 3.01Å; S101-R1019 PolarHBondContact O-NH1 3.41Å; S101-T1053 WeakPolarHBondContact O-CG2 3.32Å
102	D	64.6	Low	70.8	Confident	29 Å²	29	56.9 Å²	56.9	16%	0.155	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-101	-10.7	179.3	-64.2	18	0	0	0	112.1	P97 A99 F100 R1019	P97-D102 HydrophobicContact CB-CB 3.36Å; A99-D102 VanDerWaalsContact O-CB 3.31Å; A99-D102 WeakPolarHBondContact O-CB 3.24Å; A99-D102 PolarHBondContact O-N 3.34Å; F100-D102 PolarHBondContact O-N 2.93Å; D102-R1019 IonicContact OD1-CZ 3.17Å; D102-R1019 IonicContact OD1-NH1 3.72Å; D102-R1019 PolarHBondContact OD1-NH1 3.3Å; D102-R1019 IonicContact OD1-NH2 2.69Å; D102-R1019 PolarHBondContact OD1-NH2 2.87Å; D102-R1019 IonicContact OD2-NH2 2.66Å; D102-R1019 PolarHBondContact OD2-NH2 2.87Å; D102-R1019 VanDerWaalsContact OD2-NH2 3.07Å
103	C	65.4	Low	71.2	Confident	26 Å²	26	59.5 Å²	59.5	18%	0.176	33%	0.326	C	S	.	.			trans	-79.4	135	-172.3	-60.7	0	0	0	0	111.7	P97 A99 F100 P109	P97-C103 HydrophobicContact CG-CB 4.24Å; P97-C103 WeakPolarHBondContact CG-SG 3.37Å; A99-C103 PolarHBondContact O-SG 3.04Å; A99-C103 VanDerWaalsContact O-SG 3.42Å; F100-C103 WeakPolarHBondContact O-CB 3.46Å; F100-C103 PolarHBondContact O-N 3.38Å; C103-P109 VanDerWaalsContact SG-CD 3.56Å
104	V	58.1	Low	72	Confident	74 Å²	74	56 Å²	56	45%	0.448	32%	0.317	S	S	.	.			trans	-114.3	129.8	178.2	-175.8	0	0	0	0	109.5	N106 E107	V104-N106 PolarHBondContact O-N 2.88Å; V104-N106 VanDerWaalsContact O-N 3.11Å; V104-E107 PolarHBondContact O-N 2.89Å
105	G	62.8	Low	72.8	Confident	44 Å²	44	49.3 Å²	49.3	45%	0.454	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	-114.6	179.3	0	0	0	0	0	112.7
106	N	66.9	Low	73.6	Confident	145 Å²	145	54.6 Å²	54.6	78%	0.775	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	13.1	-173.3	-67.3	-9.8	0	0	0	114.2	V104 R138	V104-N106 PolarHBondContact O-N 2.88Å; V104-N106 VanDerWaalsContact O-N 3.11Å; N106-R138 VanDerWaalsContact CA-NH1 3.35Å; N106-R138 PolarHBondContact O-NH1 3.17Å
107	E	70.9	Confident	74.2	Confident	99 Å²	99	53.6 Å²	53.6	46%	0.463	30%	0.298	S	S	.	.			trans	-76	149.7	175.1	-65.2	-177.4	175.6	0	0	112.1	V104 R138	V104-E107 PolarHBondContact O-N 2.89Å; E107-R138 PolarHBondContact O-NH1 3.43Å
108	L	80.1	Confident	75	Confident	20 Å²	20	59.4 Å²	59.4	11%	0.105	33%	0.328	C	S	.	.			trans	-113.1	145.2	172.8	-76.5	172.4	0	0	0	109.7	W112 Q114 F124 P137 R138	L108-W112 HydrophobicContact CB-CB 4.03Å; L108-W112 HydrophobicContact CD1-CB 4.49Å; L108-W112 HydrophobicContact CD2-CB 4.46Å; L108-Q114 HydrophobicContact CD1-CB 3.84Å; L108-F124 HydrophobicContact CD1-CD1 3.91Å; L108-F124 HydrophobicContact CD1-CE1 4.13Å; L108-F124 HydrophobicContact CD2-CD1 4.26Å; L108-F124 HydrophobicContact CD2-CE1 4.38Å; L108-P137 HydrophobicContact CD2-CG 3.96Å; L108-R138 HydrophobicContact CD2-CG 4.22Å
109	P	78.5	Confident	75.9	Confident	3 Å²	3	62.8 Å²	62.8	2%	0.019	34%	0.34	C	S	.	.			trans	-72.9	168.2	-176.8	25.6	-26.6	0	0	0	113.1	P97 F100 C103 G111 W112	P97-P109 CarbonylContact O-C 3.23Å; P97-P109 WeakPolarHBondContact O-CA 3.4Å; P97-P109 WeakPolarHBondContact O-CB 3.44Å; F100-P109 HydrophobicContact CD1-CG 3.8Å; F100-P109 HydrophobicContact CD2-CG 3.73Å; F100-P109 HydrophobicContact CE1-CG 3.53Å; F100-P109 HydrophobicContact CE2-CG 3.48Å; F100-P109 VanDerWaalsContact CE2-CG 3.48Å; F100-P109 HydrophobicContact CG-CG 3.9Å; F100-P109 HydrophobicContact CZ-CG 3.37Å; C103-P109 VanDerWaalsContact SG-CD 3.56Å; P109-G111 PolarHBondContact O-N 3.36Å; P109-W112 HydrophobicContact CG-CG 4.3Å; P109-W112 PolarHBondContact O-N 2.86Å
110	F	79.2	Confident	76.6	Confident	27 Å²	27	64.9 Å²	64.9	12%	0.118	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	126.6	178.2	179.2	-100.7	0	0	0	111.7	I88 D92 R93 P97 L128	I88-F110 HydrophobicContact CB-CE2 4.32Å; I88-F110 HydrophobicContact CB-CZ 4.18Å; I88-F110 HydrophobicContact CD1-CE1 4.23Å; I88-F110 HydrophobicContact CD1-CZ 4.16Å; I88-F110 HydrophobicContact CG2-CD2 3.87Å; I88-F110 HydrophobicContact CG2-CE1 4.31Å; I88-F110 HydrophobicContact CG2-CE2 3.24Å; I88-F110 HydrophobicContact CG2-CZ 3.49Å; I88-F110 VanDerWaalsContact CG2-CZ 3.49Å; D92-F110 VanDerWaalsContact C-CD2 3.47Å; D92-F110 HydrophobicContact CB-CD2 3.74Å; D92-F110 HydrophobicContact CB-CE2 4Å; R93-F110 HydrophobicContact CB-CD2 4.41Å; R93-F110 HydrophobicContact CB-CE2 4.2Å; R93-F110 HydrophobicContact CG-CD1 4.41Å; R93-F110 HydrophobicContact CG-CD2 3.77Å; R93-F110 HydrophobicContact CG-CE1 3.95Å; R93-F110 HydrophobicContact CG-CE2 3.22Å; R93-F110 HydrophobicContact CG-CG 4.33Å; R93-F110 HydrophobicContact CG-CZ 3.34Å; P97-F110 PolarHBondContact O-N 2.94Å; F110-L128 HydrophobicContact CD1-CD1 4.4Å; F110-L128 HydrophobicContact CD1-CD2 4.29Å; F110-L128 HydrophobicContact CE1-CD2 3.92Å
111	G	81.8	Confident	77.6	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.01	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	-8.1	-177.8	0	0	0	0	0	115.7	P109 H127	P109-G111 PolarHBondContact O-N 3.36Å; G111-H127 WeakPolarHBondContact O-CB 3.28Å; G111-H127 PolarHBondContact O-CD2 2.92Å; G111-H127 PolarHBondContact O-N 3.28Å
112	W	86.4	Confident	78.6	Confident	27 Å²	27	64.1 Å²	64.1	10%	0.102	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	138.7	172.7	-71.7	81.5	0	0	0	112.3	F100 L108 P109 F124 I125 N126 Q133 P137	F100-W112 AromaticContact CE2-CE2 3.89Å; F100-W112 HydrophobicContact CE2-CZ2 4.26Å; F100-W112 AromaticContact CE2-NE1 3.5Å; F100-W112 AromaticContact CZ-CD1 3.81Å; F100-W112 AromaticContact CZ-CD2 3.96Å; F100-W112 HydrophobicContact CZ-CD2 3.96Å; F100-W112 AromaticContact CZ-CE2 3.56Å; F100-W112 HydrophobicContact CZ-CG 4.06Å; F100-W112 HydrophobicContact CZ-CZ2 4.02Å; F100-W112 AromaticContact CZ-NE1 3.5Å; L108-W112 HydrophobicContact CB-CB 4.03Å; L108-W112 HydrophobicContact CD1-CB 4.49Å; L108-W112 HydrophobicContact CD2-CB 4.46Å; P109-W112 HydrophobicContact CG-CG 4.3Å; P109-W112 PolarHBondContact O-N 2.86Å; W112-F124 HydrophobicContact CE3-CB 4.21Å; W112-F124 HydrophobicContact CZ3-CB 4.14Å; W112-I125 CarbonylContact C-O 3.52Å; W112-I125 VanDerWaalsContact CA-O 3.32Å; W112-I125 WeakPolarHBondContact CA-O 3.46Å; W112-N126 HydrophobicContact CD2-CB 3.85Å; W112-N126 HydrophobicContact CE3-CB 3.9Å; W112-N126 HydrophobicContact CH2-CB 3.81Å; W112-N126 HydrophobicContact CZ2-CB 3.7Å; W112-N126 VanDerWaalsContact CZ2-ND2 3.29Å; W112-N126 WeakPolarHBondContact CZ2-ND2 3.5Å; W112-N126 HydrophobicContact CZ3-CB 3.88Å; W112-Q133 HydrophobicContact CH2-CG 4.48Å; W112-Q133 HydrophobicContact CZ3-CG 4.1Å; W112-P137 HydrophobicContact CD2-CG 4.21Å; W112-P137 HydrophobicContact CE3-CB 4.21Å; W112-P137 HydrophobicContact CE3-CG 3.73Å; W112-P137 HydrophobicContact CH2-CB 3.8Å; W112-P137 HydrophobicContact CH2-CG 4.23Å; W112-P137 HydrophobicContact CZ2-CB 4.19Å; W112-P137 HydrophobicContact CZ3-CB 3.83Å; W112-P137 HydrophobicContact CZ3-CG 3.74Å
113	E	84.9	Confident	79.8	Confident	67 Å²	67	64.8 Å²	64.8	31%	0.313	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	139.6	176.3	179	-177.9	160	0	0	109.8	F124 I125 H127	E113-F124 WeakPolarHBondContact O-CA 3.39Å; E113-I125 HydrophobicContact CB-CB 4.35Å; E113-I125 PolarHBondContact N-O 2.83Å; E113-I125 PolarHBondContact O-N 2.83Å; E113-H127 IonicContact OE2-CD2 2.97Å; E113-H127 IonicContact OE2-CE1 2.83Å; E113-H127 PolarHBondContact OE2-CE1 2.73Å; E113-H127 IonicContact OE2-NE2 3.84Å; E113-H127 PolarHBondContact OE2-NE2 2.84Å
114	Q	86.8	Confident	81	Confident	105 Å²	105	64 Å²	64	49%	0.491	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	116.9	167.7	-177.4	-177.5	-18.3	0	0	108.2	L108 V122 F124	L108-Q114 HydrophobicContact CD1-CB 3.84Å; Q114-V122 HydrophobicContact CG-CG1 3.59Å; Q114-F124 HydrophobicContact CB-CD1 4.31Å; Q114-F124 HydrophobicContact CB-CE1 4.19Å; Q114-F124 HydrophobicContact CG-CD1 4.44Å; Q114-F124 HydrophobicContact CG-CE1 4Å; Q114-F124 HydrophobicContact CG-CZ 4.47Å
115	A	86.1	Confident	82.4	Confident	10 Å²	10	61.3 Å²	61.3	8%	0.083	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	165.1	176	0	0	0	0	0	110.7	V122 Y123 I125	A115-V122 WeakPolarHBondContact O-CA 3.46Å; A115-Y123 HydrophobicContact CB-CD1 4.11Å; A115-Y123 HydrophobicContact CB-CD2 4.3Å; A115-Y123 HydrophobicContact CB-CE1 3.56Å; A115-Y123 HydrophobicContact CB-CE2 3.8Å; A115-Y123 HydrophobicContact CB-CG 4.44Å; A115-Y123 PolarHBondContact N-O 2.86Å; A115-Y123 PolarHBondContact O-N 2.84Å; A115-Y123 VanDerWaalsContact O-O 3.12Å; A115-I125 HydrophobicContact CB-CD1 3.76Å; A115-I125 HydrophobicContact CB-CG1 4.29Å
116	Y	86.7	Confident	83.5	Confident	158 Å²	158	60.2 Å²	60.2	62%	0.62	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.4	131	176.5	179.6	-91.4	0	0	0	109.2	N118 G121 V122	Y116-N118 WeakPolarHBondContact CE1-OD1 3.43Å; Y116-G121 WeakPolarHBondContact CA-O 3.28Å; Y116-V122 HydrophobicContact CD2-CG2 3.95Å
117	D	85.8	Confident	84.2	Confident	55 Å²	55	55.6 Å²	55.6	29%	0.294	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	147.6	169.2	170.4	52.3	0	0	0	109.8	N119 V120 G121 Y123	D117-N119 VanDerWaalsContact C-N 3.29Å; D117-N119 PolarHBondContact O-N 3.48Å; D117-N119 WeakPolarHBondContact OD2-CB 3.38Å; D117-N119 PolarHBondContact OD2-N 2.84Å; D117-V120 HydrophobicContact CB-CB 4.26Å; D117-V120 WeakPolarHBondContact OD2-CB 3.28Å; D117-V120 WeakPolarHBondContact OD2-CG2 3.26Å; D117-V120 PolarHBondContact OD2-N 3Å; D117-G121 PolarHBondContact N-O 3.18Å; D117-G121 VanDerWaalsContact O-CA 3.24Å; D117-G121 WeakPolarHBondContact O-CA 3.22Å; D117-G121 PolarHBondContact O-N 3.34Å; D117-Y123 HydrophobicContact CB-CD1 4.28Å; D117-Y123 HydrophobicContact CB-CE1 3.87Å
118	N	84.4	Confident	84.6	Confident	135 Å²	135	56.1 Å²	56.1	72%	0.722	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-26.1	-177.1	-70.9	-25.1	0	0	0	113.2	Y116	Y116-N118 WeakPolarHBondContact CE1-OD1 3.43Å
119	N	84.2	Confident	84.8	Confident	153 Å²	153	58.1 Å²	58.1	82%	0.818	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-35.7	-175.5	-56.9	-16.7	0	0	0	111.7	D117	D117-N119 VanDerWaalsContact C-N 3.29Å; D117-N119 PolarHBondContact O-N 3.48Å; D117-N119 WeakPolarHBondContact OD2-CB 3.38Å; D117-N119 PolarHBondContact OD2-N 2.84Å
120	V	82.3	Confident	85.2	Confident	85 Å²	85	62.3 Å²	62.3	52%	0.515	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-23.8	-175.2	176.1	0	0	0	0	112.8	D117 L134	D117-V120 HydrophobicContact CB-CB 4.26Å; D117-V120 WeakPolarHBondContact OD2-CB 3.28Å; D117-V120 WeakPolarHBondContact OD2-CG2 3.26Å; D117-V120 PolarHBondContact OD2-N 3Å; V120-L134 HydrophobicContact CG1-CD2 3.27Å
121	G	88.5	Confident	85.5	Confident	21 Å²	21	64.1 Å²	64.1	22%	0.216	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	86.6	-147.5	-174.6	0	0	0	0	0	112.8	Y116 D117	Y116-G121 WeakPolarHBondContact CA-O 3.28Å; D117-G121 PolarHBondContact N-O 3.18Å; D117-G121 VanDerWaalsContact O-CA 3.24Å; D117-G121 WeakPolarHBondContact O-CA 3.22Å; D117-G121 PolarHBondContact O-N 3.34Å
122	V	87.1	Confident	85.9	Confident	63 Å²	63	69.3 Å²	69.3	38%	0.382	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	131.8	176.2	176.2	0	0	0	0	109.9	Q114 A115 Y116 F124	Q114-V122 HydrophobicContact CG-CG1 3.59Å; A115-V122 WeakPolarHBondContact O-CA 3.46Å; Y116-V122 HydrophobicContact CD2-CG2 3.95Å; V122-F124 HydrophobicContact CG1-CE2 4.13Å; V122-F124 HydrophobicContact CG1-CZ 4.07Å
123	Y	89.1	Confident	86	Confident	43 Å²	43	70.2 Å²	70.2	17%	0.169	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	163.1	173.7	70.8	-81.5	0	0	0	110.8	A115 D117 I125	A115-Y123 HydrophobicContact CB-CD1 4.11Å; A115-Y123 HydrophobicContact CB-CD2 4.3Å; A115-Y123 HydrophobicContact CB-CE1 3.56Å; A115-Y123 HydrophobicContact CB-CE2 3.8Å; A115-Y123 HydrophobicContact CB-CG 4.44Å; A115-Y123 PolarHBondContact N-O 2.86Å; A115-Y123 PolarHBondContact O-N 2.84Å; A115-Y123 VanDerWaalsContact O-O 3.12Å; D117-Y123 HydrophobicContact CB-CD1 4.28Å; D117-Y123 HydrophobicContact CB-CE1 3.87Å; Y123-I125 HydrophobicContact CD2-CG1 4.03Å; Y123-I125 HydrophobicContact CE2-CD1 3.72Å; Y123-I125 HydrophobicContact CE2-CG1 3.6Å
124	F	90.6	Very high	86.2	Confident	10 Å²	10	73 Å²	73	4%	0.044	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.5	-172.2	-59.6	-91.7	0	0	0	110.7	L108 W112 E113 Q114 V122 N132 Q133 D136 P137	L108-F124 HydrophobicContact CD1-CD1 3.91Å; L108-F124 HydrophobicContact CD1-CE1 4.13Å; L108-F124 HydrophobicContact CD2-CD1 4.26Å; L108-F124 HydrophobicContact CD2-CE1 4.38Å; W112-F124 HydrophobicContact CE3-CB 4.21Å; W112-F124 HydrophobicContact CZ3-CB 4.14Å; E113-F124 WeakPolarHBondContact O-CA 3.39Å; Q114-F124 HydrophobicContact CB-CD1 4.31Å; Q114-F124 HydrophobicContact CB-CE1 4.19Å; Q114-F124 HydrophobicContact CG-CD1 4.44Å; Q114-F124 HydrophobicContact CG-CE1 4Å; Q114-F124 HydrophobicContact CG-CZ 4.47Å; V122-F124 HydrophobicContact CG1-CE2 4.13Å; V122-F124 HydrophobicContact CG1-CZ 4.07Å; F124-N132 CarbonylContact O-C 3.23Å; F124-N132 WeakPolarHBondContact O-CA 3.46Å; F124-Q133 HydrophobicContact CB-CG 4.12Å; F124-Q133 PolarHBondContact N-O 3.11Å; F124-Q133 PolarHBondContact O-N 2.88Å; F124-D136 HydrophobicContact CD2-CB 4.45Å; F124-D136 HydrophobicContact CE1-CB 4.46Å; F124-D136 HydrophobicContact CE2-CB 3.69Å; F124-D136 HydrophobicContact CZ-CB 3.68Å; F124-P137 HydrophobicContact CB-CG 4.43Å; F124-P137 HydrophobicContact CD1-CG 4.28Å; F124-P137 VanDerWaalsContact CG-CD 3.44Å; F124-P137 HydrophobicContact CG-CG 4.38Å
125	I	87.2	Confident	86.1	Confident	16 Å²	16	73 Å²	73	8%	0.082	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130.1	-177.9	-57.4	175.6	0	0	0	108	W112 E113 A115 Y123 N132	W112-I125 CarbonylContact C-O 3.52Å; W112-I125 VanDerWaalsContact CA-O 3.32Å; W112-I125 WeakPolarHBondContact CA-O 3.46Å; E113-I125 HydrophobicContact CB-CB 4.35Å; E113-I125 PolarHBondContact N-O 2.83Å; E113-I125 PolarHBondContact O-N 2.83Å; A115-I125 HydrophobicContact CB-CD1 3.76Å; A115-I125 HydrophobicContact CB-CG1 4.29Å; Y123-I125 HydrophobicContact CD2-CG1 4.03Å; Y123-I125 HydrophobicContact CE2-CD1 3.72Å; Y123-I125 HydrophobicContact CE2-CG1 3.6Å; I125-N132 WeakPolarHBondContact CG2-OD1 3.44Å
126	N	87	Confident	85.9	Confident	21 Å²	21	74 Å²	74	11%	0.112	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	105.3	169.5	-175.5	-7.3	0	0	0	110	W112 L128 S129 A130 T131	W112-N126 HydrophobicContact CD2-CB 3.85Å; W112-N126 HydrophobicContact CE3-CB 3.9Å; W112-N126 HydrophobicContact CH2-CB 3.81Å; W112-N126 HydrophobicContact CZ2-CB 3.7Å; W112-N126 VanDerWaalsContact CZ2-ND2 3.29Å; W112-N126 WeakPolarHBondContact CZ2-ND2 3.5Å; W112-N126 HydrophobicContact CZ3-CB 3.88Å; N126-L128 PolarHBondContact O-N 2.84Å; N126-L128 WeakPolarHBondContact OD1-CB 3.5Å; N126-L128 PolarHBondContact OD1-N 2.76Å; N126-S129 WeakPolarHBondContact CB-OG 3.38Å; N126-S129 PolarHBondContact ND2-OG 2.81Å; N126-A130 VanDerWaalsContact O-CA 3.24Å; N126-A130 WeakPolarHBondContact O-CA 3.33Å; N126-A130 PolarHBondContact O-N 3.24Å; N126-T131 PolarHBondContact N-O 2.58Å; N126-T131 PolarHBondContact O-N 3.38Å
127	H	80.6	Confident	85.6	Confident	49 Å²	49	66.5 Å²	66.5	23%	0.227	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-11.2	178.9	-65.5	-67.9	0	0	0	114.3	I88 G111 E113	I88-H127 HydrophobicContact CD1-CB 3.69Å; I88-H127 HydrophobicContact CG1-CB 3.49Å; I88-H127 VanDerWaalsContact CG1-CB 3.49Å; G111-H127 WeakPolarHBondContact O-CB 3.28Å; G111-H127 PolarHBondContact O-CD2 2.92Å; G111-H127 PolarHBondContact O-N 3.28Å; E113-H127 IonicContact OE2-CD2 2.97Å; E113-H127 IonicContact OE2-CE1 2.83Å; E113-H127 PolarHBondContact OE2-CE1 2.73Å; E113-H127 IonicContact OE2-NE2 3.84Å; E113-H127 PolarHBondContact OE2-NE2 2.84Å
128	L	79.8	Confident	85.3	Confident	109 Å²	109	65.1 Å²	65.1	57%	0.571	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-36.8	176.5	-58.3	173.5	0	0	0	112.1	I88 F110 N126	I88-L128 HydrophobicContact CD1-CD2 3.59Å; I88-L128 HydrophobicContact CD1-CG 4.3Å; F110-L128 HydrophobicContact CD1-CD1 4.4Å; F110-L128 HydrophobicContact CD1-CD2 4.29Å; F110-L128 HydrophobicContact CE1-CD2 3.92Å; N126-L128 PolarHBondContact O-N 2.84Å; N126-L128 WeakPolarHBondContact OD1-CB 3.5Å; N126-L128 PolarHBondContact OD1-N 2.76Å
129	S	84	Confident	85.1	Confident	62 Å²	62	61.8 Å²	61.8	43%	0.434	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-7.8	175.7	51.5	0	0	0	0	113.7	N126 T131	N126-S129 WeakPolarHBondContact CB-OG 3.38Å; N126-S129 PolarHBondContact ND2-OG 2.81Å; S129-T131 VanDerWaalsContact C-N 3.32Å; S129-T131 PolarHBondContact O-N 2.87Å; S129-T131 PolarHBondContact OG-OG1 3.24Å
130	A	86	Confident	85	Confident	91 Å²	91	58.1 Å²	58.1	75%	0.752	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	42.4	-171.1	0	0	0	0	0	113.3	N126	N126-A130 VanDerWaalsContact O-CA 3.24Å; N126-A130 WeakPolarHBondContact O-CA 3.33Å; N126-A130 PolarHBondContact O-N 3.24Å
131	T	87	Confident	84.8	Confident	65 Å²	65	59.4 Å²	59.4	40%	0.399	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	145	-178.1	55.8	0	0	0	0	112.1	N126 S129	N126-T131 PolarHBondContact N-O 2.58Å; N126-T131 PolarHBondContact O-N 3.38Å; S129-T131 VanDerWaalsContact C-N 3.32Å; S129-T131 PolarHBondContact O-N 2.87Å; S129-T131 PolarHBondContact OG-OG1 3.24Å
132	N	89.6	Confident	84.3	Confident	111 Å²	111	63.4 Å²	63.4	59%	0.594	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.5	145.7	176.7	-57.3	-22.2	0	0	0	110.4	F124 I125	F124-N132 CarbonylContact O-C 3.23Å; F124-N132 WeakPolarHBondContact O-CA 3.46Å; I125-N132 WeakPolarHBondContact CG2-OD1 3.44Å
133	Q	88.1	Confident	84.1	Confident	46 Å²	46	62.8 Å²	62.8	22%	0.215	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	151.1	175.9	61.9	-176.8	59.8	0	0	112	W112 F124 E135	W112-Q133 HydrophobicContact CH2-CG 4.48Å; W112-Q133 HydrophobicContact CZ3-CG 4.1Å; F124-Q133 HydrophobicContact CB-CG 4.12Å; F124-Q133 PolarHBondContact N-O 3.11Å; F124-Q133 PolarHBondContact O-N 2.88Å; Q133-E135 PolarHBondContact NE2-O 2.92Å
134	L	88.5	Confident	83.8	Confident	124 Å²	124	65.7 Å²	65.7	65%	0.649	35%	0.351	S	S	*	.	S	Bend	trans	-81.4	-35.5	178.5	-55.2	-174.8	0	0	0	112.2	V120	V120-L134 HydrophobicContact CG1-CD2 3.27Å
135	E	84.9	Confident	83.4	Confident	106 Å²	106	69 Å²	69	50%	0.495	37%	0.366	S	S	.	.	S	Bend	trans	-80.6	140.5	-176.7	-168.9	171.7	-141.6	0	0	111.3	Q133 P137 Q140	Q133-E135 PolarHBondContact NE2-O 2.92Å; E135-P137 WeakPolarHBondContact O-CD 3.37Å; E135-Q140 HydrophobicContact CG-CG 4.29Å; E135-Q140 WeakPolarHBondContact OE2-CG 3.26Å; E135-Q140 PolarHBondContact OE2-NE2 3.38Å
136	D	82.1	Confident	83.2	Confident	31 Å²	31	69.8 Å²	69.8	17%	0.166	37%	0.371	C	S	.	.			trans	-63.3	119.2	178.9	-173.1	-25.7	0	0	0	109.9	F124 R138 V139 Q140	F124-D136 HydrophobicContact CD2-CB 4.45Å; F124-D136 HydrophobicContact CE1-CB 4.46Å; F124-D136 HydrophobicContact CE2-CB 3.69Å; F124-D136 HydrophobicContact CZ-CB 3.68Å; D136-R138 PolarHBondContact O-N 3.29Å; D136-R138 VanDerWaalsContact O-N 3.09Å; D136-R138 WeakPolarHBondContact OD1-CB 3.47Å; D136-R138 WeakPolarHBondContact OD1-CG 3.32Å; D136-R138 IonicContact OD1-CZ 3.08Å; D136-R138 PolarHBondContact OD1-N 3.37Å; D136-R138 IonicContact OD1-NE 3.91Å; D136-R138 PolarHBondContact OD1-NE 3.02Å; D136-R138 IonicContact OD1-NH2 2.73Å; D136-R138 IonicContact OD2-CZ 3.43Å; D136-R138 VanDerWaalsContact OD2-CZ 3.23Å; D136-R138 IonicContact OD2-NE 2.79Å; D136-R138 PolarHBondContact OD2-NE 3.25Å; D136-R138 IonicContact OD2-NH2 3.45Å; D136-R138 PolarHBondContact OD2-NH2 3.08Å; D136-V139 HydrophobicContact CB-CB 4.46Å; D136-V139 HydrophobicContact CB-CG2 4Å; D136-V139 WeakPolarHBondContact O-CB 3.33Å; D136-V139 PolarHBondContact O-N 3.16Å; D136-Q140 PolarHBondContact O-N 2.96Å
137	P	82	Confident	83.2	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.006	38%	0.379	C	S	.	.	H	α-helix	trans	-58.6	-28.4	-179.7	27	-37.2	0	0	0	111.6	F100 L108 W112 F124 E135 V139 Q140 W141	F100-P137 HydrophobicContact CE1-CB 3.62Å; F100-P137 HydrophobicContact CE1-CG 3.78Å; F100-P137 HydrophobicContact CZ-CB 3.6Å; F100-P137 HydrophobicContact CZ-CG 3.94Å; L108-P137 HydrophobicContact CD2-CG 3.96Å; W112-P137 HydrophobicContact CD2-CG 4.21Å; W112-P137 HydrophobicContact CE3-CB 4.21Å; W112-P137 HydrophobicContact CE3-CG 3.73Å; W112-P137 HydrophobicContact CH2-CB 3.8Å; W112-P137 HydrophobicContact CH2-CG 4.23Å; W112-P137 HydrophobicContact CZ2-CB 4.19Å; W112-P137 HydrophobicContact CZ3-CB 3.83Å; W112-P137 HydrophobicContact CZ3-CG 3.74Å; F124-P137 HydrophobicContact CB-CG 4.43Å; F124-P137 HydrophobicContact CD1-CG 4.28Å; F124-P137 VanDerWaalsContact CG-CD 3.44Å; F124-P137 HydrophobicContact CG-CG 4.38Å; E135-P137 WeakPolarHBondContact O-CD 3.37Å; P137-V139 VanDerWaalsContact C-N 3.26Å; P137-V139 PolarHBondContact O-N 2.98Å; P137-Q140 PolarHBondContact O-N 3.43Å; P137-W141 WeakPolarHBondContact O-CB 3.43Å; P137-W141 PolarHBondContact O-N 2.98Å
138	R	78.4	Confident	83.4	Confident	25 Å²	25	73.8 Å²	73.8	9%	0.094	40%	0.396	C	S	.	.	H	α-helix	trans	-63.7	-31.9	175.8	-59.4	170.4	-69.9	-153	5	112.3	F100 N106 E107 L108 D136 R142	F100-R138 HydrophobicContact CD1-CG 4.29Å; F100-R138 HydrophobicContact CE1-CG 4.29Å; N106-R138 VanDerWaalsContact CA-NH1 3.35Å; N106-R138 PolarHBondContact O-NH1 3.17Å; E107-R138 PolarHBondContact O-NH1 3.43Å; L108-R138 HydrophobicContact CD2-CG 4.22Å; D136-R138 PolarHBondContact O-N 3.29Å; D136-R138 VanDerWaalsContact O-N 3.09Å; D136-R138 WeakPolarHBondContact OD1-CB 3.47Å; D136-R138 WeakPolarHBondContact OD1-CG 3.32Å; D136-R138 IonicContact OD1-CZ 3.08Å; D136-R138 PolarHBondContact OD1-N 3.37Å; D136-R138 IonicContact OD1-NE 3.91Å; D136-R138 PolarHBondContact OD1-NE 3.02Å; D136-R138 IonicContact OD1-NH2 2.73Å; D136-R138 IonicContact OD2-CZ 3.43Å; D136-R138 VanDerWaalsContact OD2-CZ 3.23Å; D136-R138 IonicContact OD2-NE 2.79Å; D136-R138 PolarHBondContact OD2-NE 3.25Å; D136-R138 IonicContact OD2-NH2 3.45Å; D136-R138 PolarHBondContact OD2-NH2 3.08Å; R138-R142 VanDerWaalsContact O-CG 3.32Å; R138-R142 WeakPolarHBondContact O-CG 3.43Å; R138-R142 PolarHBondContact O-N 2.94Å
139	V	79.4	Confident	83.7	Confident	65 Å²	65	69.7 Å²	69.7	39%	0.394	38%	0.375	S	S	.	.	H	α-helix	trans	-70.4	-45.5	175.5	175.2	0	0	0	0	110.1	D136 P137 W141 R142 A143	D136-V139 HydrophobicContact CB-CB 4.46Å; D136-V139 HydrophobicContact CB-CG2 4Å; D136-V139 WeakPolarHBondContact O-CB 3.33Å; D136-V139 PolarHBondContact O-N 3.16Å; P137-V139 VanDerWaalsContact C-N 3.26Å; P137-V139 PolarHBondContact O-N 2.98Å; V139-W141 VanDerWaalsContact C-N 3.32Å; V139-W141 PolarHBondContact O-N 3.45Å; V139-R142 PolarHBondContact O-N 3.33Å; V139-A143 WeakPolarHBondContact O-CB 3.39Å; V139-A143 PolarHBondContact O-N 3.32Å
140	Q	82.4	Confident	83.9	Confident	76 Å²	76	72.5 Å²	72.5	36%	0.355	38%	0.376	S	S	.	.	H	α-helix	trans	-60.4	-41.4	174.7	-64.9	178.2	-15	0	0	111.9	E135 D136 P137 A143 L144	E135-Q140 HydrophobicContact CG-CG 4.29Å; E135-Q140 WeakPolarHBondContact OE2-CG 3.26Å; E135-Q140 PolarHBondContact OE2-NE2 3.38Å; D136-Q140 PolarHBondContact O-N 2.96Å; P137-Q140 PolarHBondContact O-N 3.43Å; Q140-A143 PolarHBondContact O-N 2.88Å; Q140-L144 WeakPolarHBondContact O-CB 3.29Å; Q140-L144 PolarHBondContact O-N 2.87Å
141	W	79.4	Confident	84.1	Confident	113 Å²	113	74.4 Å²	74.4	43%	0.428	37%	0.369	S	S	.	.	H	α-helix	trans	-69	-36.4	177	-85	93.3	0	0	0	113.7	F100 P137 V139 L144 Q145	F100-W141 HydrophobicContact CB-CB 3.95Å; F100-W141 HydrophobicContact CB-CD2 3.55Å; F100-W141 HydrophobicContact CB-CE3 3.99Å; F100-W141 HydrophobicContact CB-CG 3.51Å; F100-W141 HydrophobicContact CD1-CB 4.26Å; F100-W141 AromaticContact CD1-CD1 3.55Å; F100-W141 AromaticContact CD1-CG 3.88Å; F100-W141 HydrophobicContact CD1-CG 3.88Å; F100-W141 AromaticContact CD2-CD1 3.38Å; F100-W141 AromaticContact CD2-CD2 3.83Å; F100-W141 HydrophobicContact CD2-CD2 3.83Å; F100-W141 AromaticContact CD2-CE2 3.33Å; F100-W141 AromaticContact CD2-CG 3.86Å; F100-W141 HydrophobicContact CD2-CG 3.86Å; F100-W141 AromaticContact CD2-CZ2 3.9Å; F100-W141 HydrophobicContact CD2-CZ2 3.9Å; F100-W141 AromaticContact CD2-NE1 3.05Å; F100-W141 AromaticContact CE1-CD1 3.87Å; F100-W141 AromaticContact CE2-CD1 3.69Å; F100-W141 AromaticContact CE2-CE2 3.98Å; F100-W141 AromaticContact CE2-NE1 3.29Å; F100-W141 VanDerWaalsContact CE2-NE1 3.29Å; F100-W141 HydrophobicContact CG-CB 4.15Å; F100-W141 AromaticContact CG-CD1 3.28Å; F100-W141 AromaticContact CG-CD2 3.74Å; F100-W141 HydrophobicContact CG-CD2 3.74Å; F100-W141 AromaticContact CG-CE2 3.77Å; F100-W141 AromaticContact CG-CG 3.45Å; F100-W141 HydrophobicContact CG-CG 3.45Å; F100-W141 VanDerWaalsContact CG-CG 3.45Å; F100-W141 AromaticContact CG-NE1 3.51Å; F100-W141 AromaticContact CZ-CD1 3.92Å; F100-W141 AromaticContact CZ-NE1 3.94Å; P137-W141 WeakPolarHBondContact O-CB 3.43Å; P137-W141 PolarHBondContact O-N 2.98Å; V139-W141 VanDerWaalsContact C-N 3.32Å; V139-W141 PolarHBondContact O-N 3.45Å; W141-L144 HydrophobicContact CE3-CD2 4.21Å; W141-L144 HydrophobicContact CZ3-CD2 4.18Å; W141-Q145 WeakPolarHBondContact O-CB 3.37Å; W141-Q145 PolarHBondContact O-N 3.47Å
142	R	77.5	Confident	84.2	Confident	104 Å²	104	76.4 Å²	76.4	39%	0.392	37%	0.37	S	S	.	.	H	α-helix	trans	-65.5	-43.6	169.7	-73.8	179.8	-159.5	132.7	-0.6	111.4	R138 V139 L144 Q145 D146	R138-R142 VanDerWaalsContact O-CG 3.32Å; R138-R142 WeakPolarHBondContact O-CG 3.43Å; R138-R142 PolarHBondContact O-N 2.94Å; V139-R142 PolarHBondContact O-N 3.33Å; R142-L144 VanDerWaalsContact C-N 3.3Å; R142-L144 PolarHBondContact O-N 2.91Å; R142-Q145 WeakPolarHBondContact O-CB 3.4Å; R142-Q145 PolarHBondContact O-N 3.38Å; R142-Q145 VanDerWaalsContact O-N 3.14Å; R142-D146 WeakPolarHBondContact O-CB 3.37Å; R142-D146 VanDerWaalsContact O-CG 3.31Å; R142-D146 PolarHBondContact O-N 2.9Å
143	A	82.4	Confident	84.2	Confident	51 Å²	51	71.7 Å²	71.7	42%	0.421	35%	0.345	S	S	.	.	H	α-helix	trans	-60	-40.3	177.3	0	0	0	0	0	112.2	V139 Q140 A147	V139-A143 WeakPolarHBondContact O-CB 3.39Å; V139-A143 PolarHBondContact O-N 3.32Å; Q140-A143 PolarHBondContact O-N 2.88Å; A143-A147 WeakPolarHBondContact O-CB 3.45Å; A143-A147 PolarHBondContact O-N 3.43Å
144	L	83.6	Confident	84.4	Confident	103 Å²	103	75.1 Å²	75.1	54%	0.539	36%	0.361	S	S	.	.	H	α-helix	trans	-65.6	-43.6	172.9	-177.8	64.4	0	0	0	112.2	Q140 W141 R142 A147 M148	Q140-L144 WeakPolarHBondContact O-CB 3.29Å; Q140-L144 PolarHBondContact O-N 2.87Å; W141-L144 HydrophobicContact CE3-CD2 4.21Å; W141-L144 HydrophobicContact CZ3-CD2 4.18Å; R142-L144 VanDerWaalsContact C-N 3.3Å; R142-L144 PolarHBondContact O-N 2.91Å; L144-A147 PolarHBondContact O-N 2.8Å; L144-M148 WeakPolarHBondContact O-CB 3.4Å; L144-M148 PolarHBondContact O-N 2.94Å
145	Q	80.7	Confident	84.5	Confident	79 Å²	79	69.6 Å²	69.6	37%	0.369	33%	0.333	S	S	.	.	H	α-helix	trans	-60.9	-45.5	175.7	-178.4	175	10.3	0	0	111.6	W141 R142 M148 I149	W141-Q145 WeakPolarHBondContact O-CB 3.37Å; W141-Q145 PolarHBondContact O-N 3.47Å; R142-Q145 WeakPolarHBondContact O-CB 3.4Å; R142-Q145 PolarHBondContact O-N 3.38Å; R142-Q145 VanDerWaalsContact O-N 3.14Å; Q145-M148 PolarHBondContact O-N 3.28Å; Q145-I149 HydrophobicContact CG-CD1 4.01Å; Q145-I149 VanDerWaalsContact O-CG1 3.29Å; Q145-I149 WeakPolarHBondContact O-CG1 3.5Å; Q145-I149 PolarHBondContact O-N 3.24Å
146	D	83.6	Confident	84.9	Confident	33 Å²	33	65.2 Å²	65.2	18%	0.176	32%	0.315	C	S	.	.	H	α-helix	trans	-66.9	-35.8	177.8	-68.3	-18.9	0	0	0	112	R142 R150	R142-D146 WeakPolarHBondContact O-CB 3.37Å; R142-D146 VanDerWaalsContact O-CG 3.31Å; R142-D146 PolarHBondContact O-N 2.9Å; D146-R150 WeakPolarHBondContact O-CB 3.48Å; D146-R150 VanDerWaalsContact O-CG 3.3Å; D146-R150 WeakPolarHBondContact O-CG 3.49Å; D146-R150 PolarHBondContact O-N 2.78Å; D146-R150 PolarHBondContact O-NE 2.85Å
147	A	86.6	Confident	85.4	Confident	33 Å²	33	67.3 Å²	67.3	27%	0.273	32%	0.324	S	S	.	.	H	α-helix	trans	-62.4	-49.2	172.4	0	0	0	0	0	111	A143 L144 I149 R150 E151	A143-A147 WeakPolarHBondContact O-CB 3.45Å; A143-A147 PolarHBondContact O-N 3.43Å; L144-A147 PolarHBondContact O-N 2.8Å; A147-I149 VanDerWaalsContact C-N 3.32Å; A147-I149 PolarHBondContact O-N 2.94Å; A147-R150 WeakPolarHBondContact O-CB 3.14Å; A147-R150 PolarHBondContact O-N 3.35Å; A147-E151 PolarHBondContact O-N 2.98Å
148	M	85.5	Confident	85.9	Confident	122 Å²	122	69.9 Å²	69.9	60%	0.601	34%	0.336	S	S	*	.	H	α-helix	trans	-61.3	-37.5	177.3	-167.1	-173.4	73	0	0	112.4	L144 Q145 Y152	L144-M148 WeakPolarHBondContact O-CB 3.4Å; L144-M148 PolarHBondContact O-N 2.94Å; Q145-M148 PolarHBondContact O-N 3.28Å; M148-Y152 WeakPolarHBondContact O-CB 3.36Å; M148-Y152 PolarHBondContact O-N 3.36Å
149	I	86.3	Confident	86.5	Confident	22 Å²	22	69.2 Å²	69.2	11%	0.113	33%	0.334	C	S	.	.	H	α-helix	trans	-66.5	-40.6	173.1	-69.9	166.4	0	0	0	111.1	Q145 A147 Y152 L153 K268	Q145-I149 HydrophobicContact CG-CD1 4.01Å; Q145-I149 VanDerWaalsContact O-CG1 3.29Å; Q145-I149 WeakPolarHBondContact O-CG1 3.5Å; Q145-I149 PolarHBondContact O-N 3.24Å; A147-I149 VanDerWaalsContact C-N 3.32Å; A147-I149 PolarHBondContact O-N 2.94Å; I149-Y152 PolarHBondContact O-N 2.98Å; I149-L153 HydrophobicContact CG2-CD1 3.97Å; I149-L153 HydrophobicContact CG2-CG 4.44Å; I149-L153 WeakPolarHBondContact O-CB 3.4Å; I149-L153 WeakPolarHBondContact O-CG 3.34Å; I149-L153 PolarHBondContact O-N 2.93Å; I149-K268 HydrophobicContact CG2-CB 4.11Å; I149-K268 HydrophobicContact CG2-CG 4.42Å
150	R	88.8	Confident	87.2	Confident	122 Å²	122	66.5 Å²	66.5	46%	0.46	32%	0.317	S	S	.	.	H	α-helix	trans	-63.9	-45.3	176.8	-79.3	-179.9	-80.4	-102.5	4.2	112.1	D146 A147 L153 Q154 K268	D146-R150 WeakPolarHBondContact O-CB 3.48Å; D146-R150 VanDerWaalsContact O-CG 3.3Å; D146-R150 WeakPolarHBondContact O-CG 3.49Å; D146-R150 PolarHBondContact O-N 2.78Å; D146-R150 PolarHBondContact O-NE 2.85Å; A147-R150 WeakPolarHBondContact O-CB 3.14Å; A147-R150 PolarHBondContact O-N 3.35Å; R150-L153 PolarHBondContact O-N 2.82Å; R150-Q154 PolarHBondContact O-N 3.41Å; R150-K268 HydrophobicContact CG-CD 4.33Å
151	E	89.3	Confident	87.8	Confident	131 Å²	131	68.4 Å²	68.4	61%	0.612	32%	0.321	S	S	*	.	H	α-helix	trans	-60.6	-46.3	174.6	-71.8	171.6	-166.2	0	0	111.6	A147 L153 Q154 A155	A147-E151 PolarHBondContact O-N 2.98Å; E151-L153 PolarHBondContact O-N 2.87Å; E151-Q154 PolarHBondContact O-N 2.94Å; E151-A155 PolarHBondContact O-N 2.9Å
152	Y	88.8	Confident	88.4	Confident	106 Å²	106	63.4 Å²	63.4	42%	0.416	30%	0.304	S	S	.	.	H	α-helix	trans	-61.8	-41.8	177	-173.3	-88.7	0	0	0	112.3	M148 I149 A156 L264 V400	M148-Y152 WeakPolarHBondContact O-CB 3.36Å; M148-Y152 PolarHBondContact O-N 3.36Å; I149-Y152 PolarHBondContact O-N 2.98Å; Y152-A156 HydrophobicContact CE1-CB 4.44Å; Y152-A156 WeakPolarHBondContact O-CB 3.36Å; Y152-A156 PolarHBondContact O-N 3.08Å; Y152-L264 HydrophobicContact CD1-CD1 3.74Å; Y152-L264 HydrophobicContact CE1-CD1 3.41Å; Y152-L264 VanDerWaalsContact CE1-CD1 3.41Å; Y152-V400 HydrophobicContact CD2-CG1 4.11Å; Y152-V400 HydrophobicContact CE2-CG1 4.49Å
153	L	91	Very high	89.2	Confident	13 Å²	13	59.4 Å²	59.4	7%	0.068	29%	0.289	C	S	.	.	H	α-helix	trans	-63.9	-43.7	176	-78.5	170.5	0	0	0	112	I149 R150 E151 A156 Q157 Y261 L264 A265 K268	I149-L153 HydrophobicContact CG2-CD1 3.97Å; I149-L153 HydrophobicContact CG2-CG 4.44Å; I149-L153 WeakPolarHBondContact O-CB 3.4Å; I149-L153 WeakPolarHBondContact O-CG 3.34Å; I149-L153 PolarHBondContact O-N 2.93Å; R150-L153 PolarHBondContact O-N 2.82Å; E151-L153 PolarHBondContact O-N 2.87Å; L153-A156 PolarHBondContact O-N 2.9Å; L153-Q157 WeakPolarHBondContact O-CB 3.45Å; L153-Q157 PolarHBondContact O-N 2.73Å; L153-Y261 HydrophobicContact CB-CE2 4.14Å; L153-Y261 HydrophobicContact CD2-CD2 3.65Å; L153-Y261 HydrophobicContact CD2-CE2 3.71Å; L153-Y261 HydrophobicContact CD2-CG 4.29Å; L153-Y261 WeakPolarHBondContact O-CE2 3.15Å; L153-L264 HydrophobicContact CD2-CB 3.75Å; L153-A265 HydrophobicContact CD2-CB 4.46Å; L153-K268 HydrophobicContact CD1-CB 4.2Å; L153-K268 HydrophobicContact CD1-CD 3.58Å; L153-K268 HydrophobicContact CD1-CG 4.48Å
154	Q	92.1	Very high	89.9	Confident	117 Å²	117	61.5 Å²	61.5	55%	0.547	29%	0.29	S	S	.	.	H	α-helix	trans	-59.6	-51.7	176.1	180	-176.6	-25.7	0	0	110.9	R150 E151 A156 Q157 E158	R150-Q154 PolarHBondContact O-N 3.41Å; E151-Q154 PolarHBondContact O-N 2.94Å; Q154-A156 VanDerWaalsContact C-N 3.34Å; Q154-A156 PolarHBondContact O-N 3.01Å; Q154-Q157 WeakPolarHBondContact O-CA 3.33Å; Q154-Q157 VanDerWaalsContact O-CB 3.31Å; Q154-Q157 WeakPolarHBondContact O-CB 3.49Å; Q154-Q157 PolarHBondContact O-N 3.35Å; Q154-E158 WeakPolarHBondContact CG-OE1 3.33Å; Q154-E158 PolarHBondContact NE2-OE1 2.8Å; Q154-E158 PolarHBondContact O-N 3.24Å
155	A	90.2	Very high	90.5	Very high	9 Å²	9	60.5 Å²	60.5	7%	0.074	29%	0.285	C	S	.	.	H	α-helix	trans	-64.5	-38.3	-179.4	0	0	0	0	0	111.8	E151 Q157 E158 Q159 V400 T404	E151-A155 PolarHBondContact O-N 2.9Å; A155-Q157 VanDerWaalsContact C-N 3.28Å; A155-Q157 PolarHBondContact O-N 2.97Å; A155-E158 PolarHBondContact O-N 3.24Å; A155-E158 VanDerWaalsContact O-N 3.15Å; A155-Q159 WeakPolarHBondContact O-CG 3.34Å; A155-Q159 PolarHBondContact O-N 3.44Å; A155-V400 HydrophobicContact CB-CB 4.31Å; A155-V400 HydrophobicContact CB-CG1 3.41Å; A155-V400 VanDerWaalsContact CB-CG1 3.41Å; A155-T404 HydrophobicContact CB-CG2 4.37Å
156	A	91.9	Very high	91.2	Very high	13 Å²	13	57 Å²	57	11%	0.107	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-37.7	171.7	0	0	0	0	0	112	Y152 L153 Q154 Q159 M160 Y261	Y152-A156 HydrophobicContact CE1-CB 4.44Å; Y152-A156 WeakPolarHBondContact O-CB 3.36Å; Y152-A156 PolarHBondContact O-N 3.08Å; L153-A156 PolarHBondContact O-N 2.9Å; Q154-A156 VanDerWaalsContact C-N 3.34Å; Q154-A156 PolarHBondContact O-N 3.01Å; A156-Q159 PolarHBondContact O-N 3.24Å; A156-M160 WeakPolarHBondContact O-CB 3.08Å; A156-M160 VanDerWaalsContact O-CG 3.23Å; A156-M160 WeakPolarHBondContact O-CG 3.48Å; A156-M160 PolarHBondContact O-N 2.91Å; A156-Y261 HydrophobicContact CB-CD2 4.19Å
157	Q	93.7	Very high	91.8	Very high	76 Å²	76	56.3 Å²	56.3	36%	0.355	27%	0.265	S	S	.	.	H	α-helix	trans	-67	-37	174.3	-160.6	-173.1	38.1	0	0	112.3	L153 Q154 A155 M160 R161 Y261	L153-Q157 WeakPolarHBondContact O-CB 3.45Å; L153-Q157 PolarHBondContact O-N 2.73Å; Q154-Q157 WeakPolarHBondContact O-CA 3.33Å; Q154-Q157 VanDerWaalsContact O-CB 3.31Å; Q154-Q157 WeakPolarHBondContact O-CB 3.49Å; Q154-Q157 PolarHBondContact O-N 3.35Å; A155-Q157 VanDerWaalsContact C-N 3.28Å; A155-Q157 PolarHBondContact O-N 2.97Å; Q157-M160 WeakPolarHBondContact O-CB 3.47Å; Q157-M160 PolarHBondContact O-N 3.28Å; Q157-R161 WeakPolarHBondContact O-CG 3.38Å; Q157-R161 PolarHBondContact O-N 3.09Å; Q157-Y261 HydrophobicContact CB-CE2 4.06Å
158	E	91.7	Very high	92.3	Very high	55 Å²	55	61 Å²	61	26%	0.257	28%	0.279	S	S	.	.	H	α-helix	trans	-69.7	-42	174.8	-69.4	173.3	-156.7	0	0	112	Q154 A155 M160 R161 A162 T404	Q154-E158 WeakPolarHBondContact CG-OE1 3.33Å; Q154-E158 PolarHBondContact NE2-OE1 2.8Å; Q154-E158 PolarHBondContact O-N 3.24Å; A155-E158 PolarHBondContact O-N 3.24Å; A155-E158 VanDerWaalsContact O-N 3.15Å; E158-M160 VanDerWaalsContact C-N 3.27Å; E158-M160 PolarHBondContact O-N 3.09Å; E158-R161 PolarHBondContact O-N 3.45Å; E158-A162 PolarHBondContact O-N 3.42Å; E158-T404 HydrophobicContact CB-CG2 4.01Å
159	Q	92.7	Very high	92.8	Very high	10 Å²	10	55.7 Å²	55.7	5%	0.047	25%	0.253	C	S	.	.	H	α-helix	trans	-57.7	-40.3	169.6	-70.1	-174.5	17.6	0	0	111.7	A155 A156 A162 K163 K257 E403 T404	A155-Q159 WeakPolarHBondContact O-CG 3.34Å; A155-Q159 PolarHBondContact O-N 3.44Å; A156-Q159 PolarHBondContact O-N 3.24Å; Q159-A162 PolarHBondContact O-N 3.27Å; Q159-K163 WeakPolarHBondContact O-CG 3.46Å; Q159-K163 PolarHBondContact O-N 2.93Å; Q159-K257 HydrophobicContact CB-CD 4.41Å; Q159-E403 PolarHBondContact NE2-OE2 3.19Å; Q159-T404 HydrophobicContact CB-CG2 4.5Å; Q159-T404 HydrophobicContact CG-CG2 3.52Å
160	M	93.7	Very high	93.3	Very high	8 Å²	8	55.3 Å²	55.3	4%	0.039	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-51.8	176.3	-80.9	-63.7	-68.2	0	0	111.7	A156 Q157 E158 A162 K163 E164 L254 K257 Q258	A156-M160 WeakPolarHBondContact O-CB 3.08Å; A156-M160 VanDerWaalsContact O-CG 3.23Å; A156-M160 WeakPolarHBondContact O-CG 3.48Å; A156-M160 PolarHBondContact O-N 2.91Å; Q157-M160 WeakPolarHBondContact O-CB 3.47Å; Q157-M160 PolarHBondContact O-N 3.28Å; E158-M160 VanDerWaalsContact C-N 3.27Å; E158-M160 PolarHBondContact O-N 3.09Å; M160-A162 VanDerWaalsContact C-N 3.28Å; M160-A162 PolarHBondContact O-N 2.86Å; M160-K163 PolarHBondContact O-N 3.07Å; M160-K163 VanDerWaalsContact O-N 3.08Å; M160-E164 WeakPolarHBondContact O-CG 3.46Å; M160-E164 PolarHBondContact O-N 2.92Å; M160-L254 HydrophobicContact CE-CD1 3.33Å; M160-L254 HydrophobicContact CE-CG 3.82Å; M160-L254 HydrophobicContact SD-CD1 3.63Å; M160-L254 HydrophobicContact SD-CG 4.41Å; M160-K257 HydrophobicContact CG-CB 4.19Å; M160-K257 HydrophobicContact SD-CB 3.24Å; M160-K257 WeakPolarHBondContact SD-CB 3.38Å; M160-K257 HydrophobicContact SD-CD 4.41Å; M160-K257 HydrophobicContact SD-CG 4.43Å; M160-Q258 HydrophobicContact CE-CB 3.61Å; M160-Q258 HydrophobicContact CE-CG 4.38Å; M160-Q258 VanDerWaalsContact CE-OE1 3.28Å; M160-Q258 HydrophobicContact SD-CB 4.48Å; M160-Q258 PolarHBondContact SD-N 3.03Å
161	R	93.9	Very high	93.7	Very high	117 Å²	117	52.5 Å²	52.5	44%	0.442	24%	0.242	S	C	.	.	H	α-helix	trans	-56.2	-41.9	175.2	-68.5	176.7	-170.7	113	-1.1	111.9	Q157 E158 E164 L165	Q157-R161 WeakPolarHBondContact O-CG 3.38Å; Q157-R161 PolarHBondContact O-N 3.09Å; E158-R161 PolarHBondContact O-N 3.45Å; R161-E164 PolarHBondContact O-N 3.24Å; R161-L165 WeakPolarHBondContact O-CG 3.35Å; R161-L165 PolarHBondContact O-N 2.92Å; R161-L165 VanDerWaalsContact O-N 3.07Å
162	A	92.9	Very high	94	Very high	8 Å²	8	49.6 Å²	49.6	7%	0.066	23%	0.231	C	C	.	.	H	α-helix	trans	-61.7	-45.5	175.8	0	0	0	0	0	111.7	E158 Q159 M160 E164 L165 I166 D407	E158-A162 PolarHBondContact O-N 3.42Å; Q159-A162 PolarHBondContact O-N 3.27Å; M160-A162 VanDerWaalsContact C-N 3.28Å; M160-A162 PolarHBondContact O-N 2.86Å; A162-E164 PolarHBondContact O-N 3.02Å; A162-L165 PolarHBondContact O-N 2.99Å; A162-I166 VanDerWaalsContact O-CG1 3.3Å; A162-I166 WeakPolarHBondContact O-CG1 3.41Å; A162-I166 PolarHBondContact O-N 3.5Å; A162-D407 HydrophobicContact CB-CB 4.05Å
163	K	94.5	Very high	94.4	Very high	19 Å²	19	45.1 Å²	45.1	8%	0.083	21%	0.213	C	C	.	.	H	α-helix	trans	-64.4	-36.1	175.7	-71.3	-72.5	-177.7	-169	0	113.3	Q159 M160 I166 L167 V250 E253 L254 K257 D407	Q159-K163 WeakPolarHBondContact O-CG 3.46Å; Q159-K163 PolarHBondContact O-N 2.93Å; M160-K163 PolarHBondContact O-N 3.07Å; M160-K163 VanDerWaalsContact O-N 3.08Å; K163-I166 HydrophobicContact CD-CD1 4.3Å; K163-I166 PolarHBondContact O-N 2.69Å; K163-L167 WeakPolarHBondContact O-CB 3.11Å; K163-L167 PolarHBondContact O-N 3.45Å; K163-V250 HydrophobicContact CD-CG1 4.49Å; K163-E253 WeakPolarHBondContact CE-OE2 3.32Å; K163-E253 IonicContact NZ-OE2 2.73Å; K163-E253 PolarHBondContact NZ-OE2 3.26Å; K163-L254 HydrophobicContact CB-CD1 3.7Å; K163-K257 HydrophobicContact CG-CD 4.41Å; K163-D407 VanDerWaalsContact CE-CG 3.42Å; K163-D407 WeakPolarHBondContact CE-OD1 3.17Å; K163-D407 VanDerWaalsContact CE-OD2 3.27Å; K163-D407 WeakPolarHBondContact CE-OD2 3.38Å; K163-D407 IonicContact NZ-OD1 3.2Å; K163-D407 PolarHBondContact NZ-OD1 3.4Å
164	E	96.4	Very high	94.6	Very high	95 Å²	95	47.3 Å²	47.3	44%	0.444	22%	0.22	S	C	.	.	H	α-helix	trans	-62.7	-42.6	173.6	-70.8	173.2	166.3	0	0	111.6	M160 R161 A162 L167 K168 L254	M160-E164 WeakPolarHBondContact O-CG 3.46Å; M160-E164 PolarHBondContact O-N 2.92Å; R161-E164 PolarHBondContact O-N 3.24Å; A162-E164 PolarHBondContact O-N 3.02Å; E164-L167 WeakPolarHBondContact O-CB 3.19Å; E164-L167 PolarHBondContact O-N 2.8Å; E164-K168 PolarHBondContact O-N 3.5Å; E164-L254 HydrophobicContact CG-CD1 3.66Å; E164-L254 HydrophobicContact CG-CD2 4Å; E164-L254 HydrophobicContact CG-CG 4.47Å
165	L	95.7	Very high	94.7	Very high	83 Å²	83	45.2 Å²	45.2	44%	0.435	21%	0.212	S	C	.	.	H	α-helix	trans	-67.4	-41	175.3	-66.8	174.8	0	0	0	111.7	R161 A162 L167 K168 V169 L411	R161-L165 WeakPolarHBondContact O-CG 3.35Å; R161-L165 PolarHBondContact O-N 2.92Å; R161-L165 VanDerWaalsContact O-N 3.07Å; A162-L165 PolarHBondContact O-N 2.99Å; L165-L167 VanDerWaalsContact C-N 3.3Å; L165-L167 PolarHBondContact O-N 3.46Å; L165-K168 PolarHBondContact O-N 3.45Å; L165-V169 WeakPolarHBondContact O-CG2 3.48Å; L165-V169 PolarHBondContact O-N 2.86Å; L165-L411 HydrophobicContact CB-CD1 3.74Å; L165-L411 HydrophobicContact CB-CD2 3.74Å; L165-L411 HydrophobicContact CB-CG 4.42Å; L165-L411 HydrophobicContact CD1-CD2 3.84Å; L165-L411 HydrophobicContact CG-CD2 4.46Å
166	I	96	Very high	94.9	Very high	5 Å²	5	45.1 Å²	45.1	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-59.9	-43.3	173.2	-67.1	162.6	0	0	0	110.2	A162 K163 K168 V169 K170 V250 T410 L411	A162-I166 VanDerWaalsContact O-CG1 3.3Å; A162-I166 WeakPolarHBondContact O-CG1 3.41Å; A162-I166 PolarHBondContact O-N 3.5Å; K163-I166 HydrophobicContact CD-CD1 4.3Å; K163-I166 PolarHBondContact O-N 2.69Å; I166-K168 PolarHBondContact O-N 3.04Å; I166-V169 PolarHBondContact O-N 3.35Å; I166-K170 HydrophobicContact CG2-CD 4.38Å; I166-K170 HydrophobicContact CG2-CG 4.45Å; I166-K170 WeakPolarHBondContact O-CB 3.44Å; I166-K170 WeakPolarHBondContact O-CG 3.44Å; I166-K170 PolarHBondContact O-N 3.15Å; I166-V250 HydrophobicContact CG2-CG1 4.2Å; I166-V250 HydrophobicContact CG2-CG2 4.15Å; I166-T410 WeakPolarHBondContact CD1-OG1 3.5Å; I166-L411 HydrophobicContact CD1-CB 4.33Å; I166-L411 HydrophobicContact CG1-CB 3.81Å; I166-L411 HydrophobicContact CG1-CD1 3.88Å; I166-L411 HydrophobicContact CG1-CG 4.41Å
167	L	96.8	Very high	95	Very high	18 Å²	18	44.6 Å²	44.6	9%	0.094	21%	0.206	C	C	.	.	H	α-helix	trans	-61.8	-42.8	177.1	177.9	59.2	0	0	0	111.9	K163 E164 L165 K170 K171 E247 V250 E251 L254	K163-L167 WeakPolarHBondContact O-CB 3.11Å; K163-L167 PolarHBondContact O-N 3.45Å; E164-L167 WeakPolarHBondContact O-CB 3.19Å; E164-L167 PolarHBondContact O-N 2.8Å; L165-L167 VanDerWaalsContact C-N 3.3Å; L165-L167 PolarHBondContact O-N 3.46Å; L167-K170 PolarHBondContact O-N 2.88Å; L167-K171 HydrophobicContact CD1-CD 4.24Å; L167-K171 HydrophobicContact CG-CD 4.22Å; L167-K171 WeakPolarHBondContact O-CB 3.45Å; L167-K171 WeakPolarHBondContact O-CG 3.48Å; L167-K171 PolarHBondContact O-N 3.46Å; L167-E247 HydrophobicContact CD1-CG 3.93Å; L167-V250 HydrophobicContact CB-CG1 3.93Å; L167-E251 HydrophobicContact CD1-CG 3.38Å; L167-E251 HydrophobicContact CD2-CG 3.78Å; L167-E251 HydrophobicContact CG-CG 4.23Å; L167-L254 HydrophobicContact CD2-CD2 3.91Å
168	K	96.6	Very high	95	Very high	131 Å²	131	42.9 Å²	42.9	57%	0.57	20%	0.198	S	C	*	.	H	α-helix	trans	-61.5	-49.4	175.5	-174.3	-175.7	174.9	-171.6	0	111.1	E164 L165 I166 K170 K171 D172	E164-K168 PolarHBondContact O-N 3.5Å; L165-K168 PolarHBondContact O-N 3.45Å; I166-K168 PolarHBondContact O-N 3.04Å; K168-K170 PolarHBondContact O-N 3.24Å; K168-K171 WeakPolarHBondContact O-CB 3.49Å; K168-K171 PolarHBondContact O-N 3.34Å; K168-K171 VanDerWaalsContact O-N 3.13Å; K168-D172 PolarHBondContact O-N 2.96Å
169	V	96.9	Very high	95	Very high	11 Å²	11	44.5 Å²	44.5	7%	0.067	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-43	177.8	173	0	0	0	0	111.3	L165 I166 K171 D172 R173 L411 E414 K415 L418	L165-V169 WeakPolarHBondContact O-CG2 3.48Å; L165-V169 PolarHBondContact O-N 2.86Å; I166-V169 PolarHBondContact O-N 3.35Å; V169-K171 VanDerWaalsContact C-N 3.35Å; V169-K171 PolarHBondContact O-N 2.85Å; V169-D172 PolarHBondContact O-N 3.2Å; V169-R173 WeakPolarHBondContact O-CG 3.5Å; V169-R173 PolarHBondContact O-N 3.2Å; V169-L411 HydrophobicContact CG2-CD1 4.17Å; V169-E414 HydrophobicContact CG1-CB 3.84Å; V169-E414 WeakPolarHBondContact CG1-O 3.3Å; V169-K415 HydrophobicContact CG2-CG 3.91Å; V169-L418 HydrophobicContact CG1-CB 4.08Å; V169-L418 HydrophobicContact CG1-CD2 4Å
170	K	96.8	Very high	94.9	Very high	15 Å²	15	46.1 Å²	46.1	7%	0.065	21%	0.213	C	C	.	.	H	α-helix	trans	-65.4	-34.2	174.9	-76.8	-166.5	179.2	-61.3	0	113.2	I166 L167 K168 R174 E246 V250 E414	I166-K170 HydrophobicContact CG2-CD 4.38Å; I166-K170 HydrophobicContact CG2-CG 4.45Å; I166-K170 WeakPolarHBondContact O-CB 3.44Å; I166-K170 WeakPolarHBondContact O-CG 3.44Å; I166-K170 PolarHBondContact O-N 3.15Å; L167-K170 PolarHBondContact O-N 2.88Å; K168-K170 PolarHBondContact O-N 3.24Å; K170-R174 PolarHBondContact O-N 2.7Å; K170-E246 HydrophobicContact CD-CB 3.97Å; K170-E246 IonicContact NZ-OE2 3.18Å; K170-E246 PolarHBondContact NZ-OE2 2.67Å; K170-V250 HydrophobicContact CD-CG2 4.04Å; K170-E414 WeakPolarHBondContact CG-OE2 3.33Å; K170-E414 IonicContact NZ-OE1 3.81Å; K170-E414 PolarHBondContact NZ-OE1 2.97Å; K170-E414 IonicContact NZ-OE2 3.63Å; K170-E414 PolarHBondContact NZ-OE2 3.15Å
171	K	96.9	Very high	94.8	Very high	63 Å²	63	47.7 Å²	47.7	27%	0.274	22%	0.22	S	C	.	.	H	α-helix	trans	-64	-46.5	171.7	-84.5	169.6	178.1	173.6	0	111.8	L167 K168 V169 R173 R174 I175 E247 E251	L167-K171 HydrophobicContact CD1-CD 4.24Å; L167-K171 HydrophobicContact CG-CD 4.22Å; L167-K171 WeakPolarHBondContact O-CB 3.45Å; L167-K171 WeakPolarHBondContact O-CG 3.48Å; L167-K171 PolarHBondContact O-N 3.46Å; K168-K171 WeakPolarHBondContact O-CB 3.49Å; K168-K171 PolarHBondContact O-N 3.34Å; K168-K171 VanDerWaalsContact O-N 3.13Å; V169-K171 VanDerWaalsContact C-N 3.35Å; V169-K171 PolarHBondContact O-N 2.85Å; K171-R173 PolarHBondContact O-N 3.12Å; K171-R174 PolarHBondContact O-N 3.02Å; K171-I175 VanDerWaalsContact O-CG1 3.3Å; K171-I175 WeakPolarHBondContact O-CG1 3.48Å; K171-I175 PolarHBondContact O-N 3.27Å; K171-E247 WeakPolarHBondContact CE-OE1 3.38Å; K171-E247 HydrophobicContact CG-CG 4.13Å; K171-E247 WeakPolarHBondContact CG-OE1 3.44Å; K171-E251 VanDerWaalsContact CE-OE1 3.26Å; K171-E251 WeakPolarHBondContact CE-OE1 3.45Å; K171-E251 IonicContact NZ-OE1 3.76Å; K171-E251 PolarHBondContact NZ-OE1 3.22Å
172	D	95.4	Very high	94.8	Very high	69 Å²	69	46.9 Å²	46.9	37%	0.369	22%	0.221	S	C	.	.	H	α-helix	trans	-62.1	-43.6	176.4	-67.5	-28.7	0	0	0	111	K168 V169 R174 I175 L176 L418	K168-D172 PolarHBondContact O-N 2.96Å; V169-D172 PolarHBondContact O-N 3.2Å; D172-R174 PolarHBondContact O-N 3.07Å; D172-I175 PolarHBondContact O-N 3.22Å; D172-L176 WeakPolarHBondContact O-CB 3.38Å; D172-L176 PolarHBondContact O-N 3.19Å; D172-L418 HydrophobicContact CB-CD1 4.39Å; D172-L418 HydrophobicContact CB-CD2 3.91Å
173	R	96	Very high	94.6	Very high	12 Å²	12	51.4 Å²	51.4	5%	0.045	24%	0.241	C	C	.	.	H	α-helix	trans	-61.1	-40.3	172.5	-71.3	-177.3	66.8	-156.6	1.1	113.2	V169 K171 A177 L243 E414 L418 E421	V169-R173 WeakPolarHBondContact O-CG 3.5Å; V169-R173 PolarHBondContact O-N 3.2Å; K171-R173 PolarHBondContact O-N 3.12Å; R173-A177 WeakPolarHBondContact O-CB 3.48Å; R173-A177 PolarHBondContact O-N 2.77Å; R173-L243 HydrophobicContact CB-CD2 4.38Å; R173-E414 IonicContact CZ-OE2 3.7Å; R173-E414 VanDerWaalsContact NH1-CD 3.31Å; R173-E414 IonicContact NH1-OE1 2.65Å; R173-E414 PolarHBondContact NH1-OE1 2.84Å; R173-E414 IonicContact NH1-OE2 2.67Å; R173-E414 PolarHBondContact NH1-OE2 2.77Å; R173-L418 HydrophobicContact CG-CB 3.74Å; R173-L418 HydrophobicContact CG-CD1 3.67Å; R173-L418 HydrophobicContact CG-CG 4.17Å; R173-E421 IonicContact CZ-OE1 3.59Å; R173-E421 IonicContact NE-OE1 3.38Å; R173-E421 PolarHBondContact NE-OE1 3.48Å; R173-E421 IonicContact NE-OE2 2.83Å; R173-E421 PolarHBondContact NE-OE2 3.36Å; R173-E421 IonicContact NH2-OE1 3.84Å; R173-E421 PolarHBondContact NH2-OE1 2.96Å
174	R	96.2	Very high	94.4	Very high	59 Å²	59	52.4 Å²	52.4	22%	0.223	25%	0.247	C	C	.	.	H	α-helix	trans	-62.1	-49.4	173.5	175.3	176	58.9	86.9	-8	110.7	K170 K171 D172 L176 A177 E178 L240 R244 E247	K170-R174 PolarHBondContact O-N 2.7Å; K171-R174 PolarHBondContact O-N 3.02Å; D172-R174 PolarHBondContact O-N 3.07Å; R174-L176 VanDerWaalsContact C-N 3.25Å; R174-L176 PolarHBondContact O-N 2.66Å; R174-A177 PolarHBondContact O-N 2.87Å; R174-E178 IonicContact NH1-OE2 3.97Å; R174-E178 PolarHBondContact NH1-OE2 2.87Å; R174-E178 WeakPolarHBondContact O-CB 3.28Å; R174-E178 PolarHBondContact O-N 2.97Å; R174-L240 HydrophobicContact CG-CD1 3.79Å; R174-R244 VanDerWaalsContact CD-CG 3.47Å; R174-R244 HydrophobicContact CG-CG 4.39Å; R174-E247 WeakPolarHBondContact CD-OE2 3.3Å; R174-E247 IonicContact CZ-OE1 2.64Å; R174-E247 IonicContact CZ-OE2 3.07Å; R174-E247 IonicContact NE-OE1 2.69Å; R174-E247 IonicContact NE-OE2 3.96Å; R174-E247 PolarHBondContact NE-OE2 2.87Å; R174-E247 IonicContact NH2-OE1 3.25Å; R174-E247 PolarHBondContact NH2-OE1 3.35Å; R174-E247 VanDerWaalsContact NH2-OE1 3.11Å; R174-E247 IonicContact NH2-OE2 2.89Å
175	I	94.9	Very high	94.1	Very high	73 Å²	73	49 Å²	49	37%	0.374	23%	0.233	S	C	.	.	H	α-helix	trans	-59.3	-41.9	-177.7	-69.3	163.7	0	0	0	109.9	K171 D172 E178 Q179	K171-I175 VanDerWaalsContact O-CG1 3.3Å; K171-I175 WeakPolarHBondContact O-CG1 3.48Å; K171-I175 PolarHBondContact O-N 3.27Å; D172-I175 PolarHBondContact O-N 3.22Å; I175-E178 PolarHBondContact O-N 3.41Å; I175-Q179 VanDerWaalsContact O-CG 3.31Å; I175-Q179 WeakPolarHBondContact O-CG 3.39Å; I175-Q179 PolarHBondContact O-N 3.21Å
176	L	92.6	Very high	93.7	Very high	8 Å²	8	49 Å²	49	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-62	-50.8	175.3	-165.9	64.2	0	0	0	111.8	D172 R174 E178 Q179 E180 L418 E421 L422 V425	D172-L176 WeakPolarHBondContact O-CB 3.38Å; D172-L176 PolarHBondContact O-N 3.19Å; R174-L176 VanDerWaalsContact C-N 3.25Å; R174-L176 PolarHBondContact O-N 2.66Å; L176-E178 VanDerWaalsContact C-N 3.26Å; L176-E178 PolarHBondContact O-N 3.44Å; L176-Q179 WeakPolarHBondContact O-CB 3.44Å; L176-Q179 PolarHBondContact O-N 3.39Å; L176-E180 WeakPolarHBondContact O-CG 3.48Å; L176-E180 PolarHBondContact O-N 3.12Å; L176-L418 HydrophobicContact CD2-CD1 4.33Å; L176-E421 HydrophobicContact CD2-CB 3.71Å; L176-L422 HydrophobicContact CD1-CD2 4.17Å; L176-L422 HydrophobicContact CD2-CD2 3.91Å; L176-L422 HydrophobicContact CD2-CG 4.12Å; L176-V425 HydrophobicContact CD1-CB 4.44Å; L176-V425 HydrophobicContact CD1-CG1 4.46Å; L176-V425 HydrophobicContact CD1-CG2 3.94Å; L176-V425 HydrophobicContact CD2-CG2 4.49Å; L176-V425 HydrophobicContact CG-CG2 4.27Å
177	A	94.1	Very high	93.3	Very high	2 Å²	2	49.9 Å²	49.9	2%	0.017	24%	0.24	C	C	.	.	H	α-helix	trans	-64	-28.4	177	0	0	0	0	0	113.6	R173 R174 F181 R239 L243	R173-A177 WeakPolarHBondContact O-CB 3.48Å; R173-A177 PolarHBondContact O-N 2.77Å; R174-A177 PolarHBondContact O-N 2.87Å; A177-F181 VanDerWaalsContact O-CB 3.28Å; A177-F181 WeakPolarHBondContact O-CB 3.32Å; A177-F181 PolarHBondContact O-N 3Å; A177-R239 HydrophobicContact CB-CG 4.38Å; A177-L243 HydrophobicContact CB-CD1 3.61Å
178	E	95	Very high	92.9	Very high	40 Å²	40	49.9 Å²	49.9	19%	0.187	24%	0.239	C	C	.	.	H	α-helix	trans	-73.4	-38.2	175.2	-175.7	149.7	-143	0	0	111.3	R174 I175 L176 Q182 L240 R244	R174-E178 IonicContact NH1-OE2 3.97Å; R174-E178 PolarHBondContact NH1-OE2 2.87Å; R174-E178 WeakPolarHBondContact O-CB 3.28Å; R174-E178 PolarHBondContact O-N 2.97Å; I175-E178 PolarHBondContact O-N 3.41Å; L176-E178 VanDerWaalsContact C-N 3.26Å; L176-E178 PolarHBondContact O-N 3.44Å; E178-Q182 VanDerWaalsContact O-CG 3.25Å; E178-Q182 WeakPolarHBondContact O-CG 3.46Å; E178-Q182 PolarHBondContact O-N 3.41Å; E178-L240 HydrophobicContact CB-CD1 3.96Å; E178-L240 HydrophobicContact CB-CD2 4.46Å; E178-R244 IonicContact OE1-CZ 3.15Å; E178-R244 IonicContact OE1-NH2 2.73Å; E178-R244 PolarHBondContact OE1-NH2 3.34Å; E178-R244 IonicContact OE2-NH2 3.53Å
179	Q	92.1	Very high	92.5	Very high	89 Å²	89	47.4 Å²	47.4	42%	0.416	23%	0.232	S	C	.	.	H	α-helix	trans	-66.6	-46.6	170.5	-71.2	170.3	3.9	0	0	111.9	I175 L176 F181 Q182 Q183	I175-Q179 VanDerWaalsContact O-CG 3.31Å; I175-Q179 WeakPolarHBondContact O-CG 3.39Å; I175-Q179 PolarHBondContact O-N 3.21Å; L176-Q179 WeakPolarHBondContact O-CB 3.44Å; L176-Q179 PolarHBondContact O-N 3.39Å; Q179-F181 VanDerWaalsContact C-N 3.32Å; Q179-F181 PolarHBondContact O-N 3.25Å; Q179-Q182 PolarHBondContact O-N 2.91Å; Q179-Q183 VanDerWaalsContact O-CG 3.29Å; Q179-Q183 WeakPolarHBondContact O-CG 3.26Å; Q179-Q183 PolarHBondContact O-N 3.09Å
180	E	89	Confident	92	Very high	44 Å²	44	53 Å²	53	21%	0.206	26%	0.256	C	S	.	.	H	α-helix	trans	-56.4	-45.7	174.6	-69.7	173.3	-137.4	0	0	111.3	L176 Q182 Q183 L184 R239 V425	L176-E180 WeakPolarHBondContact O-CG 3.48Å; L176-E180 PolarHBondContact O-N 3.12Å; E180-Q182 PolarHBondContact O-N 3.39Å; E180-Q183 PolarHBondContact O-N 2.95Å; E180-L184 WeakPolarHBondContact O-CG 3.45Å; E180-L184 PolarHBondContact O-N 3.26Å; E180-R239 IonicContact OE1-CZ 3.8Å; E180-R239 IonicContact OE1-NH1 3.54Å; E180-R239 PolarHBondContact OE1-NH1 2.69Å; E180-R239 IonicContact OE1-NH2 3.69Å; E180-R239 PolarHBondContact OE1-NH2 2.73Å; E180-R239 IonicContact OE2-CZ 3.86Å; E180-R239 IonicContact OE2-NH1 2.68Å; E180-R239 PolarHBondContact OE2-NH1 3.46Å; E180-R239 IonicContact OE2-NH2 2.77Å; E180-V425 HydrophobicContact CG-CG2 4.3Å
181	F	93.2	Very high	91.4	Very high	41 Å²	41	53.2 Å²	53.2	18%	0.18	26%	0.258	C	S	.	.	H	α-helix	trans	-60.9	-44.2	176.4	169.3	-109.2	0	0	0	112.6	A177 Q179 L184 C185 I233 A236 R237 L240	A177-F181 VanDerWaalsContact O-CB 3.28Å; A177-F181 WeakPolarHBondContact O-CB 3.32Å; A177-F181 PolarHBondContact O-N 3Å; Q179-F181 VanDerWaalsContact C-N 3.32Å; Q179-F181 PolarHBondContact O-N 3.25Å; F181-L184 PolarHBondContact O-N 2.78Å; F181-C185 PolarHBondContact O-N 2.97Å; F181-C185 VanDerWaalsContact O-N 3.08Å; F181-I233 HydrophobicContact CE2-CG2 4.01Å; F181-A236 HydrophobicContact CB-CB 4.27Å; F181-A236 HydrophobicContact CD2-CB 4.16Å; F181-R237 HydrophobicContact CD2-CG 3.85Å; F181-R237 HydrophobicContact CE2-CG 3.29Å; F181-R237 VanDerWaalsContact CE2-NE 3.32Å; F181-R237 HydrophobicContact CZ-CG 3.88Å; F181-L240 HydrophobicContact CB-CD2 4.49Å; F181-L240 HydrophobicContact CD1-CD2 4.08Å; F181-L240 HydrophobicContact CG-CD2 4.37Å
182	Q	92.1	Very high	90.8	Very high	100 Å²	100	53.1 Å²	53.1	47%	0.467	26%	0.259	S	S	.	.	H	α-helix	trans	-63.1	-44.5	176	-73.3	169.2	20.8	0	0	111.5	E178 Q179 E180 L184 C185 D186	E178-Q182 VanDerWaalsContact O-CG 3.25Å; E178-Q182 WeakPolarHBondContact O-CG 3.46Å; E178-Q182 PolarHBondContact O-N 3.41Å; Q179-Q182 PolarHBondContact O-N 2.91Å; E180-Q182 PolarHBondContact O-N 3.39Å; Q182-L184 VanDerWaalsContact C-N 3.33Å; Q182-L184 PolarHBondContact O-N 2.82Å; Q182-C185 PolarHBondContact O-N 3.13Å; Q182-D186 PolarHBondContact O-N 3.36Å
183	Q	89.2	Confident	90.1	Very high	103 Å²	103	54.5 Å²	54.5	48%	0.481	27%	0.266	S	S	.	.	H	α-helix	trans	-59.1	-41.5	177	-71.8	173.2	21.3	0	0	112.4	Q179 E180 D186 V187	Q179-Q183 VanDerWaalsContact O-CG 3.29Å; Q179-Q183 WeakPolarHBondContact O-CG 3.26Å; Q179-Q183 PolarHBondContact O-N 3.09Å; E180-Q183 PolarHBondContact O-N 2.95Å; Q183-D186 PolarHBondContact O-N 3.2Å; Q183-V187 WeakPolarHBondContact O-CG2 3.36Å; Q183-V187 PolarHBondContact O-N 2.77Å
184	L	90.1	Very high	89.1	Confident	39 Å²	39	56 Å²	56	20%	0.204	28%	0.279	C	S	.	.	H	α-helix	trans	-65.4	-42.8	175.7	-70.2	171.6	0	0	0	111.9	E180 F181 Q182 V187 L188 L229 E232 I233 A236	E180-L184 WeakPolarHBondContact O-CG 3.45Å; E180-L184 PolarHBondContact O-N 3.26Å; F181-L184 PolarHBondContact O-N 2.78Å; Q182-L184 VanDerWaalsContact C-N 3.33Å; Q182-L184 PolarHBondContact O-N 2.82Å; L184-V187 PolarHBondContact O-N 3.45Å; L184-L188 PolarHBondContact O-N 3.15Å; L184-L229 HydrophobicContact CD2-CD2 4.4Å; L184-E232 HydrophobicContact CD1-CB 4.19Å; L184-E232 HydrophobicContact CD2-CB 4.46Å; L184-I233 HydrophobicContact CB-CD1 4.39Å; L184-I233 HydrophobicContact CB-CG1 3.66Å; L184-A236 HydrophobicContact CD1-CB 3.92Å
185	C	90	Very high	87.8	Confident	24 Å²	24	56.8 Å²	56.8	16%	0.162	29%	0.29	C	S	.	.	H	α-helix	trans	-62.5	-42.8	174.4	-78.7	0	0	0	0	112.5	F181 Q182 V187 L188 N189	F181-C185 PolarHBondContact O-N 2.97Å; F181-C185 VanDerWaalsContact O-N 3.08Å; Q182-C185 PolarHBondContact O-N 3.13Å; C185-V187 VanDerWaalsContact C-N 3.3Å; C185-V187 PolarHBondContact O-N 2.83Å; C185-L188 PolarHBondContact O-N 2.74Å; C185-N189 WeakPolarHBondContact O-CB 3.42Å; C185-N189 PolarHBondContact O-N 2.78Å; C185-N189 PolarHBondContact O-ND2 2.85Å; C185-N189 PolarHBondContact O-OD1 2.8Å
186	D	88.9	Confident	86.3	Confident	83 Å²	83	56.7 Å²	56.7	44%	0.444	29%	0.293	S	S	.	.	H	α-helix	trans	-62.6	-36.5	175.9	-78	-7.3	0	0	0	112.6	Q182 Q183 K190	Q182-D186 PolarHBondContact O-N 3.36Å; Q183-D186 PolarHBondContact O-N 3.2Å; D186-K190 WeakPolarHBondContact O-CB 3.47Å; D186-K190 VanDerWaalsContact O-CD 3.25Å; D186-K190 WeakPolarHBondContact O-CD 3.47Å; D186-K190 WeakPolarHBondContact O-CG 3.43Å; D186-K190 PolarHBondContact O-N 3.14Å; D186-K190 VanDerWaalsContact O-N 3.14Å
187	V	87.6	Confident	84.8	Confident	24 Å²	24	60.4 Å²	60.4	15%	0.145	32%	0.316	C	S	.	.	H	α-helix	trans	-69.7	-43.5	176.2	171.3	0	0	0	0	110.7	Q183 L184 C185 K190 V191 L229	Q183-V187 WeakPolarHBondContact O-CG2 3.36Å; Q183-V187 PolarHBondContact O-N 2.77Å; L184-V187 PolarHBondContact O-N 3.45Å; C185-V187 VanDerWaalsContact C-N 3.3Å; C185-V187 PolarHBondContact O-N 2.83Å; V187-K190 PolarHBondContact O-N 3.38Å; V187-V191 WeakPolarHBondContact O-CG2 3.45Å; V187-V191 PolarHBondContact O-N 3.28Å; V187-V191 VanDerWaalsContact O-N 3.13Å; V187-L229 HydrophobicContact CG1-CD1 3.91Å; V187-L229 HydrophobicContact CG1-CD2 4.03Å
188	L	88.1	Confident	82.9	Confident	17 Å²	17	63.4 Å²	63.4	9%	0.089	33%	0.334	C	S	.	.	H	α-helix	trans	-61.1	-48.4	175.3	-179.8	65.1	0	0	0	111.3	L184 C185 K190 V191 E192 P226 L229 R230 I233	L184-L188 PolarHBondContact O-N 3.15Å; C185-L188 PolarHBondContact O-N 2.74Å; L188-K190 VanDerWaalsContact C-N 3.3Å; L188-K190 PolarHBondContact O-N 3.45Å; L188-V191 PolarHBondContact O-N 3.01Å; L188-E192 HydrophobicContact CD1-CG 4.12Å; L188-E192 HydrophobicContact CG-CG 4.31Å; L188-E192 PolarHBondContact O-N 3.37Å; L188-P226 HydrophobicContact CD1-CB 4.36Å; L188-L229 HydrophobicContact CB-CD1 4.47Å; L188-L229 HydrophobicContact CD1-CB 4.25Å; L188-L229 HydrophobicContact CD1-CD1 4.31Å; L188-R230 HydrophobicContact CD1-CG 4.29Å; L188-R230 HydrophobicContact CD2-CG 3.9Å; L188-I233 HydrophobicContact CB-CD1 3.78Å; L188-I233 HydrophobicContact CD2-CD1 3.6Å; L188-I233 HydrophobicContact CG-CD1 4.3Å
189	N	87.6	Confident	81	Confident	79 Å²	79	66.2 Å²	66.2	42%	0.422	35%	0.354	S	S	.	.	H	α-helix	trans	-55.4	-44.9	177.5	-68	-15.3	0	0	0	111.2	C185 V191 E192 D193	C185-N189 WeakPolarHBondContact O-CB 3.42Å; C185-N189 PolarHBondContact O-N 2.78Å; C185-N189 PolarHBondContact O-ND2 2.85Å; C185-N189 PolarHBondContact O-OD1 2.8Å; N189-V191 VanDerWaalsContact C-N 3.3Å; N189-V191 PolarHBondContact O-N 3.32Å; N189-E192 PolarHBondContact O-N 3.34Å; N189-D193 WeakPolarHBondContact O-CB 3.38Å; N189-D193 VanDerWaalsContact O-CG 3.27Å; N189-D193 PolarHBondContact O-N 3.38Å
190	K	86.9	Confident	79	Confident	129 Å²	129	68.5 Å²	68.5	56%	0.561	37%	0.368	S	S	*	.	H	α-helix	trans	-63.1	-32.1	177	-72.4	162.1	-170	160.9	0	113.4	D186 V187 L188 S194	D186-K190 WeakPolarHBondContact O-CB 3.47Å; D186-K190 VanDerWaalsContact O-CD 3.25Å; D186-K190 WeakPolarHBondContact O-CD 3.47Å; D186-K190 WeakPolarHBondContact O-CG 3.43Å; D186-K190 PolarHBondContact O-N 3.14Å; D186-K190 VanDerWaalsContact O-N 3.14Å; V187-K190 PolarHBondContact O-N 3.38Å; L188-K190 VanDerWaalsContact C-N 3.3Å; L188-K190 PolarHBondContact O-N 3.45Å; K190-S194 VanDerWaalsContact O-CB 3.27Å; K190-S194 WeakPolarHBondContact O-CB 3.35Å; K190-S194 PolarHBondContact O-N 3.27Å; K190-S194 VanDerWaalsContact O-N 3.08Å; K190-S194 PolarHBondContact O-OG 3.31Å
191	V	84.4	Confident	77.1	Confident	19 Å²	19	71.2 Å²	71.2	12%	0.115	39%	0.392	C	S	.	.	H	α-helix	trans	-75.4	-40.3	174.8	173.1	0	0	0	0	110.9	V187 L188 N189 S194 T195 P226 L229	V187-V191 WeakPolarHBondContact O-CG2 3.45Å; V187-V191 PolarHBondContact O-N 3.28Å; V187-V191 VanDerWaalsContact O-N 3.13Å; L188-V191 PolarHBondContact O-N 3.01Å; N189-V191 VanDerWaalsContact C-N 3.3Å; N189-V191 PolarHBondContact O-N 3.32Å; V191-S194 PolarHBondContact O-N 3.05Å; V191-T195 WeakPolarHBondContact O-CG2 3.32Å; V191-T195 PolarHBondContact O-N 3.13Å; V191-T195 PolarHBondContact O-OG1 2.8Å; V191-P226 HydrophobicContact CG1-CB 4.5Å; V191-L229 HydrophobicContact CG2-CD1 4.35Å
192	E	82.8	Confident	74.4	Confident	62 Å²	62	78.3 Å²	78.3	29%	0.29	42%	0.417	S	S	.	.	H	α-helix	trans	-68.2	-38.6	176.2	-67.6	-173.6	164	0	0	111.9	L188 N189 T195 T196 R230	L188-E192 HydrophobicContact CD1-CG 4.12Å; L188-E192 HydrophobicContact CG-CG 4.31Å; L188-E192 PolarHBondContact O-N 3.37Å; N189-E192 PolarHBondContact O-N 3.34Å; E192-T195 WeakPolarHBondContact CA-OG1 3.36Å; E192-T195 PolarHBondContact O-N 3.03Å; E192-T195 PolarHBondContact O-OG1 2.91Å; E192-T196 WeakPolarHBondContact O-CB 3.2Å; E192-T196 WeakPolarHBondContact O-CG2 3.35Å; E192-T196 PolarHBondContact O-N 2.98Å; E192-T196 PolarHBondContact O-OG1 3.37Å; E192-R230 IonicContact OE1-CZ 2.8Å; E192-R230 IonicContact OE1-NE 2.68Å; E192-R230 IonicContact OE1-NH2 3.52Å; E192-R230 PolarHBondContact OE1-NH2 2.78Å
193	D	80.8	Confident	71.9	Confident	97 Å²	97	76.6 Å²	76.6	52%	0.519	43%	0.427	S	S	.	.	H	α-helix	trans	-65.9	-41.4	171.4	-71.4	-24.6	0	0	0	112.2	N189 T195 T196 T197	N189-D193 WeakPolarHBondContact O-CB 3.38Å; N189-D193 VanDerWaalsContact O-CG 3.27Å; N189-D193 PolarHBondContact O-N 3.38Å; D193-T195 VanDerWaalsContact C-N 3.34Å; D193-T195 PolarHBondContact O-N 3.15Å; D193-T196 WeakPolarHBondContact CA-OG1 3.44Å; D193-T196 PolarHBondContact O-OG1 2.81Å; D193-T197 VanDerWaalsContact O-CB 3.26Å; D193-T197 WeakPolarHBondContact O-CB 3.33Å; D193-T197 PolarHBondContact O-N 3.04Å; D193-T197 PolarHBondContact O-OG1 2.91Å
194	S	75.9	Confident	69.5	Low	44 Å²	44	78.8 Å²	78.8	31%	0.308	44%	0.44	S	S	.	.	H	α-helix	trans	-64.2	-39.5	177.2	-65.6	0	0	0	0	111.9	K190 V191 T198	K190-S194 VanDerWaalsContact O-CB 3.27Å; K190-S194 WeakPolarHBondContact O-CB 3.35Å; K190-S194 PolarHBondContact O-N 3.27Å; K190-S194 VanDerWaalsContact O-N 3.08Å; K190-S194 PolarHBondContact O-OG 3.31Å; V191-S194 PolarHBondContact O-N 3.05Å; S194-T198 WeakPolarHBondContact O-CB 3.44Å; S194-T198 PolarHBondContact O-N 3.45Å; S194-T198 PolarHBondContact O-OG1 3.06Å
195	T	69.2	Low	66.8	Low	76 Å²	76	84 Å²	84	47%	0.466	47%	0.468	S	S	.	.	H	α-helix	trans	-71.4	-51.2	177.4	48.5	0	0	0	0	111.1	V191 E192 D193 T197 T198 T199	V191-T195 WeakPolarHBondContact O-CG2 3.32Å; V191-T195 PolarHBondContact O-N 3.13Å; V191-T195 PolarHBondContact O-OG1 2.8Å; E192-T195 WeakPolarHBondContact CA-OG1 3.36Å; E192-T195 PolarHBondContact O-N 3.03Å; E192-T195 PolarHBondContact O-OG1 2.91Å; D193-T195 VanDerWaalsContact C-N 3.34Å; D193-T195 PolarHBondContact O-N 3.15Å; T195-T197 PolarHBondContact O-N 3.32Å; T195-T198 WeakPolarHBondContact O-CA 3.14Å; T195-T198 WeakPolarHBondContact O-CB 3.22Å; T195-T198 PolarHBondContact O-N 3.43Å; T195-T199 PolarHBondContact O-N 3.42Å; T195-T199 PolarHBondContact O-OG1 3.42Å
196	T	63.7	Low	64	Low	70 Å²	70	87.7 Å²	87.7	43%	0.429	49%	0.494	S	S	.	.	H	α-helix	trans	-60	-42.7	179.8	51.7	0	0	0	0	113.4	E192 D193 T198 T199 I200	E192-T196 WeakPolarHBondContact O-CB 3.2Å; E192-T196 WeakPolarHBondContact O-CG2 3.35Å; E192-T196 PolarHBondContact O-N 2.98Å; E192-T196 PolarHBondContact O-OG1 3.37Å; D193-T196 WeakPolarHBondContact CA-OG1 3.44Å; D193-T196 PolarHBondContact O-OG1 2.81Å; T196-T198 VanDerWaalsContact C-N 3.27Å; T196-T198 PolarHBondContact O-N 3.18Å; T196-T199 PolarHBondContact O-N 3.39Å; T196-I200 WeakPolarHBondContact O-CG1 3.48Å; T196-I200 PolarHBondContact O-N 3.21Å
197	T	60.1	Low	61.4	Low	86 Å²	86	90.8 Å²	90.8	53%	0.528	52%	0.516	S	S	.	.	H	α-helix	trans	-59.3	-41	174.4	-55.5	0	0	0	0	111.1	D193 T195 S201	D193-T197 VanDerWaalsContact O-CB 3.26Å; D193-T197 WeakPolarHBondContact O-CB 3.33Å; D193-T197 PolarHBondContact O-N 3.04Å; D193-T197 PolarHBondContact O-OG1 2.91Å; T195-T197 PolarHBondContact O-N 3.32Å; T197-S201 PolarHBondContact O-N 3.33Å; T197-S201 VanDerWaalsContact O-N 3.16Å; T197-S201 PolarHBondContact O-OG 3.36Å; T197-S201 VanDerWaalsContact O-OG 3.08Å
198	T	55	Low	58.9	Low	66 Å²	66	94.7 Å²	94.7	41%	0.405	54%	0.544	S	S	.	.	H	α-helix	trans	-66.8	-35.3	177.3	-59.5	0	0	0	0	112.6	S194 T195 T196	S194-T198 WeakPolarHBondContact O-CB 3.44Å; S194-T198 PolarHBondContact O-N 3.45Å; S194-T198 PolarHBondContact O-OG1 3.06Å; T195-T198 WeakPolarHBondContact O-CA 3.14Å; T195-T198 WeakPolarHBondContact O-CB 3.22Å; T195-T198 PolarHBondContact O-N 3.43Å; T196-T198 VanDerWaalsContact C-N 3.27Å; T196-T198 PolarHBondContact O-N 3.18Å
199	T	53.5	Low	56.2	Low	98 Å²	98	104.9 Å²	104.9	60%	0.601	58%	0.581	S	S	*	*	H	α-helix	trans	-73.8	-42.9	177.7	-25.2	0	0	0	0	112.1	T195 T196 S201 R202 G203	T195-T199 PolarHBondContact O-N 3.42Å; T195-T199 PolarHBondContact O-OG1 3.42Å; T196-T199 PolarHBondContact O-N 3.39Å; T199-S201 VanDerWaalsContact C-N 3.32Å; T199-S201 PolarHBondContact O-N 2.92Å; T199-R202 CarbonylContact O-C 3.54Å; T199-R202 PolarHBondContact O-N 3.08Å; T199-G203 PolarHBondContact O-N 2.8Å
200	I	51.3	Low	53.7	Low	138 Å²	138	106.1 Å²	106.1	71%	0.708	60%	0.596	S	S	*	*	H	α-helix	trans	-63.3	-39.7	179	-66.5	169.5	0	0	0	110.4	T196 R202 G203	T196-I200 WeakPolarHBondContact O-CG1 3.48Å; T196-I200 PolarHBondContact O-N 3.21Å; I200-R202 PolarHBondContact O-N 2.64Å; I200-R202 VanDerWaalsContact O-N 3.12Å; I200-G203 PolarHBondContact O-N 2.97Å
201	S	48.8	Very low	51.1	Low	100 Å²	100	107.3 Å²	107.3	70%	0.699	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-4.5	174.1	-58.6	0	0	0	0	115.1	T197 T199	T197-S201 PolarHBondContact O-N 3.33Å; T197-S201 VanDerWaalsContact O-N 3.16Å; T197-S201 PolarHBondContact O-OG 3.36Å; T197-S201 VanDerWaalsContact O-OG 3.08Å; T199-S201 VanDerWaalsContact C-N 3.32Å; T199-S201 PolarHBondContact O-N 2.92Å
202	R	37.4	Very low	48.7	Very low	191 Å²	191	114.7 Å²	114.7	72%	0.721	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.3	19.3	176.4	-63.8	-172.8	-177.4	127.3	3.8	113.4	T199 I200 I204	T199-R202 CarbonylContact O-C 3.54Å; T199-R202 PolarHBondContact O-N 3.08Å; I200-R202 PolarHBondContact O-N 2.64Å; I200-R202 VanDerWaalsContact O-N 3.12Å; R202-I204 VanDerWaalsContact C-N 3.3Å; R202-I204 PolarHBondContact O-N 2.63Å
203	G	37.6	Very low	46.1	Very low	64 Å²	64	115 Å²	115	66%	0.66	67%	0.666	S	S	*	*	S	Bend	trans	-76	-1.8	-178.7	0	0	0	0	0	116.6	T199 I200	T199-G203 PolarHBondContact O-N 2.8Å; I200-G203 PolarHBondContact O-N 2.97Å
204	I	40	Very low	43.7	Very low	148 Å²	148	115.8 Å²	115.8	76%	0.759	68%	0.679	S	S	*	*	S	Bend	trans	-133.3	115.4	175.2	-51.3	178.5	0	0	0	108.9	R202	R202-I204 VanDerWaalsContact C-N 3.3Å; R202-I204 PolarHBondContact O-N 2.63Å
205	N	33.3	Very low	41.7	Very low	148 Å²	148	120 Å²	120	79%	0.791	71%	0.708	S	S	*	*	S	Bend	trans	60.5	93.2	173.6	-57.7	-19.9	0	0	0	117.5
206	S	31.5	Very low	39.9	Very low	103 Å²	103	120.9 Å²	120.9	72%	0.72	72%	0.718	S	S	*	*				-175.3	130.9	96.5	52.3	0	0	0	0	112.9	S208	S206-S208 PolarHBondContact O-N 3.09Å
207	V	33.2	Very low	38.4	Very low	148 Å²	148	123.5 Å²	123.5	90%	0.897	73%	0.734	S	S	*	*			trans	-79.3	101.8	153.4	174.1	0	0	0	0	106.1
208	S	35.7	Very low	37.1	Very low	105 Å²	105	126.6 Å²	126.6	73%	0.734	75%	0.746	S	S	*	*			trans	-147.3	121.6	167.3	-81.2	0	0	0	0	110.9	S206	S206-S208 PolarHBondContact O-N 3.09Å
209	R	30.7	Very low	36.3	Very low	231 Å²	231	128.7 Å²	128.7	87%	0.872	76%	0.759	S	S	*	*			trans	-71.4	161.3	176.2	-68.1	162.3	138.1	-178.9	-8	109.9
210	S	35.2	Very low	35.8	Very low	105 Å²	105	129.4 Å²	129.4	73%	0.734	77%	0.768	S	S	*	*			trans	54.9	116.8	162.5	55.4	0	0	0	0	117.5
211	N	32.8	Very low	35.6	Very low	154 Å²	154	126.1 Å²	126.1	82%	0.824	76%	0.758	S	S	*	*				-151.5	111	119.7	-99.2	-9.8	0	0	0	110.1
212	L	34.7	Very low	35.6	Very low	175 Å²	175	126.1 Å²	126.1	92%	0.916	76%	0.758	S	S	*	*			trans	-63.5	140.4	152	-94.9	70.4	0	0	0	107.4
213	G	28	Very low	36.9	Very low	67 Å²	67	126.9 Å²	126.9	69%	0.691	76%	0.76	S	S	*	*			trans	91	88.6	169.2	0	0	0	0	0	114.9
214	S	30.6	Very low	38.5	Very low	114 Å²	114	126.7 Å²	126.7	80%	0.797	74%	0.742	S	S	*	*			trans	-151.3	91	145.7	-79.5	0	0	0	0	108.2	S216	S214-S216 PolarHBondContact O-N 3.13Å
215	S	32.7	Very low	40.5	Very low	132 Å²	132	124 Å²	124	92%	0.923	73%	0.729	S	S	*	*			trans	-72.1	109.5	169.3	-179.3	0	0	0	0	108.9
216	S	33.1	Very low	42.9	Very low	96 Å²	96	119.3 Å²	119.3	67%	0.671	71%	0.707	S	S	*	*			trans	-155.4	102.1	165.2	44.3	0	0	0	0	111.9	S214	S214-S216 PolarHBondContact O-N 3.13Å
217	T	30.9	Very low	45.4	Very low	124 Å²	124	119.2 Å²	119.2	76%	0.761	70%	0.698	S	S	*	*			trans	47.9	85.7	152.4	47.4	0	0	0	0	118.4	T219	T217-T219 PolarHBondContact O-N 2.88Å
218	L	34.1	Very low	48.1	Very low	151 Å²	151	116.6 Å²	116.6	79%	0.791	68%	0.679	S	S	*	*				21.1	77.4	129.6	-66.7	166	0	0	0	116.6
219	T	36.8	Very low	50.6	Low	110 Å²	110	111.8 Å²	111.8	68%	0.675	65%	0.645	S	S	*	*			trans	-90.1	137	157.1	55.9	0	0	0	0	109.1	T217 S221	T217-T219 PolarHBondContact O-N 2.88Å; T219-S221 PolarHBondContact O-N 2.91Å
220	S	44.5	Very low	53.4	Low	113 Å²	113	106.1 Å²	106.1	79%	0.79	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-1.5	-157.7	-47	0	0	0	0	116.8
221	S	45.6	Very low	56	Low	70 Å²	70	102.9 Å²	102.9	49%	0.49	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.4	-6.8	-172.6	-52.4	0	0	0	0	114.9	T219	T219-S221 PolarHBondContact O-N 2.91Å
222	S	49.1	Very low	58.8	Low	99 Å²	99	99 Å²	99	69%	0.692	58%	0.578	S	S	*	*	S	Bend	trans	-99.6	9.3	-166.9	79.2	0	0	0	0	116.7
223	R	64.3	Low	61.5	Low	207 Å²	207	91 Å²	91	78%	0.781	54%	0.536	S	S	*	.	S	Bend	trans	-94.1	-22.1	-175.1	-64.1	-164.2	-167	-164.3	6	115.7
224	H	71.8	Confident	64.6	Low	61 Å²	61	95.7 Å²	95.7	28%	0.282	53%	0.533	S	S	.	.	S	Bend	trans	-102	119.1	-172.1	-53.6	75.9	0	0	0	109.2	L229 K430	H224-L229 HydrophobicContact CB-CD1 3.77Å; H224-L229 HydrophobicContact CB-CD2 4.46Å; H224-L229 HydrophobicContact CB-CG 4.16Å; H224-K430 PolarHBondContact NE2-NZ 2.98Å
225	D	82.4	Confident	67.6	Low	90 Å²	90	95.5 Å²	95.5	48%	0.481	52%	0.522	S	S	.	.			trans	-69.7	123.8	171.4	-179.9	-22.4	0	0	0	109.1	D227 L228 L229	D225-D227 VanDerWaalsContact C-N 3.27Å; D225-D227 PolarHBondContact O-N 2.69Å; D225-D227 PolarHBondContact OD1-N 2.94Å; D225-L228 HydrophobicContact CB-CB 3.9Å; D225-L228 PolarHBondContact O-N 2.97Å; D225-L229 PolarHBondContact O-N 3.29Å
226	P	82.3	Confident	70.5	Confident	50 Å²	50	89.8 Å²	89.8	33%	0.325	48%	0.483	S	S	.	.	H	α-helix	trans	-62.1	-31.5	-178.1	26.2	-35.3	0	0	0	113.3	L188 V191 R230	L188-P226 HydrophobicContact CD1-CB 4.36Å; V191-P226 HydrophobicContact CG1-CB 4.5Å; P226-R230 WeakPolarHBondContact O-CD 3.41Å; P226-R230 WeakPolarHBondContact O-CG 3.31Å; P226-R230 PolarHBondContact O-N 3.42Å
227	D	84.5	Confident	73.3	Confident	101 Å²	101	92.1 Å²	92.1	54%	0.54	48%	0.477	S	S	.	.	H	α-helix	trans	-80.1	-30.8	-179.2	-71.6	-30	0	0	0	111.8	D225 R230 S231	D225-D227 VanDerWaalsContact C-N 3.27Å; D225-D227 PolarHBondContact O-N 2.69Å; D225-D227 PolarHBondContact OD1-N 2.94Å; D227-R230 PolarHBondContact O-N 2.94Å; D227-R230 IonicContact OD1-CZ 2.89Å; D227-R230 IonicContact OD1-NH1 2.78Å; D227-R230 PolarHBondContact OD1-NH1 3.45Å; D227-S231 PolarHBondContact O-N 2.92Å
228	L	89.5	Confident	76.3	Confident	93 Å²	93	92.9 Å²	92.9	49%	0.487	47%	0.472	S	S	.	.	H	α-helix	trans	-61.7	-50.6	166.9	-178.9	62.2	0	0	0	110.8	D225 R230 S231 E232	D225-L228 HydrophobicContact CB-CB 3.9Å; D225-L228 PolarHBondContact O-N 2.97Å; L228-R230 VanDerWaalsContact C-N 3.29Å; L228-R230 PolarHBondContact O-N 2.84Å; L228-S231 WeakPolarHBondContact O-CA 3.29Å; L228-S231 WeakPolarHBondContact O-CB 3.37Å; L228-S231 PolarHBondContact O-N 3.35Å; L228-S231 PolarHBondContact O-OG 2.88Å; L228-E232 PolarHBondContact O-N 2.89Å
229	L	88.8	Confident	79.3	Confident	5 Å²	5	88 Å²	88	3%	0.026	44%	0.443	C	S	.	.	H	α-helix	trans	-55.9	-42.7	176.1	-74.5	175	0	0	0	112	L184 V187 L188 V191 H224 D225 S231 E232 I233	L184-L229 HydrophobicContact CD2-CD2 4.4Å; V187-L229 HydrophobicContact CG1-CD1 3.91Å; V187-L229 HydrophobicContact CG1-CD2 4.03Å; L188-L229 HydrophobicContact CB-CD1 4.47Å; L188-L229 HydrophobicContact CD1-CB 4.25Å; L188-L229 HydrophobicContact CD1-CD1 4.31Å; V191-L229 HydrophobicContact CG2-CD1 4.35Å; H224-L229 HydrophobicContact CB-CD1 3.77Å; H224-L229 HydrophobicContact CB-CD2 4.46Å; H224-L229 HydrophobicContact CB-CG 4.16Å; D225-L229 PolarHBondContact O-N 3.29Å; L229-S231 VanDerWaalsContact C-N 3.28Å; L229-S231 PolarHBondContact O-N 2.96Å; L229-E232 PolarHBondContact O-N 2.94Å; L229-I233 WeakPolarHBondContact O-CB 3.05Å; L229-I233 WeakPolarHBondContact O-CD1 3.06Å; L229-I233 WeakPolarHBondContact O-CG1 3.37Å; L229-I233 PolarHBondContact O-N 3.42Å
230	R	89.2	Confident	82.1	Confident	111 Å²	111	83 Å²	83	42%	0.419	41%	0.412	S	S	.	.	H	α-helix	trans	-62.7	-34.4	175.5	-74.1	163.3	175.2	-179.9	-3.8	112.6	L188 E192 P226 D227 L228 R234	L188-R230 HydrophobicContact CD1-CG 4.29Å; L188-R230 HydrophobicContact CD2-CG 3.9Å; E192-R230 IonicContact OE1-CZ 2.8Å; E192-R230 IonicContact OE1-NE 2.68Å; E192-R230 IonicContact OE1-NH2 3.52Å; E192-R230 PolarHBondContact OE1-NH2 2.78Å; P226-R230 WeakPolarHBondContact O-CD 3.41Å; P226-R230 WeakPolarHBondContact O-CG 3.31Å; P226-R230 PolarHBondContact O-N 3.42Å; D227-R230 PolarHBondContact O-N 2.94Å; D227-R230 IonicContact OD1-CZ 2.89Å; D227-R230 IonicContact OD1-NH1 2.78Å; D227-R230 PolarHBondContact OD1-NH1 3.45Å; L228-R230 VanDerWaalsContact C-N 3.29Å; L228-R230 PolarHBondContact O-N 2.84Å; R230-R234 PolarHBondContact O-N 2.87Å; R230-R234 VanDerWaalsContact O-N 3.13Å
231	S	90.2	Very high	84.4	Confident	37 Å²	37	79.8 Å²	79.8	26%	0.259	39%	0.392	S	S	.	.	H	α-helix	trans	-70.2	-41.8	174.5	84.2	0	0	0	0	112.3	D227 L228 L229 R234 I235	D227-S231 PolarHBondContact O-N 2.92Å; L228-S231 WeakPolarHBondContact O-CA 3.29Å; L228-S231 WeakPolarHBondContact O-CB 3.37Å; L228-S231 PolarHBondContact O-N 3.35Å; L228-S231 PolarHBondContact O-OG 2.88Å; L229-S231 VanDerWaalsContact C-N 3.28Å; L229-S231 PolarHBondContact O-N 2.96Å; S231-R234 WeakPolarHBondContact O-CB 3.5Å; S231-R234 PolarHBondContact O-N 3.35Å; S231-I235 WeakPolarHBondContact O-CG1 3.33Å; S231-I235 PolarHBondContact O-N 3.44Å
232	E	91.2	Very high	86.7	Confident	74 Å²	74	81.8 Å²	81.8	35%	0.346	39%	0.389	S	S	.	.	H	α-helix	trans	-64.4	-45	175.4	-69.4	175	-179.8	0	0	111.4	L184 L228 L229 R234 I235 A236	L184-E232 HydrophobicContact CD1-CB 4.19Å; L184-E232 HydrophobicContact CD2-CB 4.46Å; L228-E232 PolarHBondContact O-N 2.89Å; L229-E232 PolarHBondContact O-N 2.94Å; E232-R234 PolarHBondContact O-N 3.34Å; E232-I235 CarbonylContact O-C 3.6Å; E232-I235 PolarHBondContact O-N 2.95Å; E232-I235 VanDerWaalsContact O-N 3.1Å; E232-A236 WeakPolarHBondContact O-CB 3.32Å; E232-A236 PolarHBondContact O-N 3.06Å
233	I	92.8	Very high	88.9	Confident	5 Å²	5	77.1 Å²	77.1	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-56.5	-38.9	173.1	-74.1	168	0	0	0	111	F181 L184 L188 L229 R237	F181-I233 HydrophobicContact CE2-CG2 4.01Å; L184-I233 HydrophobicContact CB-CD1 4.39Å; L184-I233 HydrophobicContact CB-CG1 3.66Å; L188-I233 HydrophobicContact CB-CD1 3.78Å; L188-I233 HydrophobicContact CD2-CD1 3.6Å; L188-I233 HydrophobicContact CG-CD1 4.3Å; L229-I233 WeakPolarHBondContact O-CB 3.05Å; L229-I233 WeakPolarHBondContact O-CD1 3.06Å; L229-I233 WeakPolarHBondContact O-CG1 3.37Å; L229-I233 PolarHBondContact O-N 3.42Å; I233-R237 WeakPolarHBondContact O-CB 3.29Å; I233-R237 VanDerWaalsContact O-CG 3.25Å; I233-R237 WeakPolarHBondContact O-CG 3.34Å; I233-R237 PolarHBondContact O-N 3.16Å
234	R	92.9	Very high	90.4	Very high	166 Å²	166	72 Å²	72	63%	0.626	34%	0.337	S	S	*	.	H	α-helix	trans	-65.3	-44.4	175.7	-167.6	-173.4	-63.8	122.7	-2.4	111.5	R230 S231 E232 R237 Q238	R230-R234 PolarHBondContact O-N 2.87Å; R230-R234 VanDerWaalsContact O-N 3.13Å; S231-R234 WeakPolarHBondContact O-CB 3.5Å; S231-R234 PolarHBondContact O-N 3.35Å; E232-R234 PolarHBondContact O-N 3.34Å; R234-R237 PolarHBondContact O-N 3.11Å; R234-Q238 PolarHBondContact O-N 2.83Å
235	I	93	Very high	91.3	Very high	110 Å²	110	74.5 Å²	74.5	56%	0.564	34%	0.344	S	S	*	.	H	α-helix	trans	-65.5	-43	176.8	-65.1	165.8	0	0	0	110.9	S231 E232 Q238 R239	S231-I235 WeakPolarHBondContact O-CG1 3.33Å; S231-I235 PolarHBondContact O-N 3.44Å; E232-I235 CarbonylContact O-C 3.6Å; E232-I235 PolarHBondContact O-N 2.95Å; E232-I235 VanDerWaalsContact O-N 3.1Å; I235-Q238 WeakPolarHBondContact O-CB 3.48Å; I235-Q238 PolarHBondContact O-N 3.46Å; I235-Q238 VanDerWaalsContact O-N 3.15Å; I235-R239 PolarHBondContact O-N 3.35Å
236	A	93.4	Very high	91.8	Very high	13 Å²	13	72.2 Å²	72.2	11%	0.107	33%	0.331	C	S	.	.	H	α-helix	trans	-62.4	-43.2	176.7	0	0	0	0	0	112	F181 L184 E232 Q238 R239 L240	F181-A236 HydrophobicContact CB-CB 4.27Å; F181-A236 HydrophobicContact CD2-CB 4.16Å; L184-A236 HydrophobicContact CD1-CB 3.92Å; E232-A236 WeakPolarHBondContact O-CB 3.32Å; E232-A236 PolarHBondContact O-N 3.06Å; A236-Q238 VanDerWaalsContact C-N 3.31Å; A236-Q238 PolarHBondContact O-N 3.36Å; A236-R239 PolarHBondContact O-N 2.87Å; A236-L240 WeakPolarHBondContact O-CB 3.39Å; A236-L240 PolarHBondContact O-N 3.48Å
237	R	93	Very high	92.4	Very high	145 Å²	145	70.6 Å²	70.6	55%	0.547	32%	0.318	S	S	.	.	H	α-helix	trans	-57.6	-43.1	171	-75.2	173.6	-175.1	169.9	7.5	111.8	F181 I233 R234 L240 A241	F181-R237 HydrophobicContact CD2-CG 3.85Å; F181-R237 HydrophobicContact CE2-CG 3.29Å; F181-R237 VanDerWaalsContact CE2-NE 3.32Å; F181-R237 HydrophobicContact CZ-CG 3.88Å; I233-R237 WeakPolarHBondContact O-CB 3.29Å; I233-R237 VanDerWaalsContact O-CG 3.25Å; I233-R237 WeakPolarHBondContact O-CG 3.34Å; I233-R237 PolarHBondContact O-N 3.16Å; R234-R237 PolarHBondContact O-N 3.11Å; R237-L240 PolarHBondContact O-N 2.75Å; R237-A241 VanDerWaalsContact O-CB 3.31Å; R237-A241 WeakPolarHBondContact O-CB 3.39Å; R237-A241 PolarHBondContact O-N 2.91Å
238	Q	94	Very high	92.7	Very high	140 Å²	140	72.4 Å²	72.4	65%	0.654	32%	0.318	S	S	*	.	H	α-helix	trans	-66.9	-41.8	178.2	-167.1	-179.9	8.6	0	0	112.2	R234 I235 A236 A241 R242	R234-Q238 PolarHBondContact O-N 2.83Å; I235-Q238 WeakPolarHBondContact O-CB 3.48Å; I235-Q238 PolarHBondContact O-N 3.46Å; I235-Q238 VanDerWaalsContact O-N 3.15Å; A236-Q238 VanDerWaalsContact C-N 3.31Å; A236-Q238 PolarHBondContact O-N 3.36Å; Q238-A241 PolarHBondContact O-N 3.4Å; Q238-R242 WeakPolarHBondContact O-CB 3.35Å; Q238-R242 PolarHBondContact O-N 3.38Å
239	R	95.1	Very high	92.9	Very high	48 Å²	48	72.4 Å²	72.4	18%	0.181	32%	0.315	C	S	.	.	H	α-helix	trans	-60.7	-46.2	172.8	176.8	175.4	167.4	-150.3	-14.3	111.2	A177 E180 I235 A236 R242 L243 E421	A177-R239 HydrophobicContact CB-CG 4.38Å; E180-R239 IonicContact OE1-CZ 3.8Å; E180-R239 IonicContact OE1-NH1 3.54Å; E180-R239 PolarHBondContact OE1-NH1 2.69Å; E180-R239 IonicContact OE1-NH2 3.69Å; E180-R239 PolarHBondContact OE1-NH2 2.73Å; E180-R239 IonicContact OE2-CZ 3.86Å; E180-R239 IonicContact OE2-NH1 2.68Å; E180-R239 PolarHBondContact OE2-NH1 3.46Å; E180-R239 IonicContact OE2-NH2 2.77Å; I235-R239 PolarHBondContact O-N 3.35Å; A236-R239 PolarHBondContact O-N 2.87Å; R239-R242 WeakPolarHBondContact O-CB 3.2Å; R239-R242 PolarHBondContact O-N 3.46Å; R239-L243 HydrophobicContact CG-CD1 3.98Å; R239-L243 HydrophobicContact CG-CG 4.49Å; R239-L243 WeakPolarHBondContact O-CG 3.24Å; R239-L243 PolarHBondContact O-N 3.42Å; R239-E421 IonicContact CZ-OE2 2.75Å; R239-E421 IonicContact NH2-OE1 2.62Å; R239-E421 IonicContact NH2-OE2 3.58Å; R239-E421 PolarHBondContact NH2-OE2 2.94Å
240	L	96.4	Very high	93.1	Very high	5 Å²	5	72.7 Å²	72.7	3%	0.026	32%	0.317	C	S	.	.	H	α-helix	trans	-64.3	-41.9	178.4	-178.2	57.7	0	0	0	112	R174 E178 F181 A236 R237 R242 R244	R174-L240 HydrophobicContact CG-CD1 3.79Å; E178-L240 HydrophobicContact CB-CD1 3.96Å; E178-L240 HydrophobicContact CB-CD2 4.46Å; F181-L240 HydrophobicContact CB-CD2 4.49Å; F181-L240 HydrophobicContact CD1-CD2 4.08Å; F181-L240 HydrophobicContact CG-CD2 4.37Å; A236-L240 WeakPolarHBondContact O-CB 3.39Å; A236-L240 PolarHBondContact O-N 3.48Å; R237-L240 PolarHBondContact O-N 2.75Å; L240-R242 VanDerWaalsContact C-N 3.34Å; L240-R244 HydrophobicContact CD1-CG 4.34Å; L240-R244 VanDerWaalsContact O-CB 3.32Å; L240-R244 WeakPolarHBondContact O-CB 3.43Å; L240-R244 VanDerWaalsContact O-CG 3.26Å; L240-R244 WeakPolarHBondContact O-CG 3.44Å; L240-R244 PolarHBondContact O-N 3Å
241	A	92.7	Very high	93.4	Very high	46 Å²	46	69.9 Å²	69.9	38%	0.38	31%	0.309	S	S	.	.	H	α-helix	trans	-63.9	-38	174	0	0	0	0	0	112.3	R237 Q238 R245	R237-A241 VanDerWaalsContact O-CB 3.31Å; R237-A241 WeakPolarHBondContact O-CB 3.39Å; R237-A241 PolarHBondContact O-N 2.91Å; Q238-A241 PolarHBondContact O-N 3.4Å; A241-R245 WeakPolarHBondContact O-CG 3.42Å; A241-R245 PolarHBondContact O-N 2.9Å
242	R	94.7	Very high	93.4	Very high	112 Å²	112	71.2 Å²	71.2	42%	0.423	32%	0.317	S	S	.	.	H	α-helix	trans	-65.2	-52.7	174.4	-172.4	-177.2	67.3	-147.1	-2	111.5	Q238 R239 L240 R244 R245 E246	Q238-R242 WeakPolarHBondContact O-CB 3.35Å; Q238-R242 PolarHBondContact O-N 3.38Å; R239-R242 WeakPolarHBondContact O-CB 3.2Å; R239-R242 PolarHBondContact O-N 3.46Å; L240-R242 VanDerWaalsContact C-N 3.34Å; R242-R244 VanDerWaalsContact C-N 3.32Å; R242-R244 PolarHBondContact O-N 3.21Å; R242-R245 WeakPolarHBondContact O-CA 3.09Å; R242-R245 WeakPolarHBondContact O-CB 3.09Å; R242-R245 PolarHBondContact O-N 3.22Å; R242-E246 WeakPolarHBondContact CD-OE1 3.27Å; R242-E246 VanDerWaalsContact CG-OE1 3.25Å; R242-E246 WeakPolarHBondContact CG-OE1 3.48Å; R242-E246 IonicContact NE-OE1 3.19Å; R242-E246 PolarHBondContact O-N 3.15Å
243	L	95.6	Very high	93.3	Very high	1 Å²	1	69.6 Å²	69.6	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-59.8	-40.3	178.4	-72.1	170.9	0	0	0	112.1	R173 A177 R239 R245 E246 E247	R173-L243 HydrophobicContact CB-CD2 4.38Å; A177-L243 HydrophobicContact CB-CD1 3.61Å; R239-L243 HydrophobicContact CG-CD1 3.98Å; R239-L243 HydrophobicContact CG-CG 4.49Å; R239-L243 WeakPolarHBondContact O-CG 3.24Å; R239-L243 PolarHBondContact O-N 3.42Å; L243-R245 VanDerWaalsContact C-N 3.28Å; L243-R245 PolarHBondContact O-N 3.49Å; L243-E246 PolarHBondContact O-N 2.97Å; L243-E247 WeakPolarHBondContact O-CB 3.23Å; L243-E247 PolarHBondContact O-N 3.38Å
244	R	94.8	Very high	93.4	Very high	98 Å²	98	70.7 Å²	70.7	37%	0.37	32%	0.315	S	S	.	.	H	α-helix	trans	-62.9	-29.2	173.3	-76.3	172.5	176.6	168.9	-2	113.4	R174 E178 L240 R242 R248	R174-R244 VanDerWaalsContact CD-CG 3.47Å; R174-R244 HydrophobicContact CG-CG 4.39Å; E178-R244 IonicContact OE1-CZ 3.15Å; E178-R244 IonicContact OE1-NH2 2.73Å; E178-R244 PolarHBondContact OE1-NH2 3.34Å; E178-R244 IonicContact OE2-NH2 3.53Å; L240-R244 HydrophobicContact CD1-CG 4.34Å; L240-R244 VanDerWaalsContact O-CB 3.32Å; L240-R244 WeakPolarHBondContact O-CB 3.43Å; L240-R244 VanDerWaalsContact O-CG 3.26Å; L240-R244 WeakPolarHBondContact O-CG 3.44Å; L240-R244 PolarHBondContact O-N 3Å; R242-R244 VanDerWaalsContact C-N 3.32Å; R242-R244 PolarHBondContact O-N 3.21Å; R244-R248 WeakPolarHBondContact O-CG 3.48Å; R244-R248 VanDerWaalsContact O-CZ 3.31Å; R244-R248 PolarHBondContact O-N 2.99Å; R244-R248 PolarHBondContact O-NE 3.4Å; R244-R248 PolarHBondContact O-NH2 3.25Å
245	R	90.2	Very high	93.3	Very high	114 Å²	114	69 Å²	69	43%	0.43	31%	0.312	S	S	.	.	H	α-helix	trans	-75.5	-45	172.6	-77.4	-175	-71.9	104.8	-7.8	111.1	A241 R242 L243 R248 Q249	A241-R245 WeakPolarHBondContact O-CG 3.42Å; A241-R245 PolarHBondContact O-N 2.9Å; R242-R245 WeakPolarHBondContact O-CA 3.09Å; R242-R245 WeakPolarHBondContact O-CB 3.09Å; R242-R245 PolarHBondContact O-N 3.22Å; L243-R245 VanDerWaalsContact C-N 3.28Å; L243-R245 PolarHBondContact O-N 3.49Å; R245-R248 PolarHBondContact O-N 2.98Å; R245-Q249 WeakPolarHBondContact O-CB 3.48Å; R245-Q249 PolarHBondContact O-N 3.48Å
246	E	93.4	Very high	93	Very high	43 Å²	43	67.3 Å²	67.3	20%	0.201	30%	0.302	C	S	.	.	H	α-helix	trans	-63	-42.8	178	-66.9	171.8	-155.7	0	0	112.5	K170 R242 L243 Q249 V250	K170-E246 HydrophobicContact CD-CB 3.97Å; K170-E246 IonicContact NZ-OE2 3.18Å; K170-E246 PolarHBondContact NZ-OE2 2.67Å; R242-E246 WeakPolarHBondContact CD-OE1 3.27Å; R242-E246 VanDerWaalsContact CG-OE1 3.25Å; R242-E246 WeakPolarHBondContact CG-OE1 3.48Å; R242-E246 IonicContact NE-OE1 3.19Å; R242-E246 PolarHBondContact O-N 3.15Å; L243-E246 PolarHBondContact O-N 2.97Å; E246-Q249 WeakPolarHBondContact O-CB 3.46Å; E246-Q249 PolarHBondContact O-N 3.14Å; E246-V250 WeakPolarHBondContact O-CG2 3.45Å; E246-V250 PolarHBondContact O-N 3.5Å
247	E	94.8	Very high	92.9	Very high	15 Å²	15	69.4 Å²	69.4	7%	0.07	31%	0.309	C	S	.	.	H	α-helix	trans	-58.3	-52.9	173.6	-180	-176.2	177.7	0	0	110.7	L167 K171 R174 L243 Q249 V250 E251	L167-E247 HydrophobicContact CD1-CG 3.93Å; K171-E247 WeakPolarHBondContact CE-OE1 3.38Å; K171-E247 HydrophobicContact CG-CG 4.13Å; K171-E247 WeakPolarHBondContact CG-OE1 3.44Å; R174-E247 WeakPolarHBondContact CD-OE2 3.3Å; R174-E247 IonicContact CZ-OE1 2.64Å; R174-E247 IonicContact CZ-OE2 3.07Å; R174-E247 IonicContact NE-OE1 2.69Å; R174-E247 IonicContact NE-OE2 3.96Å; R174-E247 PolarHBondContact NE-OE2 2.87Å; R174-E247 IonicContact NH2-OE1 3.25Å; R174-E247 PolarHBondContact NH2-OE1 3.35Å; R174-E247 VanDerWaalsContact NH2-OE1 3.11Å; R174-E247 IonicContact NH2-OE2 2.89Å; L243-E247 WeakPolarHBondContact O-CB 3.23Å; L243-E247 PolarHBondContact O-N 3.38Å; E247-Q249 VanDerWaalsContact C-N 3.28Å; E247-Q249 PolarHBondContact O-N 2.96Å; E247-V250 PolarHBondContact O-N 3.09Å; E247-V250 VanDerWaalsContact O-N 3.13Å; E247-E251 WeakPolarHBondContact O-CG 3.29Å; E247-E251 PolarHBondContact O-N 3.38Å
248	R	91.6	Very high	92.8	Very high	139 Å²	139	65.9 Å²	65.9	53%	0.525	30%	0.299	S	S	.	.	H	α-helix	trans	-59.8	-36.3	176.8	-80.6	-179.4	-78.8	124.4	-10.6	112.7	R244 R245 C252	R244-R248 WeakPolarHBondContact O-CG 3.48Å; R244-R248 VanDerWaalsContact O-CZ 3.31Å; R244-R248 PolarHBondContact O-N 2.99Å; R244-R248 PolarHBondContact O-NE 3.4Å; R244-R248 PolarHBondContact O-NH2 3.25Å; R245-R248 PolarHBondContact O-N 2.98Å; R248-C252 WeakPolarHBondContact O-CB 3.41Å; R248-C252 PolarHBondContact O-N 3.45Å; R248-C252 PolarHBondContact O-SG 3.35Å; R248-C252 VanDerWaalsContact O-SG 3.34Å
249	Q	92.8	Very high	92.5	Very high	94 Å²	94	63.4 Å²	63.4	44%	0.439	28%	0.283	S	S	.	.	H	α-helix	trans	-62.8	-48.9	174.1	-177.6	-172.4	-28.5	0	0	110.9	R245 E246 E247 C252 E253	R245-Q249 WeakPolarHBondContact O-CB 3.48Å; R245-Q249 PolarHBondContact O-N 3.48Å; E246-Q249 WeakPolarHBondContact O-CB 3.46Å; E246-Q249 PolarHBondContact O-N 3.14Å; E247-Q249 VanDerWaalsContact C-N 3.28Å; E247-Q249 PolarHBondContact O-N 2.96Å; Q249-C252 PolarHBondContact O-N 2.96Å; Q249-E253 PolarHBondContact NE2-OE1 3.16Å; Q249-E253 WeakPolarHBondContact O-CG 3.5Å; Q249-E253 PolarHBondContact O-N 2.95Å
250	V	94.3	Very high	92.2	Very high	10 Å²	10	62.4 Å²	62.4	6%	0.061	29%	0.288	C	S	.	.	H	α-helix	trans	-66.3	-37.7	179.5	177.6	0	0	0	0	111.4	K163 I166 L167 K170 E246 E247 C252 E253 L254	K163-V250 HydrophobicContact CD-CG1 4.49Å; I166-V250 HydrophobicContact CG2-CG1 4.2Å; I166-V250 HydrophobicContact CG2-CG2 4.15Å; L167-V250 HydrophobicContact CB-CG1 3.93Å; K170-V250 HydrophobicContact CD-CG2 4.04Å; E246-V250 WeakPolarHBondContact O-CG2 3.45Å; E246-V250 PolarHBondContact O-N 3.5Å; E247-V250 PolarHBondContact O-N 3.09Å; E247-V250 VanDerWaalsContact O-N 3.13Å; V250-C252 VanDerWaalsContact C-N 3.33Å; V250-C252 PolarHBondContact O-N 3.3Å; V250-E253 PolarHBondContact O-N 2.89Å; V250-L254 VanDerWaalsContact O-CB 3.24Å; V250-L254 WeakPolarHBondContact O-CB 3.12Å; V250-L254 PolarHBondContact O-N 3.27Å
251	E	94.8	Very high	91.9	Very high	53 Å²	53	65 Å²	65	25%	0.248	30%	0.298	C	S	.	.	H	α-helix	trans	-60.7	-41.7	172.1	-70.2	-164.7	151.3	0	0	112.4	L167 K171 E247 K255	L167-E251 HydrophobicContact CD1-CG 3.38Å; L167-E251 HydrophobicContact CD2-CG 3.78Å; L167-E251 HydrophobicContact CG-CG 4.23Å; K171-E251 VanDerWaalsContact CE-OE1 3.26Å; K171-E251 WeakPolarHBondContact CE-OE1 3.45Å; K171-E251 IonicContact NZ-OE1 3.76Å; K171-E251 PolarHBondContact NZ-OE1 3.22Å; E247-E251 WeakPolarHBondContact O-CG 3.29Å; E247-E251 PolarHBondContact O-N 3.38Å; E251-K255 WeakPolarHBondContact O-CB 3.49Å; E251-K255 VanDerWaalsContact O-CG 3.31Å; E251-K255 WeakPolarHBondContact O-CG 3.42Å; E251-K255 PolarHBondContact O-N 3.08Å
252	C	89.5	Confident	91.8	Very high	64 Å²	64	66.4 Å²	66.4	43%	0.432	30%	0.299	S	S	.	.	H	α-helix	trans	-66.4	-45.1	174.2	-76.1	0	0	0	0	111.6	R248 Q249 V250 L254 K255 H256	R248-C252 WeakPolarHBondContact O-CB 3.41Å; R248-C252 PolarHBondContact O-N 3.45Å; R248-C252 PolarHBondContact O-SG 3.35Å; R248-C252 VanDerWaalsContact O-SG 3.34Å; Q249-C252 PolarHBondContact O-N 2.96Å; V250-C252 VanDerWaalsContact C-N 3.33Å; V250-C252 PolarHBondContact O-N 3.3Å; C252-L254 VanDerWaalsContact C-N 3.32Å; C252-L254 PolarHBondContact O-N 2.84Å; C252-K255 PolarHBondContact O-N 2.92Å; C252-H256 WeakPolarHBondContact O-CB 3.36Å; C252-H256 PolarHBondContact O-N 2.92Å; C252-H256 PolarHBondContact O-ND1 2.86Å
253	E	90.7	Very high	91.3	Very high	41 Å²	41	62.6 Å²	62.6	19%	0.192	29%	0.288	C	S	.	.	H	α-helix	trans	-58.1	-44.5	175	-75.6	179.1	-158.5	0	0	111.4	K163 Q249 V250 H256 K257	K163-E253 WeakPolarHBondContact CE-OE2 3.32Å; K163-E253 IonicContact NZ-OE2 2.73Å; K163-E253 PolarHBondContact NZ-OE2 3.26Å; Q249-E253 PolarHBondContact NE2-OE1 3.16Å; Q249-E253 WeakPolarHBondContact O-CG 3.5Å; Q249-E253 PolarHBondContact O-N 2.95Å; V250-E253 PolarHBondContact O-N 2.89Å; E253-H256 PolarHBondContact O-N 3.2Å; E253-K257 PolarHBondContact O-N 2.85Å
254	L	93.9	Very high	90.8	Very high	27 Å²	27	64.8 Å²	64.8	14%	0.141	30%	0.3	C	S	.	.	H	α-helix	trans	-61.9	-49.3	177.9	-173.3	74.1	0	0	0	111.7	M160 K163 E164 L167 V250 C252 H256 K257 Q258	M160-L254 HydrophobicContact CE-CD1 3.33Å; M160-L254 HydrophobicContact CE-CG 3.82Å; M160-L254 HydrophobicContact SD-CD1 3.63Å; M160-L254 HydrophobicContact SD-CG 4.41Å; K163-L254 HydrophobicContact CB-CD1 3.7Å; E164-L254 HydrophobicContact CG-CD1 3.66Å; E164-L254 HydrophobicContact CG-CD2 4Å; E164-L254 HydrophobicContact CG-CG 4.47Å; L167-L254 HydrophobicContact CD2-CD2 3.91Å; V250-L254 VanDerWaalsContact O-CB 3.24Å; V250-L254 WeakPolarHBondContact O-CB 3.12Å; V250-L254 PolarHBondContact O-N 3.27Å; C252-L254 VanDerWaalsContact C-N 3.32Å; C252-L254 PolarHBondContact O-N 2.84Å; L254-H256 VanDerWaalsContact C-N 3.27Å; L254-H256 PolarHBondContact O-N 3.01Å; L254-K257 PolarHBondContact O-N 3.07Å; L254-Q258 WeakPolarHBondContact O-CB 3.45Å; L254-Q258 PolarHBondContact O-N 2.82Å
255	K	90.9	Very high	90.6	Very high	130 Å²	130	61.1 Å²	61.1	57%	0.565	29%	0.29	S	S	*	.	H	α-helix	trans	-59.1	-37.9	175.8	-75.1	172.9	-178.8	176.2	0	112.3	E251 C252 R259	E251-K255 WeakPolarHBondContact O-CB 3.49Å; E251-K255 VanDerWaalsContact O-CG 3.31Å; E251-K255 WeakPolarHBondContact O-CG 3.42Å; E251-K255 PolarHBondContact O-N 3.08Å; C252-K255 PolarHBondContact O-N 2.92Å; K255-R259 WeakPolarHBondContact O-CB 3.24Å; K255-R259 VanDerWaalsContact O-CG 3.3Å; K255-R259 WeakPolarHBondContact O-CG 3.48Å; K255-R259 PolarHBondContact O-N 2.81Å
256	H	87.7	Confident	90.5	Very high	76 Å²	76	59.5 Å²	59.5	35%	0.352	29%	0.288	S	S	.	.	H	α-helix	trans	-70.5	-42.7	177.4	-74.5	112.8	0	0	0	113	C252 E253 L254 G260 R1070	C252-H256 WeakPolarHBondContact O-CB 3.36Å; C252-H256 PolarHBondContact O-N 2.92Å; C252-H256 PolarHBondContact O-ND1 2.86Å; E253-H256 PolarHBondContact O-N 3.2Å; L254-H256 VanDerWaalsContact C-N 3.27Å; L254-H256 PolarHBondContact O-N 3.01Å; H256-G260 PolarHBondContact O-N 3.26Å; H256-R1070 PolarHBondContact CD2-NH2 3.19Å; H256-R1070 PolarHBondContact NE2-NH2 2.95Å
257	K	89.4	Confident	89.9	Confident	57 Å²	57	57.7 Å²	57.7	25%	0.248	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-40.4	174.2	-74.3	-165.6	-174.7	-164.1	0	111.3	Q159 M160 K163 E253 L254 G260 Y261 D407	Q159-K257 HydrophobicContact CB-CD 4.41Å; M160-K257 HydrophobicContact CG-CB 4.19Å; M160-K257 HydrophobicContact SD-CB 3.24Å; M160-K257 WeakPolarHBondContact SD-CB 3.38Å; M160-K257 HydrophobicContact SD-CD 4.41Å; M160-K257 HydrophobicContact SD-CG 4.43Å; K163-K257 HydrophobicContact CG-CD 4.41Å; E253-K257 PolarHBondContact O-N 2.85Å; L254-K257 PolarHBondContact O-N 3.07Å; K257-G260 PolarHBondContact O-N 3.14Å; K257-Y261 WeakPolarHBondContact O-CB 3.47Å; K257-Y261 PolarHBondContact O-N 2.81Å; K257-D407 IonicContact NZ-OD2 2.82Å; K257-D407 PolarHBondContact NZ-OD2 2.65Å
258	Q	92.8	Very high	89.5	Confident	70 Å²	70	59.5 Å²	59.5	33%	0.327	29%	0.287	S	S	.	.	H	α-helix	trans	-58.3	-54.5	174.3	-176.6	59	47.6	0	0	111.4	M160 L254 G260 Y261 D262	M160-Q258 HydrophobicContact CE-CB 3.61Å; M160-Q258 HydrophobicContact CE-CG 4.38Å; M160-Q258 VanDerWaalsContact CE-OE1 3.28Å; M160-Q258 HydrophobicContact SD-CB 4.48Å; M160-Q258 PolarHBondContact SD-N 3.03Å; L254-Q258 WeakPolarHBondContact O-CB 3.45Å; L254-Q258 PolarHBondContact O-N 2.82Å; Q258-G260 VanDerWaalsContact C-N 3.26Å; Q258-G260 PolarHBondContact O-N 3.37Å; Q258-Y261 WeakPolarHBondContact O-CB 3.41Å; Q258-Y261 PolarHBondContact O-N 3.21Å; Q258-Y261 VanDerWaalsContact O-N 3.1Å; Q258-D262 WeakPolarHBondContact CG-OD2 3.44Å; Q258-D262 PolarHBondContact NE2-OD1 3.47Å; Q258-D262 PolarHBondContact NE2-OD2 2.84Å; Q258-D262 VanDerWaalsContact O-CG 3.27Å; Q258-D262 PolarHBondContact O-N 3.36Å
259	R	87.6	Confident	89.1	Confident	88 Å²	88	57 Å²	57	33%	0.332	28%	0.284	S	S	.	.	H	α-helix	trans	-56.5	-41.3	177	-72.1	174.8	-179.3	-152.7	1.4	111.7	K255 D262 T263 E1069	K255-R259 WeakPolarHBondContact O-CB 3.24Å; K255-R259 VanDerWaalsContact O-CG 3.3Å; K255-R259 WeakPolarHBondContact O-CG 3.48Å; K255-R259 PolarHBondContact O-N 2.81Å; R259-D262 PolarHBondContact O-N 2.92Å; R259-T263 WeakPolarHBondContact O-CG2 3.45Å; R259-T263 PolarHBondContact O-N 3.35Å; R259-T263 PolarHBondContact O-OG1 2.91Å; R259-E1069 IonicContact CZ-OE1 2.76Å; R259-E1069 IonicContact CZ-OE2 2.75Å; R259-E1069 IonicContact NH1-OE1 2.86Å; R259-E1069 PolarHBondContact NH1-OE1 3.12Å; R259-E1069 IonicContact NH1-OE2 3.4Å; R259-E1069 PolarHBondContact NH1-OE2 3.46Å; R259-E1069 IonicContact NH2-OE1 3.77Å; R259-E1069 PolarHBondContact NH2-OE1 3.11Å
260	G	87.4	Confident	88.5	Confident	27 Å²	27	56.4 Å²	56.4	28%	0.278	28%	0.278	S	S	.	.	H	α-helix	trans	-61.8	-45.1	175.5	0	0	0	0	0	113.1	H256 K257 Q258 T263 L264	H256-G260 PolarHBondContact O-N 3.26Å; K257-G260 PolarHBondContact O-N 3.14Å; Q258-G260 VanDerWaalsContact C-N 3.26Å; Q258-G260 PolarHBondContact O-N 3.37Å; G260-T263 WeakPolarHBondContact CA-OG1 3.37Å; G260-T263 PolarHBondContact O-N 3.06Å; G260-T263 PolarHBondContact O-OG1 3.05Å; G260-L264 WeakPolarHBondContact O-CG 3.25Å; G260-L264 PolarHBondContact O-N 2.9Å; G260-L264 VanDerWaalsContact O-N 3.08Å
261	Y	91.2	Very high	87.5	Confident	59 Å²	59	58.3 Å²	58.3	23%	0.231	29%	0.289	C	S	.	.	H	α-helix	trans	-60.6	-49.2	174	177	-87.4	0	0	0	111.2	L153 A156 Q157 K257 Q258 T263 L264 A265	L153-Y261 HydrophobicContact CB-CE2 4.14Å; L153-Y261 HydrophobicContact CD2-CD2 3.65Å; L153-Y261 HydrophobicContact CD2-CE2 3.71Å; L153-Y261 HydrophobicContact CD2-CG 4.29Å; L153-Y261 WeakPolarHBondContact O-CE2 3.15Å; A156-Y261 HydrophobicContact CB-CD2 4.19Å; Q157-Y261 HydrophobicContact CB-CE2 4.06Å; K257-Y261 WeakPolarHBondContact O-CB 3.47Å; K257-Y261 PolarHBondContact O-N 2.81Å; Q258-Y261 WeakPolarHBondContact O-CB 3.41Å; Q258-Y261 PolarHBondContact O-N 3.21Å; Q258-Y261 VanDerWaalsContact O-N 3.1Å; Y261-T263 VanDerWaalsContact C-N 3.34Å; Y261-T263 PolarHBondContact O-N 2.91Å; Y261-L264 PolarHBondContact O-N 3.06Å; Y261-L264 VanDerWaalsContact O-N 3.13Å; Y261-A265 HydrophobicContact CE1-CB 4.39Å; Y261-A265 WeakPolarHBondContact O-CB 3.46Å; Y261-A265 PolarHBondContact O-N 2.95Å
262	D	90.2	Very high	86.6	Confident	76 Å²	76	59.1 Å²	59.1	41%	0.406	30%	0.301	S	S	.	.	H	α-helix	trans	-60.4	-43	179.8	-64.8	-32.4	0	0	0	111.5	Q258 R259 L264 A265 E266	Q258-D262 WeakPolarHBondContact CG-OD2 3.44Å; Q258-D262 PolarHBondContact NE2-OD1 3.47Å; Q258-D262 PolarHBondContact NE2-OD2 2.84Å; Q258-D262 VanDerWaalsContact O-CG 3.27Å; Q258-D262 PolarHBondContact O-N 3.36Å; R259-D262 PolarHBondContact O-N 2.92Å; D262-L264 VanDerWaalsContact C-N 3.34Å; D262-L264 PolarHBondContact O-N 3.45Å; D262-A265 PolarHBondContact O-N 3Å; D262-E266 WeakPolarHBondContact O-CB 3.11Å; D262-E266 PolarHBondContact O-N 3.01Å
263	T	85.1	Confident	85.9	Confident	32 Å²	32	60.7 Å²	60.7	20%	0.196	31%	0.312	C	S	.	.	H	α-helix	trans	-62.8	-38.2	175.3	48.7	0	0	0	0	113.1	R259 G260 Y261 I267 Q1062	R259-T263 WeakPolarHBondContact O-CG2 3.45Å; R259-T263 PolarHBondContact O-N 3.35Å; R259-T263 PolarHBondContact O-OG1 2.91Å; G260-T263 WeakPolarHBondContact CA-OG1 3.37Å; G260-T263 PolarHBondContact O-N 3.06Å; G260-T263 PolarHBondContact O-OG1 3.05Å; Y261-T263 VanDerWaalsContact C-N 3.34Å; Y261-T263 PolarHBondContact O-N 2.91Å; T263-I267 WeakPolarHBondContact O-CB 3.43Å; T263-I267 WeakPolarHBondContact O-CD1 3.49Å; T263-I267 VanDerWaalsContact O-CG1 3.23Å; T263-I267 WeakPolarHBondContact O-CG1 3.21Å; T263-I267 PolarHBondContact O-N 3.02Å; T263-Q1062 HydrophobicContact CG2-CG 4.3Å
264	L	85	Confident	85	Confident	48 Å²	48	61.1 Å²	61.1	25%	0.251	32%	0.316	S	S	.	.	H	α-helix	trans	-77.4	-31.9	179	-72.4	170.3	0	0	0	112.5	Y152 L153 G260 Y261 D262 K268	Y152-L264 HydrophobicContact CD1-CD1 3.74Å; Y152-L264 HydrophobicContact CE1-CD1 3.41Å; Y152-L264 VanDerWaalsContact CE1-CD1 3.41Å; L153-L264 HydrophobicContact CD2-CB 3.75Å; G260-L264 WeakPolarHBondContact O-CG 3.25Å; G260-L264 PolarHBondContact O-N 2.9Å; G260-L264 VanDerWaalsContact O-N 3.08Å; Y261-L264 PolarHBondContact O-N 3.06Å; Y261-L264 VanDerWaalsContact O-N 3.13Å; D262-L264 VanDerWaalsContact C-N 3.34Å; D262-L264 PolarHBondContact O-N 3.45Å; L264-K268 WeakPolarHBondContact O-CB 3.44Å; L264-K268 PolarHBondContact O-N 3.04Å
265	A	89.9	Confident	83.6	Confident	21 Å²	21	64 Å²	64	17%	0.174	34%	0.337	C	S	.	.	H	α-helix	trans	-66.6	-45.4	171.3	0	0	0	0	0	110.8	L153 Y261 D262 I267 K268 D269	L153-A265 HydrophobicContact CD2-CB 4.46Å; Y261-A265 HydrophobicContact CE1-CB 4.39Å; Y261-A265 WeakPolarHBondContact O-CB 3.46Å; Y261-A265 PolarHBondContact O-N 2.95Å; D262-A265 PolarHBondContact O-N 3Å; A265-I267 VanDerWaalsContact C-N 3.35Å; A265-I267 PolarHBondContact O-N 2.85Å; A265-K268 PolarHBondContact O-N 3.36Å; A265-D269 PolarHBondContact O-N 3.28Å
266	E	87.5	Confident	82.4	Confident	80 Å²	80	66.6 Å²	66.6	37%	0.374	35%	0.351	S	S	.	.	H	α-helix	trans	-57.4	-47.4	172.8	-168.7	-165.8	-172.7	0	0	111	D262 D269 R270 Q1062	D262-E266 WeakPolarHBondContact O-CB 3.11Å; D262-E266 PolarHBondContact O-N 3.01Å; E266-D269 PolarHBondContact O-N 2.78Å; E266-R270 WeakPolarHBondContact O-CB 3.38Å; E266-R270 WeakPolarHBondContact O-CG 3.17Å; E266-R270 PolarHBondContact O-N 2.81Å; E266-R270 IonicContact OE1-CZ 2.73Å; E266-R270 VanDerWaalsContact OE1-CZ 3.28Å; E266-R270 IonicContact OE1-NE 3.51Å; E266-R270 PolarHBondContact OE1-NE 3.07Å; E266-R270 VanDerWaalsContact OE1-NE 3.11Å; E266-R270 IonicContact OE1-NH2 3.89Å; E266-R270 PolarHBondContact OE1-NH2 2.82Å; E266-R270 IonicContact OE2-NH2 3.38Å; E266-Q1062 PolarHBondContact OE2-NE2 2.74Å
267	I	81.6	Confident	81.4	Confident	4 Å²	4	64 Å²	64	2%	0.021	35%	0.345	C	S	.	.	H	α-helix	trans	-60	-46.3	176.2	-78.6	167.6	0	0	0	111.8	T263 A265 D269 R270 V271 L1055 V1059	T263-I267 WeakPolarHBondContact O-CB 3.43Å; T263-I267 WeakPolarHBondContact O-CD1 3.49Å; T263-I267 VanDerWaalsContact O-CG1 3.23Å; T263-I267 WeakPolarHBondContact O-CG1 3.21Å; T263-I267 PolarHBondContact O-N 3.02Å; A265-I267 VanDerWaalsContact C-N 3.35Å; A265-I267 PolarHBondContact O-N 2.85Å; I267-D269 VanDerWaalsContact C-N 3.29Å; I267-D269 PolarHBondContact O-N 3.41Å; I267-R270 WeakPolarHBondContact O-CB 3.42Å; I267-R270 PolarHBondContact O-N 3.13Å; I267-V271 HydrophobicContact CG2-CG2 4.43Å; I267-V271 WeakPolarHBondContact O-CB 3.45Å; I267-V271 VanDerWaalsContact O-CG2 3.31Å; I267-V271 WeakPolarHBondContact O-CG2 3.28Å; I267-V271 PolarHBondContact O-N 3.48Å; I267-L1055 HydrophobicContact CD1-CD1 4.18Å; I267-L1055 HydrophobicContact CG2-CD1 3.32Å; I267-V1059 HydrophobicContact CD1-CG2 3.7Å
268	K	85.3	Confident	80.4	Confident	53 Å²	53	64.3 Å²	64.3	23%	0.23	35%	0.345	C	S	.	.	H	α-helix	trans	-57.4	-44.9	177.4	173.8	-172.9	136.5	-74	0	111	I149 R150 L153 L264 A265 V271 S272	I149-K268 HydrophobicContact CG2-CB 4.11Å; I149-K268 HydrophobicContact CG2-CG 4.42Å; R150-K268 HydrophobicContact CG-CD 4.33Å; L153-K268 HydrophobicContact CD1-CB 4.2Å; L153-K268 HydrophobicContact CD1-CD 3.58Å; L153-K268 HydrophobicContact CD1-CG 4.48Å; L264-K268 WeakPolarHBondContact O-CB 3.44Å; L264-K268 PolarHBondContact O-N 3.04Å; A265-K268 PolarHBondContact O-N 3.36Å; K268-V271 PolarHBondContact O-N 3.42Å; K268-S272 WeakPolarHBondContact O-CB 2.98Å; K268-S272 PolarHBondContact O-N 3.49Å; K268-S272 PolarHBondContact O-OG 3.04Å
269	D	83.9	Confident	79.6	Confident	88 Å²	88	64.9 Å²	64.9	47%	0.471	35%	0.353	S	S	.	.	H	α-helix	trans	-72.9	-36.4	-177.6	-67.6	-11.1	0	0	0	111.2	A265 E266 I267 S272 S273	A265-D269 PolarHBondContact O-N 3.28Å; E266-D269 PolarHBondContact O-N 2.78Å; I267-D269 VanDerWaalsContact C-N 3.29Å; I267-D269 PolarHBondContact O-N 3.41Å; D269-S272 PolarHBondContact O-N 2.89Å; D269-S273 VanDerWaalsContact O-CB 3.3Å; D269-S273 WeakPolarHBondContact O-CB 3.15Å; D269-S273 PolarHBondContact O-N 3.43Å; D269-S273 PolarHBondContact O-OG 3.31Å
270	R	79.4	Confident	79	Confident	81 Å²	81	63.7 Å²	63.7	31%	0.306	36%	0.362	S	S	.	.	H	α-helix	trans	-58.1	-52.2	169.1	-74	167.2	174.9	-130.8	1	111.8	E266 I267 S272 S273 N274 D1058	E266-R270 WeakPolarHBondContact O-CB 3.38Å; E266-R270 WeakPolarHBondContact O-CG 3.17Å; E266-R270 PolarHBondContact O-N 2.81Å; E266-R270 IonicContact OE1-CZ 2.73Å; E266-R270 VanDerWaalsContact OE1-CZ 3.28Å; E266-R270 IonicContact OE1-NE 3.51Å; E266-R270 PolarHBondContact OE1-NE 3.07Å; E266-R270 VanDerWaalsContact OE1-NE 3.11Å; E266-R270 IonicContact OE1-NH2 3.89Å; E266-R270 PolarHBondContact OE1-NH2 2.82Å; E266-R270 IonicContact OE2-NH2 3.38Å; I267-R270 WeakPolarHBondContact O-CB 3.42Å; I267-R270 PolarHBondContact O-N 3.13Å; R270-S272 VanDerWaalsContact C-N 3.31Å; R270-S272 PolarHBondContact O-N 2.98Å; R270-S273 PolarHBondContact O-N 2.83Å; R270-S273 VanDerWaalsContact O-N 3.11Å; R270-S273 PolarHBondContact O-OG 3.19Å; R270-N274 PolarHBondContact O-N 3.1Å; R270-D1058 WeakPolarHBondContact CD-OD2 3.4Å; R270-D1058 IonicContact CZ-OD2 3.85Å; R270-D1058 IonicContact NE-OD2 2.76Å; R270-D1058 IonicContact NH1-OD1 2.74Å; R270-D1058 PolarHBondContact NH1-OD1 3.33Å; R270-D1058 IonicContact NH1-OD2 3.15Å; R270-D1058 PolarHBondContact NH1-OD2 2.94Å
271	V	74.3	Confident	78.7	Confident	50 Å²	50	66.8 Å²	66.8	30%	0.303	38%	0.379	S	S	.	.	H	α-helix	trans	-59.9	-40.5	177.5	170.8	0	0	0	0	111.4	I267 K268 S273 N274	I267-V271 HydrophobicContact CG2-CG2 4.43Å; I267-V271 WeakPolarHBondContact O-CB 3.45Å; I267-V271 VanDerWaalsContact O-CG2 3.31Å; I267-V271 WeakPolarHBondContact O-CG2 3.28Å; I267-V271 PolarHBondContact O-N 3.48Å; K268-V271 PolarHBondContact O-N 3.42Å; V271-S273 VanDerWaalsContact C-N 3.33Å; V271-S273 PolarHBondContact O-N 3.38Å; V271-N274 CarbonylContact O-C 3.5Å
272	S	75.3	Confident	78.2	Confident	70 Å²	70	67.8 Å²	67.8	49%	0.49	39%	0.386	S	S	.	.	H	α-helix	trans	-66.4	-34	175.9	-56.2	0	0	0	0	112.6	K268 D269 R270	K268-S272 WeakPolarHBondContact O-CB 2.98Å; K268-S272 PolarHBondContact O-N 3.49Å; K268-S272 PolarHBondContact O-OG 3.04Å; D269-S272 PolarHBondContact O-N 2.89Å; R270-S272 VanDerWaalsContact C-N 3.31Å; R270-S272 PolarHBondContact O-N 2.98Å
273	S	75.7	Confident	77.4	Confident	96 Å²	96	66.9 Å²	66.9	67%	0.671	38%	0.384	S	S	*	.	H	α-helix	trans	-81.3	-28	-178.9	73	0	0	0	0	114.3	D269 R270 V271	D269-S273 VanDerWaalsContact O-CB 3.3Å; D269-S273 WeakPolarHBondContact O-CB 3.15Å; D269-S273 PolarHBondContact O-N 3.43Å; D269-S273 PolarHBondContact O-OG 3.31Å; R270-S273 PolarHBondContact O-N 2.83Å; R270-S273 VanDerWaalsContact O-N 3.11Å; R270-S273 PolarHBondContact O-OG 3.19Å; V271-S273 VanDerWaalsContact C-N 3.33Å; V271-S273 PolarHBondContact O-N 3.38Å
274	N	70.9	Confident	77.2	Confident	51 Å²	51	73.8 Å²	73.8	27%	0.273	41%	0.407	S	S	.	.			trans	-130.9	85.4	-178.2	-175.4	-0.6	0	0	0	111.6	R270 V271 E276 G277	R270-N274 PolarHBondContact O-N 3.1Å; V271-N274 CarbonylContact O-C 3.5Å; N274-E276 VanDerWaalsContact C-N 3.32Å; N274-E276 PolarHBondContact O-N 3.48Å; N274-E276 PolarHBondContact OD1-N 2.96Å; N274-G277 PolarHBondContact ND2-O 3.18Å; N274-G277 PolarHBondContact OD1-N 3.49Å; N274-G277 PolarHBondContact OD1-O 2.91Å
275	P	64.3	Low	77.2	Confident	88 Å²	88	74 Å²	74	57%	0.571	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-15.1	-177.9	30.5	-36.1	0	0	0	114.4
276	E	65.1	Low	76.9	Confident	184 Å²	184	74.2 Å²	74.2	86%	0.86	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-11.7	180	-62	-167.6	162.6	0	0	112.8	N274	N274-E276 VanDerWaalsContact C-N 3.32Å; N274-E276 PolarHBondContact O-N 3.48Å; N274-E276 PolarHBondContact OD1-N 2.96Å
277	G	66.8	Low	76.6	Confident	22 Å²	22	73.1 Å²	73.1	23%	0.227	42%	0.419	C	S	.	.			trans	86	-174.4	-176.9	0	0	0	0	0	112.9	N274 T279	N274-G277 PolarHBondContact ND2-O 3.18Å; N274-G277 PolarHBondContact OD1-N 3.49Å; N274-G277 PolarHBondContact OD1-O 2.91Å; G277-T279 PolarHBondContact O-N 2.88Å
278	Y	69.9	Low	76.8	Confident	63 Å²	63	82.6 Å²	82.6	25%	0.247	45%	0.454	C	S	.	.			trans	-66.8	130.5	-173.9	-61	-50	0	0	0	113	E282 T283 L286 S1054 I1057 D1058	Y278-E282 WeakPolarHBondContact CA-OE2 3.47Å; Y278-E282 HydrophobicContact CD1-CB 4.42Å; Y278-T283 HydrophobicContact CD2-CG2 4.34Å; Y278-T283 HydrophobicContact CG-CG2 4.33Å; Y278-L286 HydrophobicContact CD1-CD1 4.03Å; Y278-L286 HydrophobicContact CD2-CD1 3.76Å; Y278-L286 HydrophobicContact CE1-CD1 4.02Å; Y278-L286 HydrophobicContact CE2-CD1 3.69Å; Y278-L286 HydrophobicContact CG-CD1 3.96Å; Y278-S1054 WeakPolarHBondContact CE2-O 3.02Å; Y278-S1054 PolarHBondContact OH-O 3.14Å; Y278-I1057 HydrophobicContact CE2-CB 4.28Å; Y278-I1057 HydrophobicContact CE2-CG2 4.47Å; Y278-D1058 WeakPolarHBondContact OH-CB 3.38Å; Y278-D1058 PolarHBondContact OH-OD1 3.17Å; Y278-D1058 PolarHBondContact OH-OD2 2.9Å
279	T	75.5	Confident	77.1	Confident	82 Å²	82	82.8 Å²	82.8	50%	0.503	46%	0.456	S	S	.	.			trans	-60.2	148.3	165.2	-53.6	0	0	0	0	109.6	G277 S281 E282 T283	G277-T279 PolarHBondContact O-N 2.88Å; T279-S281 PolarHBondContact O-N 2.78Å; T279-S281 VanDerWaalsContact O-N 3.12Å; T279-E282 WeakPolarHBondContact CB-OE2 3.41Å; T279-E282 PolarHBondContact N-OE2 3.13Å; T279-E282 WeakPolarHBondContact O-CA 3.39Å; T279-E282 WeakPolarHBondContact O-CB 3.39Å; T279-E282 PolarHBondContact O-N 3.43Å; T279-E282 PolarHBondContact OG1-OE2 3.07Å; T279-T283 PolarHBondContact O-N 3.37Å
280	A	74.7	Confident	77.2	Confident	63 Å²	63	81.4 Å²	81.4	52%	0.521	45%	0.446	S	S	.	.	H	α-helix	trans	-51.7	-39.5	177.3	0	0	0	0	0	112.9	E282 T283 Y284	A280-E282 VanDerWaalsContact C-N 3.33Å; A280-E282 PolarHBondContact O-N 3.22Å; A280-T283 PolarHBondContact O-N 3.16Å; A280-T283 PolarHBondContact O-OG1 3.42Å; A280-Y284 WeakPolarHBondContact O-CD2 3.41Å; A280-Y284 PolarHBondContact O-N 3.19Å; A280-Y284 VanDerWaalsContact O-N 3.08Å
281	S	80.8	Confident	77.6	Confident	91 Å²	91	82.8 Å²	82.8	64%	0.636	46%	0.456	S	S	*	.	H	α-helix	trans	-62.3	-36.5	175.4	-57.5	0	0	0	0	113.6	T279 A285	T279-S281 PolarHBondContact O-N 2.78Å; T279-S281 VanDerWaalsContact O-N 3.12Å; S281-A285 PolarHBondContact O-N 3.32Å; S281-A285 VanDerWaalsContact O-N 3.1Å
282	E	80.3	Confident	78.5	Confident	80 Å²	80	86.1 Å²	86.1	37%	0.374	47%	0.468	S	S	.	.	H	α-helix	trans	-70.4	-43.9	176.5	-62.6	171.2	145.1	0	0	110.1	Y278 T279 A280 Y284 A285 L286	Y278-E282 WeakPolarHBondContact CA-OE2 3.47Å; Y278-E282 HydrophobicContact CD1-CB 4.42Å; T279-E282 WeakPolarHBondContact CB-OE2 3.41Å; T279-E282 PolarHBondContact N-OE2 3.13Å; T279-E282 WeakPolarHBondContact O-CA 3.39Å; T279-E282 WeakPolarHBondContact O-CB 3.39Å; T279-E282 PolarHBondContact O-N 3.43Å; T279-E282 PolarHBondContact OG1-OE2 3.07Å; A280-E282 VanDerWaalsContact C-N 3.33Å; A280-E282 PolarHBondContact O-N 3.22Å; E282-Y284 VanDerWaalsContact C-N 3.29Å; E282-Y284 PolarHBondContact O-N 2.9Å; E282-A285 WeakPolarHBondContact O-CA 3.48Å; E282-A285 WeakPolarHBondContact O-CB 3.36Å; E282-A285 PolarHBondContact O-N 3.12Å; E282-L286 WeakPolarHBondContact O-CB 3.35Å; E282-L286 VanDerWaalsContact O-CG 3.26Å; E282-L286 WeakPolarHBondContact O-CG 3.31Å; E282-L286 PolarHBondContact O-N 2.99Å
283	T	74.8	Confident	79.2	Confident	58 Å²	58	83.6 Å²	83.6	36%	0.356	45%	0.449	S	S	.	.	H	α-helix	trans	-61.5	-36.3	176.5	67.7	0	0	0	0	112.5	Y278 T279 A280 A287	Y278-T283 HydrophobicContact CD2-CG2 4.34Å; Y278-T283 HydrophobicContact CG-CG2 4.33Å; T279-T283 PolarHBondContact O-N 3.37Å; A280-T283 PolarHBondContact O-N 3.16Å; A280-T283 PolarHBondContact O-OG1 3.42Å; T283-A287 VanDerWaalsContact O-CB 3.27Å; T283-A287 WeakPolarHBondContact O-CB 3.44Å; T283-A287 PolarHBondContact O-N 3.43Å
284	Y	81.2	Confident	79.8	Confident	176 Å²	176	85.9 Å²	85.9	69%	0.69	44%	0.443	S	S	*	.	H	α-helix	trans	-66.6	-36	171.4	-76.3	-61.5	0	0	0	113.4	A280 E282 R288	A280-Y284 WeakPolarHBondContact O-CD2 3.41Å; A280-Y284 PolarHBondContact O-N 3.19Å; A280-Y284 VanDerWaalsContact O-N 3.08Å; E282-Y284 VanDerWaalsContact C-N 3.29Å; E282-Y284 PolarHBondContact O-N 2.9Å; Y284-R288 WeakPolarHBondContact O-CB 3.34Å; Y284-R288 PolarHBondContact O-N 2.87Å; Y284-R288 VanDerWaalsContact O-N 3.08Å
285	A	84.4	Confident	80.8	Confident	54 Å²	54	87.8 Å²	87.8	45%	0.446	46%	0.456	S	S	.	.	H	α-helix	trans	-67.6	-48.1	175.1	0	0	0	0	0	111.4	S281 E282 A287 R288 E289	S281-A285 PolarHBondContact O-N 3.32Å; S281-A285 VanDerWaalsContact O-N 3.1Å; E282-A285 WeakPolarHBondContact O-CA 3.48Å; E282-A285 WeakPolarHBondContact O-CB 3.36Å; E282-A285 PolarHBondContact O-N 3.12Å; A285-A287 VanDerWaalsContact C-N 3.32Å; A285-A287 PolarHBondContact O-N 2.75Å; A285-R288 PolarHBondContact O-N 2.81Å; A285-R288 VanDerWaalsContact O-N 3.17Å; A285-E289 PolarHBondContact O-N 2.85Å
286	L	82.7	Confident	82.2	Confident	24 Å²	24	85 Å²	85	13%	0.126	44%	0.438	C	S	.	.	H	α-helix	trans	-59.3	-40.7	175.9	-65.3	171.6	0	0	0	111.6	Y278 E282 E289 K290 I1057 L1061	Y278-L286 HydrophobicContact CD1-CD1 4.03Å; Y278-L286 HydrophobicContact CD2-CD1 3.76Å; Y278-L286 HydrophobicContact CE1-CD1 4.02Å; Y278-L286 HydrophobicContact CE2-CD1 3.69Å; Y278-L286 HydrophobicContact CG-CD1 3.96Å; E282-L286 WeakPolarHBondContact O-CB 3.35Å; E282-L286 VanDerWaalsContact O-CG 3.26Å; E282-L286 WeakPolarHBondContact O-CG 3.31Å; E282-L286 PolarHBondContact O-N 2.99Å; L286-E289 PolarHBondContact O-N 3.33Å; L286-K290 WeakPolarHBondContact O-CB 3.37Å; L286-K290 PolarHBondContact O-N 2.83Å; L286-I1057 HydrophobicContact CB-CG2 4.35Å; L286-I1057 HydrophobicContact CD1-CG2 4.1Å; L286-L1061 HydrophobicContact CB-CD1 3.92Å; L286-L1061 HydrophobicContact CD2-CD1 3.42Å; L286-L1061 VanDerWaalsContact CD2-CD1 3.42Å; L286-L1061 HydrophobicContact CG-CD1 4.17Å
287	A	81	Confident	83.4	Confident	57 Å²	57	77.2 Å²	77.2	47%	0.471	40%	0.402	S	S	.	.	H	α-helix	trans	-65.4	-40.8	175.2	0	0	0	0	0	112.7	T283 A285 K290 E291	T283-A287 VanDerWaalsContact O-CB 3.27Å; T283-A287 WeakPolarHBondContact O-CB 3.44Å; T283-A287 PolarHBondContact O-N 3.43Å; A285-A287 VanDerWaalsContact C-N 3.32Å; A285-A287 PolarHBondContact O-N 2.75Å; A287-K290 PolarHBondContact O-N 3.45Å; A287-E291 PolarHBondContact O-N 2.76Å; A287-E291 VanDerWaalsContact O-N 3.13Å
288	R	87.5	Confident	84.5	Confident	203 Å²	203	78.4 Å²	78.4	77%	0.766	41%	0.41	S	S	*	.	H	α-helix	trans	-64.6	-40.2	174.4	-176.3	-175.7	-69.5	158.1	-1.8	111.3	Y284 A285 E291 H292	Y284-R288 WeakPolarHBondContact O-CB 3.34Å; Y284-R288 PolarHBondContact O-N 2.87Å; Y284-R288 VanDerWaalsContact O-N 3.08Å; A285-R288 PolarHBondContact O-N 2.81Å; A285-R288 VanDerWaalsContact O-N 3.17Å; R288-E291 PolarHBondContact O-N 3.26Å; R288-H292 PolarHBondContact O-N 2.81Å
289	E	90.4	Very high	85.6	Confident	58 Å²	58	78 Å²	78	27%	0.271	42%	0.42	S	S	.	.	H	α-helix	trans	-65.5	-44.2	176	-161.2	-165.3	149.2	0	0	111.6	A285 L286 E291 H292 L293 L1061 R1065	A285-E289 PolarHBondContact O-N 2.85Å; L286-E289 PolarHBondContact O-N 3.33Å; E289-E291 VanDerWaalsContact C-N 3.25Å; E289-E291 PolarHBondContact O-N 2.88Å; E289-H292 WeakPolarHBondContact O-CB 3.47Å; E289-H292 PolarHBondContact O-N 2.86Å; E289-H292 VanDerWaalsContact O-N 3.13Å; E289-L293 HydrophobicContact CG-CD1 4.3Å; E289-L293 HydrophobicContact CG-CG 4.48Å; E289-L293 WeakPolarHBondContact O-CG 3.2Å; E289-L293 PolarHBondContact O-N 3.13Å; E289-L1061 HydrophobicContact CB-CD2 4.49Å; E289-R1065 IonicContact OE1-CZ 3.81Å; E289-R1065 IonicContact OE1-NE 2.78Å; E289-R1065 PolarHBondContact OE1-NE 3.42Å; E289-R1065 IonicContact OE1-NH2 3.2Å; E289-R1065 PolarHBondContact OE1-NH2 3.04Å; E289-R1065 IonicContact OE2-CZ 3.11Å; E289-R1065 IonicContact OE2-NH2 3.76Å; E289-R1065 PolarHBondContact OE2-NH2 3.47Å
290	K	87.1	Confident	86.5	Confident	58 Å²	58	74.9 Å²	74.9	25%	0.252	40%	0.401	S	S	.	.	H	α-helix	trans	-57.2	-39.2	176.4	-163.4	165.5	-170.8	160	0	111.8	L286 A287 R294 D1060 L1061	L286-K290 WeakPolarHBondContact O-CB 3.37Å; L286-K290 PolarHBondContact O-N 2.83Å; A287-K290 PolarHBondContact O-N 3.45Å; K290-R294 WeakPolarHBondContact O-CG 3.44Å; K290-R294 PolarHBondContact O-N 3.49Å; K290-R294 VanDerWaalsContact O-N 3.14Å; K290-D1060 IonicContact NZ-OD2 2.87Å; K290-D1060 PolarHBondContact NZ-OD2 3.45Å; K290-L1061 HydrophobicContact CB-CD2 3.86Å; K290-L1061 HydrophobicContact CG-CD2 4.3Å
291	E	87.4	Confident	87.1	Confident	111 Å²	111	74.2 Å²	74.2	52%	0.519	39%	0.388	S	S	.	.	H	α-helix	trans	-72.5	-40.9	175.6	-172.1	59.5	-165.2	0	0	112.3	A287 R288 E289 L293 R294 V295	A287-E291 PolarHBondContact O-N 2.76Å; A287-E291 VanDerWaalsContact O-N 3.13Å; R288-E291 PolarHBondContact O-N 3.26Å; E289-E291 VanDerWaalsContact C-N 3.25Å; E289-E291 PolarHBondContact O-N 2.88Å; E291-L293 PolarHBondContact O-N 3.32Å; E291-R294 WeakPolarHBondContact O-CB 3.34Å; E291-R294 PolarHBondContact O-N 3.29Å; E291-R294 VanDerWaalsContact O-N 3.16Å; E291-V295 WeakPolarHBondContact O-CG2 3.31Å; E291-V295 PolarHBondContact O-N 3.32Å
292	H	92	Very high	87.6	Confident	120 Å²	120	75.5 Å²	75.5	56%	0.556	38%	0.384	S	S	*	.	H	α-helix	trans	-57.1	-48.6	172.8	176.3	-98.9	0	0	0	111.7	R288 E289 R294 V295 S296	R288-H292 PolarHBondContact O-N 2.81Å; E289-H292 WeakPolarHBondContact O-CB 3.47Å; E289-H292 PolarHBondContact O-N 2.86Å; E289-H292 VanDerWaalsContact O-N 3.13Å; H292-R294 VanDerWaalsContact C-N 3.28Å; H292-R294 PolarHBondContact O-N 3Å; H292-V295 PolarHBondContact O-N 3.08Å; H292-V295 VanDerWaalsContact O-N 3.09Å; H292-S296 PolarHBondContact O-N 3.27Å; H292-S296 PolarHBondContact O-OG 2.79Å
293	L	91.2	Very high	88.2	Confident	16 Å²	16	76.9 Å²	76.9	8%	0.084	39%	0.386	C	S	.	.	H	α-helix	trans	-61.3	-34	176.7	-68.5	172	0	0	0	112.4	E289 E291 L297 L1061 T1064 R1065 L1068	E289-L293 HydrophobicContact CG-CD1 4.3Å; E289-L293 HydrophobicContact CG-CG 4.48Å; E289-L293 WeakPolarHBondContact O-CG 3.2Å; E289-L293 PolarHBondContact O-N 3.13Å; E291-L293 PolarHBondContact O-N 3.32Å; L293-L297 WeakPolarHBondContact O-CB 3.5Å; L293-L297 PolarHBondContact O-N 3.49Å; L293-L1061 HydrophobicContact CD1-CD2 4.11Å; L293-T1064 WeakPolarHBondContact CD1-OG1 3.17Å; L293-R1065 HydrophobicContact CD1-CG 3.73Å; L293-R1065 HydrophobicContact CD2-CG 4.2Å; L293-L1068 HydrophobicContact CD2-CD2 3.82Å
294	R	87.3	Confident	88.9	Confident	145 Å²	145	74.9 Å²	74.9	55%	0.547	37%	0.372	S	S	.	.	H	α-helix	trans	-64.5	-42.2	172.1	-79	-170	64.1	69.5	9.3	112.7	K290 E291 H292 A298	K290-R294 WeakPolarHBondContact O-CG 3.44Å; K290-R294 PolarHBondContact O-N 3.49Å; K290-R294 VanDerWaalsContact O-N 3.14Å; E291-R294 WeakPolarHBondContact O-CB 3.34Å; E291-R294 PolarHBondContact O-N 3.29Å; E291-R294 VanDerWaalsContact O-N 3.16Å; H292-R294 VanDerWaalsContact C-N 3.28Å; H292-R294 PolarHBondContact O-N 3Å; R294-A298 WeakPolarHBondContact O-CB 3.39Å; R294-A298 PolarHBondContact O-N 3.19Å; R294-A298 VanDerWaalsContact O-N 3.13Å
295	V	91.9	Very high	89.2	Confident	91 Å²	91	70 Å²	70	55%	0.552	36%	0.358	S	S	*	.	H	α-helix	trans	-68	-46.2	179.1	174.5	0	0	0	0	110.6	E291 H292 L297 A298 A299	E291-V295 WeakPolarHBondContact O-CG2 3.31Å; E291-V295 PolarHBondContact O-N 3.32Å; H292-V295 PolarHBondContact O-N 3.08Å; H292-V295 VanDerWaalsContact O-N 3.09Å; V295-L297 PolarHBondContact O-N 2.99Å; V295-A298 PolarHBondContact O-N 3.13Å; V295-A299 PolarHBondContact O-N 3.31Å
296	S	94	Very high	89.6	Confident	28 Å²	28	73.6 Å²	73.6	20%	0.196	36%	0.364	C	S	.	.	H	α-helix	trans	-60.8	-45.4	176.5	-58.9	0	0	0	0	111.9	H292 A298 A299 V300	H292-S296 PolarHBondContact O-N 3.27Å; H292-S296 PolarHBondContact O-OG 2.79Å; S296-A298 VanDerWaalsContact C-N 3.31Å; S296-A298 PolarHBondContact O-N 2.93Å; S296-A299 WeakPolarHBondContact O-CB 3.39Å; S296-A299 PolarHBondContact O-N 3.25Å; S296-V300 WeakPolarHBondContact O-CG2 3.22Å; S296-V300 PolarHBondContact O-N 2.7Å
297	L	90.5	Very high	90.1	Very high	21 Å²	21	73 Å²	73	11%	0.11	36%	0.361	C	S	.	.	H	α-helix	trans	-59.6	-41	177.1	-176.1	69.3	0	0	0	112	L293 V295 A299 V300 D301 K1067 L1068 E1071	L293-L297 WeakPolarHBondContact O-CB 3.5Å; L293-L297 PolarHBondContact O-N 3.49Å; V295-L297 PolarHBondContact O-N 2.99Å; L297-A299 VanDerWaalsContact C-N 3.31Å; L297-A299 PolarHBondContact O-N 2.81Å; L297-V300 PolarHBondContact O-N 3.44Å; L297-D301 WeakPolarHBondContact O-CB 3.21Å; L297-D301 PolarHBondContact O-N 3.3Å; L297-K1067 HydrophobicContact CD1-CD 4.01Å; L297-K1067 HydrophobicContact CD1-CG 4.13Å; L297-K1067 HydrophobicContact CD2-CD 3.89Å; L297-L1068 HydrophobicContact CB-CD1 4.34Å; L297-L1068 HydrophobicContact CD1-CD1 4.48Å; L297-E1071 HydrophobicContact CD1-CB 4.41Å; L297-E1071 HydrophobicContact CD1-CG 4.13Å
298	A	90.3	Very high	90.4	Very high	47 Å²	47	71 Å²	71	39%	0.388	34%	0.343	S	S	.	.	H	α-helix	trans	-65.7	-31.9	175.5	0	0	0	0	0	112.9	R294 V295 S296 Q302	R294-A298 WeakPolarHBondContact O-CB 3.39Å; R294-A298 PolarHBondContact O-N 3.19Å; R294-A298 VanDerWaalsContact O-N 3.13Å; V295-A298 PolarHBondContact O-N 3.13Å; S296-A298 VanDerWaalsContact C-N 3.31Å; S296-A298 PolarHBondContact O-N 2.93Å; A298-Q302 VanDerWaalsContact O-CG 3.28Å; A298-Q302 WeakPolarHBondContact O-CG 3.49Å; A298-Q302 PolarHBondContact O-N 3.08Å; A298-Q302 VanDerWaalsContact O-N 3.15Å
299	A	93.8	Very high	90.3	Very high	55 Å²	55	66 Å²	66	46%	0.455	33%	0.328	S	S	.	.	H	α-helix	trans	-72.3	-40.1	174.2	0	0	0	0	0	112.2	V295 S296 L297 Q302 R303	V295-A299 PolarHBondContact O-N 3.31Å; S296-A299 WeakPolarHBondContact O-CB 3.39Å; S296-A299 PolarHBondContact O-N 3.25Å; L297-A299 VanDerWaalsContact C-N 3.31Å; L297-A299 PolarHBondContact O-N 2.81Å; A299-Q302 WeakPolarHBondContact O-CB 3.46Å; A299-Q302 PolarHBondContact O-N 3.34Å; A299-R303 PolarHBondContact O-N 3.01Å
300	V	92.8	Very high	90.3	Very high	17 Å²	17	65.8 Å²	65.8	10%	0.103	33%	0.329	C	S	.	.	H	α-helix	trans	-66	-43.7	174.9	176.2	0	0	0	0	110.8	S296 L297 Q302 R303 K304 L1068 E1071 E1072 V1075	S296-V300 WeakPolarHBondContact O-CG2 3.22Å; S296-V300 PolarHBondContact O-N 2.7Å; L297-V300 PolarHBondContact O-N 3.44Å; V300-Q302 VanDerWaalsContact C-N 3.29Å; V300-Q302 PolarHBondContact O-N 3.32Å; V300-R303 PolarHBondContact O-N 2.79Å; V300-R303 VanDerWaalsContact O-N 3.1Å; V300-K304 WeakPolarHBondContact O-CB 3.27Å; V300-K304 PolarHBondContact O-N 3.1Å; V300-L1068 HydrophobicContact CB-CD1 4.38Å; V300-L1068 HydrophobicContact CG2-CD1 3.76Å; V300-E1071 HydrophobicContact CG1-CB 3.69Å; V300-E1071 WeakPolarHBondContact CG1-O 3.29Å; V300-E1072 HydrophobicContact CG1-CG 4.13Å; V300-E1072 HydrophobicContact CG2-CG 3.7Å; V300-V1075 HydrophobicContact CG1-CG2 3.89Å
301	D	88.8	Confident	90.2	Very high	48 Å²	48	63.3 Å²	63.3	26%	0.257	32%	0.318	S	S	.	.	H	α-helix	trans	-57.5	-39.6	172.3	-85.9	-37.3	0	0	0	112	L297 K304 N305	L297-D301 WeakPolarHBondContact O-CB 3.21Å; L297-D301 PolarHBondContact O-N 3.3Å; D301-K304 VanDerWaalsContact OD1-CE 3.3Å; D301-K304 WeakPolarHBondContact OD1-CE 3.41Å; D301-K304 IonicContact OD1-NZ 3.76Å; D301-K304 PolarHBondContact OD1-NZ 3.13Å; D301-N305 WeakPolarHBondContact O-CB 3.36Å; D301-N305 PolarHBondContact O-N 3.38Å; D301-N305 PolarHBondContact O-ND2 2.84Å
302	Q	90.8	Very high	90.1	Very high	118 Å²	118	60.3 Å²	60.3	55%	0.551	31%	0.306	S	S	*	.	H	α-helix	trans	-65.9	-41.2	173.7	-74.9	173.1	36.1	0	0	112.7	A298 A299 V300 N305 K306	A298-Q302 VanDerWaalsContact O-CG 3.28Å; A298-Q302 WeakPolarHBondContact O-CG 3.49Å; A298-Q302 PolarHBondContact O-N 3.08Å; A298-Q302 VanDerWaalsContact O-N 3.15Å; A299-Q302 WeakPolarHBondContact O-CB 3.46Å; A299-Q302 PolarHBondContact O-N 3.34Å; V300-Q302 VanDerWaalsContact C-N 3.29Å; V300-Q302 PolarHBondContact O-N 3.32Å; Q302-N305 PolarHBondContact O-N 3.15Å; Q302-K306 WeakPolarHBondContact O-CG 3.45Å; Q302-K306 PolarHBondContact O-N 2.72Å; Q302-K306 VanDerWaalsContact O-N 3.14Å
303	R	92.8	Very high	89.9	Confident	110 Å²	110	60.9 Å²	60.9	42%	0.415	30%	0.303	S	S	.	.	H	α-helix	trans	-65.3	-44.7	177.1	-175.3	170.3	173.3	-143.6	-7.4	111.1	A299 V300 N305 K306 L307 V1075 D1076	A299-R303 PolarHBondContact O-N 3.01Å; V300-R303 PolarHBondContact O-N 2.79Å; V300-R303 VanDerWaalsContact O-N 3.1Å; R303-N305 PolarHBondContact O-N 2.89Å; R303-K306 PolarHBondContact O-N 2.96Å; R303-L307 HydrophobicContact CG-CD1 4.34Å; R303-L307 WeakPolarHBondContact O-CG 3.3Å; R303-L307 PolarHBondContact O-N 3.11Å; R303-V1075 HydrophobicContact CB-CG1 4.5Å; R303-V1075 HydrophobicContact CG-CG1 3.8Å; R303-V1075 VanDerWaalsContact CZ-CG1 3.48Å; R303-D1076 IonicContact NH1-OD1 2.73Å; R303-D1076 IonicContact NH2-OD1 2.69Å
304	K	88.9	Confident	89.6	Confident	15 Å²	15	61.3 Å²	61.3	7%	0.065	31%	0.305	C	S	.	.	H	α-helix	trans	-54	-51.2	173.3	-178.4	173.7	62.7	-163.2	0	111.9	V300 D301 K306 L307 V308 E1071 V1075 L1078	V300-K304 WeakPolarHBondContact O-CB 3.27Å; V300-K304 PolarHBondContact O-N 3.1Å; D301-K304 VanDerWaalsContact OD1-CE 3.3Å; D301-K304 WeakPolarHBondContact OD1-CE 3.41Å; D301-K304 IonicContact OD1-NZ 3.76Å; D301-K304 PolarHBondContact OD1-NZ 3.13Å; K304-K306 VanDerWaalsContact C-N 3.33Å; K304-K306 PolarHBondContact O-N 3.07Å; K304-L307 PolarHBondContact O-N 2.8Å; K304-V308 VanDerWaalsContact O-CG2 3.26Å; K304-V308 WeakPolarHBondContact O-CG2 3.46Å; K304-V308 PolarHBondContact O-N 3.16Å; K304-E1071 IonicContact NZ-OE1 3.11Å; K304-E1071 PolarHBondContact NZ-OE1 3.02Å; K304-E1071 IonicContact NZ-OE2 3.05Å; K304-E1071 PolarHBondContact NZ-OE2 3.18Å; K304-V1075 HydrophobicContact CB-CG2 3.68Å; K304-V1075 HydrophobicContact CG-CG2 4.47Å; K304-L1078 HydrophobicContact CG-CD1 3.74Å
305	N	88	Confident	89.4	Confident	74 Å²	74	55.8 Å²	55.8	40%	0.396	29%	0.285	S	S	.	.	H	α-helix	trans	-63.7	-35.8	-179.3	-69.2	-23.6	0	0	0	112.7	D301 Q302 R303 Q309	D301-N305 WeakPolarHBondContact O-CB 3.36Å; D301-N305 PolarHBondContact O-N 3.38Å; D301-N305 PolarHBondContact O-ND2 2.84Å; Q302-N305 PolarHBondContact O-N 3.15Å; R303-N305 PolarHBondContact O-N 2.89Å; N305-Q309 WeakPolarHBondContact O-CG 3.34Å; N305-Q309 PolarHBondContact O-N 3.36Å
306	K	93.2	Very high	89	Confident	129 Å²	129	53.3 Å²	53.3	56%	0.561	27%	0.272	S	S	*	.	H	α-helix	trans	-63.3	-49.6	172.8	-72.1	172.8	-178.8	178.8	0	111.8	Q302 R303 K304 V308 Q309 D310	Q302-K306 WeakPolarHBondContact O-CG 3.45Å; Q302-K306 PolarHBondContact O-N 2.72Å; Q302-K306 VanDerWaalsContact O-N 3.14Å; R303-K306 PolarHBondContact O-N 2.96Å; K304-K306 VanDerWaalsContact C-N 3.33Å; K304-K306 PolarHBondContact O-N 3.07Å; K306-V308 VanDerWaalsContact C-N 3.28Å; K306-V308 PolarHBondContact O-N 3.37Å; K306-Q309 WeakPolarHBondContact O-CB 3.49Å; K306-Q309 PolarHBondContact O-N 3.43Å; K306-Q309 VanDerWaalsContact O-N 3.09Å; K306-D310 PolarHBondContact O-N 3.48Å
307	L	91.6	Very high	88.5	Confident	11 Å²	11	54.7 Å²	54.7	6%	0.058	28%	0.277	C	S	.	.	H	α-helix	trans	-60.6	-38.1	178.8	-69.6	172.6	0	0	0	112.3	R303 K304 D310 L311 V1075 L1078 Q1079 V1082	R303-L307 HydrophobicContact CG-CD1 4.34Å; R303-L307 WeakPolarHBondContact O-CG 3.3Å; R303-L307 PolarHBondContact O-N 3.11Å; K304-L307 PolarHBondContact O-N 2.8Å; L307-D310 PolarHBondContact O-N 2.89Å; L307-L311 VanDerWaalsContact O-CB 3.23Å; L307-L311 WeakPolarHBondContact O-CB 3.42Å; L307-L311 PolarHBondContact O-N 3.41Å; L307-V1075 HydrophobicContact CD1-CG1 4.01Å; L307-V1075 WeakPolarHBondContact CD1-O 3.24Å; L307-L1078 HydrophobicContact CB-CB 4.18Å; L307-L1078 HydrophobicContact CD1-CB 3.99Å; L307-Q1079 HydrophobicContact CD1-CB 4.18Å; L307-V1082 HydrophobicContact CB-CG2 4.47Å; L307-V1082 HydrophobicContact CD2-CG2 4.35Å
308	V	87.8	Confident	88	Confident	16 Å²	16	53.9 Å²	53.9	10%	0.097	27%	0.273	C	S	.	.	H	α-helix	trans	-63.9	-42.9	173.9	167.7	0	0	0	0	111.8	K304 K306 L311 L312 L1078 Y1113	K304-V308 VanDerWaalsContact O-CG2 3.26Å; K304-V308 WeakPolarHBondContact O-CG2 3.46Å; K304-V308 PolarHBondContact O-N 3.16Å; K306-V308 VanDerWaalsContact C-N 3.28Å; K306-V308 PolarHBondContact O-N 3.37Å; V308-L311 PolarHBondContact O-N 2.91Å; V308-L312 WeakPolarHBondContact O-CB 3.19Å; V308-L312 PolarHBondContact O-N 3.31Å; V308-L1078 HydrophobicContact CG2-CD1 4.19Å; V308-L1078 HydrophobicContact CG2-CD2 4.22Å; V308-Y1113 HydrophobicContact CB-CD2 4.34Å; V308-Y1113 HydrophobicContact CB-CE2 4.34Å; V308-Y1113 HydrophobicContact CG1-CD1 3.69Å; V308-Y1113 HydrophobicContact CG1-CD2 3.6Å; V308-Y1113 HydrophobicContact CG1-CE1 4.08Å; V308-Y1113 HydrophobicContact CG1-CE2 4.05Å; V308-Y1113 HydrophobicContact CG1-CG 3.41Å; V308-Y1113 VanDerWaalsContact CG1-CG 3.41Å; V308-Y1113 HydrophobicContact CG2-CD2 3.75Å; V308-Y1113 HydrophobicContact CG2-CE1 4.28Å; V308-Y1113 HydrophobicContact CG2-CE2 3.4Å; V308-Y1113 VanDerWaalsContact CG2-CE2 3.4Å; V308-Y1113 HydrophobicContact CG2-CG 4.36Å
309	Q	86.2	Confident	87.4	Confident	97 Å²	97	56.5 Å²	56.5	45%	0.453	28%	0.277	S	S	.	.	H	α-helix	trans	-65.5	-38.6	175.4	-74.5	175.4	-9.2	0	0	112.2	N305 K306 R313	N305-Q309 WeakPolarHBondContact O-CG 3.34Å; N305-Q309 PolarHBondContact O-N 3.36Å; K306-Q309 WeakPolarHBondContact O-CB 3.49Å; K306-Q309 PolarHBondContact O-N 3.43Å; K306-Q309 VanDerWaalsContact O-N 3.09Å; Q309-R313 WeakPolarHBondContact O-CB 3.5Å; Q309-R313 PolarHBondContact O-N 3.21Å
310	D	89.2	Confident	86.5	Confident	55 Å²	55	60.2 Å²	60.2	29%	0.294	29%	0.285	S	S	.	.	H	α-helix	trans	-67.8	-40.3	175.2	-67.2	-31.5	0	0	0	111.4	K306 L307 R313 L314	K306-D310 PolarHBondContact O-N 3.48Å; L307-D310 PolarHBondContact O-N 2.89Å; D310-R313 PolarHBondContact O-N 3.49Å; D310-R313 IonicContact OD1-CZ 2.73Å; D310-R313 IonicContact OD1-NH1 2.62Å; D310-R313 PolarHBondContact OD1-NH1 2.97Å; D310-R313 IonicContact OD1-NH2 2.89Å; D310-R313 PolarHBondContact OD1-NH2 2.83Å; D310-L314 WeakPolarHBondContact O-CB 3.44Å; D310-L314 WeakPolarHBondContact O-CG 3.24Å; D310-L314 PolarHBondContact O-N 3.31Å
311	L	86.8	Confident	85.2	Confident	6 Å²	6	62.1 Å²	62.1	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-44	174.9	-166.8	155.5	0	0	0	111.7	L307 V308 R313 L314 K315 L1078 V1081 V1082 L1110	L307-L311 VanDerWaalsContact O-CB 3.23Å; L307-L311 WeakPolarHBondContact O-CB 3.42Å; L307-L311 PolarHBondContact O-N 3.41Å; V308-L311 PolarHBondContact O-N 2.91Å; L311-R313 VanDerWaalsContact C-N 3.34Å; L311-R313 PolarHBondContact O-N 3.35Å; L311-L314 PolarHBondContact O-N 3.15Å; L311-K315 WeakPolarHBondContact O-CB 3.21Å; L311-K315 PolarHBondContact O-N 3.42Å; L311-L1078 HydrophobicContact CD1-CD2 4.22Å; L311-V1081 HydrophobicContact CD1-CB 4.41Å; L311-V1081 HydrophobicContact CD1-CG1 3.72Å; L311-V1082 HydrophobicContact CB-CG2 3.82Å; L311-V1082 HydrophobicContact CD1-CG2 4.17Å; L311-V1082 HydrophobicContact CG-CG2 4.34Å; L311-L1110 HydrophobicContact CD2-CD1 4.37Å; L311-L1110 HydrophobicContact CD2-CD2 3.31Å; L311-L1110 HydrophobicContact CD2-CG 3.89Å
312	L	84.2	Confident	83.8	Confident	48 Å²	48	63.3 Å²	63.3	25%	0.251	32%	0.315	S	S	.	.	H	α-helix	trans	-64.8	-37.7	175.9	-176.4	61.9	0	0	0	111.8	V308 S316 Y1114	V308-L312 WeakPolarHBondContact O-CB 3.19Å; V308-L312 PolarHBondContact O-N 3.31Å; L312-S316 WeakPolarHBondContact O-CB 3.44Å; L312-S316 PolarHBondContact O-N 2.91Å; L312-S316 PolarHBondContact O-OG 3.45Å; L312-Y1114 HydrophobicContact CD1-CE1 3.72Å; L312-Y1114 HydrophobicContact CD1-CE2 4.48Å
313	R	87.4	Confident	81.7	Confident	131 Å²	131	62.8 Å²	62.8	49%	0.494	32%	0.32	S	S	.	.	H	α-helix	trans	-64.9	-50.9	174	-164.3	-174.2	-47.8	120.6	19.8	111.2	Q309 D310 L311 K315 S316 D317	Q309-R313 WeakPolarHBondContact O-CB 3.5Å; Q309-R313 PolarHBondContact O-N 3.21Å; D310-R313 PolarHBondContact O-N 3.49Å; D310-R313 IonicContact OD1-CZ 2.73Å; D310-R313 IonicContact OD1-NH1 2.62Å; D310-R313 PolarHBondContact OD1-NH1 2.97Å; D310-R313 IonicContact OD1-NH2 2.89Å; D310-R313 PolarHBondContact OD1-NH2 2.83Å; L311-R313 VanDerWaalsContact C-N 3.34Å; L311-R313 PolarHBondContact O-N 3.35Å; R313-K315 VanDerWaalsContact C-N 3.33Å; R313-K315 PolarHBondContact O-N 2.85Å; R313-S316 WeakPolarHBondContact O-CB 3.46Å; R313-S316 PolarHBondContact O-N 3.03Å; R313-S316 VanDerWaalsContact O-N 3.11Å; R313-D317 PolarHBondContact O-N 2.64Å
314	L	85.2	Confident	79	Confident	26 Å²	26	64.2 Å²	64.2	14%	0.136	34%	0.341	C	S	.	.	H	α-helix	trans	-57.8	-43.6	176.9	-74.8	171.4	0	0	0	112	D310 L311 D317 L318 V1082 L1085 K1089	D310-L314 WeakPolarHBondContact O-CB 3.44Å; D310-L314 WeakPolarHBondContact O-CG 3.24Å; D310-L314 PolarHBondContact O-N 3.31Å; L311-L314 PolarHBondContact O-N 3.15Å; L314-D317 PolarHBondContact O-N 2.99Å; L314-L318 WeakPolarHBondContact O-CB 3.5Å; L314-L318 VanDerWaalsContact O-CG 3.3Å; L314-L318 WeakPolarHBondContact O-CG 3.34Å; L314-L318 PolarHBondContact O-N 3.42Å; L314-V1082 HydrophobicContact CD1-CG1 4.09Å; L314-L1085 HydrophobicContact CB-CD2 3.71Å; L314-L1085 HydrophobicContact CB-CG 4.16Å; L314-L1085 HydrophobicContact CD1-CB 4.36Å; L314-L1085 HydrophobicContact CD1-CD2 4.42Å; L314-L1085 HydrophobicContact CD1-CG 4.44Å; L314-K1089 HydrophobicContact CD2-CD 3.67Å
315	K	83.1	Confident	76.7	Confident	28 Å²	28	69.1 Å²	69.1	12%	0.122	38%	0.375	C	S	.	.	H	α-helix	trans	-61.3	-45	174.6	179.2	170.6	176.1	-167.1	0	111.7	L311 R313 L318 Q319 L1096 L1110 Y1114	L311-K315 WeakPolarHBondContact O-CB 3.21Å; L311-K315 PolarHBondContact O-N 3.42Å; R313-K315 VanDerWaalsContact C-N 3.33Å; R313-K315 PolarHBondContact O-N 2.85Å; K315-L318 PolarHBondContact O-N 3.38Å; K315-Q319 WeakPolarHBondContact O-CG 3.35Å; K315-Q319 PolarHBondContact O-N 2.84Å; K315-L1096 HydrophobicContact CG-CD1 4.18Å; K315-L1110 HydrophobicContact CD-CD1 4.01Å; K315-L1110 HydrophobicContact CD-CD2 4.09Å; K315-Y1114 VanDerWaalsContact CD-OH 3.28Å; K315-Y1114 WeakPolarHBondContact CD-OH 3.2Å; K315-Y1114 WeakPolarHBondContact CE-OH 3.5Å; K315-Y1114 VanDerWaalsContact NZ-CE2 3.34Å; K315-Y1114 PolarHBondContact NZ-OH 3.3Å
316	S	83.2	Confident	73.8	Confident	40 Å²	40	74.4 Å²	74.4	28%	0.28	40%	0.397	S	S	.	.	H	α-helix	trans	-63.9	-43	178.9	-58.5	0	0	0	0	112.3	L312 R313 L318 Q319 Q320	L312-S316 WeakPolarHBondContact O-CB 3.44Å; L312-S316 PolarHBondContact O-N 2.91Å; L312-S316 PolarHBondContact O-OG 3.45Å; R313-S316 WeakPolarHBondContact O-CB 3.46Å; R313-S316 PolarHBondContact O-N 3.03Å; R313-S316 VanDerWaalsContact O-N 3.11Å; S316-L318 PolarHBondContact O-N 2.93Å; S316-Q319 PolarHBondContact O-N 3.39Å; S316-Q320 WeakPolarHBondContact O-CB 3.47Å; S316-Q320 WeakPolarHBondContact O-CG 3.34Å; S316-Q320 PolarHBondContact O-N 3.05Å
317	D	84.1	Confident	70.7	Confident	56 Å²	56	74 Å²	74	30%	0.299	41%	0.411	S	S	.	.	H	α-helix	trans	-60.3	-45	176.5	-66.5	-15	0	0	0	111.4	R313 L314 Q320 S321 K1089	R313-D317 PolarHBondContact O-N 2.64Å; L314-D317 PolarHBondContact O-N 2.99Å; D317-Q320 PolarHBondContact O-N 2.95Å; D317-S321 WeakPolarHBondContact O-CB 3.14Å; D317-S321 PolarHBondContact O-N 3.26Å; D317-K1089 IonicContact OD2-NZ 2.68Å; D317-K1089 PolarHBondContact OD2-NZ 3.04Å
318	L	80.8	Confident	67.5	Low	4 Å²	4	78 Å²	78	2%	0.021	45%	0.445	C	S	.	.	H	α-helix	trans	-67.8	-37.1	179.1	-73.8	173	0	0	0	112.1	L314 K315 S316 S321 L1085 W1088 K1089 G1095 L1096	L314-L318 WeakPolarHBondContact O-CB 3.5Å; L314-L318 VanDerWaalsContact O-CG 3.3Å; L314-L318 WeakPolarHBondContact O-CG 3.34Å; L314-L318 PolarHBondContact O-N 3.42Å; K315-L318 PolarHBondContact O-N 3.38Å; S316-L318 PolarHBondContact O-N 2.93Å; L318-S321 PolarHBondContact O-OG 2.7Å; L318-L1085 HydrophobicContact CD1-CD1 3.34Å; L318-L1085 HydrophobicContact CD1-CD2 4.33Å; L318-L1085 HydrophobicContact CD1-CG 3.86Å; L318-W1088 HydrophobicContact CD2-CE3 4.49Å; L318-W1088 HydrophobicContact CD2-CZ3 4.5Å; L318-K1089 HydrophobicContact CD2-CB 4.31Å; L318-K1089 HydrophobicContact CD2-CG 4.3Å; L318-G1095 WeakPolarHBondContact CB-O 3.32Å; L318-L1096 HydrophobicContact CB-CD1 4.17Å; L318-L1096 HydrophobicContact CD1-CD1 4.41Å
319	Q	77.3	Confident	64.3	Low	102 Å²	102	83.9 Å²	83.9	48%	0.477	49%	0.485	S	S	.	.	H	α-helix	trans	-66.6	-43.4	172.6	-72	-175.6	-84.7	0	0	112.3	K315 S316 S321 A322	K315-Q319 WeakPolarHBondContact O-CG 3.35Å; K315-Q319 PolarHBondContact O-N 2.84Å; S316-Q319 PolarHBondContact O-N 3.39Å; Q319-S321 VanDerWaalsContact C-N 3.3Å; Q319-S321 PolarHBondContact O-N 2.94Å; Q319-A322 WeakPolarHBondContact O-CB 3.36Å; Q319-A322 PolarHBondContact O-N 3.11Å
320	Q	75.4	Confident	61.3	Low	134 Å²	134	84.4 Å²	84.4	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-64.5	-33.9	176.9	-73.7	175	49	0	0	112.4	S316 D317 A322 T323	S316-Q320 WeakPolarHBondContact O-CB 3.47Å; S316-Q320 WeakPolarHBondContact O-CG 3.34Å; S316-Q320 PolarHBondContact O-N 3.05Å; D317-Q320 PolarHBondContact O-N 2.95Å; Q320-A322 PolarHBondContact O-N 3.34Å; Q320-T323 PolarHBondContact O-N 2.98Å; Q320-T323 PolarHBondContact O-OG1 3.12Å
321	S	64.2	Low	58.1	Low	57 Å²	57	87.5 Å²	87.5	40%	0.399	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-11.9	177.5	80.1	0	0	0	0	114.8	D317 L318 Q319	D317-S321 WeakPolarHBondContact O-CB 3.14Å; D317-S321 PolarHBondContact O-N 3.26Å; L318-S321 PolarHBondContact O-OG 2.7Å; Q319-S321 VanDerWaalsContact C-N 3.3Å; Q319-S321 PolarHBondContact O-N 2.94Å
322	A	60.8	Low	55.2	Low	72 Å²	72	93.1 Å²	93.1	60%	0.595	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-11.4	-178.8	0	0	0	0	0	114.8	Q319 Q320	Q319-A322 WeakPolarHBondContact O-CB 3.36Å; Q319-A322 PolarHBondContact O-N 3.11Å; Q320-A322 PolarHBondContact O-N 3.34Å
323	T	44.8	Very low	52.2	Low	107 Å²	107	96 Å²	96	66%	0.656	59%	0.589	S	S	*	*			trans	-120.8	118.9	-171.9	53.8	0	0	0	0	113.1	Q320	Q320-T323 PolarHBondContact O-N 2.98Å; Q320-T323 PolarHBondContact O-OG1 3.12Å
324	V	36.8	Very low	49.4	Very low	140 Å²	140	97.9 Å²	97.9	85%	0.848	61%	0.607	S	S	*	*			trans	-92.7	139.2	176.2	179	0	0	0	0	110.2
325	P	40.3	Very low	46.6	Very low	119 Å²	119	102.4 Å²	102.4	77%	0.773	64%	0.636	S	S	*	*			trans	-95.2	136.8	-176.9	35	-32.6	0	0	0	113.8
326	E	27.5	Very low	43.7	Very low	185 Å²	185	106.1 Å²	106.1	86%	0.864	67%	0.666	S	S	*	*			trans	-123.8	139.3	164.1	-78.6	-161.7	145.4	0	0	112.6
327	S	28.7	Very low	40.9	Very low	121 Å²	121	112 Å²	112	85%	0.846	69%	0.694	S	S	*	*			trans	41.9	117.6	162.9	60.1	0	0	0	0	121
328	A	23.1	Very low	37.9	Very low	94 Å²	94	114.8 Å²	114.8	78%	0.777	72%	0.717	S	S	*	*			trans	-86.8	145.1	166.8	0	0	0	0	0	112.3
329	C	21.1	Very low	35.3	Very low	139 Å²	139	120.9 Å²	120.9	94%	0.939	76%	0.755	S	S	*	*			trans	-121	126.5	154.9	-90.5	0	0	0	0	109.7
330	S	22.6	Very low	32.7	Very low	109 Å²	109	118.7 Å²	118.7	76%	0.762	76%	0.759	S	S	*	*			trans	-88.9	142.9	-173.7	-58.9	0	0	0	0	113
331	S	22.7	Very low	30.2	Very low	119 Å²	119	118 Å²	118	83%	0.832	77%	0.768	S	S	*	*			trans	48	113	140.2	-53.7	0	0	0	0	119.8
332	S	25.6	Very low	28.4	Very low	124 Å²	124	123.7 Å²	123.7	87%	0.867	79%	0.793	S	S	*	*				-141.3	134.1	125.7	59.9	0	0	0	0	111.2
333	S	22.8	Very low	26.5	Very low	109 Å²	109	124.7 Å²	124.7	76%	0.762	80%	0.801	S	S	*	*			trans	-100.5	126.8	-178.9	52.7	0	0	0	0	110.1
334	I	28.5	Very low	25.6	Very low	170 Å²	170	128.3 Å²	128.3	87%	0.872	81%	0.811	S	S	*	*			trans	-125.3	133	156.5	-64.7	-175	0	0	0	108.8
335	V	25	Very low	25.3	Very low	122 Å²	122	126.6 Å²	126.6	74%	0.739	80%	0.803	S	S	*	*			trans	-87	148.8	-167.9	-165.6	0	0	0	0	110.1
336	S	23.4	Very low	24.8	Very low	106 Å²	106	126.8 Å²	126.8	74%	0.741	80%	0.804	S	S	*	*			trans	-11.9	131.5	163	-48.6	0	0	0	0	116.8
337	N	24.4	Very low	24.9	Very low	164 Å²	164	125 Å²	125	88%	0.877	81%	0.806	S	S	*	*			trans	-133.7	119.1	145.5	-126.8	-3.9	0	0	0	111.3
338	S	21.4	Very low	24.6	Very low	113 Å²	113	124.2 Å²	124.2	79%	0.79	80%	0.8	S	S	*	*			trans	-107.3	118.4	179.1	161.2	0	0	0	0	108.2
339	V	25.5	Very low	24.7	Very low	133 Å²	133	127.9 Å²	127.9	81%	0.806	81%	0.807	S	S	*	*			trans	-131.8	105.9	171.5	-175.9	0	0	0	0	110.6
340	G	22.7	Very low	24.8	Very low	55 Å²	55	125.9 Å²	125.9	57%	0.567	80%	0.795	S	S	*	*				64	119.6	117.3	0	0	0	0	0	120.4
341	C	21.9	Very low	24.9	Very low	120 Å²	120	131.2 Å²	131.2	81%	0.811	80%	0.798	S	S	*	*				42.6	133.6	126.9	-54.7	0	0	0	0	119.4
342	L	26.9	Very low	25.1	Very low	176 Å²	176	130.7 Å²	130.7	92%	0.921	79%	0.793	S	S	*	*				-158.5	159.8	63.8	-85.4	165.2	0	0	0	112.3
343	A	21.7	Very low	25.1	Very low	94 Å²	94	130.8 Å²	130.8	78%	0.777	79%	0.788	S	S	*	*			trans	-142.9	126.1	173.2	0	0	0	0	0	109.8
344	E	25.4	Very low	25.1	Very low	183 Å²	183	134.4 Å²	134.4	86%	0.855	79%	0.792	S	S	*	*			trans	-168.2	168.4	176	-118.2	-162.4	-176.4	0	0	109.5
345	P	30.2	Very low	25.1	Very low	104 Å²	104	131.6 Å²	131.6	68%	0.675	79%	0.788	S	S	*	*				-121.6	172.9	-67.2	24.4	-3.8	0	0	0	112.6
346	P	30.3	Very low	25.7	Very low	122 Å²	122	131.4 Å²	131.4	79%	0.792	79%	0.789	S	S	*	*			trans	-95.2	153	-177.5	36.8	-33.5	0	0	0	113.6
347	T	28.5	Very low	25.9	Very low	148 Å²	148	130.9 Å²	130.9	91%	0.908	79%	0.791	S	S	*	*			trans	-123.8	138.6	165.1	40.8	0	0	0	0	112.4
348	S	22.9	Very low	26.1	Very low	105 Å²	105	130.1 Å²	130.1	73%	0.734	79%	0.787	S	S	*	*			trans	-95.1	142.2	-177.2	-55	0	0	0	0	110.5
349	N	25.9	Very low	26.6	Very low	170 Å²	170	135.7 Å²	135.7	91%	0.909	79%	0.791	S	S	*	*				-173.9	148.5	112.1	-96.3	-27.7	0	0	0	113.9
350	S	23.3	Very low	27.2	Very low	98 Å²	98	136.3 Å²	136.3	69%	0.685	79%	0.788	S	S	*	*			trans	-110.1	134.2	-179.9	170.5	0	0	0	0	110.6
351	R	25	Very low	27.9	Very low	221 Å²	221	139.1 Å²	139.1	83%	0.834	80%	0.796	S	S	*	*			trans	-153.4	130.6	145.8	-161.8	151.2	-67.9	169.2	0.1	111.8
352	C	25	Very low	28.7	Very low	107 Å²	107	144 Å²	144	72%	0.723	80%	0.804	S	S	*	*			trans	-74.7	151.1	177.8	-57.1	0	0	0	0	111.1
353	V	26	Very low	29.5	Very low	126 Å²	126	138.3 Å²	138.3	76%	0.764	79%	0.788	S	S	*	*			trans	-120.1	127.7	171.2	178	0	0	0	0	108.6
354	H	24.3	Very low	30.6	Very low	185 Å²	185	140.2 Å²	140.2	86%	0.856	79%	0.785	S	S	*	*			trans	-75.2	149.4	173.1	-74.8	-94.5	0	0	0	111
355	S	26.6	Very low	32.6	Very low	111 Å²	111	134.8 Å²	134.8	78%	0.776	77%	0.765	S	S	*	*			trans	-144.1	161.6	167.4	-147.5	0	0	0	0	108.3
356	P	38.9	Very low	34.9	Very low	119 Å²	119	134.2 Å²	134.2	77%	0.773	76%	0.759	S	S	*	*				-112.6	150.3	-83	28.6	-15.6	0	0	0	111.6
357	A	26.6	Very low	37.4	Very low	94 Å²	94	130.6 Å²	130.6	78%	0.777	74%	0.74	S	S	*	*			trans	-81.8	127.4	174.4	0	0	0	0	0	110.1
358	D	29	Very low	39.9	Very low	148 Å²	148	126.4 Å²	126.4	79%	0.791	71%	0.712	S	S	*	*			trans	-145.1	137.6	152.1	-134.9	-25.5	0	0	0	110.8
359	R	33.1	Very low	42.7	Very low	230 Å²	230	122.1 Å²	122.1	87%	0.868	68%	0.681	S	S	*	*			trans	63.2	67.5	176.7	-49.1	-176.1	-174	-157.8	0.6	117.6	P361	R359-P361 WeakPolarHBondContact O-CD 3.43Å
360	I	36.7	Very low	45.6	Very low	146 Å²	146	116.2 Å²	116.2	75%	0.749	66%	0.656	S	S	*	*			trans	-89.6	115.7	155.8	-60.3	173.4	0	0	0	108.8	K362	I360-K362 PolarHBondContact O-N 3.03Å
361	P	37.4	Very low	48.7	Very low	114 Å²	114	118.3 Å²	118.3	74%	0.74	65%	0.648	S	S	*	*			trans	-66.1	129.8	170.9	-17.1	31.5	0	0	0	110.2	R359 G363	R359-P361 WeakPolarHBondContact O-CD 3.43Å; P361-G363 VanDerWaalsContact C-N 3.3Å; P361-G363 PolarHBondContact O-N 2.95Å
362	K	39.3	Very low	51.6	Low	222 Å²	222	107.9 Å²	107.9	97%	0.965	61%	0.609	S	S	*	*			trans	-76.1	78.8	179.4	-64.9	176.4	-178.7	175.5	0	110.6	I360	I360-K362 PolarHBondContact O-N 3.03Å
363	G	43.8	Very low	54.7	Low	58 Å²	58	109 Å²	109	60%	0.598	60%	0.598	S	S	*	*			trans	-142.4	144.2	174.4	0	0	0	0	0	110.9	P361	P361-G363 VanDerWaalsContact C-N 3.3Å; P361-G363 PolarHBondContact O-N 2.95Å
364	L	44.4	Very low	57.8	Low	134 Å²	134	108.3 Å²	108.3	70%	0.702	59%	0.59	S	S	*	*			trans	-60.3	143.2	-166.3	-87.9	60.7	0	0	0	114.1	V366 A367	L364-V366 HydrophobicContact CB-CG2 4.35Å; L364-V366 PolarHBondContact O-N 2.93Å; L364-A367 PolarHBondContact O-N 3.21Å
365	P	68.4	Low	61	Low	69 Å²	69	104.3 Å²	104.3	45%	0.448	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.9	-10.7	176.5	-26.4	34.5	0	0	0	116.3	A367 D368 I369	P365-A367 PolarHBondContact O-N 2.85Å; P365-D368 PolarHBondContact O-N 3Å; P365-I369 PolarHBondContact O-N 3.43Å; P365-I369 VanDerWaalsContact O-N 3.07Å
366	V	77.3	Confident	64.1	Low	91 Å²	91	100.8 Å²	100.8	55%	0.552	54%	0.541	S	S	*	.	H	α-helix	trans	-57.6	-36.1	175.9	-178.8	0	0	0	0	111.3	L364 I369 A370	L364-V366 HydrophobicContact CB-CG2 4.35Å; L364-V366 PolarHBondContact O-N 2.93Å; V366-I369 PolarHBondContact O-N 3.28Å; V366-A370 WeakPolarHBondContact O-CB 3.44Å; V366-A370 PolarHBondContact O-N 2.88Å
367	A	82.3	Confident	66.6	Low	47 Å²	47	100.3 Å²	100.3	39%	0.388	53%	0.529	S	S	.	.	H	α-helix	trans	-66.6	-37.5	177.7	0	0	0	0	0	112.5	L364 P365 A370 R371	L364-A367 PolarHBondContact O-N 3.21Å; P365-A367 PolarHBondContact O-N 2.85Å; A367-A370 PolarHBondContact O-N 3.35Å; A367-R371 WeakPolarHBondContact O-CG 3.31Å; A367-R371 PolarHBondContact O-N 2.99Å
368	D	81.6	Confident	69.8	Low	60 Å²	60	100.4 Å²	100.4	32%	0.321	51%	0.513	S	S	.	.	H	α-helix	trans	-70.8	-40.5	176.1	-66.1	-54.3	0	0	0	112	P365 A370 R371 A372	P365-D368 PolarHBondContact O-N 3Å; D368-A370 VanDerWaalsContact C-N 3.32Å; D368-A370 PolarHBondContact O-N 2.92Å; D368-R371 PolarHBondContact O-N 3.45Å; D368-R371 IonicContact OD1-CZ 3.39Å; D368-R371 IonicContact OD1-NE 3.29Å; D368-R371 PolarHBondContact OD1-NE 2.92Å; D368-R371 IonicContact OD1-NH2 2.67Å; D368-R371 PolarHBondContact OD1-NH2 3.34Å; D368-R371 IonicContact OD2-NH2 3.81Å; D368-A372 VanDerWaalsContact O-CB 3.3Å; D368-A372 WeakPolarHBondContact O-CB 3.04Å; D368-A372 PolarHBondContact O-N 3.37Å
369	I	83	Confident	72.7	Confident	15 Å²	15	94.1 Å²	94.1	8%	0.077	48%	0.48	C	S	.	.	H	α-helix	trans	-60.4	-42.8	172.5	-70.7	164.5	0	0	0	111	P365 V366 R373 L496 T500	P365-I369 PolarHBondContact O-N 3.43Å; P365-I369 VanDerWaalsContact O-N 3.07Å; V366-I369 PolarHBondContact O-N 3.28Å; I369-R373 HydrophobicContact CG2-CG 4.44Å; I369-R373 WeakPolarHBondContact O-CB 2.96Å; I369-R373 VanDerWaalsContact O-CG 3.25Å; I369-R373 WeakPolarHBondContact O-CG 3.24Å; I369-R373 PolarHBondContact O-N 2.85Å; I369-L496 HydrophobicContact CD1-CB 4.3Å; I369-L496 HydrophobicContact CG1-CB 3.63Å; I369-L496 HydrophobicContact CG1-CD1 4.09Å; I369-L496 HydrophobicContact CG1-CG 4.43Å; I369-T500 HydrophobicContact CD1-CG2 3.38Å
370	A	85.1	Confident	75.5	Confident	46 Å²	46	86.8 Å²	86.8	38%	0.38	45%	0.453	S	S	.	.	H	α-helix	trans	-63.5	-47.4	176.7	0	0	0	0	0	111.5	V366 A367 D368 A372 R373 L374	V366-A370 WeakPolarHBondContact O-CB 3.44Å; V366-A370 PolarHBondContact O-N 2.88Å; A367-A370 PolarHBondContact O-N 3.35Å; D368-A370 VanDerWaalsContact C-N 3.32Å; D368-A370 PolarHBondContact O-N 2.92Å; A370-A372 PolarHBondContact O-N 2.94Å; A370-R373 PolarHBondContact O-N 3.04Å; A370-L374 WeakPolarHBondContact O-CG 3.14Å; A370-L374 PolarHBondContact O-N 3.16Å
371	R	89.2	Confident	78.1	Confident	142 Å²	142	86.7 Å²	86.7	54%	0.536	45%	0.449	S	S	.	.	H	α-helix	trans	-56.6	-49.2	174.5	-77.7	-174.3	-79.3	-104.2	8.3	112.2	A367 D368 R373 L374 Q375	A367-R371 WeakPolarHBondContact O-CG 3.31Å; A367-R371 PolarHBondContact O-N 2.99Å; D368-R371 PolarHBondContact O-N 3.45Å; D368-R371 IonicContact OD1-CZ 3.39Å; D368-R371 IonicContact OD1-NE 3.29Å; D368-R371 PolarHBondContact OD1-NE 2.92Å; D368-R371 IonicContact OD1-NH2 2.67Å; D368-R371 PolarHBondContact OD1-NH2 3.34Å; D368-R371 IonicContact OD2-NH2 3.81Å; R371-R373 PolarHBondContact O-N 3.44Å; R371-L374 PolarHBondContact O-N 3.19Å; R371-Q375 WeakPolarHBondContact O-CG 3.02Å; R371-Q375 PolarHBondContact O-N 3.48Å
372	A	85.8	Confident	80.8	Confident	1 Å²	1	88.1 Å²	88.1	1%	0.008	44%	0.439	C	S	.	.	H	α-helix	trans	-62.8	-40.4	-179.9	0	0	0	0	0	112.4	D368 A370 Y376 Y492 V493 L496	D368-A372 VanDerWaalsContact O-CB 3.3Å; D368-A372 WeakPolarHBondContact O-CB 3.04Å; D368-A372 PolarHBondContact O-N 3.37Å; A370-A372 PolarHBondContact O-N 2.94Å; A372-Y376 WeakPolarHBondContact O-CB 3.45Å; A372-Y376 PolarHBondContact O-N 2.73Å; A372-Y492 HydrophobicContact CB-CD1 3.69Å; A372-Y492 HydrophobicContact CB-CE1 3.76Å; A372-V493 HydrophobicContact CB-CG2 3.68Å; A372-L496 HydrophobicContact CB-CD1 3.93Å
373	R	89.4	Confident	83.4	Confident	131 Å²	131	78 Å²	78	49%	0.494	40%	0.395	S	S	.	.	H	α-helix	trans	-66.7	-40.8	175.8	-76.1	175.5	176.8	-174.2	-0.3	112.7	I369 A370 R371 Y376 Q377 V493	I369-R373 HydrophobicContact CG2-CG 4.44Å; I369-R373 WeakPolarHBondContact O-CB 2.96Å; I369-R373 VanDerWaalsContact O-CG 3.25Å; I369-R373 WeakPolarHBondContact O-CG 3.24Å; I369-R373 PolarHBondContact O-N 2.85Å; A370-R373 PolarHBondContact O-N 3.04Å; R371-R373 PolarHBondContact O-N 3.44Å; R373-Y376 PolarHBondContact O-N 3.23Å; R373-Q377 WeakPolarHBondContact O-CG 3.3Å; R373-Q377 PolarHBondContact O-N 3.1Å; R373-V493 HydrophobicContact CG-CG1 3.94Å; R373-V493 HydrophobicContact CG-CG2 4.28Å
374	L	91.3	Very high	85.7	Confident	112 Å²	112	80.5 Å²	80.5	59%	0.586	39%	0.391	S	S	*	.	H	α-helix	trans	-64	-46.2	175.4	-71.7	170.1	0	0	0	111	A370 R371 Y376 Q377 E378	A370-L374 WeakPolarHBondContact O-CG 3.14Å; A370-L374 PolarHBondContact O-N 3.16Å; R371-L374 PolarHBondContact O-N 3.19Å; L374-Y376 VanDerWaalsContact C-N 3.3Å; L374-Y376 PolarHBondContact O-N 3.45Å; L374-Q377 PolarHBondContact O-N 2.82Å; L374-E378 WeakPolarHBondContact O-CB 3.37Å; L374-E378 PolarHBondContact O-N 3.21Å
375	Q	91.6	Very high	88.1	Confident	100 Å²	100	78 Å²	78	47%	0.467	38%	0.379	S	S	.	.	H	α-helix	trans	-59.6	-39.1	174.5	-74.3	179.4	-25.9	0	0	112.6	R371 T379 L489	R371-Q375 WeakPolarHBondContact O-CG 3.02Å; R371-Q375 PolarHBondContact O-N 3.48Å; Q375-T379 VanDerWaalsContact O-CB 3.28Å; Q375-T379 WeakPolarHBondContact O-CB 3.21Å; Q375-T379 PolarHBondContact O-N 2.86Å; Q375-T379 PolarHBondContact O-OG1 3.02Å; Q375-L489 HydrophobicContact CB-CD1 4.2Å; Q375-L489 HydrophobicContact CB-CD2 4.22Å
376	Y	92.4	Very high	89.3	Confident	37 Å²	37	75.2 Å²	75.2	15%	0.145	36%	0.36	C	S	.	.	H	α-helix	trans	-63.6	-46.1	174.7	177.1	-94.4	0	0	0	111.9	A372 R373 L374 T379 R380 L486 L489 E490	A372-Y376 WeakPolarHBondContact O-CB 3.45Å; A372-Y376 PolarHBondContact O-N 2.73Å; R373-Y376 PolarHBondContact O-N 3.23Å; L374-Y376 VanDerWaalsContact C-N 3.3Å; L374-Y376 PolarHBondContact O-N 3.45Å; Y376-T379 PolarHBondContact O-N 2.79Å; Y376-R380 HydrophobicContact CE1-CG 4.29Å; Y376-R380 WeakPolarHBondContact O-CG 3.5Å; Y376-R380 PolarHBondContact O-N 3.32Å; Y376-R380 PolarHBondContact OH-NH1 3.23Å; Y376-L486 HydrophobicContact CD2-CD1 3.54Å; Y376-L486 HydrophobicContact CE2-CD1 3.37Å; Y376-L486 HydrophobicContact CE2-CG 4.08Å; Y376-L486 HydrophobicContact CG-CD1 4.3Å; Y376-L489 HydrophobicContact CD2-CB 4.11Å; Y376-E490 HydrophobicContact CD2-CB 4.42Å; Y376-E490 HydrophobicContact CE2-CB 3.86Å; Y376-E490 HydrophobicContact CE2-CG 4.11Å
377	Q	91.3	Very high	90	Very high	110 Å²	110	72.6 Å²	72.6	51%	0.514	34%	0.342	S	S	.	.	H	α-helix	trans	-64.8	-40	177.1	-74.1	175.4	-23.8	0	0	112.8	R373 L374 R380 H381	R373-Q377 WeakPolarHBondContact O-CG 3.3Å; R373-Q377 PolarHBondContact O-N 3.1Å; L374-Q377 PolarHBondContact O-N 2.82Å; Q377-R380 PolarHBondContact O-N 3.34Å; Q377-H381 PolarHBondContact O-N 2.98Å; Q377-H381 PolarHBondContact O-ND1 2.73Å
378	E	92.8	Very high	90.5	Very high	95 Å²	95	75.5 Å²	75.5	44%	0.444	35%	0.347	S	S	.	.	H	α-helix	trans	-64	-43.7	174.2	-170.1	-171.8	168.5	0	0	111	L374 R380 H381 R382	L374-E378 WeakPolarHBondContact O-CB 3.37Å; L374-E378 PolarHBondContact O-N 3.21Å; E378-R380 VanDerWaalsContact C-N 3.33Å; E378-R380 PolarHBondContact O-N 3.27Å; E378-H381 PolarHBondContact O-N 2.97Å; E378-H381 VanDerWaalsContact O-N 3.17Å; E378-R382 WeakPolarHBondContact O-CG 3.38Å; E378-R382 PolarHBondContact O-N 2.83Å; E378-R382 IonicContact OE1-CZ 3.52Å; E378-R382 IonicContact OE1-NE 3.94Å; E378-R382 PolarHBondContact OE1-NE 3.09Å; E378-R382 IonicContact OE1-NH2 2.66Å; E378-R382 PolarHBondContact OE1-NH2 2.89Å
379	T	90.7	Very high	91.1	Very high	16 Å²	16	77.1 Å²	77.1	10%	0.098	35%	0.349	C	S	.	.	H	α-helix	trans	-63.2	-37.6	176.3	-57.2	0	0	0	0	111.6	Q375 Y376 R382 L383 I482 V485 L486 L489	Q375-T379 VanDerWaalsContact O-CB 3.28Å; Q375-T379 WeakPolarHBondContact O-CB 3.21Å; Q375-T379 PolarHBondContact O-N 2.86Å; Q375-T379 PolarHBondContact O-OG1 3.02Å; Y376-T379 PolarHBondContact O-N 2.79Å; T379-R382 PolarHBondContact O-N 2.8Å; T379-L383 WeakPolarHBondContact O-CB 3.22Å; T379-L383 PolarHBondContact O-N 2.89Å; T379-I482 HydrophobicContact CG2-CG2 3.85Å; T379-V485 HydrophobicContact CG2-CB 4.37Å; T379-V485 HydrophobicContact CG2-CG1 4.09Å; T379-L486 HydrophobicContact CG2-CB 4.04Å; T379-L486 HydrophobicContact CG2-CD1 4.19Å; T379-L489 HydrophobicContact CG2-CD1 4.43Å; T379-L489 WeakPolarHBondContact OG1-CD1 3.39Å
380	R	91.4	Very high	91.5	Very high	77 Å²	77	77.1 Å²	77.1	29%	0.291	35%	0.349	S	S	.	.	H	α-helix	trans	-65.2	-39.5	171.9	-72.4	-176.7	73.9	132.7	-0.6	112.6	Y376 Q377 E378 L383 H384 L486 D522	Y376-R380 HydrophobicContact CE1-CG 4.29Å; Y376-R380 WeakPolarHBondContact O-CG 3.5Å; Y376-R380 PolarHBondContact O-N 3.32Å; Y376-R380 PolarHBondContact OH-NH1 3.23Å; Q377-R380 PolarHBondContact O-N 3.34Å; E378-R380 VanDerWaalsContact C-N 3.33Å; E378-R380 PolarHBondContact O-N 3.27Å; R380-L383 WeakPolarHBondContact O-CB 3.4Å; R380-L383 PolarHBondContact O-N 3.24Å; R380-H384 PolarHBondContact O-N 2.81Å; R380-L486 HydrophobicContact CG-CD1 3.48Å; R380-L486 VanDerWaalsContact CG-CD1 3.48Å; R380-L486 HydrophobicContact CG-CD2 4.17Å; R380-L486 HydrophobicContact CG-CG 4.5Å; R380-D522 IonicContact CZ-OD1 3.11Å; R380-D522 IonicContact NH1-OD1 2.69Å; R380-D522 PolarHBondContact NH1-OD1 2.87Å; R380-D522 VanDerWaalsContact NH1-OD1 3.08Å; R380-D522 IonicContact NH1-OD2 3.37Å; R380-D522 PolarHBondContact NH1-OD2 2.95Å; R380-D522 IonicContact NH2-OD1 3.6Å; R380-D522 PolarHBondContact NH2-OD1 3.34Å
381	H	92.9	Very high	91.8	Very high	144 Å²	144	77.7 Å²	77.7	67%	0.667	35%	0.354	S	S	*	.	H	α-helix	trans	-65.6	-42.9	174.8	-82.7	79.6	0	0	0	112.2	Q377 E378 L383 H384 N385	Q377-H381 PolarHBondContact O-N 2.98Å; Q377-H381 PolarHBondContact O-ND1 2.73Å; E378-H381 PolarHBondContact O-N 2.97Å; E378-H381 VanDerWaalsContact O-N 3.17Å; H381-L383 VanDerWaalsContact C-N 3.31Å; H381-L383 PolarHBondContact O-N 2.88Å; H381-H384 PolarHBondContact O-N 2.82Å; H381-N385 PolarHBondContact O-N 3.18Å
382	R	93.9	Very high	92	Very high	143 Å²	143	75.4 Å²	75.4	54%	0.54	35%	0.352	S	S	.	.	H	α-helix	trans	-59.9	-41.2	174	-68	175.2	-175.6	-148.6	5.4	111.6	E378 T379 L386 I482	E378-R382 WeakPolarHBondContact O-CG 3.38Å; E378-R382 PolarHBondContact O-N 2.83Å; E378-R382 IonicContact OE1-CZ 3.52Å; E378-R382 IonicContact OE1-NE 3.94Å; E378-R382 PolarHBondContact OE1-NE 3.09Å; E378-R382 IonicContact OE1-NH2 2.66Å; E378-R382 PolarHBondContact OE1-NH2 2.89Å; T379-R382 PolarHBondContact O-N 2.8Å; R382-L386 WeakPolarHBondContact O-CG 3.48Å; R382-L386 PolarHBondContact O-N 2.88Å; R382-L386 VanDerWaalsContact O-N 3.16Å; R382-I482 HydrophobicContact CB-CD1 4.42Å
383	L	92.5	Very high	92.3	Very high	9 Å²	9	75.9 Å²	75.9	5%	0.047	35%	0.354	C	S	.	.	H	α-helix	trans	-61.3	-47.3	174.3	-179.3	60.9	0	0	0	112	T379 R380 H381 L386 Q387 I479 I482 L486	T379-L383 WeakPolarHBondContact O-CB 3.22Å; T379-L383 PolarHBondContact O-N 2.89Å; R380-L383 WeakPolarHBondContact O-CB 3.4Å; R380-L383 PolarHBondContact O-N 3.24Å; H381-L383 VanDerWaalsContact C-N 3.31Å; H381-L383 PolarHBondContact O-N 2.88Å; L383-L386 PolarHBondContact O-N 2.94Å; L383-Q387 WeakPolarHBondContact O-CG 3.38Å; L383-Q387 PolarHBondContact O-N 2.6Å; L383-I479 HydrophobicContact CD1-CB 4.4Å; L383-I479 HydrophobicContact CD1-CG1 4.28Å; L383-I479 HydrophobicContact CD1-CG2 3.91Å; L383-I482 HydrophobicContact CB-CG2 3.81Å; L383-I482 HydrophobicContact CD1-CG2 4.18Å; L383-I482 HydrophobicContact CG-CG2 4.49Å; L383-L486 HydrophobicContact CD2-CD2 3.95Å
384	H	92.5	Very high	92.2	Very high	111 Å²	111	73.4 Å²	73.4	51%	0.514	35%	0.348	S	S	.	.	H	α-helix	trans	-61.5	-44.8	179.1	-172.8	-77.8	0	0	0	112.2	R380 H381 L386 Q387 E388	R380-H384 PolarHBondContact O-N 2.81Å; H381-H384 PolarHBondContact O-N 2.82Å; H384-L386 VanDerWaalsContact C-N 3.31Å; H384-L386 PolarHBondContact O-N 2.92Å; H384-Q387 WeakPolarHBondContact O-CB 3.35Å; H384-Q387 PolarHBondContact O-N 2.91Å; H384-Q387 VanDerWaalsContact O-N 3.11Å; H384-E388 PolarHBondContact O-N 2.78Å
385	N	95.3	Very high	92.1	Very high	81 Å²	81	75.8 Å²	75.8	43%	0.433	36%	0.356	S	S	.	.	H	α-helix	trans	-62.4	-36.9	177.7	-175.9	-96.2	0	0	0	112.4	H381 R389	H381-N385 PolarHBondContact O-N 3.18Å; N385-R389 WeakPolarHBondContact O-CG 3.42Å; N385-R389 PolarHBondContact O-N 3.19Å
386	L	93.1	Very high	91.8	Very high	11 Å²	11	76.8 Å²	76.8	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-70.2	-32.8	173	-71	-178.5	0	0	0	113.2	R382 L383 H384 L390 I475 E478 I479 I482	R382-L386 WeakPolarHBondContact O-CG 3.48Å; R382-L386 PolarHBondContact O-N 2.88Å; R382-L386 VanDerWaalsContact O-N 3.16Å; L383-L386 PolarHBondContact O-N 2.94Å; H384-L386 VanDerWaalsContact C-N 3.31Å; H384-L386 PolarHBondContact O-N 2.92Å; L386-L390 VanDerWaalsContact O-CB 3.3Å; L386-L390 WeakPolarHBondContact O-CB 3.1Å; L386-L390 PolarHBondContact O-N 2.77Å; L386-I475 HydrophobicContact CB-CG2 4.18Å; L386-I475 HydrophobicContact CD2-CG2 4.34Å; L386-I475 WeakPolarHBondContact O-CG2 3.45Å; L386-E478 HydrophobicContact CD1-CB 3.71Å; L386-I479 HydrophobicContact CB-CD1 4.17Å; L386-I479 HydrophobicContact CB-CG1 3.73Å; L386-I479 HydrophobicContact CD1-CG1 4.18Å; L386-I482 HydrophobicContact CD1-CD1 3.4Å; L386-I482 VanDerWaalsContact CD1-CD1 3.4Å
387	Q	92.7	Very high	91.6	Very high	37 Å²	37	75.6 Å²	75.6	17%	0.173	36%	0.357	C	S	.	.	H	α-helix	trans	-68.1	-41	174.3	-73.4	168	-24.8	0	0	111.8	L383 H384 L390 A391 I479 W525	L383-Q387 WeakPolarHBondContact O-CG 3.38Å; L383-Q387 PolarHBondContact O-N 2.6Å; H384-Q387 WeakPolarHBondContact O-CB 3.35Å; H384-Q387 PolarHBondContact O-N 2.91Å; H384-Q387 VanDerWaalsContact O-N 3.11Å; Q387-L390 WeakPolarHBondContact O-CB 3.23Å; Q387-L390 PolarHBondContact O-N 2.84Å; Q387-A391 PolarHBondContact O-N 3.39Å; Q387-I479 HydrophobicContact CG-CD1 4.24Å; Q387-W525 VanDerWaalsContact NE2-CE3 3.29Å
388	E	92.8	Very high	91.2	Very high	108 Å²	108	73.2 Å²	73.2	51%	0.505	35%	0.352	S	S	.	.	H	α-helix	trans	-61.4	-47.7	173.3	-176.2	177	-167	0	0	111.3	H384 L390 A391 L392	H384-E388 PolarHBondContact O-N 2.78Å; E388-L390 VanDerWaalsContact C-N 3.33Å; E388-L390 PolarHBondContact O-N 2.86Å; E388-A391 PolarHBondContact O-N 2.88Å; E388-L392 WeakPolarHBondContact O-CG 3.41Å; E388-L392 PolarHBondContact O-N 3.17Å; E388-L392 VanDerWaalsContact O-N 3.09Å
389	R	93	Very high	90.5	Very high	93 Å²	93	72.3 Å²	72.3	35%	0.351	36%	0.355	S	S	.	.	H	α-helix	trans	-61.4	-37.9	172.8	-73.1	177.8	61.1	-153.8	-3.6	113	N385 I393 E471 I475	N385-R389 WeakPolarHBondContact O-CG 3.42Å; N385-R389 PolarHBondContact O-N 3.19Å; R389-I393 WeakPolarHBondContact O-CG1 3.36Å; R389-I393 PolarHBondContact O-N 2.83Å; R389-E471 IonicContact CZ-OE1 2.85Å; R389-E471 IonicContact NH2-OE1 2.71Å; R389-E471 PolarHBondContact NH2-OE1 2.77Å; R389-I475 HydrophobicContact CB-CD1 3.82Å
390	L	92.9	Very high	90.1	Very high	16 Å²	16	73.4 Å²	73.4	8%	0.084	36%	0.361	C	S	.	.	H	α-helix	trans	-63.7	-43.7	175.8	-178.5	63.8	0	0	0	111.1	L386 Q387 E388 I393 E394 R472 I475 I479	L386-L390 VanDerWaalsContact O-CB 3.3Å; L386-L390 WeakPolarHBondContact O-CB 3.1Å; L386-L390 PolarHBondContact O-N 2.77Å; Q387-L390 WeakPolarHBondContact O-CB 3.23Å; Q387-L390 PolarHBondContact O-N 2.84Å; E388-L390 VanDerWaalsContact C-N 3.33Å; E388-L390 PolarHBondContact O-N 2.86Å; L390-I393 PolarHBondContact O-N 2.87Å; L390-E394 HydrophobicContact CD1-CG 4.11Å; L390-E394 HydrophobicContact CG-CG 4.3Å; L390-E394 WeakPolarHBondContact O-CB 3.4Å; L390-E394 WeakPolarHBondContact O-CG 3.23Å; L390-E394 PolarHBondContact O-N 3.26Å; L390-R472 HydrophobicContact CD1-CG 3.56Å; L390-I475 HydrophobicContact CB-CG2 3.95Å; L390-I475 HydrophobicContact CD1-CG2 4.4Å; L390-I479 HydrophobicContact CB-CD1 4.34Å; L390-I479 HydrophobicContact CD2-CD1 3.87Å
391	A	91	Very high	89.7	Confident	57 Å²	57	72.7 Å²	72.7	47%	0.471	36%	0.361	S	S	.	.	H	α-helix	trans	-61.8	-45.6	178.8	0	0	0	0	0	112	Q387 E388 I393 E394 E395	Q387-A391 PolarHBondContact O-N 3.39Å; E388-A391 PolarHBondContact O-N 2.88Å; A391-I393 PolarHBondContact O-N 3.43Å; A391-E394 PolarHBondContact O-N 3.23Å; A391-E395 PolarHBondContact O-N 3.35Å
392	L	93.4	Very high	89.4	Confident	94 Å²	94	67 Å²	67	49%	0.492	34%	0.335	S	S	.	.	H	α-helix	trans	-62.2	-28.7	176.9	-67.9	172.6	0	0	0	113.5	E388 Q396	E388-L392 WeakPolarHBondContact O-CG 3.41Å; E388-L392 PolarHBondContact O-N 3.17Å; E388-L392 VanDerWaalsContact O-N 3.09Å; L392-Q396 PolarHBondContact O-NE2 3.34Å
393	I	91.6	Very high	89.1	Confident	12 Å²	12	64.2 Å²	64.2	6%	0.062	33%	0.328	C	S	.	.	H	α-helix	trans	-83.5	-37.7	174.9	-68.3	173.9	0	0	0	111	R389 L390 A391 E395 Q396 I397 L468 E471 R472 I475	R389-I393 WeakPolarHBondContact O-CG1 3.36Å; R389-I393 PolarHBondContact O-N 2.83Å; L390-I393 PolarHBondContact O-N 2.87Å; A391-I393 PolarHBondContact O-N 3.43Å; I393-E395 VanDerWaalsContact C-N 3.28Å; I393-E395 PolarHBondContact O-N 2.53Å; I393-Q396 PolarHBondContact O-N 3.47Å; I393-Q396 VanDerWaalsContact O-N 3.14Å; I393-I397 HydrophobicContact CG2-CD1 3.51Å; I393-I397 HydrophobicContact CG2-CG1 4.31Å; I393-I397 WeakPolarHBondContact O-CG1 3.44Å; I393-I397 PolarHBondContact O-N 2.87Å; I393-L468 WeakPolarHBondContact CG2-O 3.48Å; I393-E471 HydrophobicContact CD1-CB 4.15Å; I393-E471 HydrophobicContact CD1-CG 3.67Å; I393-R472 HydrophobicContact CG2-CB 3.79Å; I393-R472 HydrophobicContact CG2-CG 4.2Å; I393-I475 HydrophobicContact CD1-CD1 3.7Å
394	E	87.9	Confident	88.8	Confident	78 Å²	78	63.8 Å²	63.8	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-67.8	-27.4	176.5	-75.2	-177.6	164.2	0	0	112.3	L390 A391 Q396 R472 R476	L390-E394 HydrophobicContact CD1-CG 4.11Å; L390-E394 HydrophobicContact CG-CG 4.3Å; L390-E394 WeakPolarHBondContact O-CB 3.4Å; L390-E394 WeakPolarHBondContact O-CG 3.23Å; L390-E394 PolarHBondContact O-N 3.26Å; A391-E394 PolarHBondContact O-N 3.23Å; E394-Q396 VanDerWaalsContact C-N 3.34Å; E394-R472 HydrophobicContact CG-CG 4.11Å; E394-R476 IonicContact OE1-NH2 3.65Å; E394-R476 PolarHBondContact OE1-NH2 2.92Å; E394-R476 VanDerWaalsContact OE1-NH2 3.09Å
395	E	87.8	Confident	88.7	Confident	163 Å²	163	58.5 Å²	58.5	76%	0.762	30%	0.302	S	S	*	.	H	α-helix	trans	-66.2	-32.1	169.2	-172.7	173.6	-170.9	0	0	113	A391 I393	A391-E395 PolarHBondContact O-N 3.35Å; I393-E395 VanDerWaalsContact C-N 3.28Å; I393-E395 PolarHBondContact O-N 2.53Å
396	Q	85.8	Confident	88.5	Confident	121 Å²	121	60.4 Å²	60.4	57%	0.565	30%	0.303	S	S	*	.	H	α-helix	trans	-86.4	-14.2	-179.9	-69.7	173.1	61.4	0	0	114	L392 I393 E394 L468	L392-Q396 PolarHBondContact O-NE2 3.34Å; I393-Q396 PolarHBondContact O-N 3.47Å; I393-Q396 VanDerWaalsContact O-N 3.14Å; E394-Q396 VanDerWaalsContact C-N 3.34Å; Q396-L468 HydrophobicContact CB-CD1 4.36Å
397	I	87.8	Confident	88.4	Confident	11 Å²	11	60.7 Å²	60.7	6%	0.056	30%	0.304	C	S	.	.			trans	-119.6	100	-173.9	-54.9	171.4	0	0	0	111.1	I393 P399 L468 H469 R472	I393-I397 HydrophobicContact CG2-CD1 3.51Å; I393-I397 HydrophobicContact CG2-CG1 4.31Å; I393-I397 WeakPolarHBondContact O-CG1 3.44Å; I393-I397 PolarHBondContact O-N 2.87Å; I397-P399 WeakPolarHBondContact O-CD 3.37Å; I397-L468 VanDerWaalsContact CD1-C 3.43Å; I397-L468 HydrophobicContact CD1-CB 3.77Å; I397-L468 WeakPolarHBondContact CD1-O 3.37Å; I397-L468 HydrophobicContact CG1-CB 4.07Å; I397-H469 HydrophobicContact CD1-CB 4.27Å; I397-R472 HydrophobicContact CD1-CB 4.3Å
398	S	84	Confident	88.3	Confident	61 Å²	61	61.4 Å²	61.4	43%	0.427	31%	0.308	S	S	.	.			trans	-72	122.6	162.8	175.4	0	0	0	0	110.7	V400 Q401 M402	S398-V400 PolarHBondContact O-N 3.29Å; S398-V400 PolarHBondContact OG-N 2.78Å; S398-Q401 PolarHBondContact O-N 3.36Å; S398-M402 PolarHBondContact O-N 3.46Å
399	P	77.8	Confident	88.2	Confident	75 Å²	75	57.9 Å²	57.9	49%	0.487	29%	0.292	S	S	.	.	H	α-helix	trans	-60.9	-30.6	175.4	-23.4	34.5	0	0	0	113.2	I397 E403	I397-P399 WeakPolarHBondContact O-CD 3.37Å; P399-E403 PolarHBondContact O-N 3.32Å
400	V	82.2	Confident	88.2	Confident	39 Å²	39	56 Å²	56	24%	0.236	29%	0.291	C	S	.	.	H	α-helix	trans	-74.9	-38.4	-177.2	-158.7	0	0	0	0	110.7	Y152 A155 S398 E403 T404	Y152-V400 HydrophobicContact CD2-CG1 4.11Å; Y152-V400 HydrophobicContact CE2-CG1 4.49Å; A155-V400 HydrophobicContact CB-CB 4.31Å; A155-V400 HydrophobicContact CB-CG1 3.41Å; A155-V400 VanDerWaalsContact CB-CG1 3.41Å; S398-V400 PolarHBondContact O-N 3.29Å; S398-V400 PolarHBondContact OG-N 2.78Å; V400-E403 PolarHBondContact O-N 2.75Å; V400-T404 PolarHBondContact O-N 2.85Å
401	Q	83.8	Confident	88.3	Confident	62 Å²	62	55.9 Å²	55.9	29%	0.29	29%	0.29	S	S	.	.	H	α-helix	trans	-64	-39.8	172.6	-172.6	63.6	40.7	0	0	111.8	S398 E403 T404 D405	S398-Q401 PolarHBondContact O-N 3.36Å; Q401-E403 PolarHBondContact O-N 3.32Å; Q401-T404 WeakPolarHBondContact CA-OG1 3.48Å; Q401-T404 PolarHBondContact NE2-OG1 3.27Å; Q401-T404 PolarHBondContact O-N 2.99Å; Q401-T404 VanDerWaalsContact O-N 3.1Å; Q401-T404 PolarHBondContact O-OG1 3Å; Q401-D405 PolarHBondContact NE2-OD1 2.87Å; Q401-D405 WeakPolarHBondContact O-CB 3.48Å; Q401-D405 PolarHBondContact O-N 3.39Å
402	M	86.4	Confident	88.3	Confident	24 Å²	24	53.7 Å²	53.7	12%	0.118	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-31	177.1	-179	-168	55.2	0	0	112.4	S398 R406 F466 H469	S398-M402 PolarHBondContact O-N 3.46Å; M402-R406 VanDerWaalsContact O-CG 3.3Å; M402-R406 WeakPolarHBondContact O-CG 3.25Å; M402-R406 PolarHBondContact O-N 2.89Å; M402-F466 HydrophobicContact CG-CE1 3.91Å; M402-F466 HydrophobicContact CG-CZ 4.36Å; M402-H469 PolarHBondContact SD-CE1 2.83Å; M402-H469 PolarHBondContact SD-ND1 3.5Å
403	E	86.7	Confident	88.3	Confident	85 Å²	85	54.5 Å²	54.5	40%	0.397	27%	0.272	S	S	.	.	H	α-helix	trans	-72.3	-37.7	174.6	-68.1	-174.6	171.1	0	0	113	Q159 P399 V400 Q401 D405 R406 D407	Q159-E403 PolarHBondContact NE2-OE2 3.19Å; P399-E403 PolarHBondContact O-N 3.32Å; V400-E403 PolarHBondContact O-N 2.75Å; Q401-E403 PolarHBondContact O-N 3.32Å; E403-D405 VanDerWaalsContact C-N 3.32Å; E403-R406 PolarHBondContact O-N 2.87Å; E403-D407 PolarHBondContact O-N 3.03Å
404	T	87.3	Confident	88.5	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-41.8	171.2	52.6	0	0	0	0	110.8	A155 E158 Q159 V400 Q401 R406 D407 Q408	A155-T404 HydrophobicContact CB-CG2 4.37Å; E158-T404 HydrophobicContact CB-CG2 4.01Å; Q159-T404 HydrophobicContact CB-CG2 4.5Å; Q159-T404 HydrophobicContact CG-CG2 3.52Å; V400-T404 PolarHBondContact O-N 2.85Å; Q401-T404 WeakPolarHBondContact CA-OG1 3.48Å; Q401-T404 PolarHBondContact NE2-OG1 3.27Å; Q401-T404 PolarHBondContact O-N 2.99Å; Q401-T404 VanDerWaalsContact O-N 3.1Å; Q401-T404 PolarHBondContact O-OG1 3Å; T404-R406 VanDerWaalsContact C-N 3.34Å; T404-R406 PolarHBondContact O-N 3.38Å; T404-D407 PolarHBondContact O-N 3.4Å; T404-Q408 WeakPolarHBondContact O-CG 3.33Å; T404-Q408 PolarHBondContact O-N 3.44Å
405	D	89.7	Confident	88.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.8	-36.7	-178.9	-66.5	4.6	0	0	0	111.4	Q401 E403 Q408 I409 M462 R465 F466	Q401-D405 PolarHBondContact NE2-OD1 2.87Å; Q401-D405 WeakPolarHBondContact O-CB 3.48Å; Q401-D405 PolarHBondContact O-N 3.39Å; E403-D405 VanDerWaalsContact C-N 3.32Å; D405-Q408 PolarHBondContact O-N 3.08Å; D405-I409 WeakPolarHBondContact O-CG1 3.38Å; D405-I409 PolarHBondContact O-N 3.02Å; D405-M462 HydrophobicContact CB-CG 3.78Å; D405-M462 HydrophobicContact CB-SD 3.76Å; D405-M462 VanDerWaalsContact O-SD 3.38Å; D405-R465 IonicContact OD1-NH1 3.71Å; D405-R465 PolarHBondContact OD1-NH1 2.97Å; D405-R465 WeakPolarHBondContact OD2-CD 3.44Å; D405-R465 IonicContact OD2-CZ 3.41Å; D405-R465 IonicContact OD2-NE 3.61Å; D405-R465 IonicContact OD2-NH1 3.23Å; D405-R465 PolarHBondContact OD2-NH1 2.81Å; D405-F466 HydrophobicContact CB-CE2 4.16Å; D405-F466 HydrophobicContact CB-CZ 4.28Å
406	R	90.5	Very high	89.2	Confident	121 Å²	121	49.2 Å²	49.2	46%	0.457	25%	0.246	S	C	.	.	H	α-helix	trans	-60.6	-50.2	170.5	-75.9	172.7	-178.9	169.8	-0.1	112.1	M402 E403 T404 Q408 I409 T410 F466	M402-R406 VanDerWaalsContact O-CG 3.3Å; M402-R406 WeakPolarHBondContact O-CG 3.25Å; M402-R406 PolarHBondContact O-N 2.89Å; E403-R406 PolarHBondContact O-N 2.87Å; T404-R406 VanDerWaalsContact C-N 3.34Å; T404-R406 PolarHBondContact O-N 3.38Å; R406-Q408 VanDerWaalsContact C-N 3.29Å; R406-Q408 PolarHBondContact O-N 3.3Å; R406-I409 PolarHBondContact O-N 3.29Å; R406-T410 PolarHBondContact O-N 2.94Å; R406-T410 VanDerWaalsContact O-N 3.1Å; R406-F466 HydrophobicContact CG-CE1 4.01Å; R406-F466 HydrophobicContact CG-CZ 3.73Å
407	D	91.1	Very high	89.6	Confident	16 Å²	16	47.1 Å²	47.1	9%	0.086	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-37.4	178.3	-80.5	-24.9	0	0	0	110.5	A162 K163 K257 E403 T404 T410 L411	A162-D407 HydrophobicContact CB-CB 4.05Å; K163-D407 VanDerWaalsContact CE-CG 3.42Å; K163-D407 WeakPolarHBondContact CE-OD1 3.17Å; K163-D407 VanDerWaalsContact CE-OD2 3.27Å; K163-D407 WeakPolarHBondContact CE-OD2 3.38Å; K163-D407 IonicContact NZ-OD1 3.2Å; K163-D407 PolarHBondContact NZ-OD1 3.4Å; K257-D407 IonicContact NZ-OD2 2.82Å; K257-D407 PolarHBondContact NZ-OD2 2.65Å; E403-D407 PolarHBondContact O-N 3.03Å; T404-D407 PolarHBondContact O-N 3.4Å; D407-T410 PolarHBondContact O-N 2.81Å; D407-T410 PolarHBondContact O-OG1 3.13Å; D407-L411 PolarHBondContact O-N 3.39Å
408	Q	90.8	Very high	90	Very high	52 Å²	52	46.9 Å²	46.9	24%	0.243	24%	0.235	C	C	.	.	H	α-helix	trans	-62.9	-44.2	173.8	-73.7	-179.6	31.7	0	0	113.4	T404 D405 R406 T410 L411 I412 M462	T404-Q408 WeakPolarHBondContact O-CG 3.33Å; T404-Q408 PolarHBondContact O-N 3.44Å; D405-Q408 PolarHBondContact O-N 3.08Å; R406-Q408 VanDerWaalsContact C-N 3.29Å; R406-Q408 PolarHBondContact O-N 3.3Å; Q408-T410 VanDerWaalsContact C-N 3.33Å; Q408-T410 PolarHBondContact O-N 3.32Å; Q408-L411 WeakPolarHBondContact O-CB 3.3Å; Q408-L411 PolarHBondContact O-N 3.21Å; Q408-L411 VanDerWaalsContact O-N 3.16Å; Q408-I412 WeakPolarHBondContact O-CG1 3.45Å; Q408-I412 PolarHBondContact O-N 3.25Å; Q408-M462 HydrophobicContact CB-CE 4.15Å; Q408-M462 HydrophobicContact CB-SD 3.69Å
409	I	91.6	Very high	90.6	Very high	34 Å²	34	44.5 Å²	44.5	17%	0.174	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-42.7	174.7	-71.8	177.2	0	0	0	110.8	D405 R406 L411 I412 Q413 M462 F466	D405-I409 WeakPolarHBondContact O-CG1 3.38Å; D405-I409 PolarHBondContact O-N 3.02Å; R406-I409 PolarHBondContact O-N 3.29Å; I409-L411 VanDerWaalsContact C-N 3.28Å; I409-L411 PolarHBondContact O-N 3.24Å; I409-I412 PolarHBondContact O-N 3.33Å; I409-Q413 HydrophobicContact CG2-CG 4.47Å; I409-Q413 WeakPolarHBondContact O-CG 3.21Å; I409-Q413 PolarHBondContact O-N 3.49Å; I409-M462 HydrophobicContact CD1-CB 4.42Å; I409-M462 HydrophobicContact CG1-CE 3.85Å; I409-M462 HydrophobicContact CG1-SD 3.91Å; I409-F466 HydrophobicContact CD1-CD2 3.88Å; I409-F466 HydrophobicContact CD1-CE2 3.37Å; I409-F466 HydrophobicContact CD1-CZ 4.21Å
410	T	92.1	Very high	91.4	Very high	53 Å²	53	45.7 Å²	45.7	33%	0.325	22%	0.217	S	C	.	.	H	α-helix	trans	-65	-32.3	176.3	63	0	0	0	0	112.6	I166 R406 D407 Q408 E414	I166-T410 WeakPolarHBondContact CD1-OG1 3.5Å; R406-T410 PolarHBondContact O-N 2.94Å; R406-T410 VanDerWaalsContact O-N 3.1Å; D407-T410 PolarHBondContact O-N 2.81Å; D407-T410 PolarHBondContact O-OG1 3.13Å; Q408-T410 VanDerWaalsContact C-N 3.33Å; Q408-T410 PolarHBondContact O-N 3.32Å; T410-E414 WeakPolarHBondContact O-CB 3.1Å; T410-E414 VanDerWaalsContact O-CG 3.24Å; T410-E414 WeakPolarHBondContact O-CG 3.18Å; T410-E414 PolarHBondContact O-N 3.36Å
411	L	94.1	Very high	91.9	Very high	14 Å²	14	44.4 Å²	44.4	7%	0.073	21%	0.208	C	C	.	.	H	α-helix	trans	-66.2	-41.1	172.7	177.9	60.8	0	0	0	112.1	L165 I166 V169 D407 Q408 I409 K415	L165-L411 HydrophobicContact CB-CD1 3.74Å; L165-L411 HydrophobicContact CB-CD2 3.74Å; L165-L411 HydrophobicContact CB-CG 4.42Å; L165-L411 HydrophobicContact CD1-CD2 3.84Å; L165-L411 HydrophobicContact CG-CD2 4.46Å; I166-L411 HydrophobicContact CD1-CB 4.33Å; I166-L411 HydrophobicContact CG1-CB 3.81Å; I166-L411 HydrophobicContact CG1-CD1 3.88Å; I166-L411 HydrophobicContact CG1-CG 4.41Å; V169-L411 HydrophobicContact CG2-CD1 4.17Å; D407-L411 PolarHBondContact O-N 3.39Å; Q408-L411 WeakPolarHBondContact O-CB 3.3Å; Q408-L411 PolarHBondContact O-N 3.21Å; Q408-L411 VanDerWaalsContact O-N 3.16Å; I409-L411 VanDerWaalsContact C-N 3.28Å; I409-L411 PolarHBondContact O-N 3.24Å; L411-K415 HydrophobicContact CD1-CD 4.38Å; L411-K415 HydrophobicContact CD1-CG 4.26Å; L411-K415 HydrophobicContact CG-CD 4.32Å; L411-K415 WeakPolarHBondContact O-CB 3.28Å; L411-K415 VanDerWaalsContact O-CG 3.3Å; L411-K415 WeakPolarHBondContact O-CG 3.3Å; L411-K415 PolarHBondContact O-N 3.02Å
412	I	92.6	Very high	92.2	Very high	11 Å²	11	41.9 Å²	41.9	6%	0.056	20%	0.197	C	C	.	.	H	α-helix	trans	-61	-51.2	174.9	-67.1	168.5	0	0	0	109.7	Q408 I409 E414 K415 E416 L451 A454 H459 M462	Q408-I412 WeakPolarHBondContact O-CG1 3.45Å; Q408-I412 PolarHBondContact O-N 3.25Å; I409-I412 PolarHBondContact O-N 3.33Å; I412-E414 PolarHBondContact O-N 3.38Å; I412-K415 WeakPolarHBondContact O-CB 3.24Å; I412-K415 PolarHBondContact O-N 2.91Å; I412-K415 VanDerWaalsContact O-N 3.13Å; I412-E416 HydrophobicContact CG2-CG 4.39Å; I412-E416 WeakPolarHBondContact O-CG 3.42Å; I412-E416 PolarHBondContact O-N 2.78Å; I412-L451 HydrophobicContact CG2-CD2 3.9Å; I412-A454 HydrophobicContact CD1-CB 4.05Å; I412-A454 HydrophobicContact CG1-CB 4.13Å; I412-H459 HydrophobicContact CD1-CB 4.46Å; I412-M462 HydrophobicContact CD1-CE 3.83Å
413	Q	93.1	Very high	92.5	Very high	112 Å²	112	45.6 Å²	45.6	52%	0.523	21%	0.209	S	C	.	.	H	α-helix	trans	-58.3	-42.9	178.8	-69.6	172.9	-6.3	0	0	112.8	I409 E416 Q417	I409-Q413 HydrophobicContact CG2-CG 4.47Å; I409-Q413 WeakPolarHBondContact O-CG 3.21Å; I409-Q413 PolarHBondContact O-N 3.49Å; Q413-E416 PolarHBondContact O-N 3.07Å; Q413-Q417 VanDerWaalsContact O-CB 3.29Å; Q413-Q417 WeakPolarHBondContact O-CB 3.4Å; Q413-Q417 PolarHBondContact O-N 2.93Å
414	E	95.1	Very high	92.5	Very high	34 Å²	34	47.3 Å²	47.3	16%	0.159	22%	0.219	C	C	.	.	H	α-helix	trans	-68.1	-35.7	177	-72.5	-74.4	147.7	0	0	112.5	V169 K170 R173 T410 I412 L418	V169-E414 HydrophobicContact CG1-CB 3.84Å; V169-E414 WeakPolarHBondContact CG1-O 3.3Å; K170-E414 WeakPolarHBondContact CG-OE2 3.33Å; K170-E414 IonicContact NZ-OE1 3.81Å; K170-E414 PolarHBondContact NZ-OE1 2.97Å; K170-E414 IonicContact NZ-OE2 3.63Å; K170-E414 PolarHBondContact NZ-OE2 3.15Å; R173-E414 IonicContact CZ-OE2 3.7Å; R173-E414 VanDerWaalsContact NH1-CD 3.31Å; R173-E414 IonicContact NH1-OE1 2.65Å; R173-E414 PolarHBondContact NH1-OE1 2.84Å; R173-E414 IonicContact NH1-OE2 2.67Å; R173-E414 PolarHBondContact NH1-OE2 2.77Å; T410-E414 WeakPolarHBondContact O-CB 3.1Å; T410-E414 VanDerWaalsContact O-CG 3.24Å; T410-E414 WeakPolarHBondContact O-CG 3.18Å; T410-E414 PolarHBondContact O-N 3.36Å; I412-E414 PolarHBondContact O-N 3.38Å; E414-L418 WeakPolarHBondContact O-CB 3.4Å; E414-L418 PolarHBondContact O-N 3.5Å
415	K	95.5	Very high	92.4	Very high	19 Å²	19	48.8 Å²	48.8	8%	0.083	23%	0.228	C	C	.	.	H	α-helix	trans	-67.9	-43.9	173.7	-77.6	177.7	-176.2	179.1	0	111.8	V169 L411 I412 Q417 L418 L419 L447 D450 L451	V169-K415 HydrophobicContact CG2-CG 3.91Å; L411-K415 HydrophobicContact CD1-CD 4.38Å; L411-K415 HydrophobicContact CD1-CG 4.26Å; L411-K415 HydrophobicContact CG-CD 4.32Å; L411-K415 WeakPolarHBondContact O-CB 3.28Å; L411-K415 VanDerWaalsContact O-CG 3.3Å; L411-K415 WeakPolarHBondContact O-CG 3.3Å; L411-K415 PolarHBondContact O-N 3.02Å; I412-K415 WeakPolarHBondContact O-CB 3.24Å; I412-K415 PolarHBondContact O-N 2.91Å; I412-K415 VanDerWaalsContact O-N 3.13Å; K415-Q417 VanDerWaalsContact C-N 3.31Å; K415-Q417 PolarHBondContact O-N 2.68Å; K415-L418 PolarHBondContact O-N 3.29Å; K415-L419 WeakPolarHBondContact O-CB 3.42Å; K415-L419 PolarHBondContact O-N 3.31Å; K415-L447 HydrophobicContact CG-CD2 4.27Å; K415-D450 WeakPolarHBondContact CE-OD2 3.28Å; K415-D450 IonicContact NZ-OD1 3.4Å; K415-D450 PolarHBondContact NZ-OD1 2.83Å; K415-D450 IonicContact NZ-OD2 2.69Å; K415-D450 PolarHBondContact NZ-OD2 2.97Å; K415-L451 HydrophobicContact CB-CD1 4.36Å; K415-L451 HydrophobicContact CB-CD2 3.82Å; K415-L451 HydrophobicContact CB-CG 4.18Å; K415-L451 HydrophobicContact CD-CD2 4.45Å
416	E	95	Very high	92	Very high	88 Å²	88	48.8 Å²	48.8	41%	0.411	23%	0.228	S	C	.	.	H	α-helix	trans	-60.1	-42.9	174.7	-73	180	162.5	0	0	111.2	I412 Q413 L419 H420 L451	I412-E416 HydrophobicContact CG2-CG 4.39Å; I412-E416 WeakPolarHBondContact O-CG 3.42Å; I412-E416 PolarHBondContact O-N 2.78Å; Q413-E416 PolarHBondContact O-N 3.07Å; E416-L419 PolarHBondContact O-N 2.96Å; E416-H420 WeakPolarHBondContact O-CB 3.39Å; E416-H420 PolarHBondContact O-N 2.73Å; E416-L451 HydrophobicContact CG-CD1 3.84Å; E416-L451 HydrophobicContact CG-CD2 3.69Å; E416-L451 HydrophobicContact CG-CG 4.42Å
417	Q	94.9	Very high	91.4	Very high	77 Å²	77	51.1 Å²	51.1	36%	0.36	24%	0.238	S	C	.	.	H	α-helix	trans	-66.9	-40.4	176.8	-176.8	60.5	38.1	0	0	112.3	Q413 K415 H420 E421	Q413-Q417 VanDerWaalsContact O-CB 3.29Å; Q413-Q417 WeakPolarHBondContact O-CB 3.4Å; Q413-Q417 PolarHBondContact O-N 2.93Å; K415-Q417 VanDerWaalsContact C-N 3.31Å; K415-Q417 PolarHBondContact O-N 2.68Å; Q417-H420 PolarHBondContact O-N 3.15Å; Q417-E421 WeakPolarHBondContact CG-OE1 3.5Å; Q417-E421 PolarHBondContact NE2-OE1 3.37Å; Q417-E421 VanDerWaalsContact O-CG 3.31Å; Q417-E421 WeakPolarHBondContact O-CG 3.3Å; Q417-E421 PolarHBondContact O-N 2.91Å
418	L	96.4	Very high	90.5	Very high	6 Å²	6	51.9 Å²	51.9	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-63.3	-42.9	172.1	175.2	59.1	0	0	0	111.5	V169 D172 R173 L176 E414 K415 H420 E421 L422 L447	V169-L418 HydrophobicContact CG1-CB 4.08Å; V169-L418 HydrophobicContact CG1-CD2 4Å; D172-L418 HydrophobicContact CB-CD1 4.39Å; D172-L418 HydrophobicContact CB-CD2 3.91Å; R173-L418 HydrophobicContact CG-CB 3.74Å; R173-L418 HydrophobicContact CG-CD1 3.67Å; R173-L418 HydrophobicContact CG-CG 4.17Å; L176-L418 HydrophobicContact CD2-CD1 4.33Å; E414-L418 WeakPolarHBondContact O-CB 3.4Å; E414-L418 PolarHBondContact O-N 3.5Å; K415-L418 PolarHBondContact O-N 3.29Å; L418-H420 VanDerWaalsContact C-N 3.33Å; L418-H420 PolarHBondContact O-N 2.93Å; L418-E421 PolarHBondContact O-N 3.43Å; L418-L422 HydrophobicContact CD1-CD1 4.02Å; L418-L422 HydrophobicContact CD1-CG 3.99Å; L418-L422 HydrophobicContact CG-CD1 3.93Å; L418-L422 HydrophobicContact CG-CG 4.36Å; L418-L422 WeakPolarHBondContact O-CB 3.27Å; L418-L422 VanDerWaalsContact O-CG 3.29Å; L418-L422 WeakPolarHBondContact O-CG 3.01Å; L418-L422 PolarHBondContact O-N 2.96Å; L418-L447 HydrophobicContact CD2-CD1 3.9Å; L418-L447 HydrophobicContact CG-CD1 3.98Å
419	L	95.8	Very high	89.3	Confident	12 Å²	12	58.6 Å²	58.6	6%	0.063	28%	0.281	C	S	.	.	H	α-helix	trans	-61.4	-41	176.2	175.5	63	0	0	0	111.6	K415 E416 R423 M444 E448 L451	K415-L419 WeakPolarHBondContact O-CB 3.42Å; K415-L419 PolarHBondContact O-N 3.31Å; E416-L419 PolarHBondContact O-N 2.96Å; L419-R423 HydrophobicContact CD1-CG 4.49Å; L419-R423 WeakPolarHBondContact O-CB 3.29Å; L419-R423 VanDerWaalsContact O-CG 3.3Å; L419-R423 WeakPolarHBondContact O-CG 3.24Å; L419-R423 PolarHBondContact O-N 3.39Å; L419-M444 HydrophobicContact CD1-CB 3.97Å; L419-M444 HydrophobicContact CD1-CG 3.95Å; L419-E448 HydrophobicContact CD1-CG 3.85Å; L419-E448 HydrophobicContact CD2-CG 3.55Å; L419-E448 HydrophobicContact CG-CG 4.36Å; L419-L451 HydrophobicContact CB-CD1 4.46Å; L419-L451 HydrophobicContact CD2-CD1 3.78Å
420	H	94.1	Very high	88.1	Confident	100 Å²	100	62.4 Å²	62.4	46%	0.463	30%	0.296	S	S	.	.	H	α-helix	trans	-62.1	-48.4	173.4	-179.7	74	0	0	0	111.6	E416 Q417 L418 L422 R423 M424	E416-H420 WeakPolarHBondContact O-CB 3.39Å; E416-H420 PolarHBondContact O-N 2.73Å; Q417-H420 PolarHBondContact O-N 3.15Å; L418-H420 VanDerWaalsContact C-N 3.33Å; L418-H420 PolarHBondContact O-N 2.93Å; H420-L422 PolarHBondContact O-N 2.79Å; H420-R423 PolarHBondContact O-N 3.44Å; H420-M424 WeakPolarHBondContact O-CG 3.4Å; H420-M424 PolarHBondContact O-N 3.25Å
421	E	92.4	Very high	87	Confident	11 Å²	11	67.4 Å²	67.4	5%	0.051	31%	0.314	C	S	.	.	H	α-helix	trans	-61.1	-41.5	178	-69.7	171.3	-159.9	0	0	111.8	R173 L176 R239 Q417 L418 M424 V425	R173-E421 IonicContact CZ-OE1 3.59Å; R173-E421 IonicContact NE-OE1 3.38Å; R173-E421 PolarHBondContact NE-OE1 3.48Å; R173-E421 IonicContact NE-OE2 2.83Å; R173-E421 PolarHBondContact NE-OE2 3.36Å; R173-E421 IonicContact NH2-OE1 3.84Å; R173-E421 PolarHBondContact NH2-OE1 2.96Å; L176-E421 HydrophobicContact CD2-CB 3.71Å; R239-E421 IonicContact CZ-OE2 2.75Å; R239-E421 IonicContact NH2-OE1 2.62Å; R239-E421 IonicContact NH2-OE2 3.58Å; R239-E421 PolarHBondContact NH2-OE2 2.94Å; Q417-E421 WeakPolarHBondContact CG-OE1 3.5Å; Q417-E421 PolarHBondContact NE2-OE1 3.37Å; Q417-E421 VanDerWaalsContact O-CG 3.31Å; Q417-E421 WeakPolarHBondContact O-CG 3.3Å; Q417-E421 PolarHBondContact O-N 2.91Å; L418-E421 PolarHBondContact O-N 3.43Å; E421-M424 PolarHBondContact O-N 3.5Å; E421-V425 PolarHBondContact O-N 2.9Å
422	L	91.8	Very high	86	Confident	10 Å²	10	67.8 Å²	67.8	5%	0.052	32%	0.317	C	S	.	.	H	α-helix	trans	-63.7	-41.3	175.1	-72.3	168.7	0	0	0	112.7	L176 L418 H420 M424 V425 C426 L440 M444 L447	L176-L422 HydrophobicContact CD1-CD2 4.17Å; L176-L422 HydrophobicContact CD2-CD2 3.91Å; L176-L422 HydrophobicContact CD2-CG 4.12Å; L418-L422 HydrophobicContact CD1-CD1 4.02Å; L418-L422 HydrophobicContact CD1-CG 3.99Å; L418-L422 HydrophobicContact CG-CD1 3.93Å; L418-L422 HydrophobicContact CG-CG 4.36Å; L418-L422 WeakPolarHBondContact O-CB 3.27Å; L418-L422 VanDerWaalsContact O-CG 3.29Å; L418-L422 WeakPolarHBondContact O-CG 3.01Å; L418-L422 PolarHBondContact O-N 2.96Å; H420-L422 PolarHBondContact O-N 2.79Å; L422-M424 VanDerWaalsContact C-N 3.33Å; L422-M424 PolarHBondContact O-N 3.14Å; L422-V425 PolarHBondContact O-N 3.39Å; L422-C426 PolarHBondContact O-N 2.82Å; L422-C426 PolarHBondContact O-SG 3.29Å; L422-L440 HydrophobicContact CD2-CD2 3.68Å; L422-M444 HydrophobicContact CB-CG 3.71Å; L422-M444 HydrophobicContact CB-SD 4.04Å; L422-M444 HydrophobicContact CD1-CG 4.24Å; L422-L447 HydrophobicContact CD1-CD1 3.57Å
423	R	91.2	Very high	85.4	Confident	102 Å²	102	70.7 Å²	70.7	39%	0.385	34%	0.336	S	S	.	.	H	α-helix	trans	-61	-41.4	174.5	-76.7	170.1	176.5	-179.3	-0.4	111.6	L419 H420 V425 C426 Y427 M444 E448	L419-R423 HydrophobicContact CD1-CG 4.49Å; L419-R423 WeakPolarHBondContact O-CB 3.29Å; L419-R423 VanDerWaalsContact O-CG 3.3Å; L419-R423 WeakPolarHBondContact O-CG 3.24Å; L419-R423 PolarHBondContact O-N 3.39Å; H420-R423 PolarHBondContact O-N 3.44Å; R423-V425 VanDerWaalsContact C-N 3.28Å; R423-V425 PolarHBondContact O-N 3.32Å; R423-C426 PolarHBondContact O-N 2.86Å; R423-Y427 HydrophobicContact CB-CD2 4.38Å; R423-Y427 WeakPolarHBondContact O-CD2 3.48Å; R423-Y427 PolarHBondContact O-N 2.95Å; R423-M444 HydrophobicContact CG-CE 3.5Å; R423-M444 VanDerWaalsContact CG-CE 3.5Å; R423-M444 HydrophobicContact CG-SD 3.95Å; R423-E448 IonicContact CZ-OE1 2.72Å; R423-E448 IonicContact NE-OE1 2.79Å; R423-E448 IonicContact NH2-OE1 3.72Å; R423-E448 PolarHBondContact NH2-OE1 2.88Å
424	M	87.2	Confident	84.8	Confident	121 Å²	121	70.3 Å²	70.3	60%	0.596	34%	0.344	S	S	*	.	H	α-helix	trans	-63.2	-33.5	176.8	-66.4	-54.1	-61.6	0	0	112.4	H420 E421 L422 G428	H420-M424 WeakPolarHBondContact O-CG 3.4Å; H420-M424 PolarHBondContact O-N 3.25Å; E421-M424 PolarHBondContact O-N 3.5Å; L422-M424 VanDerWaalsContact C-N 3.33Å; L422-M424 PolarHBondContact O-N 3.14Å; M424-G428 WeakPolarHBondContact O-CA 3.3Å; M424-G428 PolarHBondContact O-N 2.97Å
425	V	84.5	Confident	84.4	Confident	31 Å²	31	76.7 Å²	76.7	19%	0.188	37%	0.373	C	S	.	.	H	α-helix	trans	-76.4	-37.9	175.4	173.2	0	0	0	0	112.4	L176 E180 E421 L422 R423 L440	L176-V425 HydrophobicContact CD1-CB 4.44Å; L176-V425 HydrophobicContact CD1-CG1 4.46Å; L176-V425 HydrophobicContact CD1-CG2 3.94Å; L176-V425 HydrophobicContact CD2-CG2 4.49Å; L176-V425 HydrophobicContact CG-CG2 4.27Å; E180-V425 HydrophobicContact CG-CG2 4.3Å; E421-V425 PolarHBondContact O-N 2.9Å; L422-V425 PolarHBondContact O-N 3.39Å; R423-V425 VanDerWaalsContact C-N 3.28Å; R423-V425 PolarHBondContact O-N 3.32Å; V425-L440 HydrophobicContact CG1-CD1 4.35Å
426	C	81.4	Confident	83.8	Confident	1 Å²	1	81.2 Å²	81.2	1%	0.007	40%	0.395	C	S	.	.	H	α-helix	trans	-73.5	-37.5	-179.7	-62.6	0	0	0	0	113.4	L422 R423 L440 M444	L422-C426 PolarHBondContact O-N 2.82Å; L422-C426 PolarHBondContact O-SG 3.29Å; R423-C426 PolarHBondContact O-N 2.86Å; C426-L440 VanDerWaalsContact SG-CB 3.54Å; C426-M444 HydrophobicContact CB-SD 4.21Å; C426-M444 VanDerWaalsContact SG-SD 3.63Å
427	Y	79.4	Confident	83.4	Confident	169 Å²	169	79.1 Å²	79.1	66%	0.663	39%	0.385	S	S	*	.	S	Bend	trans	-103.6	8.8	-176.8	-59.1	-65.1	0	0	0	114.1	R423 M444	R423-Y427 HydrophobicContact CB-CD2 4.38Å; R423-Y427 WeakPolarHBondContact O-CD2 3.48Å; R423-Y427 PolarHBondContact O-N 2.95Å; Y427-M444 HydrophobicContact CE2-CE 4.13Å
428	G	72	Confident	83.1	Confident	32 Å²	32	78 Å²	78	33%	0.33	39%	0.389	S	S	.	.	S	Bend	trans	-71.1	175.3	176.5	0	0	0	0	0	114.2	M424 K430	M424-G428 WeakPolarHBondContact O-CA 3.3Å; M424-G428 PolarHBondContact O-N 2.97Å; G428-K430 PolarHBondContact O-N 3.38Å; G428-K430 VanDerWaalsContact O-N 3.08Å
429	E	65.5	Low	82.7	Confident	193 Å²	193	82.5 Å²	82.5	90%	0.902	41%	0.411	S	S	*	.	S	Bend	trans	-60	-23.6	-175.2	-60.3	-165.5	145.6	0	0	114.7
430	K	66.4	Low	82.4	Confident	114 Å²	114	83.1 Å²	83.1	50%	0.496	41%	0.414	S	S	.	.	S	Bend	trans	-116.2	94.7	-179.8	-70.5	167.4	-173.6	150.3	0	108.6	H224 G428	H224-K430 PolarHBondContact NE2-NZ 2.98Å; G428-K430 PolarHBondContact O-N 3.38Å; G428-K430 VanDerWaalsContact O-N 3.08Å
431	K	68.7	Low	82.2	Confident	159 Å²	159	81.9 Å²	81.9	69%	0.691	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-57.7	130.7	173.7	-70.4	-168.9	175.2	-170.8	0	110.2
432	P	74.1	Confident	82.2	Confident	22 Å²	22	88.1 Å²	88.1	14%	0.143	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-65.3	163.9	174.4	24.8	-30.7	0	0	0	111.5	Q436 Q437 L440	P432-Q436 HydrophobicContact CB-CB 4.33Å; P432-Q437 HydrophobicContact CG-CB 3.98Å; P432-Q437 HydrophobicContact CG-CG 4.18Å; P432-L440 HydrophobicContact CG-CD1 4.2Å
433	P	79.3	Confident	82.2	Confident	72 Å²	72	92.7 Å²	92.7	47%	0.468	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-51.2	145.4	171.1	-25	33.5	0	0	0	111.7	E435 Q436 Q437	P433-E435 VanDerWaalsContact C-N 3.29Å; P433-E435 PolarHBondContact O-N 3.16Å; P433-E435 VanDerWaalsContact O-N 3.16Å; P433-Q436 HydrophobicContact CB-CB 4.49Å; P433-Q436 HydrophobicContact CB-CG 4.41Å; P433-Q436 CarbonylContact O-C 3.23Å; P433-Q436 WeakPolarHBondContact O-CA 3.21Å; P433-Q436 WeakPolarHBondContact O-CB 3.35Å; P433-Q436 PolarHBondContact O-N 2.79Å; P433-Q437 PolarHBondContact O-N 3.32Å
434	P	81.2	Confident	82.3	Confident	104 Å²	104	88.2 Å²	88.2	68%	0.675	44%	0.441	S	S	*	.	H	α-helix	trans	-58.8	-36.2	-169.3	21.8	-33.7	0	0	0	113.9	Q437 A438	P434-Q437 PolarHBondContact O-N 2.89Å; P434-A438 WeakPolarHBondContact O-CB 3.32Å; P434-A438 PolarHBondContact O-N 3.18Å
435	E	86.1	Confident	82.6	Confident	168 Å²	168	88.2 Å²	88.2	79%	0.785	44%	0.439	S	S	*	.	H	α-helix	trans	-66.3	-39.3	175.2	-62.8	177.8	177.3	0	0	112.5	P433 M439	P433-E435 VanDerWaalsContact C-N 3.29Å; P433-E435 PolarHBondContact O-N 3.16Å; P433-E435 VanDerWaalsContact O-N 3.16Å; E435-M439 PolarHBondContact O-N 2.68Å
436	Q	83.5	Confident	83.1	Confident	113 Å²	113	89.5 Å²	89.5	53%	0.528	45%	0.453	S	S	.	.	H	α-helix	trans	-72.3	-38.5	176.2	-66.2	-176.7	-4.9	0	0	110.8	P432 P433 M439 L440	P432-Q436 HydrophobicContact CB-CB 4.33Å; P433-Q436 HydrophobicContact CB-CB 4.49Å; P433-Q436 HydrophobicContact CB-CG 4.41Å; P433-Q436 CarbonylContact O-C 3.23Å; P433-Q436 WeakPolarHBondContact O-CA 3.21Å; P433-Q436 WeakPolarHBondContact O-CB 3.35Å; P433-Q436 PolarHBondContact O-N 2.79Å; Q436-M439 PolarHBondContact O-N 3.49Å; Q436-L440 WeakPolarHBondContact O-CB 3.44Å; Q436-L440 VanDerWaalsContact O-CG 3.24Å; Q436-L440 WeakPolarHBondContact O-CG 3.38Å; Q436-L440 PolarHBondContact O-N 2.97Å
437	Q	85.1	Confident	83.7	Confident	44 Å²	44	90.5 Å²	90.5	21%	0.206	46%	0.459	C	S	.	.	H	α-helix	trans	-59.3	-49.7	174.7	-163.9	-174.4	-37.6	0	0	110.6	P432 P433 P434 M439 L440 E441	P432-Q437 HydrophobicContact CG-CB 3.98Å; P432-Q437 HydrophobicContact CG-CG 4.18Å; P433-Q437 PolarHBondContact O-N 3.32Å; P434-Q437 PolarHBondContact O-N 2.89Å; Q437-M439 VanDerWaalsContact C-N 3.34Å; Q437-M439 PolarHBondContact O-N 2.86Å; Q437-L440 PolarHBondContact O-N 3.13Å; Q437-L440 VanDerWaalsContact O-N 3.12Å; Q437-E441 HydrophobicContact CG-CG 4.49Å; Q437-E441 WeakPolarHBondContact CG-OE1 3.25Å; Q437-E441 PolarHBondContact NE2-OE1 2.96Å; Q437-E441 WeakPolarHBondContact O-CB 3.32Å; Q437-E441 WeakPolarHBondContact O-CG 3.43Å; Q437-E441 PolarHBondContact O-N 2.97Å
438	A	88.2	Confident	84.5	Confident	55 Å²	55	84.2 Å²	84.2	46%	0.455	44%	0.435	S	S	.	.	H	α-helix	trans	-58.8	-42	177.8	0	0	0	0	0	112.7	P434 L440 E441 E442	P434-A438 WeakPolarHBondContact O-CB 3.32Å; P434-A438 PolarHBondContact O-N 3.18Å; A438-L440 PolarHBondContact O-N 3.36Å; A438-E441 PolarHBondContact O-N 2.98Å; A438-E442 WeakPolarHBondContact O-CB 3.42Å; A438-E442 PolarHBondContact O-N 3.44Å
439	M	89.6	Confident	85.5	Confident	100 Å²	100	86.1 Å²	86.1	49%	0.493	44%	0.436	S	S	.	.	H	α-helix	trans	-66.2	-35.4	176	-171.5	-165.4	-62	0	0	112.8	E435 Q436 Q437 K443	E435-M439 PolarHBondContact O-N 2.68Å; Q436-M439 PolarHBondContact O-N 3.49Å; Q437-M439 VanDerWaalsContact C-N 3.34Å; Q437-M439 PolarHBondContact O-N 2.86Å; M439-K443 VanDerWaalsContact O-CG 3.29Å; M439-K443 WeakPolarHBondContact O-CG 3.33Å; M439-K443 PolarHBondContact O-N 3.06Å; M439-K443 VanDerWaalsContact O-N 3.14Å
440	L	88.2	Confident	86.8	Confident	24 Å²	24	79.7 Å²	79.7	13%	0.126	41%	0.407	C	S	.	.	H	α-helix	trans	-73.2	-39.3	176.5	-68.1	167.1	0	0	0	111.3	L422 V425 C426 P432 Q436 Q437 A438 K443 M444	L422-L440 HydrophobicContact CD2-CD2 3.68Å; V425-L440 HydrophobicContact CG1-CD1 4.35Å; C426-L440 VanDerWaalsContact SG-CB 3.54Å; P432-L440 HydrophobicContact CG-CD1 4.2Å; Q436-L440 WeakPolarHBondContact O-CB 3.44Å; Q436-L440 VanDerWaalsContact O-CG 3.24Å; Q436-L440 WeakPolarHBondContact O-CG 3.38Å; Q436-L440 PolarHBondContact O-N 2.97Å; Q437-L440 PolarHBondContact O-N 3.13Å; Q437-L440 VanDerWaalsContact O-N 3.12Å; A438-L440 PolarHBondContact O-N 3.36Å; L440-K443 PolarHBondContact O-N 3.43Å; L440-M444 WeakPolarHBondContact O-CB 3.5Å; L440-M444 WeakPolarHBondContact O-CG 3.17Å; L440-M444 PolarHBondContact O-N 3.09Å
441	E	90	Very high	88	Confident	74 Å²	74	74.7 Å²	74.7	35%	0.346	39%	0.386	S	S	.	.	H	α-helix	trans	-63.8	-41.6	174	-73.9	174.2	-177.7	0	0	111.8	Q437 A438 M444 H445	Q437-E441 HydrophobicContact CG-CG 4.49Å; Q437-E441 WeakPolarHBondContact CG-OE1 3.25Å; Q437-E441 PolarHBondContact NE2-OE1 2.96Å; Q437-E441 WeakPolarHBondContact O-CB 3.32Å; Q437-E441 WeakPolarHBondContact O-CG 3.43Å; Q437-E441 PolarHBondContact O-N 2.97Å; A438-E441 PolarHBondContact O-N 2.98Å; E441-M444 PolarHBondContact O-N 3.19Å; E441-H445 WeakPolarHBondContact O-CB 3.31Å; E441-H445 PolarHBondContact O-N 3.27Å
442	E	92.9	Very high	89.1	Confident	143 Å²	143	71.4 Å²	71.4	67%	0.668	37%	0.369	S	S	*	.	H	α-helix	trans	-59.8	-47.3	172.4	-175.1	-174.4	-176.1	0	0	111.4	A438 M444 H445 A446	A438-E442 WeakPolarHBondContact O-CB 3.42Å; A438-E442 PolarHBondContact O-N 3.44Å; E442-M444 VanDerWaalsContact C-N 3.35Å; E442-M444 PolarHBondContact O-N 3.08Å; E442-H445 PolarHBondContact O-N 3.18Å; E442-A446 WeakPolarHBondContact O-CB 3.5Å; E442-A446 PolarHBondContact O-N 3.1Å
443	K	91.9	Very high	89.8	Confident	105 Å²	105	76.6 Å²	76.6	46%	0.457	39%	0.392	S	S	.	.	H	α-helix	trans	-61.9	-40.5	175.8	-75.8	170.1	-178.8	173.9	0	112.4	M439 L440 A446 L447	M439-K443 VanDerWaalsContact O-CG 3.29Å; M439-K443 WeakPolarHBondContact O-CG 3.33Å; M439-K443 PolarHBondContact O-N 3.06Å; M439-K443 VanDerWaalsContact O-N 3.14Å; L440-K443 PolarHBondContact O-N 3.43Å; K443-A446 PolarHBondContact O-N 3.1Å; K443-L447 WeakPolarHBondContact O-CB 3.37Å; K443-L447 WeakPolarHBondContact O-CG 3.21Å; K443-L447 PolarHBondContact O-N 3.14Å
444	M	92.3	Very high	90.2	Very high	9 Å²	9	74 Å²	74	4%	0.044	38%	0.376	C	S	.	.	H	α-helix	trans	-63.4	-47.4	175.1	-78.1	177	32.5	0	0	111.4	L419 L422 R423 C426 Y427 L440 E441 E442 A446 L447 E448	L419-M444 HydrophobicContact CD1-CB 3.97Å; L419-M444 HydrophobicContact CD1-CG 3.95Å; L422-M444 HydrophobicContact CB-CG 3.71Å; L422-M444 HydrophobicContact CB-SD 4.04Å; L422-M444 HydrophobicContact CD1-CG 4.24Å; R423-M444 HydrophobicContact CG-CE 3.5Å; R423-M444 VanDerWaalsContact CG-CE 3.5Å; R423-M444 HydrophobicContact CG-SD 3.95Å; C426-M444 HydrophobicContact CB-SD 4.21Å; C426-M444 VanDerWaalsContact SG-SD 3.63Å; Y427-M444 HydrophobicContact CE2-CE 4.13Å; L440-M444 WeakPolarHBondContact O-CB 3.5Å; L440-M444 WeakPolarHBondContact O-CG 3.17Å; L440-M444 PolarHBondContact O-N 3.09Å; E441-M444 PolarHBondContact O-N 3.19Å; E442-M444 VanDerWaalsContact C-N 3.35Å; E442-M444 PolarHBondContact O-N 3.08Å; M444-A446 VanDerWaalsContact C-N 3.33Å; M444-A446 PolarHBondContact O-N 2.95Å; M444-L447 PolarHBondContact O-N 3.32Å; M444-E448 WeakPolarHBondContact O-CB 3.38Å; M444-E448 WeakPolarHBondContact O-CG 3.49Å; M444-E448 PolarHBondContact O-N 2.83Å
445	H	94.7	Very high	90.4	Very high	120 Å²	120	72.4 Å²	72.4	56%	0.556	36%	0.361	S	S	*	.	H	α-helix	trans	-62.4	-40.3	177.9	-176	-86.6	0	0	0	112	E441 E442 E448 E449	E441-H445 WeakPolarHBondContact O-CB 3.31Å; E441-H445 PolarHBondContact O-N 3.27Å; E442-H445 PolarHBondContact O-N 3.18Å; H445-E448 PolarHBondContact O-N 2.89Å; H445-E449 PolarHBondContact O-N 2.81Å
446	A	94.6	Very high	90	Very high	59 Å²	59	71.7 Å²	71.7	49%	0.488	35%	0.352	S	S	.	.	H	α-helix	trans	-63.4	-45	174.8	0	0	0	0	0	112.4	E442 K443 M444 E449 D450	E442-A446 WeakPolarHBondContact O-CB 3.5Å; E442-A446 PolarHBondContact O-N 3.1Å; K443-A446 PolarHBondContact O-N 3.1Å; M444-A446 VanDerWaalsContact C-N 3.33Å; M444-A446 PolarHBondContact O-N 2.95Å; A446-E449 PolarHBondContact O-N 3.17Å; A446-D450 VanDerWaalsContact O-CB 3.28Å; A446-D450 WeakPolarHBondContact O-CB 3.47Å; A446-D450 PolarHBondContact O-N 3Å
447	L	94.5	Very high	89.5	Confident	22 Å²	22	72 Å²	72	12%	0.115	36%	0.356	C	S	.	.	H	α-helix	trans	-65.1	-37.5	175	-75.7	170.2	0	0	0	112.3	K415 L418 L422 K443 M444 L451	K415-L447 HydrophobicContact CG-CD2 4.27Å; L418-L447 HydrophobicContact CD2-CD1 3.9Å; L418-L447 HydrophobicContact CG-CD1 3.98Å; L422-L447 HydrophobicContact CD1-CD1 3.57Å; K443-L447 WeakPolarHBondContact O-CB 3.37Å; K443-L447 WeakPolarHBondContact O-CG 3.21Å; K443-L447 PolarHBondContact O-N 3.14Å; M444-L447 PolarHBondContact O-N 3.32Å; L447-L451 VanDerWaalsContact O-CB 3.3Å; L447-L451 WeakPolarHBondContact O-CB 3.31Å; L447-L451 VanDerWaalsContact O-CG 3.24Å; L447-L451 WeakPolarHBondContact O-CG 3.26Å; L447-L451 PolarHBondContact O-N 3.25Å
448	E	95.1	Very high	89.3	Confident	37 Å²	37	72.3 Å²	72.3	17%	0.173	36%	0.361	C	S	.	.	H	α-helix	trans	-64.2	-42.6	175.5	-79.9	-178.6	-167.7	0	0	112.4	L419 R423 M444 H445 R452	L419-E448 HydrophobicContact CD1-CG 3.85Å; L419-E448 HydrophobicContact CD2-CG 3.55Å; L419-E448 HydrophobicContact CG-CG 4.36Å; R423-E448 IonicContact CZ-OE1 2.72Å; R423-E448 IonicContact NE-OE1 2.79Å; R423-E448 IonicContact NH2-OE1 3.72Å; R423-E448 PolarHBondContact NH2-OE1 2.88Å; M444-E448 WeakPolarHBondContact O-CB 3.38Å; M444-E448 WeakPolarHBondContact O-CG 3.49Å; M444-E448 PolarHBondContact O-N 2.83Å; H445-E448 PolarHBondContact O-N 2.89Å; E448-R452 WeakPolarHBondContact O-CB 3.49Å; E448-R452 WeakPolarHBondContact O-CG 3.26Å; E448-R452 PolarHBondContact O-N 2.82Å; E448-R452 IonicContact OE2-CZ 3.83Å; E448-R452 IonicContact OE2-NH2 3.71Å; E448-R452 PolarHBondContact OE2-NH2 2.88Å
449	E	94.3	Very high	89.2	Confident	72 Å²	72	72.2 Å²	72.2	34%	0.336	35%	0.351	S	S	.	.	H	α-helix	trans	-73.2	-36.8	178.9	-162.3	56.3	-142.4	0	0	112.4	H445 A446 R452 Q453 R456	H445-E449 PolarHBondContact O-N 2.81Å; A446-E449 PolarHBondContact O-N 3.17Å; E449-R452 PolarHBondContact O-N 2.89Å; E449-R452 VanDerWaalsContact OE2-CD 3.22Å; E449-R452 WeakPolarHBondContact OE2-CD 3.49Å; E449-R452 IonicContact OE2-CZ 2.92Å; E449-R452 IonicContact OE2-NE 2.73Å; E449-R452 IonicContact OE2-NH1 2.75Å; E449-R452 PolarHBondContact OE2-NH1 2.87Å; E449-Q453 WeakPolarHBondContact O-CB 3.38Å; E449-Q453 PolarHBondContact O-N 2.93Å; E449-R456 IonicContact OE1-CZ 3.67Å; E449-R456 IonicContact OE1-NH1 3.37Å; E449-R456 PolarHBondContact OE1-NH1 2.82Å; E449-R456 IonicContact OE1-NH2 2.74Å
450	D	91.7	Very high	88.9	Confident	57 Å²	57	72 Å²	72	31%	0.305	35%	0.349	S	S	.	.	H	α-helix	trans	-59.5	-44.8	171.2	179.9	8.4	0	0	0	111.3	K415 A446 Q453 A454	K415-D450 WeakPolarHBondContact CE-OD2 3.28Å; K415-D450 IonicContact NZ-OD1 3.4Å; K415-D450 PolarHBondContact NZ-OD1 2.83Å; K415-D450 IonicContact NZ-OD2 2.69Å; K415-D450 PolarHBondContact NZ-OD2 2.97Å; A446-D450 VanDerWaalsContact O-CB 3.28Å; A446-D450 WeakPolarHBondContact O-CB 3.47Å; A446-D450 PolarHBondContact O-N 3Å; D450-Q453 PolarHBondContact O-N 2.79Å; D450-A454 WeakPolarHBondContact O-CB 3.44Å; D450-A454 PolarHBondContact O-N 2.83Å
451	L	93	Very high	88.9	Confident	10 Å²	10	75.1 Å²	75.1	5%	0.052	36%	0.363	C	S	.	.	H	α-helix	trans	-64.6	-43.1	172.7	-76	168.8	0	0	0	112.7	I412 K415 E416 L419 L447 Q453 A454 L455	I412-L451 HydrophobicContact CG2-CD2 3.9Å; K415-L451 HydrophobicContact CB-CD1 4.36Å; K415-L451 HydrophobicContact CB-CD2 3.82Å; K415-L451 HydrophobicContact CB-CG 4.18Å; K415-L451 HydrophobicContact CD-CD2 4.45Å; E416-L451 HydrophobicContact CG-CD1 3.84Å; E416-L451 HydrophobicContact CG-CD2 3.69Å; E416-L451 HydrophobicContact CG-CG 4.42Å; L419-L451 HydrophobicContact CB-CD1 4.46Å; L419-L451 HydrophobicContact CD2-CD1 3.78Å; L447-L451 VanDerWaalsContact O-CB 3.3Å; L447-L451 WeakPolarHBondContact O-CB 3.31Å; L447-L451 VanDerWaalsContact O-CG 3.24Å; L447-L451 WeakPolarHBondContact O-CG 3.26Å; L447-L451 PolarHBondContact O-N 3.25Å; L451-Q453 VanDerWaalsContact C-N 3.29Å; L451-Q453 PolarHBondContact O-N 3.39Å; L451-A454 PolarHBondContact O-N 2.83Å; L451-L455 WeakPolarHBondContact O-CB 3.1Å; L451-L455 VanDerWaalsContact O-CG 3.27Å; L451-L455 WeakPolarHBondContact O-CG 3.43Å; L451-L455 PolarHBondContact O-N 3.48Å
452	R	91.2	Very high	88.7	Confident	89 Å²	89	71.6 Å²	71.6	34%	0.336	35%	0.346	S	S	.	.	H	α-helix	trans	-61.4	-38.3	174.1	-72.7	167.9	-165.2	129.4	10.9	111.5	E448 E449 R456	E448-R452 WeakPolarHBondContact O-CB 3.49Å; E448-R452 WeakPolarHBondContact O-CG 3.26Å; E448-R452 PolarHBondContact O-N 2.82Å; E448-R452 IonicContact OE2-CZ 3.83Å; E448-R452 IonicContact OE2-NH2 3.71Å; E448-R452 PolarHBondContact OE2-NH2 2.88Å; E449-R452 PolarHBondContact O-N 2.89Å; E449-R452 VanDerWaalsContact OE2-CD 3.22Å; E449-R452 WeakPolarHBondContact OE2-CD 3.49Å; E449-R452 IonicContact OE2-CZ 2.92Å; E449-R452 IonicContact OE2-NE 2.73Å; E449-R452 IonicContact OE2-NH1 2.75Å; E449-R452 PolarHBondContact OE2-NH1 2.87Å; R452-R456 WeakPolarHBondContact O-CB 3.07Å; R452-R456 VanDerWaalsContact O-CD 3.32Å; R452-R456 WeakPolarHBondContact O-CD 3.36Å; R452-R456 WeakPolarHBondContact O-CG 3.38Å; R452-R456 PolarHBondContact O-N 2.76Å; R452-R456 VanDerWaalsContact O-N 3.13Å
453	Q	89.3	Confident	88.5	Confident	132 Å²	132	68.3 Å²	68.3	62%	0.617	33%	0.333	S	S	*	.	H	α-helix	trans	-66.4	-46.2	176.9	-173.7	176.3	2.8	0	0	111.4	E449 D450 L451 R456	E449-Q453 WeakPolarHBondContact O-CB 3.38Å; E449-Q453 PolarHBondContact O-N 2.93Å; D450-Q453 PolarHBondContact O-N 2.79Å; L451-Q453 VanDerWaalsContact C-N 3.29Å; L451-Q453 PolarHBondContact O-N 3.39Å; Q453-R456 PolarHBondContact O-N 2.82Å
454	A	87.7	Confident	88.4	Confident	17 Å²	17	68 Å²	68	14%	0.14	33%	0.333	C	S	.	.	H	α-helix	trans	-62.5	-43	176.3	0	0	0	0	0	112.5	I412 D450 L451 R456 T458 H459	I412-A454 HydrophobicContact CD1-CB 4.05Å; I412-A454 HydrophobicContact CG1-CB 4.13Å; D450-A454 WeakPolarHBondContact O-CB 3.44Å; D450-A454 PolarHBondContact O-N 2.83Å; L451-A454 PolarHBondContact O-N 2.83Å; A454-R456 PolarHBondContact O-N 2.91Å; A454-T458 PolarHBondContact O-N 3.3Å; A454-T458 PolarHBondContact O-OG1 3.47Å; A454-T458 VanDerWaalsContact O-OG1 3.04Å; A454-H459 WeakPolarHBondContact O-CB 3.46Å; A454-H459 PolarHBondContact O-N 3.11Å
455	L	85.4	Confident	88.4	Confident	70 Å²	70	71.2 Å²	71.2	37%	0.366	35%	0.345	S	S	.	.	H	α-helix	trans	-69.6	-30.9	-179	-71.1	173.5	0	0	0	113.7	L451 H459	L451-L455 WeakPolarHBondContact O-CB 3.1Å; L451-L455 VanDerWaalsContact O-CG 3.27Å; L451-L455 WeakPolarHBondContact O-CG 3.43Å; L451-L455 PolarHBondContact O-N 3.48Å; L455-H459 HydrophobicContact CD2-CB 3.93Å
456	R	77.1	Confident	88.2	Confident	154 Å²	154	67.8 Å²	67.8	58%	0.581	33%	0.328	S	S	*	.	H	α-helix	trans	-71.6	-30.4	-174.8	-81.9	167.9	-174.4	142	-1.9	114.9	E449 R452 Q453 A454	E449-R456 IonicContact OE1-CZ 3.67Å; E449-R456 IonicContact OE1-NH1 3.37Å; E449-R456 PolarHBondContact OE1-NH1 2.82Å; E449-R456 IonicContact OE1-NH2 2.74Å; R452-R456 WeakPolarHBondContact O-CB 3.07Å; R452-R456 VanDerWaalsContact O-CD 3.32Å; R452-R456 WeakPolarHBondContact O-CD 3.36Å; R452-R456 WeakPolarHBondContact O-CG 3.38Å; R452-R456 PolarHBondContact O-N 2.76Å; R452-R456 VanDerWaalsContact O-N 3.13Å; Q453-R456 PolarHBondContact O-N 2.82Å; A454-R456 PolarHBondContact O-N 2.91Å
457	L	72.5	Confident	88.1	Confident	119 Å²	119	68.1 Å²	68.1	62%	0.623	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.3	-63.6	-173.7	-63.1	174.7	0	0	0	111.3	H459 E461	L457-H459 PolarHBondContact O-N 3Å; L457-E461 WeakPolarHBondContact O-CG 3.48Å; L457-E461 PolarHBondContact O-N 3.03Å
458	T	81.3	Confident	88	Confident	51 Å²	51	69 Å²	69	31%	0.313	33%	0.332	S	S	.	.	H	α-helix	trans	-71.4	-37.7	-170	64	0	0	0	0	112.8	A454 Q460 E461 M462	A454-T458 PolarHBondContact O-N 3.3Å; A454-T458 PolarHBondContact O-OG1 3.47Å; A454-T458 VanDerWaalsContact O-OG1 3.04Å; T458-Q460 PolarHBondContact O-N 3.03Å; T458-E461 PolarHBondContact O-N 3.34Å; T458-M462 WeakPolarHBondContact O-CB 3.27Å; T458-M462 VanDerWaalsContact O-CG 3.24Å; T458-M462 WeakPolarHBondContact O-CG 3.4Å; T458-M462 PolarHBondContact O-N 2.89Å
459	H	85.2	Confident	87.9	Confident	52 Å²	52	68 Å²	68	24%	0.241	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-39.5	-178.2	-171.8	-107.3	0	0	0	113.8	I412 A454 L455 L457 M462 I463	I412-H459 HydrophobicContact CD1-CB 4.46Å; A454-H459 WeakPolarHBondContact O-CB 3.46Å; A454-H459 PolarHBondContact O-N 3.11Å; L455-H459 HydrophobicContact CD2-CB 3.93Å; L457-H459 PolarHBondContact O-N 3Å; H459-M462 HydrophobicContact CB-CE 4.38Å; H459-M462 PolarHBondContact O-N 3.43Å; H459-I463 VanDerWaalsContact CE1-CD1 3.47Å; H459-I463 WeakPolarHBondContact CE1-CD1 3.46Å; H459-I463 WeakPolarHBondContact O-CG1 3.41Å; H459-I463 PolarHBondContact O-N 3.08Å
460	Q	84.8	Confident	87.8	Confident	96 Å²	96	69.2 Å²	69.2	45%	0.449	34%	0.336	S	S	.	.	H	α-helix	trans	-67.7	-45.6	177.9	-179.2	58.3	30.4	0	0	111.2	T458 M462 I463 E464	T458-Q460 PolarHBondContact O-N 3.03Å; Q460-M462 VanDerWaalsContact C-N 3.29Å; Q460-M462 PolarHBondContact O-N 3.12Å; Q460-I463 PolarHBondContact O-N 3.33Å; Q460-E464 PolarHBondContact NE2-OE1 2.97Å; Q460-E464 WeakPolarHBondContact O-CG 3.39Å; Q460-E464 PolarHBondContact O-N 2.85Å
461	E	86.7	Confident	87.8	Confident	89 Å²	89	69.8 Å²	69.8	42%	0.416	34%	0.336	S	S	.	.	H	α-helix	trans	-59.5	-39.5	174.1	-66.3	175.7	-173.1	0	0	112.1	L457 T458 E464 R465	L457-E461 WeakPolarHBondContact O-CG 3.48Å; L457-E461 PolarHBondContact O-N 3.03Å; T458-E461 PolarHBondContact O-N 3.34Å; E461-E464 PolarHBondContact O-N 3.01Å; E461-R465 VanDerWaalsContact O-CG 3.29Å; E461-R465 WeakPolarHBondContact O-CG 3.24Å; E461-R465 PolarHBondContact O-N 2.84Å; E461-R465 IonicContact OE2-CZ 2.85Å; E461-R465 IonicContact OE2-NH2 3.92Å; E461-R465 PolarHBondContact OE2-NH2 3.31Å
462	M	87.4	Confident	87.8	Confident	0 Å²	0	71 Å²	71	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-62	-48.2	174.7	-74	-170.6	-65.6	0	0	111.2	D405 Q408 I409 I412 T458 H459 Q460 E464 R465 F466	D405-M462 HydrophobicContact CB-CG 3.78Å; D405-M462 HydrophobicContact CB-SD 3.76Å; D405-M462 VanDerWaalsContact O-SD 3.38Å; Q408-M462 HydrophobicContact CB-CE 4.15Å; Q408-M462 HydrophobicContact CB-SD 3.69Å; I409-M462 HydrophobicContact CD1-CB 4.42Å; I409-M462 HydrophobicContact CG1-CE 3.85Å; I409-M462 HydrophobicContact CG1-SD 3.91Å; I412-M462 HydrophobicContact CD1-CE 3.83Å; T458-M462 WeakPolarHBondContact O-CB 3.27Å; T458-M462 VanDerWaalsContact O-CG 3.24Å; T458-M462 WeakPolarHBondContact O-CG 3.4Å; T458-M462 PolarHBondContact O-N 2.89Å; H459-M462 HydrophobicContact CB-CE 4.38Å; H459-M462 PolarHBondContact O-N 3.43Å; Q460-M462 VanDerWaalsContact C-N 3.29Å; Q460-M462 PolarHBondContact O-N 3.12Å; M462-E464 VanDerWaalsContact C-N 3.28Å; M462-E464 PolarHBondContact O-N 3.01Å; M462-R465 PolarHBondContact O-N 2.92Å; M462-F466 HydrophobicContact CB-CD2 4.49Å; M462-F466 HydrophobicContact CB-CE2 4.38Å; M462-F466 WeakPolarHBondContact O-CD2 3.35Å; M462-F466 PolarHBondContact O-N 3.43Å
463	I	88	Confident	87.8	Confident	75 Å²	75	69.8 Å²	69.8	39%	0.385	34%	0.34	S	S	.	.	H	α-helix	trans	-55.6	-45.2	176	-70.3	163.8	0	0	0	110.9	H459 Q460 F466 S467	H459-I463 VanDerWaalsContact CE1-CD1 3.47Å; H459-I463 WeakPolarHBondContact CE1-CD1 3.46Å; H459-I463 WeakPolarHBondContact O-CG1 3.41Å; H459-I463 PolarHBondContact O-N 3.08Å; Q460-I463 PolarHBondContact O-N 3.33Å; I463-F466 PolarHBondContact O-N 2.85Å; I463-S467 PolarHBondContact O-N 2.92Å
464	E	89.9	Confident	88	Confident	99 Å²	99	68.9 Å²	68.9	46%	0.463	33%	0.334	S	S	.	.	H	α-helix	trans	-61.6	-46.8	178.7	-73.6	172.1	-161.5	0	0	111.4	Q460 E461 M462 F466 S467 L468	Q460-E464 PolarHBondContact NE2-OE1 2.97Å; Q460-E464 WeakPolarHBondContact O-CG 3.39Å; Q460-E464 PolarHBondContact O-N 2.85Å; E461-E464 PolarHBondContact O-N 3.01Å; M462-E464 VanDerWaalsContact C-N 3.28Å; M462-E464 PolarHBondContact O-N 3.01Å; E464-F466 VanDerWaalsContact C-N 3.35Å; E464-F466 PolarHBondContact O-N 3.48Å; E464-S467 PolarHBondContact O-N 2.68Å; E464-S467 VanDerWaalsContact O-N 3.15Å; E464-S467 PolarHBondContact O-OG 3.11Å; E464-L468 WeakPolarHBondContact O-CG 3.49Å; E464-L468 PolarHBondContact O-N 2.69Å
465	R	91.2	Very high	88.2	Confident	76 Å²	76	68.1 Å²	68.1	29%	0.287	33%	0.328	S	S	.	.	H	α-helix	trans	-59.8	-39.6	173.6	-67.6	167.1	-162.9	145.7	12.8	113	D405 E461 M462 L468 H469	D405-R465 IonicContact OD1-NH1 3.71Å; D405-R465 PolarHBondContact OD1-NH1 2.97Å; D405-R465 WeakPolarHBondContact OD2-CD 3.44Å; D405-R465 IonicContact OD2-CZ 3.41Å; D405-R465 IonicContact OD2-NE 3.61Å; D405-R465 IonicContact OD2-NH1 3.23Å; D405-R465 PolarHBondContact OD2-NH1 2.81Å; E461-R465 VanDerWaalsContact O-CG 3.29Å; E461-R465 WeakPolarHBondContact O-CG 3.24Å; E461-R465 PolarHBondContact O-N 2.84Å; E461-R465 IonicContact OE2-CZ 2.85Å; E461-R465 IonicContact OE2-NH2 3.92Å; E461-R465 PolarHBondContact OE2-NH2 3.31Å; M462-R465 PolarHBondContact O-N 2.92Å; R465-L468 PolarHBondContact O-N 2.93Å; R465-H469 WeakPolarHBondContact O-CB 3.44Å; R465-H469 PolarHBondContact O-N 2.96Å
466	F	92	Very high	88.4	Confident	48 Å²	48	68.1 Å²	68.1	21%	0.211	32%	0.323	C	S	.	.	H	α-helix	trans	-66.5	-39.3	174.5	-77.6	-66.7	0	0	0	111.9	M402 D405 R406 I409 M462 I463 E464 H469 D470	M402-F466 HydrophobicContact CG-CE1 3.91Å; M402-F466 HydrophobicContact CG-CZ 4.36Å; D405-F466 HydrophobicContact CB-CE2 4.16Å; D405-F466 HydrophobicContact CB-CZ 4.28Å; R406-F466 HydrophobicContact CG-CE1 4.01Å; R406-F466 HydrophobicContact CG-CZ 3.73Å; I409-F466 HydrophobicContact CD1-CD2 3.88Å; I409-F466 HydrophobicContact CD1-CE2 3.37Å; I409-F466 HydrophobicContact CD1-CZ 4.21Å; M462-F466 HydrophobicContact CB-CD2 4.49Å; M462-F466 HydrophobicContact CB-CE2 4.38Å; M462-F466 WeakPolarHBondContact O-CD2 3.35Å; M462-F466 PolarHBondContact O-N 3.43Å; I463-F466 PolarHBondContact O-N 2.85Å; E464-F466 VanDerWaalsContact C-N 3.35Å; E464-F466 PolarHBondContact O-N 3.48Å; F466-H469 WeakPolarHBondContact O-CB 3.48Å; F466-H469 PolarHBondContact O-N 3.49Å; F466-H469 VanDerWaalsContact O-N 3.14Å; F466-D470 PolarHBondContact O-N 3.1Å
467	S	92.7	Very high	89	Confident	66 Å²	66	68.2 Å²	68.2	46%	0.462	32%	0.323	S	S	.	.	H	α-helix	trans	-64.5	-40.1	176	75.7	0	0	0	0	112.9	I463 E464 H469 D470 E471	I463-S467 PolarHBondContact O-N 2.92Å; E464-S467 PolarHBondContact O-N 2.68Å; E464-S467 VanDerWaalsContact O-N 3.15Å; E464-S467 PolarHBondContact O-OG 3.11Å; S467-H469 VanDerWaalsContact C-N 3.3Å; S467-H469 PolarHBondContact O-N 3.23Å; S467-D470 PolarHBondContact O-N 2.85Å; S467-E471 PolarHBondContact O-N 3.28Å
468	L	92.3	Very high	89.9	Confident	40 Å²	40	65.5 Å²	65.5	21%	0.209	31%	0.307	C	S	.	.	H	α-helix	trans	-64.3	-37	172.4	-68.9	173.1	0	0	0	110.8	I393 Q396 I397 E464 R465 E471 R472	I393-L468 WeakPolarHBondContact CG2-O 3.48Å; Q396-L468 HydrophobicContact CB-CD1 4.36Å; I397-L468 VanDerWaalsContact CD1-C 3.43Å; I397-L468 HydrophobicContact CD1-CB 3.77Å; I397-L468 WeakPolarHBondContact CD1-O 3.37Å; I397-L468 HydrophobicContact CG1-CB 4.07Å; E464-L468 WeakPolarHBondContact O-CG 3.49Å; E464-L468 PolarHBondContact O-N 2.69Å; R465-L468 PolarHBondContact O-N 2.93Å; L468-E471 PolarHBondContact O-N 2.89Å; L468-R472 WeakPolarHBondContact O-CB 3.24Å; L468-R472 PolarHBondContact O-N 3.24Å
469	H	91.6	Very high	90.5	Very high	17 Å²	17	63.7 Å²	63.7	8%	0.079	30%	0.296	C	S	.	.	H	α-helix	trans	-64.6	-40.6	174.9	-170.7	98.4	0	0	0	112.5	I397 M402 R465 F466 S467 R472 L473	I397-H469 HydrophobicContact CD1-CB 4.27Å; M402-H469 PolarHBondContact SD-CE1 2.83Å; M402-H469 PolarHBondContact SD-ND1 3.5Å; R465-H469 WeakPolarHBondContact O-CB 3.44Å; R465-H469 PolarHBondContact O-N 2.96Å; F466-H469 WeakPolarHBondContact O-CB 3.48Å; F466-H469 PolarHBondContact O-N 3.49Å; F466-H469 VanDerWaalsContact O-N 3.14Å; S467-H469 VanDerWaalsContact C-N 3.3Å; S467-H469 PolarHBondContact O-N 3.23Å; H469-R472 PolarHBondContact CE1-NH2 2.83Å; H469-R472 PolarHBondContact ND1-NH2 3.43Å; H469-R472 VanDerWaalsContact O-CB 3.32Å; H469-R472 WeakPolarHBondContact O-CB 3.33Å; H469-R472 PolarHBondContact O-N 2.89Å; H469-L473 WeakPolarHBondContact O-CG 3.35Å; H469-L473 PolarHBondContact O-N 2.83Å
470	D	91.9	Very high	90.5	Very high	96 Å²	96	63.3 Å²	63.3	51%	0.513	30%	0.295	S	S	.	.	H	α-helix	trans	-68	-36.3	175.1	-76.4	-21	0	0	0	112	F466 S467 L473 K474	F466-D470 PolarHBondContact O-N 3.1Å; S467-D470 PolarHBondContact O-N 2.85Å; D470-L473 PolarHBondContact O-N 3.02Å; D470-K474 WeakPolarHBondContact O-CB 3.36Å; D470-K474 PolarHBondContact O-N 2.87Å
471	E	93.7	Very high	90.7	Very high	69 Å²	69	61.2 Å²	61.2	32%	0.322	29%	0.29	S	S	.	.	H	α-helix	trans	-63.3	-43.9	169.4	-171.5	173.8	-179.2	0	0	111.3	R389 I393 S467 L468 L473 K474 I475	R389-E471 IonicContact CZ-OE1 2.85Å; R389-E471 IonicContact NH2-OE1 2.71Å; R389-E471 PolarHBondContact NH2-OE1 2.77Å; I393-E471 HydrophobicContact CD1-CB 4.15Å; I393-E471 HydrophobicContact CD1-CG 3.67Å; S467-E471 PolarHBondContact O-N 3.28Å; L468-E471 PolarHBondContact O-N 2.89Å; E471-L473 VanDerWaalsContact C-N 3.29Å; E471-L473 PolarHBondContact O-N 3.27Å; E471-K474 CarbonylContact O-C 3.55Å; E471-K474 WeakPolarHBondContact O-CA 3.47Å; E471-K474 WeakPolarHBondContact O-CB 3.33Å; E471-K474 PolarHBondContact O-N 3.01Å; E471-I475 HydrophobicContact CG-CD1 4.06Å; E471-I475 HydrophobicContact CG-CG1 4.19Å; E471-I475 WeakPolarHBondContact O-CG1 3.44Å; E471-I475 PolarHBondContact O-N 3.03Å
472	R	92.1	Very high	91	Very high	35 Å²	35	58.3 Å²	58.3	13%	0.132	28%	0.277	C	S	.	.	H	α-helix	trans	-54.9	-45	173.8	-165.4	-171.4	65.3	158.7	8.9	111.6	L390 I393 E394 I397 L468 H469 R476	L390-R472 HydrophobicContact CD1-CG 3.56Å; I393-R472 HydrophobicContact CG2-CB 3.79Å; I393-R472 HydrophobicContact CG2-CG 4.2Å; E394-R472 HydrophobicContact CG-CG 4.11Å; I397-R472 HydrophobicContact CD1-CB 4.3Å; L468-R472 WeakPolarHBondContact O-CB 3.24Å; L468-R472 PolarHBondContact O-N 3.24Å; H469-R472 PolarHBondContact CE1-NH2 2.83Å; H469-R472 PolarHBondContact ND1-NH2 3.43Å; H469-R472 VanDerWaalsContact O-CB 3.32Å; H469-R472 WeakPolarHBondContact O-CB 3.33Å; H469-R472 PolarHBondContact O-N 2.89Å; R472-R476 WeakPolarHBondContact O-CB 3.35Å; R472-R476 PolarHBondContact O-N 2.9Å
473	L	90.3	Very high	91	Very high	65 Å²	65	59.8 Å²	59.8	34%	0.34	29%	0.293	S	S	.	.	H	α-helix	trans	-68.1	-32.4	176	-69.2	177.3	0	0	0	112.5	H469 D470 E471 R477	H469-L473 WeakPolarHBondContact O-CG 3.35Å; H469-L473 PolarHBondContact O-N 2.83Å; D470-L473 PolarHBondContact O-N 3.02Å; E471-L473 VanDerWaalsContact C-N 3.29Å; E471-L473 PolarHBondContact O-N 3.27Å; L473-R477 WeakPolarHBondContact O-CG 3.46Å; L473-R477 PolarHBondContact O-N 2.94Å; L473-R477 PolarHBondContact O-NE 3.35Å
474	K	94	Very high	91	Very high	113 Å²	113	62.2 Å²	62.2	49%	0.491	30%	0.297	S	S	.	.	H	α-helix	trans	-69	-50.6	174.3	-178	-178.1	173.2	-176.4	0	111.4	D470 E471 R476 R477 E478	D470-K474 WeakPolarHBondContact O-CB 3.36Å; D470-K474 PolarHBondContact O-N 2.87Å; E471-K474 CarbonylContact O-C 3.55Å; E471-K474 WeakPolarHBondContact O-CA 3.47Å; E471-K474 WeakPolarHBondContact O-CB 3.33Å; E471-K474 PolarHBondContact O-N 3.01Å; K474-R476 VanDerWaalsContact C-N 3.3Å; K474-R476 PolarHBondContact O-N 3.28Å; K474-R477 WeakPolarHBondContact O-CA 3.35Å; K474-R477 WeakPolarHBondContact O-CB 3.43Å; K474-R477 PolarHBondContact O-N 2.87Å; K474-E478 WeakPolarHBondContact CE-OE1 3.3Å; K474-E478 PolarHBondContact O-N 2.92Å
475	I	92.2	Very high	91	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-60.1	-40.9	176.9	-66.8	-177.8	0	0	0	110.7	L386 R389 L390 I393 E471 R477 E478 I479	L386-I475 HydrophobicContact CB-CG2 4.18Å; L386-I475 HydrophobicContact CD2-CG2 4.34Å; L386-I475 WeakPolarHBondContact O-CG2 3.45Å; R389-I475 HydrophobicContact CB-CD1 3.82Å; L390-I475 HydrophobicContact CB-CG2 3.95Å; L390-I475 HydrophobicContact CD1-CG2 4.4Å; I393-I475 HydrophobicContact CD1-CD1 3.7Å; E471-I475 HydrophobicContact CG-CD1 4.06Å; E471-I475 HydrophobicContact CG-CG1 4.19Å; E471-I475 WeakPolarHBondContact O-CG1 3.44Å; E471-I475 PolarHBondContact O-N 3.03Å; I475-R477 VanDerWaalsContact C-N 3.32Å; I475-R477 PolarHBondContact O-N 3.38Å; I475-E478 PolarHBondContact O-N 3.08Å; I475-E478 VanDerWaalsContact O-N 3.15Å; I475-I479 HydrophobicContact CG2-CD1 3.84Å; I475-I479 HydrophobicContact CG2-CG1 4.29Å; I475-I479 WeakPolarHBondContact O-CB 3.48Å; I475-I479 WeakPolarHBondContact O-CG1 3.34Å; I475-I479 PolarHBondContact O-N 3.29Å
476	R	90.3	Very high	91	Very high	69 Å²	69	57.8 Å²	57.8	26%	0.26	28%	0.284	S	S	.	.	H	α-helix	trans	-59.2	-41.1	174	-170.4	173.7	-67.7	-146.6	0	112.3	E394 R472 K474 M480	E394-R476 IonicContact OE1-NH2 3.65Å; E394-R476 PolarHBondContact OE1-NH2 2.92Å; E394-R476 VanDerWaalsContact OE1-NH2 3.09Å; R472-R476 WeakPolarHBondContact O-CB 3.35Å; R472-R476 PolarHBondContact O-N 2.9Å; K474-R476 VanDerWaalsContact C-N 3.3Å; K474-R476 PolarHBondContact O-N 3.28Å; R476-M480 VanDerWaalsContact O-CG 3.28Å; R476-M480 WeakPolarHBondContact O-CG 3.49Å; R476-M480 PolarHBondContact O-N 2.9Å
477	R	89.7	Confident	90.7	Very high	156 Å²	156	57.5 Å²	57.5	59%	0.589	29%	0.291	S	S	*	.	H	α-helix	trans	-65.8	-38.5	173.7	-75.4	173.2	-78.4	167.4	-7.5	112.5	L473 K474 I475 M480 S481	L473-R477 WeakPolarHBondContact O-CG 3.46Å; L473-R477 PolarHBondContact O-N 2.94Å; L473-R477 PolarHBondContact O-NE 3.35Å; K474-R477 WeakPolarHBondContact O-CA 3.35Å; K474-R477 WeakPolarHBondContact O-CB 3.43Å; K474-R477 PolarHBondContact O-N 2.87Å; I475-R477 VanDerWaalsContact C-N 3.32Å; I475-R477 PolarHBondContact O-N 3.38Å; R477-M480 PolarHBondContact O-N 3.47Å; R477-S481 PolarHBondContact O-N 3.33Å
478	E	91.5	Very high	90.6	Very high	62 Å²	62	57.4 Å²	57.4	29%	0.29	29%	0.291	S	S	.	.	H	α-helix	trans	-67.1	-43	175.3	-69.9	176.4	-162.7	0	0	112.1	L386 K474 I475 M480 S481 I482	L386-E478 HydrophobicContact CD1-CB 3.71Å; K474-E478 WeakPolarHBondContact CE-OE1 3.3Å; K474-E478 PolarHBondContact O-N 2.92Å; I475-E478 PolarHBondContact O-N 3.08Å; I475-E478 VanDerWaalsContact O-N 3.15Å; E478-M480 VanDerWaalsContact C-N 3.32Å; E478-M480 PolarHBondContact O-N 2.83Å; E478-S481 PolarHBondContact O-N 3.14Å; E478-S481 VanDerWaalsContact O-N 3.13Å; E478-S481 PolarHBondContact O-OG 3.31Å; E478-I482 WeakPolarHBondContact O-CB 3.29Å; E478-I482 PolarHBondContact O-N 2.85Å
479	I	92.4	Very high	90.4	Very high	13 Å²	13	56.5 Å²	56.5	7%	0.067	29%	0.286	C	S	.	.	H	α-helix	trans	-57.6	-44.8	172.2	-74.1	170.7	0	0	0	110.7	L383 L386 Q387 L390 I475 S481 I482 G483	L383-I479 HydrophobicContact CD1-CB 4.4Å; L383-I479 HydrophobicContact CD1-CG1 4.28Å; L383-I479 HydrophobicContact CD1-CG2 3.91Å; L386-I479 HydrophobicContact CB-CD1 4.17Å; L386-I479 HydrophobicContact CB-CG1 3.73Å; L386-I479 HydrophobicContact CD1-CG1 4.18Å; Q387-I479 HydrophobicContact CG-CD1 4.24Å; L390-I479 HydrophobicContact CB-CD1 4.34Å; L390-I479 HydrophobicContact CD2-CD1 3.87Å; I475-I479 HydrophobicContact CG2-CD1 3.84Å; I475-I479 HydrophobicContact CG2-CG1 4.29Å; I475-I479 WeakPolarHBondContact O-CB 3.48Å; I475-I479 WeakPolarHBondContact O-CG1 3.34Å; I475-I479 PolarHBondContact O-N 3.29Å; I479-S481 VanDerWaalsContact C-N 3.34Å; I479-S481 PolarHBondContact O-N 3.44Å; I479-I482 PolarHBondContact O-N 3.37Å; I479-G483 PolarHBondContact O-N 2.74Å
480	M	86.9	Confident	90.2	Very high	45 Å²	45	58.8 Å²	58.8	22%	0.222	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-38.4	175.6	-71.4	170	70.6	0	0	112.6	R476 R477 E478 R484 G531	R476-M480 VanDerWaalsContact O-CG 3.28Å; R476-M480 WeakPolarHBondContact O-CG 3.49Å; R476-M480 PolarHBondContact O-N 2.9Å; R477-M480 PolarHBondContact O-N 3.47Å; E478-M480 VanDerWaalsContact C-N 3.32Å; E478-M480 PolarHBondContact O-N 2.83Å; M480-R484 WeakPolarHBondContact O-CG 3.49Å; M480-R484 PolarHBondContact O-N 3.34Å; M480-G531 WeakPolarHBondContact CE-O 3.38Å
481	S	88.7	Confident	89.8	Confident	51 Å²	51	60.7 Å²	60.7	36%	0.357	30%	0.302	S	S	.	.	H	α-helix	trans	-70.3	-43.4	178.7	79.8	0	0	0	0	111.6	R477 E478 I479 G483 R484 V485	R477-S481 PolarHBondContact O-N 3.33Å; E478-S481 PolarHBondContact O-N 3.14Å; E478-S481 VanDerWaalsContact O-N 3.13Å; E478-S481 PolarHBondContact O-OG 3.31Å; I479-S481 VanDerWaalsContact C-N 3.34Å; I479-S481 PolarHBondContact O-N 3.44Å; S481-G483 PolarHBondContact O-N 3Å; S481-R484 WeakPolarHBondContact O-CB 3.45Å; S481-R484 PolarHBondContact O-N 2.86Å; S481-V485 PolarHBondContact O-N 2.86Å
482	I	91.6	Very high	89.5	Confident	28 Å²	28	62.5 Å²	62.5	14%	0.144	31%	0.307	C	S	.	.	H	α-helix	trans	-66	-36.4	176.5	-77	160.1	0	0	0	111.6	T379 R382 L383 L386 E478 I479 R484 V485 L486	T379-I482 HydrophobicContact CG2-CG2 3.85Å; R382-I482 HydrophobicContact CB-CD1 4.42Å; L383-I482 HydrophobicContact CB-CG2 3.81Å; L383-I482 HydrophobicContact CD1-CG2 4.18Å; L383-I482 HydrophobicContact CG-CG2 4.49Å; L386-I482 HydrophobicContact CD1-CD1 3.4Å; L386-I482 VanDerWaalsContact CD1-CD1 3.4Å; E478-I482 WeakPolarHBondContact O-CB 3.29Å; E478-I482 PolarHBondContact O-N 2.85Å; I479-I482 PolarHBondContact O-N 3.37Å; I482-R484 VanDerWaalsContact C-N 3.29Å; I482-R484 PolarHBondContact O-N 2.93Å; I482-V485 PolarHBondContact O-N 2.85Å; I482-V485 VanDerWaalsContact O-N 3.15Å; I482-L486 WeakPolarHBondContact O-CB 3.38Å; I482-L486 PolarHBondContact O-N 3.27Å
483	G	89	Confident	89.1	Confident	31 Å²	31	62 Å²	62	32%	0.32	31%	0.307	S	S	.	.	H	α-helix	trans	-57.9	-38.3	172.6	0	0	0	0	0	113.2	I479 S481 A487	I479-G483 PolarHBondContact O-N 2.74Å; S481-G483 PolarHBondContact O-N 3Å; G483-A487 WeakPolarHBondContact O-CB 3.45Å; G483-A487 PolarHBondContact O-N 3.48Å
484	R	87.6	Confident	88.6	Confident	127 Å²	127	64.3 Å²	64.3	48%	0.479	32%	0.317	S	S	.	.	H	α-helix	trans	-67.1	-43.8	173.6	-61.2	176.2	-158.5	132.1	3.5	111.8	M480 S481 I482 A487 S488	M480-R484 WeakPolarHBondContact O-CG 3.49Å; M480-R484 PolarHBondContact O-N 3.34Å; S481-R484 WeakPolarHBondContact O-CB 3.45Å; S481-R484 PolarHBondContact O-N 2.86Å; I482-R484 VanDerWaalsContact C-N 3.29Å; I482-R484 PolarHBondContact O-N 2.93Å; R484-A487 PolarHBondContact O-N 2.71Å; R484-S488 PolarHBondContact O-N 2.66Å
485	V	89.4	Confident	87.9	Confident	69 Å²	69	62.8 Å²	62.8	42%	0.418	32%	0.317	S	S	.	.	H	α-helix	trans	-61.3	-46.8	177.1	177.3	0	0	0	0	110	T379 S481 I482 A487 S488 L489	T379-V485 HydrophobicContact CG2-CB 4.37Å; T379-V485 HydrophobicContact CG2-CG1 4.09Å; S481-V485 PolarHBondContact O-N 2.86Å; I482-V485 PolarHBondContact O-N 2.85Å; I482-V485 VanDerWaalsContact O-N 3.15Å; V485-A487 PolarHBondContact O-N 2.81Å; V485-S488 PolarHBondContact O-N 2.85Å; V485-S488 VanDerWaalsContact O-N 3.12Å; V485-S488 PolarHBondContact O-OG 2.69Å; V485-L489 HydrophobicContact CG1-CD1 3.88Å; V485-L489 HydrophobicContact CG1-CG 4.31Å; V485-L489 WeakPolarHBondContact O-CG 3.36Å; V485-L489 PolarHBondContact O-N 3.1Å
486	L	90.9	Very high	87.1	Confident	12 Å²	12	64.1 Å²	64.1	6%	0.063	32%	0.324	C	S	.	.	H	α-helix	trans	-57.7	-49.2	178	-173.7	65.7	0	0	0	111.8	Y376 T379 R380 L383 I482 S488 L489 E490	Y376-L486 HydrophobicContact CD2-CD1 3.54Å; Y376-L486 HydrophobicContact CE2-CD1 3.37Å; Y376-L486 HydrophobicContact CE2-CG 4.08Å; Y376-L486 HydrophobicContact CG-CD1 4.3Å; T379-L486 HydrophobicContact CG2-CB 4.04Å; T379-L486 HydrophobicContact CG2-CD1 4.19Å; R380-L486 HydrophobicContact CG-CD1 3.48Å; R380-L486 VanDerWaalsContact CG-CD1 3.48Å; R380-L486 HydrophobicContact CG-CD2 4.17Å; R380-L486 HydrophobicContact CG-CG 4.5Å; L383-L486 HydrophobicContact CD2-CD2 3.95Å; I482-L486 WeakPolarHBondContact O-CB 3.38Å; I482-L486 PolarHBondContact O-N 3.27Å; L486-S488 VanDerWaalsContact C-N 3.28Å; L486-S488 PolarHBondContact O-N 3.46Å; L486-L489 PolarHBondContact O-N 3.31Å; L486-E490 WeakPolarHBondContact O-CB 3.48Å; L486-E490 PolarHBondContact O-N 2.93Å
487	A	86.8	Confident	86.4	Confident	43 Å²	43	62.8 Å²	62.8	36%	0.355	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-32.7	176.9	0	0	0	0	0	113.1	G483 R484 V485 Q491	G483-A487 WeakPolarHBondContact O-CB 3.45Å; G483-A487 PolarHBondContact O-N 3.48Å; R484-A487 PolarHBondContact O-N 2.71Å; V485-A487 PolarHBondContact O-N 2.81Å; A487-Q491 WeakPolarHBondContact O-CG 3.4Å; A487-Q491 PolarHBondContact O-N 3.33Å
488	S	89.9	Confident	85	Confident	64 Å²	64	58 Å²	58	45%	0.448	32%	0.319	S	S	.	.	H	α-helix	trans	-72.8	-40.4	175.1	76.5	0	0	0	0	112.5	R484 V485 L486 Q491 Y492	R484-S488 PolarHBondContact O-N 2.66Å; V485-S488 PolarHBondContact O-N 2.85Å; V485-S488 VanDerWaalsContact O-N 3.12Å; V485-S488 PolarHBondContact O-OG 2.69Å; L486-S488 VanDerWaalsContact C-N 3.28Å; L486-S488 PolarHBondContact O-N 3.46Å; S488-Q491 PolarHBondContact O-N 3.06Å; S488-Y492 WeakPolarHBondContact O-CB 3.38Å; S488-Y492 PolarHBondContact O-N 3.25Å
489	L	88.6	Confident	83.2	Confident	20 Å²	20	58.2 Å²	58.2	11%	0.105	33%	0.327	C	S	.	.	H	α-helix	trans	-67.8	-36.5	175.3	-73	173	0	0	0	111.5	Q375 Y376 T379 V485 L486 Y492 V493	Q375-L489 HydrophobicContact CB-CD1 4.2Å; Q375-L489 HydrophobicContact CB-CD2 4.22Å; Y376-L489 HydrophobicContact CD2-CB 4.11Å; T379-L489 HydrophobicContact CG2-CD1 4.43Å; T379-L489 WeakPolarHBondContact OG1-CD1 3.39Å; V485-L489 HydrophobicContact CG1-CD1 3.88Å; V485-L489 HydrophobicContact CG1-CG 4.31Å; V485-L489 WeakPolarHBondContact O-CG 3.36Å; V485-L489 PolarHBondContact O-N 3.1Å; L486-L489 PolarHBondContact O-N 3.31Å; L489-Y492 PolarHBondContact O-N 2.97Å; L489-V493 WeakPolarHBondContact O-CB 3.46Å; L489-V493 VanDerWaalsContact O-CG2 3.32Å; L489-V493 WeakPolarHBondContact O-CG2 3.36Å; L489-V493 PolarHBondContact O-N 3.29Å
490	E	86.9	Confident	81.2	Confident	65 Å²	65	60.4 Å²	60.4	30%	0.304	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-48.7	174.4	-163.3	177	143.8	0	0	111.4	Y376 L486 Y492 V493 Q494	Y376-E490 HydrophobicContact CD2-CB 4.42Å; Y376-E490 HydrophobicContact CE2-CB 3.86Å; Y376-E490 HydrophobicContact CE2-CG 4.11Å; L486-E490 WeakPolarHBondContact O-CB 3.48Å; L486-E490 PolarHBondContact O-N 2.93Å; E490-Y492 VanDerWaalsContact C-N 3.28Å; E490-Y492 PolarHBondContact O-N 3.04Å; E490-V493 PolarHBondContact O-N 3.15Å; E490-Q494 VanDerWaalsContact O-CB 3.26Å; E490-Q494 WeakPolarHBondContact O-CB 3.5Å; E490-Q494 PolarHBondContact O-N 3.07Å
491	Q	84.2	Confident	79	Confident	136 Å²	136	65.5 Å²	65.5	64%	0.636	37%	0.369	S	S	*	.	H	α-helix	trans	-59.6	-38.8	173.4	-71.5	171.7	37.5	0	0	111.8	A487 S488 T495	A487-Q491 WeakPolarHBondContact O-CG 3.4Å; A487-Q491 PolarHBondContact O-N 3.33Å; S488-Q491 PolarHBondContact O-N 3.06Å; Q491-T495 WeakPolarHBondContact O-CB 3.44Å; Q491-T495 WeakPolarHBondContact O-CG2 3.31Å; Q491-T495 PolarHBondContact O-N 3.04Å; Q491-T495 PolarHBondContact O-OG1 3.04Å
492	Y	85.6	Confident	76.4	Confident	107 Å²	107	67.9 Å²	67.9	42%	0.42	39%	0.385	S	S	.	.	H	α-helix	trans	-68.6	-49.7	178.6	-173.9	-122	0	0	0	112.2	A372 S488 L489 E490 Q494 T495 L496	A372-Y492 HydrophobicContact CB-CD1 3.69Å; A372-Y492 HydrophobicContact CB-CE1 3.76Å; S488-Y492 WeakPolarHBondContact O-CB 3.38Å; S488-Y492 PolarHBondContact O-N 3.25Å; L489-Y492 PolarHBondContact O-N 2.97Å; E490-Y492 VanDerWaalsContact C-N 3.28Å; E490-Y492 PolarHBondContact O-N 3.04Å; Y492-Q494 VanDerWaalsContact C-N 3.26Å; Y492-Q494 PolarHBondContact O-N 3.41Å; Y492-T495 PolarHBondContact O-N 2.88Å; Y492-T495 PolarHBondContact O-OG1 3.4Å; Y492-L496 HydrophobicContact CD1-CD1 4.01Å; Y492-L496 HydrophobicContact CD2-CG 4.36Å; Y492-L496 HydrophobicContact CE1-CD1 3.58Å; Y492-L496 HydrophobicContact CE1-CG 4.38Å; Y492-L496 HydrophobicContact CE2-CD1 4.14Å; Y492-L496 HydrophobicContact CE2-CD2 4.17Å; Y492-L496 HydrophobicContact CE2-CG 4.06Å; Y492-L496 HydrophobicContact CG-CD1 4.46Å; Y492-L496 WeakPolarHBondContact O-CG 3.39Å; Y492-L496 PolarHBondContact O-N 2.82Å
493	V	83.9	Confident	73.4	Confident	24 Å²	24	71.2 Å²	71.2	15%	0.145	41%	0.411	C	S	.	.	H	α-helix	trans	-58.1	-40.5	174.6	171.3	0	0	0	0	110.8	A372 R373 L489 E490 S497	A372-V493 HydrophobicContact CB-CG2 3.68Å; R373-V493 HydrophobicContact CG-CG1 3.94Å; R373-V493 HydrophobicContact CG-CG2 4.28Å; L489-V493 WeakPolarHBondContact O-CB 3.46Å; L489-V493 VanDerWaalsContact O-CG2 3.32Å; L489-V493 WeakPolarHBondContact O-CG2 3.36Å; L489-V493 PolarHBondContact O-N 3.29Å; E490-V493 PolarHBondContact O-N 3.15Å; V493-S497 WeakPolarHBondContact O-CB 3.46Å; V493-S497 PolarHBondContact O-N 3.21Å; V493-S497 PolarHBondContact O-OG 3.4Å
494	Q	79.6	Confident	70.5	Confident	115 Å²	115	74.6 Å²	74.6	54%	0.537	43%	0.43	S	S	.	.	H	α-helix	trans	-68.6	-43.6	178.9	-168.2	144.8	33.7	0	0	112.5	E490 Y492 S497 A498	E490-Q494 VanDerWaalsContact O-CB 3.26Å; E490-Q494 WeakPolarHBondContact O-CB 3.5Å; E490-Q494 PolarHBondContact O-N 3.07Å; Y492-Q494 VanDerWaalsContact C-N 3.26Å; Y492-Q494 PolarHBondContact O-N 3.41Å; Q494-S497 PolarHBondContact O-N 2.92Å; Q494-S497 PolarHBondContact O-OG 3.25Å; Q494-A498 PolarHBondContact O-N 3.2Å; Q494-A498 VanDerWaalsContact O-N 3.08Å
495	T	80.4	Confident	67.7	Low	80 Å²	80	73.6 Å²	73.6	49%	0.491	44%	0.442	S	S	.	.	H	α-helix	trans	-65.6	-40.3	176	51.1	0	0	0	0	112.8	Q491 Y492 A498 S499	Q491-T495 WeakPolarHBondContact O-CB 3.44Å; Q491-T495 WeakPolarHBondContact O-CG2 3.31Å; Q491-T495 PolarHBondContact O-N 3.04Å; Q491-T495 PolarHBondContact O-OG1 3.04Å; Y492-T495 PolarHBondContact O-N 2.88Å; Y492-T495 PolarHBondContact O-OG1 3.4Å; T495-A498 PolarHBondContact O-N 3.39Å; T495-S499 WeakPolarHBondContact O-CB 3.33Å; T495-S499 PolarHBondContact O-N 3.44Å; T495-S499 PolarHBondContact O-OG 3.47Å
496	L	75.2	Confident	64.7	Low	29 Å²	29	77.9 Å²	77.9	15%	0.152	46%	0.462	C	S	.	.	H	α-helix	trans	-62.7	-44.1	173.2	-69.2	177.9	0	0	0	111.6	I369 A372 Y492 A498 S499 T500	I369-L496 HydrophobicContact CD1-CB 4.3Å; I369-L496 HydrophobicContact CG1-CB 3.63Å; I369-L496 HydrophobicContact CG1-CD1 4.09Å; I369-L496 HydrophobicContact CG1-CG 4.43Å; A372-L496 HydrophobicContact CB-CD1 3.93Å; Y492-L496 HydrophobicContact CD1-CD1 4.01Å; Y492-L496 HydrophobicContact CD2-CG 4.36Å; Y492-L496 HydrophobicContact CE1-CD1 3.58Å; Y492-L496 HydrophobicContact CE1-CG 4.38Å; Y492-L496 HydrophobicContact CE2-CD1 4.14Å; Y492-L496 HydrophobicContact CE2-CD2 4.17Å; Y492-L496 HydrophobicContact CE2-CG 4.06Å; Y492-L496 HydrophobicContact CG-CD1 4.46Å; Y492-L496 WeakPolarHBondContact O-CG 3.39Å; Y492-L496 PolarHBondContact O-N 2.82Å; L496-A498 VanDerWaalsContact C-N 3.33Å; L496-A498 PolarHBondContact O-N 3.42Å; L496-S499 WeakPolarHBondContact O-CB 3.33Å; L496-S499 PolarHBondContact O-N 3.36Å; L496-S499 VanDerWaalsContact O-N 3.1Å; L496-T500 PolarHBondContact O-N 3.27Å; L496-T500 PolarHBondContact O-OG1 2.95Å
497	S	75.3	Confident	61.7	Low	42 Å²	42	83.3 Å²	83.3	29%	0.294	50%	0.501	S	S	.	.	H	α-helix	trans	-62.2	-38	179.5	73.6	0	0	0	0	113	V493 Q494 T500	V493-S497 WeakPolarHBondContact O-CB 3.46Å; V493-S497 PolarHBondContact O-N 3.21Å; V493-S497 PolarHBondContact O-OG 3.4Å; Q494-S497 PolarHBondContact O-N 2.92Å; Q494-S497 PolarHBondContact O-OG 3.25Å; S497-T500 WeakPolarHBondContact CA-OG1 3.18Å; S497-T500 PolarHBondContact O-OG1 3.41Å
498	A	60.3	Low	58.8	Low	54 Å²	54	88.5 Å²	88.5	45%	0.446	53%	0.529	S	S	.	.	H	α-helix	trans	-68.6	-37.2	173.2	0	0	0	0	0	112.3	Q494 T495 L496 L501 S502	Q494-A498 PolarHBondContact O-N 3.2Å; Q494-A498 VanDerWaalsContact O-N 3.08Å; T495-A498 PolarHBondContact O-N 3.39Å; L496-A498 VanDerWaalsContact C-N 3.33Å; L496-A498 PolarHBondContact O-N 3.42Å; A498-L501 PolarHBondContact O-N 3.36Å; A498-S502 PolarHBondContact O-OG 3.22Å
499	S	53.9	Low	55.8	Low	68 Å²	68	88.6 Å²	88.6	48%	0.476	54%	0.539	S	S	.	.	H	α-helix	trans	-66.3	-35.6	178.2	-58.2	0	0	0	0	112.8	T495 L496 L501 S502 S503	T495-S499 WeakPolarHBondContact O-CB 3.33Å; T495-S499 PolarHBondContact O-N 3.44Å; T495-S499 PolarHBondContact O-OG 3.47Å; L496-S499 WeakPolarHBondContact O-CB 3.33Å; L496-S499 PolarHBondContact O-N 3.36Å; L496-S499 VanDerWaalsContact O-N 3.1Å; S499-L501 VanDerWaalsContact C-N 3.28Å; S499-L501 PolarHBondContact O-N 2.85Å; S499-S502 PolarHBondContact O-N 3.18Å; S499-S503 PolarHBondContact O-OG 3.32Å
500	T	49.8	Very low	53	Low	59 Å²	59	93.1 Å²	93.1	36%	0.362	57%	0.573	S	S	.	*	H	α-helix	trans	-61.1	-33.1	174.7	21.7	0	0	0	0	113.8	I369 L496 S497 S502	I369-T500 HydrophobicContact CD1-CG2 3.38Å; L496-T500 PolarHBondContact O-N 3.27Å; L496-T500 PolarHBondContact O-OG1 2.95Å; S497-T500 WeakPolarHBondContact CA-OG1 3.18Å; S497-T500 PolarHBondContact O-OG1 3.41Å; T500-S502 PolarHBondContact O-N 3.13Å
501	L	40.8	Very low	50.1	Low	151 Å²	151	94.8 Å²	94.8	79%	0.791	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-7.9	176.9	-65.1	175.8	0	0	0	113.4	A498 S499	A498-L501 PolarHBondContact O-N 3.36Å; S499-L501 VanDerWaalsContact C-N 3.28Å; S499-L501 PolarHBondContact O-N 2.85Å
502	S	35.1	Very low	47.5	Very low	101 Å²	101	97.8 Å²	97.8	71%	0.706	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	3.1	-178.4	-56.4	0	0	0	0	113.5	A498 S499 T500	A498-S502 PolarHBondContact O-OG 3.22Å; S499-S502 PolarHBondContact O-N 3.18Å; T500-S502 PolarHBondContact O-N 3.13Å
503	S	28.2	Very low	44.9	Very low	98 Å²	98	97.2 Å²	97.2	69%	0.685	62%	0.622	S	S	*	*			trans	-103.5	36.8	-175.1	-59.9	0	0	0	0	113.8	S499	S499-S503 PolarHBondContact O-OG 3.32Å
504	S	29	Very low	42.3	Very low	102 Å²	102	101 Å²	101	71%	0.713	65%	0.65	S	S	*	*	S	Bend	trans	-141.8	105.7	163.3	58.6	0	0	0	0	110.1
505	S	28.1	Very low	39.9	Very low	106 Å²	106	100.9 Å²	100.9	74%	0.741	66%	0.662	S	S	*	*			trans	-58.6	153.1	172.4	47.3	0	0	0	0	112.8
506	L	26.7	Very low	37.6	Very low	159 Å²	159	102 Å²	102	83%	0.832	68%	0.679	S	S	*	*			trans	74.8	84.3	175.5	-57	117.2	0	0	0	116.5
507	S	26.9	Very low	35.5	Very low	127 Å²	127	105.2 Å²	105.2	89%	0.888	70%	0.704	S	S	*	*				-168.2	127.5	121.7	-83.6	0	0	0	0	112.5
508	T	26.3	Very low	33.3	Very low	152 Å²	152	109.5 Å²	109.5	93%	0.933	72%	0.724	S	S	*	*			trans	-77.8	124.3	172.4	43.2	0	0	0	0	111
509	G	27.6	Very low	31.9	Very low	65 Å²	65	114.8 Å²	114.8	67%	0.67	74%	0.744	S	S	*	*			trans	120.6	139.6	154.7	0	0	0	0	0	117
510	S	28.8	Very low	30.9	Very low	116 Å²	116	119 Å²	119	81%	0.811	76%	0.761	S	S	*	*			trans	84.4	143.3	169	82.2	0	0	0	0	119.1
511	S	26.9	Very low	30.1	Very low	99 Å²	99	123.4 Å²	123.4	69%	0.692	78%	0.777	S	S	*	*			trans	75.2	48.6	167.9	73.8	0	0	0	0	120.8	A513	S511-A513 PolarHBondContact O-N 3.44Å
512	H	29.2	Very low	29.5	Very low	200 Å²	200	119.4 Å²	119.4	93%	0.926	76%	0.757	S	S	*	*			trans	-70.1	72	150.9	-74.7	-66.9	0	0	0	111.3
513	A	31.5	Very low	29.4	Very low	94 Å²	94	117.5 Å²	117.5	78%	0.777	75%	0.747	S	S	*	*			trans	-155.8	42.9	-179.7	0	0	0	0	0	114.3	S511	S511-A513 PolarHBondContact O-N 3.44Å
514	S	29.3	Very low	29.7	Very low	103 Å²	103	120.2 Å²	120.2	72%	0.72	74%	0.744	S	S	*	*	S	Bend	trans	-145.1	-6.7	178.3	54.6	0	0	0	0	115.8	A516	S514-A516 PolarHBondContact O-N 3.24Å
515	S	29	Very low	30	Very low	114 Å²	114	119.6 Å²	119.6	80%	0.797	73%	0.726	S	S	*	*	S	Bend	trans	-98.5	49.6	-174.9	41.1	0	0	0	0	114.1
516	A	30.8	Very low	30.4	Very low	102 Å²	102	120.8 Å²	120.8	84%	0.843	72%	0.723	S	S	*	*	S	Bend	trans	-154.5	29.3	176.6	0	0	0	0	0	116	S514	S514-A516 PolarHBondContact O-N 3.24Å
517	S	32.5	Very low	30.7	Very low	97 Å²	97	119.2 Å²	119.2	68%	0.678	71%	0.712	S	S	*	*			trans	-153.6	104.4	173.9	54.9	0	0	0	0	111.9
518	N	29.3	Very low	31.2	Very low	132 Å²	132	119.6 Å²	119.6	71%	0.706	69%	0.694	S	S	*	*			trans	-176.7	15.3	148.4	-96.1	2.7	0	0	0	115	N520	N518-N520 PolarHBondContact O-N 2.89Å
519	L	31.2	Very low	31.4	Very low	166 Å²	166	113 Å²	113	87%	0.869	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	22	169.9	-75.6	171.2	0	0	0	113.9
520	N	31.6	Very low	31.7	Very low	157 Å²	157	114.5 Å²	114.5	84%	0.84	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.3	10.7	-164.8	-118.8	46.9	0	0	0	115.1	N518	N518-N520 PolarHBondContact O-N 2.89Å
521	Q	32.4	Very low	31.7	Very low	150 Å²	150	111 Å²	111	70%	0.701	63%	0.632	S	S	*	*	S	Bend	trans	-123.2	-33.6	174.5	-80.5	-175.7	-22.3	0	0	115.1
522	D	28.6	Very low	32.2	Very low	67 Å²	67	110.3 Å²	110.3	36%	0.358	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.1	24.2	-177	-88.6	-54.8	0	0	0	115.1	R380 Y524 W525	R380-D522 IonicContact CZ-OD1 3.11Å; R380-D522 IonicContact NH1-OD1 2.69Å; R380-D522 PolarHBondContact NH1-OD1 2.87Å; R380-D522 VanDerWaalsContact NH1-OD1 3.08Å; R380-D522 IonicContact NH1-OD2 3.37Å; R380-D522 PolarHBondContact NH1-OD2 2.95Å; R380-D522 IonicContact NH2-OD1 3.6Å; R380-D522 PolarHBondContact NH2-OD1 3.34Å; D522-Y524 VanDerWaalsContact C-N 3.33Å; D522-W525 PolarHBondContact OD1-NE1 3.3Å
523	A	33.5	Very low	32.7	Very low	62 Å²	62	108.5 Å²	108.5	51%	0.512	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.9	-8.5	172.5	0	0	0	0	0	114.2	W525 L526	A523-W525 PolarHBondContact O-N 2.9Å; A523-L526 PolarHBondContact O-N 3.24Å
524	Y	33.6	Very low	33.1	Very low	155 Å²	155	109.5 Å²	109.5	61%	0.608	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-63.6	-29	-175.4	-144.9	-98.2	0	0	0	112.9	D522	D522-Y524 VanDerWaalsContact C-N 3.33Å
525	W	35.4	Very low	33.9	Very low	88 Å²	88	108.6 Å²	108.6	33%	0.333	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-77.5	-22.2	-178.1	-55.1	114.4	0	0	0	114.4	Q387 D522 A523 Q527	Q387-W525 VanDerWaalsContact NE2-CE3 3.29Å; D522-W525 PolarHBondContact OD1-NE1 3.3Å; A523-W525 PolarHBondContact O-N 2.9Å; W525-Q527 VanDerWaalsContact C-N 3.28Å; W525-Q527 PolarHBondContact O-N 2.9Å
526	L	36.8	Very low	34.7	Very low	131 Å²	131	109.1 Å²	109.1	69%	0.686	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-73.8	-19.9	177.7	-75	167.1	0	0	0	112.6	A523 Y528 G529	A523-L526 PolarHBondContact O-N 3.24Å; L526-Y528 VanDerWaalsContact C-N 3.29Å; L526-Y528 PolarHBondContact O-N 2.93Å; L526-G529 PolarHBondContact O-N 2.9Å; L526-G529 VanDerWaalsContact O-N 3.16Å
527	Q	33.3	Very low	35.2	Very low	127 Å²	127	110.1 Å²	110.1	59%	0.593	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-67.8	-27.2	-179.1	-172.5	167	-16.4	0	0	113.3	W525 N530	W525-Q527 VanDerWaalsContact C-N 3.28Å; W525-Q527 PolarHBondContact O-N 2.9Å; Q527-N530 PolarHBondContact O-ND2 2.89Å
528	Y	38.4	Very low	36.2	Very low	134 Å²	134	108.2 Å²	108.2	53%	0.525	56%	0.556	S	S	.	*	G	3₁₀ helix	trans	-88.8	-4.6	176	-62.5	-79.4	0	0	0	113.2	L526 N530	L526-Y528 VanDerWaalsContact C-N 3.29Å; L526-Y528 PolarHBondContact O-N 2.93Å; Y528-N530 VanDerWaalsContact C-N 3.31Å; Y528-N530 PolarHBondContact O-N 2.88Å
529	G	29.8	Very low	37.3	Very low	13 Å²	13	105 Å²	105	13%	0.134	54%	0.539	C	S	.	.			trans	-88	22	179.8	0	0	0	0	0	115	L526 G531	L526-G529 PolarHBondContact O-N 2.9Å; L526-G529 VanDerWaalsContact O-N 3.16Å; G529-G531 PolarHBondContact O-N 3.37Å
530	N	33.4	Very low	38.3	Very low	97 Å²	97	101.9 Å²	101.9	52%	0.519	52%	0.523	S	S	.	.			trans	-70.1	89.1	-175.2	-75.6	-16	0	0	0	112	Q527 Y528	Q527-N530 PolarHBondContact O-ND2 2.89Å; Y528-N530 VanDerWaalsContact C-N 3.31Å; Y528-N530 PolarHBondContact O-N 2.88Å
531	G	28.3	Very low	39	Very low	44 Å²	44	101.2 Å²	101.2	45%	0.454	51%	0.509	S	S	.	.			trans	-164.4	38.6	175.9	0	0	0	0	0	111.1	M480 G529	M480-G531 WeakPolarHBondContact CE-O 3.38Å; G529-G531 PolarHBondContact O-N 3.37Å
532	I	38.8	Very low	39.9	Very low	83 Å²	83	97.7 Å²	97.7	43%	0.426	49%	0.492	S	S	.	.			trans	-109.9	90.3	-168.1	-53.4	176.7	0	0	0	110.2	E536	I532-E536 HydrophobicContact CG2-CB 3.88Å; I532-E536 HydrophobicContact CG2-CG 3.56Å
533	E	40.1	Very low	41	Very low	162 Å²	162	103.2 Å²	103.2	76%	0.757	51%	0.508	S	S	*	.	S	Bend	trans	-136.1	-45.5	166	-75.6	-152.3	118.9	0	0	114.1
534	V	39.6	Very low	42	Very low	115 Å²	115	105 Å²	105	70%	0.697	51%	0.508	S	S	*	.	S	Bend	trans	-86.8	-49.7	-174.1	-173.8	0	0	0	0	112.6	E536 L537 V538	V534-E536 PolarHBondContact O-N 2.75Å; V534-L537 PolarHBondContact O-N 3.16Å; V534-V538 PolarHBondContact O-N 2.83Å
535	Q	45.7	Very low	42.9	Very low	84 Å²	84	101.6 Å²	101.6	39%	0.393	50%	0.498	S	S	.	.	H	α-helix	trans	-68.4	-36.2	-171.6	-167.4	62.4	45.4	0	0	113.3	L537 V538 D539	Q535-L537 PolarHBondContact O-N 3.2Å; Q535-V538 PolarHBondContact O-N 2.89Å; Q535-D539 PolarHBondContact NE2-OD1 2.88Å; Q535-D539 WeakPolarHBondContact O-CB 3.26Å; Q535-D539 VanDerWaalsContact O-CG 3.3Å; Q535-D539 PolarHBondContact O-N 2.93Å
536	E	46.3	Very low	43.2	Very low	125 Å²	125	106.2 Å²	106.2	58%	0.584	52%	0.515	S	S	*	.	H	α-helix	trans	-64.1	-30.6	177	-98.3	-166.3	-172.1	0	0	112.7	I532 V534 L540	I532-E536 HydrophobicContact CG2-CB 3.88Å; I532-E536 HydrophobicContact CG2-CG 3.56Å; V534-E536 PolarHBondContact O-N 2.75Å; E536-L540 WeakPolarHBondContact O-CB 2.87Å; E536-L540 PolarHBondContact O-N 3.28Å
537	L	41.2	Very low	43.3	Very low	124 Å²	124	107.1 Å²	107.1	65%	0.649	52%	0.52	S	S	*	.	H	α-helix	trans	-71.1	-39.3	175.9	-166.2	67.9	0	0	0	111.1	V534 Q535 R541	V534-L537 PolarHBondContact O-N 3.16Å; Q535-L537 PolarHBondContact O-N 3.2Å; L537-R541 WeakPolarHBondContact O-CB 3.11Å; L537-R541 PolarHBondContact O-N 3.19Å
538	V	52.7	Low	43.5	Very low	56 Å²	56	104.8 Å²	104.8	34%	0.339	52%	0.522	S	S	.	.	H	α-helix	trans	-65.8	-44.4	173.2	177.4	0	0	0	0	111.1	V534 Q535 R541 Q542	V534-V538 PolarHBondContact O-N 2.83Å; Q535-V538 PolarHBondContact O-N 2.89Å; V538-R541 WeakPolarHBondContact O-CB 3.48Å; V538-R541 PolarHBondContact O-N 3.42Å; V538-Q542 WeakPolarHBondContact O-CG 3.25Å; V538-Q542 PolarHBondContact O-N 2.99Å
539	D	52.6	Low	43.2	Very low	64 Å²	64	103.8 Å²	103.8	34%	0.342	53%	0.53	S	S	.	.	H	α-helix	trans	-69.2	-39.5	-179.7	-70.7	-4.9	0	0	0	111.4	Q535 Q542 R543	Q535-D539 PolarHBondContact NE2-OD1 2.88Å; Q535-D539 WeakPolarHBondContact O-CB 3.26Å; Q535-D539 VanDerWaalsContact O-CG 3.3Å; Q535-D539 PolarHBondContact O-N 2.93Å; D539-Q542 PolarHBondContact O-N 2.9Å; D539-R543 WeakPolarHBondContact O-CB 3.49Å; D539-R543 PolarHBondContact O-N 3.44Å
540	L	51.1	Low	43.3	Very low	101 Å²	101	106.9 Å²	106.9	53%	0.529	56%	0.562	S	S	.	*	H	α-helix	trans	-62.3	-43.3	171.3	-174.2	71.8	0	0	0	110.8	E536 R543 I544	E536-L540 WeakPolarHBondContact O-CB 2.87Å; E536-L540 PolarHBondContact O-N 3.28Å; L540-R543 PolarHBondContact O-N 3.2Å; L540-I544 HydrophobicContact CD1-CD1 4.49Å; L540-I544 HydrophobicContact CG-CD1 4.02Å; L540-I544 WeakPolarHBondContact O-CB 3.09Å; L540-I544 VanDerWaalsContact O-CG1 3.25Å; L540-I544 WeakPolarHBondContact O-CG1 3.45Å; L540-I544 PolarHBondContact O-N 2.85Å
541	R	47.5	Very low	42.9	Very low	144 Å²	144	108 Å²	108	54%	0.543	58%	0.576	S	S	.	*	H	α-helix	trans	-62	-48.8	176.7	-174	-174.1	175.7	-60.2	-21.2	111.3	L537 V538 R543 I544 E545	L537-R541 WeakPolarHBondContact O-CB 3.11Å; L537-R541 PolarHBondContact O-N 3.19Å; V538-R541 WeakPolarHBondContact O-CB 3.48Å; V538-R541 PolarHBondContact O-N 3.42Å; R541-R543 VanDerWaalsContact C-N 3.34Å; R541-R543 PolarHBondContact O-N 2.73Å; R541-I544 PolarHBondContact O-N 2.89Å; R541-E545 IonicContact CZ-OE1 3.09Å; R541-E545 IonicContact CZ-OE2 3.77Å; R541-E545 IonicContact NH1-OE1 3.07Å; R541-E545 PolarHBondContact NH1-OE1 2.79Å; R541-E545 IonicContact NH1-OE2 2.65Å; R541-E545 PolarHBondContact NH1-OE2 2.85Å; R541-E545 IonicContact NH2-OE1 3.8Å; R541-E545 PolarHBondContact NH2-OE1 3.41Å; R541-E545 WeakPolarHBondContact O-CG 3.36Å; R541-E545 PolarHBondContact O-N 3.1Å
542	Q	50.8	Low	42.8	Very low	76 Å²	76	111.3 Å²	111.3	36%	0.355	59%	0.592	S	S	.	*	H	α-helix	trans	-63.3	-37.9	175.3	-73.4	-167.4	23.2	0	0	112.2	V538 D539 I544 E545 R546	V538-Q542 WeakPolarHBondContact O-CG 3.25Å; V538-Q542 PolarHBondContact O-N 2.99Å; D539-Q542 PolarHBondContact O-N 2.9Å; Q542-I544 VanDerWaalsContact C-N 3.34Å; Q542-E545 PolarHBondContact O-N 3.17Å; Q542-R546 WeakPolarHBondContact O-CB 3.44Å; Q542-R546 VanDerWaalsContact O-CG 3.24Å; Q542-R546 WeakPolarHBondContact O-CG 3.47Å; Q542-R546 PolarHBondContact O-N 3.08Å
543	R	51.5	Low	42.3	Very low	182 Å²	182	111.9 Å²	111.9	69%	0.687	60%	0.599	S	S	*	*	H	α-helix	trans	-69.5	-32.8	178.1	-166.1	168.8	-176.4	166.3	0.2	111.8	D539 L540 R541 L547	D539-R543 WeakPolarHBondContact O-CB 3.49Å; D539-R543 PolarHBondContact O-N 3.44Å; L540-R543 PolarHBondContact O-N 3.2Å; R541-R543 VanDerWaalsContact C-N 3.34Å; R541-R543 PolarHBondContact O-N 2.73Å; R543-L547 WeakPolarHBondContact O-CD1 3.35Å; R543-L547 WeakPolarHBondContact O-CG 3.31Å; R543-L547 PolarHBondContact O-N 3.13Å
544	I	55.4	Low	42.1	Very low	101 Å²	101	109.7 Å²	109.7	52%	0.518	60%	0.599	S	S	.	*	H	α-helix	trans	-69.5	-44.5	169.3	-70	165.3	0	0	0	110.9	L540 R541 Q542 R546 L547 A548	L540-I544 HydrophobicContact CD1-CD1 4.49Å; L540-I544 HydrophobicContact CG-CD1 4.02Å; L540-I544 WeakPolarHBondContact O-CB 3.09Å; L540-I544 VanDerWaalsContact O-CG1 3.25Å; L540-I544 WeakPolarHBondContact O-CG1 3.45Å; L540-I544 PolarHBondContact O-N 2.85Å; R541-I544 PolarHBondContact O-N 2.89Å; Q542-I544 VanDerWaalsContact C-N 3.34Å; I544-R546 PolarHBondContact O-N 3.43Å; I544-L547 CarbonylContact O-C 3.38Å; I544-L547 PolarHBondContact O-N 3.04Å; I544-L547 VanDerWaalsContact O-N 3.13Å; I544-A548 WeakPolarHBondContact O-CB 3.26Å; I544-A548 PolarHBondContact O-N 2.88Å
545	E	52.5	Low	41.2	Very low	83 Å²	83	108.5 Å²	108.5	39%	0.388	60%	0.602	S	S	.	*	H	α-helix	trans	-62.1	-42.8	177.4	-76.8	178.1	148.8	0	0	112.3	R541 Q542 L547 A548 V549	R541-E545 IonicContact CZ-OE1 3.09Å; R541-E545 IonicContact CZ-OE2 3.77Å; R541-E545 IonicContact NH1-OE1 3.07Å; R541-E545 PolarHBondContact NH1-OE1 2.79Å; R541-E545 IonicContact NH1-OE2 2.65Å; R541-E545 PolarHBondContact NH1-OE2 2.85Å; R541-E545 IonicContact NH2-OE1 3.8Å; R541-E545 PolarHBondContact NH2-OE1 3.41Å; R541-E545 WeakPolarHBondContact O-CG 3.36Å; R541-E545 PolarHBondContact O-N 3.1Å; Q542-E545 PolarHBondContact O-N 3.17Å; E545-L547 PolarHBondContact O-N 3.2Å; E545-A548 PolarHBondContact O-N 2.96Å; E545-A548 VanDerWaalsContact O-N 3.08Å; E545-V549 PolarHBondContact O-N 3.36Å
546	R	40.7	Very low	40.4	Very low	185 Å²	185	110.3 Å²	110.3	70%	0.698	62%	0.62	S	S	*	*	H	α-helix	trans	-64.3	-25.3	174.1	-69	174.6	-155.7	173.5	7.9	113.3	Q542 I544	Q542-R546 WeakPolarHBondContact O-CB 3.44Å; Q542-R546 VanDerWaalsContact O-CG 3.24Å; Q542-R546 WeakPolarHBondContact O-CG 3.47Å; Q542-R546 PolarHBondContact O-N 3.08Å; I544-R546 PolarHBondContact O-N 3.43Å
547	L	39.9	Very low	39.4	Very low	149 Å²	149	110.1 Å²	110.1	78%	0.78	63%	0.63	S	S	*	*	H	α-helix	trans	-86.3	-16.5	173.7	-72.5	169.5	0	0	0	113.1	R543 I544 E545	R543-L547 WeakPolarHBondContact O-CD1 3.35Å; R543-L547 WeakPolarHBondContact O-CG 3.31Å; R543-L547 PolarHBondContact O-N 3.13Å; I544-L547 CarbonylContact O-C 3.38Å; I544-L547 PolarHBondContact O-N 3.04Å; I544-L547 VanDerWaalsContact O-N 3.13Å; E545-L547 PolarHBondContact O-N 3.2Å
548	A	37	Very low	38.4	Very low	79 Å²	79	110.7 Å²	110.7	65%	0.653	64%	0.643	S	S	*	*	H	α-helix	trans	-91.4	-25.5	-177.6	0	0	0	0	0	113.7	I544 E545	I544-A548 WeakPolarHBondContact O-CB 3.26Å; I544-A548 PolarHBondContact O-N 2.88Å; E545-A548 PolarHBondContact O-N 2.96Å; E545-A548 VanDerWaalsContact O-N 3.08Å
549	V	33.1	Very low	36.9	Very low	112 Å²	112	112.7 Å²	112.7	68%	0.679	66%	0.66	S	S	*	*			trans	-106.7	90.1	-176.3	-173.6	0	0	0	0	110.8	E545	E545-V549 PolarHBondContact O-N 3.36Å
550	G	30.7	Very low	35.5	Very low	79 Å²	79	115.1 Å²	115.1	81%	0.814	68%	0.682	S	S	*	*			trans	-74.2	133.6	169.3	0	0	0	0	0	111.9
551	C	25.1	Very low	34.1	Very low	120 Å²	120	115.3 Å²	115.3	81%	0.811	70%	0.698	S	S	*	*			trans	-94.1	160.6	-178.4	-83	0	0	0	0	114.7
552	S	26.5	Very low	32.8	Very low	114 Å²	114	117.2 Å²	117.2	80%	0.797	71%	0.713	S	S	*	*			trans	77	144.3	166.7	-147.5	0	0	0	0	114.4
553	V	28.5	Very low	31.8	Very low	94 Å²	94	118.5 Å²	118.5	57%	0.57	73%	0.728	S	S	*	*				-169.9	177.2	56.3	169.7	0	0	0	0	106.7
554	P	35.8	Very low	30.3	Very low	116 Å²	116	120.7 Å²	120.7	75%	0.753	74%	0.736	S	S	*	*			cis	-122.6	177.6	-27.3	30.6	-12.4	0	0	0	114.8
555	A	21.6	Very low	28.6	Very low	91 Å²	91	121.2 Å²	121.2	75%	0.752	74%	0.743	S	S	*	*			trans	-118	149.9	139.3	0	0	0	0	0	109.7
556	P	28.9	Very low	27.1	Very low	121 Å²	121	125 Å²	125	79%	0.786	76%	0.761	S	S	*	*			trans	-90.1	163.5	179.2	36.2	-34.7	0	0	0	113.3
557	P	23.5	Very low	26.2	Very low	122 Å²	122	123.6 Å²	123.6	79%	0.792	77%	0.766	S	S	*	*			trans	-98.8	151.6	-178.5	37.7	-33.1	0	0	0	113.4
558	C	20.5	Very low	25.4	Very low	136 Å²	136	122.3 Å²	122.3	92%	0.919	76%	0.756	S	S	*	*			trans	-168.5	170.3	134	-116.6	0	0	0	0	112.5
559	S	22.4	Very low	24.8	Very low	98 Å²	98	123.2 Å²	123.2	69%	0.685	75%	0.745	S	S	*	*			trans	-96.3	155.3	-161.3	56.4	0	0	0	0	116.3
560	S	22.3	Very low	24.4	Very low	115 Å²	115	119.6 Å²	119.6	80%	0.804	73%	0.73	S	S	*	*			trans	78.9	137.1	145	-61	0	0	0	0	121.3
561	A	22.5	Very low	24	Very low	105 Å²	105	117 Å²	117	87%	0.868	70%	0.703	S	S	*	*			trans	86.7	135	152.7	0	0	0	0	0	120.6
562	E	20	Very low	23.9	Very low	183 Å²	183	116.4 Å²	116.4	86%	0.855	70%	0.7	S	S	*	*			trans	-67.1	-179.9	170.8	-69.6	-174.2	156.8	0	0	114
563	P	30.2	Very low	23.8	Very low	103 Å²	103	118.6 Å²	118.6	67%	0.669	70%	0.698	S	S	*	*			cis	-140.2	-173.6	-38	37.5	-19.6	0	0	0	114.6
564	R	18.5	Very low	23.8	Very low	229 Å²	229	120.3 Å²	120.3	86%	0.864	71%	0.711	S	S	*	*			trans	80.1	120.5	147.1	-83.6	-174.7	165.6	164.5	-4	123
565	V	21.6	Very low	23.3	Very low	111 Å²	111	118.9 Å²	118.9	67%	0.673	71%	0.709	S	S	*	*				84.9	111	128.7	178.4	0	0	0	0	120.8
566	E	19.2	Very low	23.7	Very low	162 Å²	162	123 Å²	123	76%	0.757	72%	0.717	S	S	*	*			trans	40.5	117.4	132.1	-56.8	175	162.1	0	0	119.4
567	I	22.4	Very low	23.8	Very low	156 Å²	156	122.1 Å²	122.1	80%	0.8	71%	0.713	S	S	*	*				63.1	111.6	75.6	-59.4	165.2	0	0	0	112.9
568	E	23.7	Very low	24.2	Very low	123 Å²	123	120.6 Å²	120.6	58%	0.575	71%	0.711	S	S	*	*				-175.5	160	126.7	-104.3	-154.5	160.9	0	0	107.7
569	K	24.3	Very low	24.7	Very low	98 Å²	98	118 Å²	118	43%	0.426	70%	0.699	S	S	.	*			cis	-163.8	165.1	1.9	-142.1	-178.1	-167.7	108.4	0	107.1	D807 G808 E809	K569-D807 CarbonylContact O-C 3.49Å; K569-D807 VanDerWaalsContact O-C 3.23Å; K569-D807 VanDerWaalsContact O-CA 3.24Å; K569-D807 WeakPolarHBondContact O-CA 3.43Å; K569-G808 VanDerWaalsContact C-C 3.46Å; K569-G808 CarbonylContact C-O 3.57Å; K569-G808 VanDerWaalsContact C-O 3.28Å; K569-G808 CarbonylContact O-C 3.52Å; K569-G808 WeakPolarHBondContact O-CA 3.17Å; K569-G808 PolarHBondContact O-N 2.91Å; K569-G808 VanDerWaalsContact O-O 3.11Å; K569-E809 PolarHBondContact O-N 3.4Å
570	G	23.7	Very low	25.4	Very low	35 Å²	35	120.5 Å²	120.5	36%	0.361	70%	0.7	S	S	.	*	B	Isolated β-bridge		94.8	91.4	105.5	0	0	0	0	0	128.7	H806 D807 G808	G570-H806 CarbonylContact C-O 3.59Å; G570-H806 VanDerWaalsContact C-O 3.23Å; G570-H806 WeakPolarHBondContact CA-O 3.48Å; G570-H806 PolarHBondContact N-O 2.97Å; G570-D807 CarbonylContact C-O 3.5Å; G570-D807 VanDerWaalsContact N-CA 3.32Å; G570-D807 CarbonylContact O-C 3.54Å; G570-G808 CarbonylContact C-O 3.43Å; G570-G808 WeakPolarHBondContact CA-O 3.49Å; G570-G808 PolarHBondContact N-O 2.77Å; G570-G808 CarbonylContact O-C 3.59Å; G570-G808 VanDerWaalsContact O-C 3.23Å; G570-G808 WeakPolarHBondContact O-CA 3.47Å; G570-G808 PolarHBondContact O-N 3.22Å
571	G	22.6	Very low	25.8	Very low	24 Å²	24	121.3 Å²	121.3	25%	0.247	70%	0.695	C	S	.	*			trans	94.6	175.2	137	0	0	0	0	0	121.3	H806 D807	G571-H806 VanDerWaalsContact N-C 3.32Å; G571-H806 PolarHBondContact N-O 3.48Å; G571-H806 PolarHBondContact O-ND1 3.37Å; G571-D807 PolarHBondContact N-O 3.04Å; G571-D807 VanDerWaalsContact O-O 3.06Å
572	S	23.5	Very low	26.2	Very low	108 Å²	108	120 Å²	120	76%	0.755	68%	0.684	S	S	*	*			cis	-168.6	141.2	-5.1	-92.7	0	0	0	0	113.4
573	Q	25.3	Very low	26.6	Very low	161 Å²	161	119.9 Å²	119.9	75%	0.752	68%	0.683	S	S	*	*			trans	46.7	150.4	135.6	-72.5	-62.7	-44.8	0	0	122.2
574	P	28.2	Very low	26.6	Very low	129 Å²	129	125.2 Å²	125.2	84%	0.838	69%	0.69	S	S	*	*				-149.5	-171.6	58.3	40.9	-18	0	0	0	118.3
575	A	23.7	Very low	27	Very low	87 Å²	87	121.6 Å²	121.6	72%	0.719	69%	0.687	S	S	*	*			trans	-115.9	168.9	-164.9	0	0	0	0	0	116.1
576	I	31.3	Very low	27.3	Very low	178 Å²	178	121 Å²	121	91%	0.913	69%	0.688	S	S	*	*			trans	-135.4	154.7	166.7	-62.7	-176.9	0	0	0	110
577	S	29.5	Very low	27.5	Very low	101 Å²	101	119.4 Å²	119.4	71%	0.706	69%	0.694	S	S	*	*			trans	-103.7	167.8	-155.1	57.6	0	0	0	0	117.3	A579	S577-A579 PolarHBondContact O-N 2.97Å; S577-A579 VanDerWaalsContact O-N 3.16Å
578	A	33.8	Very low	27.5	Very low	90 Å²	90	122.1 Å²	122.1	74%	0.744	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	28.2	-164.5	0	0	0	0	0	117.1
579	A	30.8	Very low	27.4	Very low	81 Å²	81	121 Å²	121	67%	0.669	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-33.7	177.6	0	0	0	0	0	113.3	S577 L581	S577-A579 PolarHBondContact O-N 2.97Å; S577-A579 VanDerWaalsContact O-N 3.16Å; A579-L581 VanDerWaalsContact C-N 3.35Å; A579-L581 PolarHBondContact O-N 3.49Å
580	E	35.9	Very low	27.3	Very low	151 Å²	151	122.4 Å²	122.4	71%	0.706	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-75.3	-20.5	-171.5	-166.2	59.2	-155.6	0	0	113.7	A582	E580-A582 VanDerWaalsContact C-N 3.34Å; E580-A582 PolarHBondContact O-N 3.24Å
581	L	30.8	Very low	27.2	Very low	132 Å²	132	127.1 Å²	127.1	69%	0.691	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-78.1	-13.4	-176.6	-83.7	167.5	0	0	0	114.5	A579	A579-L581 VanDerWaalsContact C-N 3.35Å; A579-L581 PolarHBondContact O-N 3.49Å
582	A	32.1	Very low	27.2	Very low	78 Å²	78	130.5 Å²	130.5	65%	0.645	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-74.2	-26.1	-177.6	0	0	0	0	0	113.7	E580	E580-A582 VanDerWaalsContact C-N 3.34Å; E580-A582 PolarHBondContact O-N 3.24Å
583	H	28.5	Very low	27.4	Very low	180 Å²	180	133 Å²	133	83%	0.833	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-91.8	0.7	-169.1	-107.4	-66.4	0	0	0	115.8
584	R	29.4	Very low	27.3	Very low	216 Å²	216	131 Å²	131	82%	0.815	78%	0.775	S	S	*	*	S	Bend	trans	-114.3	-3.3	-170.6	-74.5	-80.3	176.3	163.8	-4.6	115.6
585	L	27.6	Very low	27	Very low	153 Å²	153	131 Å²	131	80%	0.801	77%	0.772	S	S	*	*	S	Bend	trans	-125.6	15.4	-167.7	-77.3	174	0	0	0	116.9
586	S	26.9	Very low	27.1	Very low	99 Å²	99	133.3 Å²	133.3	69%	0.692	78%	0.781	S	S	*	*			trans	-146.6	90.4	172.2	63.6	0	0	0	0	114.3
587	S	23.5	Very low	26.7	Very low	127 Å²	127	135.6 Å²	135.6	89%	0.888	78%	0.778	S	S	*	*			trans	-171.8	73.7	144	-81.1	0	0	0	0	111
588	F	22.9	Very low	26.5	Very low	213 Å²	213	136.3 Å²	136.3	93%	0.934	78%	0.781	S	S	*	*			trans	-88.9	129.7	153.8	-80.6	-94.8	0	0	0	108
589	S	21.9	Very low	26.2	Very low	99 Å²	99	140.2 Å²	140.2	69%	0.692	79%	0.788	S	S	*	*			trans	159.3	137.3	143.9	-179.1	0	0	0	0	112.8
590	T	21.3	Very low	25.9	Very low	129 Å²	129	141.5 Å²	141.5	79%	0.791	79%	0.792	S	S	*	*			trans	62.3	144	157.5	39.1	0	0	0	0	117.5
591	T	22.2	Very low	25.3	Very low	134 Å²	134	139.9 Å²	139.9	82%	0.822	80%	0.798	S	S	*	*			cis	-138.9	177.8	22.4	46.6	0	0	0	0	113.5
592	A	21.6	Very low	25.2	Very low	95 Å²	95	138.1 Å²	138.1	79%	0.785	80%	0.802	S	S	*	*			trans	-62.3	154.7	173.2	0	0	0	0	0	114.2
593	D	28.3	Very low	25	Very low	160 Å²	160	143 Å²	143	86%	0.856	81%	0.812	S	S	*	*			trans	-144.4	165.1	157.1	-141	-22.5	0	0	0	111.8
594	T	22.1	Very low	25	Very low	118 Å²	118	141.7 Å²	141.7	72%	0.724	81%	0.811	S	S	*	*			trans	-118.2	145.4	-152.6	-29.7	0	0	0	0	113.4
595	V	22.2	Very low	25	Very low	130 Å²	130	139.5 Å²	139.5	79%	0.788	82%	0.816	S	S	*	*			trans	67.4	103.2	166.1	-165.3	0	0	0	0	117.5
596	C	25.5	Very low	24.8	Very low	135 Å²	135	137.2 Å²	137.2	91%	0.912	81%	0.812	S	S	*	*				-152.6	152.4	126.7	-114.4	0	0	0	0	110.8
597	R	23.6	Very low	24.7	Very low	226 Å²	226	136 Å²	136	85%	0.853	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-96.4	149.1	-158.3	175	-179.3	143.1	117	-1.5	112.6
598	P	25.4	Very low	25	Very low	117 Å²	117	136.4 Å²	136.4	76%	0.76	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-74.6	138.8	-174	-11.3	27.5	0	0	0	112.9
599	L	27.5	Very low	25.1	Very low	172 Å²	172	134.1 Å²	134.1	90%	0.901	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-91.2	135.5	150.4	-89.6	85.4	0	0	0	108.7
600	S	24.8	Very low	25.4	Very low	107 Å²	107	135.1 Å²	135.1	75%	0.748	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-75.1	159	-179.1	48.1	0	0	0	0	113.4
601	S	24.1	Very low	25.7	Very low	117 Å²	117	139 Å²	139	82%	0.818	81%	0.813	S	S	*	*			trans	60.9	73.2	163.1	64.6	0	0	0	0	117.5
602	A	28.7	Very low	25.9	Very low	96 Å²	96	137.1 Å²	137.1	79%	0.793	81%	0.805	S	S	*	*			trans	-126.6	129.2	132	0	0	0	0	0	106.7	D604	A602-D604 PolarHBondContact O-N 3.42Å
603	E	27.6	Very low	26.1	Very low	180 Å²	180	138 Å²	138	84%	0.841	80%	0.8	S	S	*	*			trans	-79.2	117.8	-166	-63.7	173.4	129.6	0	0	111.8	N605	E603-N605 PolarHBondContact O-N 2.96Å
604	D	27.6	Very low	26.2	Very low	153 Å²	153	134.6 Å²	134.6	82%	0.818	79%	0.789	S	S	*	*			trans	-67.5	98.6	167.2	-83.8	-45.4	0	0	0	109.7	A602 S606	A602-D604 PolarHBondContact O-N 3.42Å; D604-S606 PolarHBondContact O-N 3.33Å
605	N	29.9	Very low	26.7	Very low	170 Å²	170	132.9 Å²	132.9	91%	0.909	79%	0.786	S	S	*	*			trans	-60.8	84.8	168.6	-85	-61.7	0	0	0	110.5	E603	E603-N605 PolarHBondContact O-N 2.96Å
606	S	24.3	Very low	27.3	Very low	105 Å²	105	128.4 Å²	128.4	73%	0.734	76%	0.764	S	S	*	*			trans	-128.1	124.1	174.2	61.4	0	0	0	0	110.2	D604	D604-S606 PolarHBondContact O-N 3.33Å
607	G	24.5	Very low	27.6	Very low	74 Å²	74	127.1 Å²	127.1	76%	0.763	75%	0.751	S	S	*	*			trans	97.4	86.2	173.6	0	0	0	0	0	116.2
608	T	28.7	Very low	27.9	Very low	134 Å²	134	119.6 Å²	119.6	82%	0.822	73%	0.733	S	S	*	*				-160.4	109.3	129	8.5	0	0	0	0	110	T610	T608-T610 PolarHBondContact O-N 3.45Å
609	N	26	Very low	28.7	Very low	166 Å²	166	122.7 Å²	122.7	89%	0.888	74%	0.743	S	S	*	*			trans	-76.4	80.6	-177.3	-175	10.8	0	0	0	110.7	R611	N609-R611 PolarHBondContact O-N 2.72Å
610	T	27.3	Very low	29.4	Very low	120 Å²	120	121.5 Å²	121.5	74%	0.736	73%	0.733	S	S	*	*			trans	-84.8	98.6	174.2	46.8	0	0	0	0	110.5	T608 S612	T608-T610 PolarHBondContact O-N 3.45Å; T610-S612 PolarHBondContact O-N 2.83Å
611	R	27.8	Very low	29.6	Very low	211 Å²	211	120.7 Å²	120.7	80%	0.796	73%	0.727	S	S	*	*			trans	-46.9	109.9	174.4	174.3	179.2	173.5	-93	4.9	111.3	N609 V613	N609-R611 PolarHBondContact O-N 2.72Å; R611-V613 PolarHBondContact O-N 3.01Å
612	S	26.9	Very low	30.4	Very low	94 Å²	94	121.4 Å²	121.4	66%	0.657	73%	0.727	S	S	*	*			trans	-63.6	121	176	-44.4	0	0	0	0	110.4	T610	T610-S612 PolarHBondContact O-N 2.83Å
613	V	25.8	Very low	30.7	Very low	112 Å²	112	121.5 Å²	121.5	68%	0.679	73%	0.727	S	S	*	*			trans	-95.7	119.6	169.9	-180	0	0	0	0	107.7	R611 A615	R611-V613 PolarHBondContact O-N 3.01Å; V613-A615 PolarHBondContact O-N 2.85Å
614	S	29.1	Very low	31	Very low	90 Å²	90	116.6 Å²	116.6	63%	0.629	73%	0.725	S	S	*	*			trans	-68.8	88.8	-174.8	-55.2	0	0	0	0	112.4	A616	S614-A616 PolarHBondContact O-N 2.97Å; S614-A616 VanDerWaalsContact O-N 3.09Å
615	A	33.5	Very low	31.4	Very low	81 Å²	81	116.1 Å²	116.1	67%	0.669	72%	0.722	S	S	*	*			trans	-81.3	76.9	175	0	0	0	0	0	111.7	V613 V617	V613-A615 PolarHBondContact O-N 2.85Å; A615-V617 PolarHBondContact O-N 2.97Å
616	A	34.6	Very low	31.5	Very low	37 Å²	37	113.3 Å²	113.3	31%	0.306	72%	0.716	S	S	.	*			trans	-81.7	97.3	166.7	0	0	0	0	0	109.6	S614 S618 Q765	S614-A616 PolarHBondContact O-N 2.97Å; S614-A616 VanDerWaalsContact O-N 3.09Å; A616-S618 PolarHBondContact O-N 3.43Å; A616-S618 VanDerWaalsContact O-N 3.08Å; A616-Q765 HydrophobicContact CB-CB 4.36Å
617	V	32.4	Very low	32	Very low	107 Å²	107	111.3 Å²	111.3	65%	0.648	71%	0.712	S	S	*	*			trans	-65.3	105.8	179.7	-74.8	0	0	0	0	111.9	A615	A615-V617 PolarHBondContact O-N 2.97Å
618	S	29.7	Very low	32.4	Very low	68 Å²	68	114.7 Å²	114.7	48%	0.476	72%	0.718	S	S	.	*			trans	-92.6	148.5	161.5	-62	0	0	0	0	109.1	A616 E620 S621	A616-S618 PolarHBondContact O-N 3.43Å; A616-S618 VanDerWaalsContact O-N 3.08Å; S618-E620 PolarHBondContact O-N 2.84Å; S618-S621 WeakPolarHBondContact O-CB 3.46Å; S618-S621 PolarHBondContact O-N 3.5Å
619	D	41.4	Very low	32.3	Very low	183 Å²	183	118.8 Å²	118.8	98%	0.979	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-3.9	-171.9	-145.5	28.5	0	0	0	114.1
620	E	42.2	Very low	32.7	Very low	147 Å²	147	118.4 Å²	118.4	69%	0.687	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	-4.1	174.4	-168.1	142.6	135.3	0	0	113.4	S618 V622	S618-E620 PolarHBondContact O-N 2.84Å; E620-V622 PolarHBondContact O-N 3.12Å
621	S	30.1	Very low	32.7	Very low	89 Å²	89	115.7 Å²	115.7	62%	0.622	71%	0.714	S	S	*	*			trans	-73.4	75.2	171.3	-66.7	0	0	0	0	111	S618 A623	S618-S621 WeakPolarHBondContact O-CB 3.46Å; S618-S621 PolarHBondContact O-N 3.5Å; S621-A623 PolarHBondContact O-N 2.96Å
622	V	40.8	Very low	32.6	Very low	133 Å²	133	117.3 Å²	117.3	81%	0.806	72%	0.72	S	S	*	*			trans	-53.8	131.6	173.2	174.5	0	0	0	0	109.6	E620 G624	E620-V622 PolarHBondContact O-N 3.12Å; V622-G624 PolarHBondContact O-N 3.37Å
623	A	34.7	Very low	32.5	Very low	98 Å²	98	122.1 Å²	122.1	81%	0.81	73%	0.729	S	S	*	*			trans	-60.7	109.3	-168.9	0	0	0	0	0	113.1	S621 D625	S621-A623 PolarHBondContact O-N 2.96Å; A623-D625 PolarHBondContact O-N 3.36Å
624	G	33.3	Very low	32.5	Very low	76 Å²	76	122.8 Å²	122.8	78%	0.784	74%	0.736	S	S	*	*			trans	-70.4	116.5	156.8	0	0	0	0	0	109.5	V622 S626	V622-G624 PolarHBondContact O-N 3.37Å; G624-S626 PolarHBondContact O-N 3.21Å
625	D	35.8	Very low	32.2	Very low	143 Å²	143	123 Å²	123	77%	0.765	74%	0.743	S	S	*	*			trans	-61.8	110.4	178.6	178.9	10.7	0	0	0	111.8	A623	A623-D625 PolarHBondContact O-N 3.36Å
626	S	33.1	Very low	31.9	Very low	112 Å²	112	124.1 Å²	124.1	78%	0.783	75%	0.745	S	S	*	*			trans	171.7	118.6	134.7	41.1	0	0	0	0	113.1	G624	G624-S626 PolarHBondContact O-N 3.21Å
627	G	34.1	Very low	31.5	Very low	63 Å²	63	128.3 Å²	128.3	65%	0.649	77%	0.767	S	S	*	*			trans	115.1	98.2	164.3	0	0	0	0	0	115.5	Y629	G627-Y629 PolarHBondContact O-N 3.3Å
628	V	34	Very low	31.1	Very low	145 Å²	145	130.8 Å²	130.8	88%	0.879	78%	0.777	S	S	*	*			trans	-71.5	106.8	166.3	179.5	0	0	0	0	108.4
629	Y	25.8	Very low	31.2	Very low	219 Å²	219	135.3 Å²	135.3	86%	0.859	80%	0.795	S	S	*	*			trans	-82.3	113.3	165.1	-79.3	-86.2	0	0	0	109.2	G627 G631	G627-Y629 PolarHBondContact O-N 3.3Å; Y629-G631 PolarHBondContact O-N 2.93Å; Y629-G631 VanDerWaalsContact O-N 3.14Å
630	D	33.7	Very low	30.3	Very low	158 Å²	158	130 Å²	130	85%	0.845	78%	0.784	S	S	*	*			trans	-57.2	117.6	168.6	-116.5	-33.2	0	0	0	109.3	R632	D630-R632 PolarHBondContact O-N 3.46Å; D630-R632 VanDerWaalsContact O-N 3.08Å
631	G	28.2	Very low	29.6	Very low	64 Å²	64	131.2 Å²	131.2	66%	0.66	80%	0.795	S	S	*	*			trans	-61.6	115.2	-179.8	0	0	0	0	0	109.6	Y629 K633	Y629-G631 PolarHBondContact O-N 2.93Å; Y629-G631 VanDerWaalsContact O-N 3.14Å; G631-K633 PolarHBondContact O-N 2.89Å
632	R	24.8	Very low	29.4	Very low	244 Å²	244	130.7 Å²	130.7	92%	0.921	80%	0.804	S	S	*	*			trans	-49.2	113.9	179.2	-77.8	-174.8	174.2	-172.4	-1.9	109.7	D630	D630-R632 PolarHBondContact O-N 3.46Å; D630-R632 VanDerWaalsContact O-N 3.08Å
633	K	26.2	Very low	28.9	Very low	196 Å²	196	132.8 Å²	132.8	85%	0.852	81%	0.809	S	S	*	*			trans	-52.2	126.3	168.7	-70.1	174.6	-179.3	169.8	0	107.4	G631 A635	G631-K633 PolarHBondContact O-N 2.89Å; K633-A635 PolarHBondContact O-N 3.13Å; K633-A635 VanDerWaalsContact O-N 3.13Å
634	P	25	Very low	28.5	Very low	126 Å²	126	134.2 Å²	134.2	82%	0.818	81%	0.808	S	S	*	*			trans	-60.6	122.6	-177.3	23.6	-32.7	0	0	0	108.7	S636	P634-S636 PolarHBondContact O-N 3.43Å; P634-S636 VanDerWaalsContact O-N 3.11Å
635	A	23.9	Very low	28.3	Very low	94 Å²	94	135.7 Å²	135.7	78%	0.777	81%	0.807	S	S	*	*			trans	-62.3	115.3	175.9	0	0	0	0	0	108.3	K633 T637	K633-A635 PolarHBondContact O-N 3.13Å; K633-A635 VanDerWaalsContact O-N 3.13Å; A635-T637 PolarHBondContact O-N 2.92Å
636	S	26.6	Very low	28	Very low	104 Å²	104	133.1 Å²	133.1	73%	0.727	81%	0.805	S	S	*	*			trans	-69.9	96.6	173.9	56.2	0	0	0	0	108.9	P634 N638	P634-S636 PolarHBondContact O-N 3.43Å; P634-S636 VanDerWaalsContact O-N 3.11Å; S636-N638 PolarHBondContact O-N 2.86Å
637	T	25.9	Very low	27.7	Very low	125 Å²	125	139.1 Å²	139.1	77%	0.767	81%	0.811	S	S	*	*			trans	-56.4	124.8	158.1	39.9	0	0	0	0	108.3	A635 L639	A635-T637 PolarHBondContact O-N 2.92Å; T637-L639 PolarHBondContact O-N 3.46Å
638	N	24.2	Very low	27.5	Very low	159 Å²	159	141.3 Å²	141.3	85%	0.85	81%	0.814	S	S	*	*			trans	-57.7	104.6	-175.5	-60	-62.2	0	0	0	111.8	S636	S636-N638 PolarHBondContact O-N 2.86Å
639	L	31.2	Very low	27.2	Very low	163 Å²	163	141.4 Å²	141.4	85%	0.853	81%	0.814	S	S	*	*			trans	-118.7	136.7	146.1	-91.5	92.2	0	0	0	107.4	T637	T637-L639 PolarHBondContact O-N 3.46Å
640	G	23.8	Very low	27.3	Very low	73 Å²	73	135.2 Å²	135.2	75%	0.753	80%	0.804	S	S	*	*			trans	-78.6	-167.1	-170.6	0	0	0	0	0	114.8
641	D	27.5	Very low	27	Very low	171 Å²	171	133.7 Å²	133.7	91%	0.914	80%	0.802	S	S	*	*			trans	73.4	111.3	-179.7	-60	-21.3	0	0	0	116.2
642	G	24.7	Very low	27.1	Very low	78 Å²	78	137.4 Å²	137.4	80%	0.804	81%	0.805	S	S	*	*			trans	-83.3	122.4	-172.9	0	0	0	0	0	113.2
643	L	31.1	Very low	27.6	Very low	177 Å²	177	131.4 Å²	131.4	93%	0.927	80%	0.796	S	S	*	*			trans	-127.3	102.9	148.2	-89.8	169.1	0	0	0	108.3
644	T	26.3	Very low	28.5	Very low	128 Å²	128	125.8 Å²	125.8	79%	0.785	79%	0.786	S	S	*	*			trans	-68.8	132.6	179.5	40.6	0	0	0	0	111.5
645	S	29.1	Very low	30.2	Very low	108 Å²	108	123 Å²	123	76%	0.755	77%	0.766	S	S	*	*			trans	46.7	76.8	151.8	61.5	0	0	0	0	117.9
646	A	28.8	Very low	32.8	Very low	88 Å²	88	121.3 Å²	121.3	73%	0.727	75%	0.746	S	S	*	*			trans	-134.9	58.9	156	0	0	0	0	0	111.2	P648	A646-P648 VanDerWaalsContact O-CD 3.25Å; A646-P648 WeakPolarHBondContact O-CD 3.42Å
647	W	27.1	Very low	35.6	Very low	239 Å²	239	116.4 Å²	116.4	91%	0.905	71%	0.712	S	S	*	*			trans	-61.9	117.8	173.6	-74.9	22	0	0	0	109.6	T649	W647-T649 PolarHBondContact O-N 2.86Å
648	P	29.4	Very low	38.6	Very low	109 Å²	109	112 Å²	112	71%	0.708	68%	0.683	S	S	*	*			trans	-66.7	119.9	-177.6	-20.3	33.4	0	0	0	110.7	A646 S650	A646-P648 VanDerWaalsContact O-CD 3.25Å; A646-P648 WeakPolarHBondContact O-CD 3.42Å; P648-S650 VanDerWaalsContact C-N 3.32Å; P648-S650 PolarHBondContact O-N 3.13Å
649	T	28.2	Very low	41.8	Very low	146 Å²	146	104.5 Å²	104.5	90%	0.896	64%	0.643	S	S	*	*	S	Bend	trans	-68.6	84.9	-179	-42.2	0	0	0	0	111.7	W647	W647-T649 PolarHBondContact O-N 2.86Å
650	S	27.4	Very low	44.7	Very low	90 Å²	90	97.5 Å²	97.5	63%	0.629	61%	0.606	S	S	*	*	S	Bend	trans	-155.8	141	162.5	-74.7	0	0	0	0	107.4	P648 I652	P648-S650 VanDerWaalsContact C-N 3.32Å; P648-S650 PolarHBondContact O-N 3.13Å; S650-I652 PolarHBondContact O-N 3.3Å
651	P	27.4	Very low	48	Very low	125 Å²	125	94 Å²	94	81%	0.812	57%	0.57	S	S	*	*			trans	-64.6	107.4	177	27.5	-32.6	0	0	0	107.6	V653	P651-V653 PolarHBondContact O-N 2.96Å
652	I	30.5	Very low	51	Low	143 Å²	143	86 Å²	86	73%	0.733	53%	0.528	S	S	*	.			trans	-68.4	95.1	166.6	-59.6	175.9	0	0	0	104.7	S650 A654	S650-I652 PolarHBondContact O-N 3.3Å; I652-A654 VanDerWaalsContact C-N 3.3Å; I652-A654 PolarHBondContact O-N 3.46Å
653	V	36.4	Very low	54.2	Low	118 Å²	118	82.7 Å²	82.7	72%	0.715	49%	0.491	S	S	*	.			trans	-51.5	107.5	154.2	175.5	0	0	0	0	104.2	P651 V655	P651-V653 PolarHBondContact O-N 2.96Å; V653-V655 WeakPolarHBondContact O-CG2 3.39Å; V653-V655 PolarHBondContact O-N 2.83Å
654	A	44.6	Very low	57	Low	78 Å²	78	76.9 Å²	76.9	65%	0.645	46%	0.461	S	S	*	.			trans	-57.9	108.4	-176.3	0	0	0	0	0	107.4	I652 T656	I652-A654 VanDerWaalsContact C-N 3.3Å; I652-A654 PolarHBondContact O-N 3.46Å; A654-T656 VanDerWaalsContact C-N 3.32Å; A654-T656 PolarHBondContact O-N 3.22Å
655	V	61	Low	60	Low	67 Å²	67	71.2 Å²	71.2	41%	0.406	43%	0.425	S	S	.	.			trans	-79.2	87.7	-169	-172.1	0	0	0	0	107.5	V653 N681 S684	V653-V655 WeakPolarHBondContact O-CG2 3.39Å; V653-V655 PolarHBondContact O-N 2.83Å; V655-N681 HydrophobicContact CG1-CB 3.74Å; V655-N681 WeakPolarHBondContact CG1-ND2 3.44Å; V655-S684 WeakPolarHBondContact O-CB 3.3Å; V655-S684 PolarHBondContact O-OG 2.99Å
656	T	77.9	Confident	62.8	Low	59 Å²	59	69.3 Å²	69.3	36%	0.362	41%	0.406	S	S	.	.			trans	-64.8	144.7	179.7	50	0	0	0	0	111.4	A654 N681 N782	A654-T656 VanDerWaalsContact C-N 3.32Å; A654-T656 PolarHBondContact O-N 3.22Å; T656-N681 VanDerWaalsContact O-CB 3.26Å; T656-N681 WeakPolarHBondContact O-CB 3.5Å; T656-N681 PolarHBondContact O-ND2 3.42Å; T656-N681 VanDerWaalsContact O-ND2 3.17Å; T656-N782 PolarHBondContact OG1-OD1 3Å
657	A	85	Confident	65.4	Low	1 Å²	1	69.7 Å²	69.7	1%	0.008	40%	0.395	C	S	.	.			trans	-60.4	136.4	167.3	0	0	0	0	0	109.4	L682 S684 L685 V783	A657-L682 HydrophobicContact CB-CD2 3.97Å; A657-S684 WeakPolarHBondContact CB-OG 3.39Å; A657-S684 PolarHBondContact N-OG 3.2Å; A657-L685 HydrophobicContact CB-CD1 3.79Å; A657-L685 HydrophobicContact CB-CD2 4.04Å; A657-L685 HydrophobicContact CB-CG 3.61Å; A657-V783 HydrophobicContact CB-CB 4.14Å; A657-V783 PolarHBondContact O-N 2.93Å
658	Q	89.7	Confident	68	Low	32 Å²	32	66.1 Å²	66.1	15%	0.15	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	137.3	-174	-75	176.6	-13.8	0	0	111.9	A679 R680 W780 L781 N782	Q658-A679 CarbonylContact O-C 3.47Å; Q658-A679 WeakPolarHBondContact O-CA 3.33Å; Q658-A679 WeakPolarHBondContact O-CB 3.44Å; Q658-R680 HydrophobicContact CB-CG 3.97Å; Q658-R680 PolarHBondContact N-O 2.92Å; Q658-R680 PolarHBondContact O-N 3.19Å; Q658-W780 HydrophobicContact CB-CE3 3.82Å; Q658-W780 HydrophobicContact CB-CZ3 4.41Å; Q658-L781 CarbonylContact C-O 3.55Å; Q658-L781 WeakPolarHBondContact CA-O 3.47Å; Q658-N782 VanDerWaalsContact CG-OD1 3.32Å; Q658-N782 WeakPolarHBondContact CG-OD1 3.5Å; Q658-N782 PolarHBondContact NE2-OD1 2.8Å
659	L	91.6	Very high	70.7	Confident	2 Å²	2	66 Å²	66	1%	0.01	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.6	178.1	-175.5	69.2	0	0	0	109.5	V661 I676 A679 V696 F724 L744 L781 V783	L659-V661 HydrophobicContact CD2-CG2 3.8Å; L659-V661 HydrophobicContact CG-CG2 3.85Å; L659-I676 HydrophobicContact CD1-CG2 4.1Å; L659-A679 HydrophobicContact CD1-CB 3.85Å; L659-V696 HydrophobicContact CD1-CG2 4.12Å; L659-V696 HydrophobicContact CD2-CG1 3.96Å; L659-F724 HydrophobicContact CD1-CD2 4.47Å; L659-F724 HydrophobicContact CD1-CE2 4.08Å; L659-L744 HydrophobicContact CD2-CB 4.49Å; L659-L744 HydrophobicContact CD2-CD1 3.84Å; L659-L781 PolarHBondContact N-O 3.23Å; L659-L781 PolarHBondContact O-N 3.35Å; L659-V783 HydrophobicContact CB-CG2 3.85Å
660	M	92.1	Very high	73.5	Confident	15 Å²	15	63 Å²	63	7%	0.074	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	116.2	176.9	-154.6	173.3	83.2	0	0	109.7	E677 R678 Q779 W780	M660-E677 HydrophobicContact CB-CB 4.49Å; M660-E677 HydrophobicContact CE-CB 3.6Å; M660-E677 HydrophobicContact CE-CG 3.98Å; M660-E677 WeakPolarHBondContact CE-OE2 3.47Å; M660-E677 PolarHBondContact O-N 3.21Å; M660-E677 VanDerWaalsContact O-N 3.07Å; M660-R678 HydrophobicContact CB-CG 3.9Å; M660-R678 WeakPolarHBondContact CB-O 3.44Å; M660-R678 HydrophobicContact CE-CG 4.14Å; M660-R678 PolarHBondContact N-O 2.69Å; M660-R678 HydrophobicContact SD-CG 4.34Å; M660-R678 PolarHBondContact SD-NE 3.21Å; M660-R678 PolarHBondContact SD-NH2 3.47Å; M660-Q779 WeakPolarHBondContact CA-O 3.41Å; M660-W780 HydrophobicContact CB-CD2 3.92Å; M660-W780 HydrophobicContact CB-CE3 3.73Å; M660-W780 HydrophobicContact CB-CH2 3.99Å; M660-W780 HydrophobicContact CB-CZ2 4.14Å; M660-W780 HydrophobicContact CB-CZ3 3.76Å; M660-W780 HydrophobicContact CG-CD2 3.96Å; M660-W780 HydrophobicContact CG-CE3 4.3Å; M660-W780 HydrophobicContact CG-CG 4.36Å; M660-W780 HydrophobicContact CG-CZ2 4.23Å; M660-W780 HydrophobicContact SD-CD2 4.31Å; M660-W780 HydrophobicContact SD-CH2 4.35Å; M660-W780 HydrophobicContact SD-CZ2 3.65Å
661	V	92.7	Very high	76.4	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.006	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.7	-176.2	-175.1	0	0	0	0	109.2	L659 F663 V674 S675 L744 C778 Q779 L781	L659-V661 HydrophobicContact CD2-CG2 3.8Å; L659-V661 HydrophobicContact CG-CG2 3.85Å; V661-F663 HydrophobicContact CB-CZ 4.37Å; V661-F663 HydrophobicContact CG1-CE1 3.83Å; V661-F663 HydrophobicContact CG1-CE2 4.04Å; V661-F663 HydrophobicContact CG1-CZ 3.54Å; V661-V674 HydrophobicContact CG1-CG1 4.06Å; V661-S675 CarbonylContact C-O 3.51Å; V661-S675 VanDerWaalsContact CA-O 3.28Å; V661-S675 WeakPolarHBondContact CA-O 3.24Å; V661-S675 WeakPolarHBondContact CG1-O 3.47Å; V661-L744 HydrophobicContact CG1-CD1 4.37Å; V661-L744 HydrophobicContact CG2-CD1 3.67Å; V661-C778 WeakPolarHBondContact O-CA 3.42Å; V661-Q779 PolarHBondContact N-O 2.94Å; V661-Q779 PolarHBondContact O-N 3.37Å; V661-L781 HydrophobicContact CB-CD1 3.98Å; V661-L781 HydrophobicContact CG2-CD1 3.77Å
662	G	90.8	Very high	79.4	Confident	2 Å²	2	55.7 Å²	55.7	2%	0.021	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	148.2	173.6	0	0	0	0	0	112.2	S675 R777	G662-S675 VanDerWaalsContact CA-OG 3.23Å; G662-S675 WeakPolarHBondContact CA-OG 3.31Å; G662-S675 PolarHBondContact N-O 2.95Å; G662-S675 PolarHBondContact N-OG 3.44Å; G662-S675 PolarHBondContact O-N 3.4Å; G662-S675 PolarHBondContact O-OG 3.2Å; G662-R777 CarbonylContact C-O 3.59Å; G662-R777 VanDerWaalsContact CA-O 3.27Å; G662-R777 WeakPolarHBondContact CA-O 3.2Å
663	F	91.9	Very high	82.2	Confident	8 Å²	8	50.7 Å²	50.7	4%	0.035	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	130.6	175.6	-54.5	-73.8	0	0	0	109.7	V661 I673 V674 L742 V766 F768 F771 R777	V661-F663 HydrophobicContact CB-CZ 4.37Å; V661-F663 HydrophobicContact CG1-CE1 3.83Å; V661-F663 HydrophobicContact CG1-CE2 4.04Å; V661-F663 HydrophobicContact CG1-CZ 3.54Å; F663-I673 WeakPolarHBondContact CA-O 3.48Å; F663-V674 HydrophobicContact CD1-CG1 4.39Å; F663-V674 HydrophobicContact CD1-CG2 4.23Å; F663-V674 HydrophobicContact CE1-CG1 4.04Å; F663-V674 HydrophobicContact CE1-CG2 4.32Å; F663-L742 HydrophobicContact CE1-CD2 3.67Å; F663-L742 HydrophobicContact CZ-CD2 4.1Å; F663-V766 HydrophobicContact CE2-CG1 4.27Å; F663-V766 HydrophobicContact CZ-CB 4.47Å; F663-V766 HydrophobicContact CZ-CG1 3.97Å; F663-V766 HydrophobicContact CZ-CG2 4.36Å; F663-F768 AromaticContact CD1-CE1 3.63Å; F663-F768 HydrophobicContact CD1-CE1 3.63Å; F663-F768 HydrophobicContact CD1-CZ 4Å; F663-F768 AromaticContact CE1-CE1 3.6Å; F663-F768 HydrophobicContact CE1-CE1 3.6Å; F663-F768 AromaticContact CE1-CZ 3.71Å; F663-F768 HydrophobicContact CE1-CZ 3.71Å; F663-F768 HydrophobicContact CG-CE1 4.28Å; F663-F768 HydrophobicContact CZ-CE1 4.23Å; F663-F771 HydrophobicContact CB-CE2 3.86Å; F663-R777 PolarHBondContact N-O 3.29Å; F663-R777 PolarHBondContact O-N 2.89Å
664	D	88.7	Confident	84.9	Confident	55 Å²	55	45.1 Å²	45.1	29%	0.294	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	158.5	176.3	-164.1	-1.7	0	0	0	108.9	I673	D664-I673 HydrophobicContact CB-CB 4.26Å; D664-I673 PolarHBondContact N-O 2.72Å; D664-I673 PolarHBondContact O-N 2.82Å
665	Y	90.4	Very high	87	Confident	9 Å²	9	42.7 Å²	42.7	4%	0.035	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	115.8	-175.8	-167.6	-89.4	0	0	0	112.7	I667 N670 K671 L672 I732 L734 V737 F771 A773	Y665-I667 HydrophobicContact CD1-CG1 3.89Å; Y665-I667 HydrophobicContact CE1-CG1 4.32Å; Y665-I667 PolarHBondContact O-N 3.02Å; Y665-N670 VanDerWaalsContact OH-CA 3.32Å; Y665-N670 WeakPolarHBondContact OH-CA 3.5Å; Y665-K671 WeakPolarHBondContact CA-O 3.39Å; Y665-L672 HydrophobicContact CD2-CB 3.97Å; Y665-L672 HydrophobicContact CD2-CD1 4.11Å; Y665-L672 HydrophobicContact CE2-CB 4.19Å; Y665-I732 WeakPolarHBondContact CE2-O 3.24Å; Y665-I732 PolarHBondContact OH-O 3.23Å; Y665-L734 HydrophobicContact CD1-CD1 4.15Å; Y665-L734 HydrophobicContact CD2-CD1 4.5Å; Y665-L734 HydrophobicContact CE1-CB 3.84Å; Y665-L734 HydrophobicContact CE1-CD1 4.11Å; Y665-L734 HydrophobicContact CE1-CG 4.41Å; Y665-L734 HydrophobicContact CE2-CD1 4.49Å; Y665-L734 HydrophobicContact CG-CD1 4.36Å; Y665-L734 PolarHBondContact OH-N 3.48Å; Y665-V737 HydrophobicContact CD2-CG2 4.39Å; Y665-V737 HydrophobicContact CE2-CG2 3.84Å; Y665-F771 HydrophobicContact CD2-CE1 4.01Å; Y665-F771 HydrophobicContact CG-CE1 4.01Å; Y665-A773 HydrophobicContact CD1-CB 3.84Å; Y665-A773 HydrophobicContact CG-CB 4.18Å
666	L	87.1	Confident	88.6	Confident	68 Å²	68	39.5 Å²	39.5	36%	0.356	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	97	173.9	-62.7	-178.8	0	0	0	109.2	D668 E669 N670 K671 I673	L666-D668 VanDerWaalsContact C-N 3.28Å; L666-D668 PolarHBondContact O-N 3.39Å; L666-E669 HydrophobicContact CB-CB 4.1Å; L666-E669 HydrophobicContact CB-CG 4.39Å; L666-E669 HydrophobicContact CD1-CG 4.37Å; L666-E669 PolarHBondContact O-N 2.89Å; L666-N670 PolarHBondContact O-N 2.98Å; L666-K671 PolarHBondContact N-O 3.4Å; L666-K671 PolarHBondContact O-N 2.64Å; L666-I673 HydrophobicContact CD1-CD1 3.92Å; L666-I673 HydrophobicContact CD2-CD1 4.47Å; L666-I673 HydrophobicContact CG-CD1 3.87Å
667	I	84	Confident	89.2	Confident	96 Å²	96	40.1 Å²	40.1	49%	0.492	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-57.2	-43.5	177.7	-58.4	174.2	0	0	0	110.6	Y665 E669 N670 A773	Y665-I667 HydrophobicContact CD1-CG1 3.89Å; Y665-I667 HydrophobicContact CE1-CG1 4.32Å; Y665-I667 PolarHBondContact O-N 3.02Å; I667-E669 PolarHBondContact O-N 3.17Å; I667-N670 PolarHBondContact O-N 3.32Å; I667-A773 HydrophobicContact CD1-CB 3.95Å; I667-A773 HydrophobicContact CG1-CB 3.92Å
668	D	82.2	Confident	89.5	Confident	165 Å²	165	45.6 Å²	45.6	88%	0.882	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-64.7	-26.9	-178.1	-56.4	-34.1	0	0	0	113.3	L666	L666-D668 VanDerWaalsContact C-N 3.28Å; L666-D668 PolarHBondContact O-N 3.39Å
669	E	85.3	Confident	89.5	Confident	106 Å²	106	44.3 Å²	44.3	50%	0.495	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-106.2	-5.3	-178.2	-58.1	-163.5	166.3	0	0	113.8	L666 I667 K671	L666-E669 HydrophobicContact CB-CB 4.1Å; L666-E669 HydrophobicContact CB-CG 4.39Å; L666-E669 HydrophobicContact CD1-CG 4.37Å; L666-E669 PolarHBondContact O-N 2.89Å; I667-E669 PolarHBondContact O-N 3.17Å; E669-K671 VanDerWaalsContact C-N 3.34Å; E669-K671 HydrophobicContact CB-CB 4.47Å; E669-K671 HydrophobicContact CB-CD 4Å; E669-K671 HydrophobicContact CB-CG 4.09Å; E669-K671 PolarHBondContact O-N 3.18Å; E669-K671 WeakPolarHBondContact OE2-CD 3.29Å; E669-K671 WeakPolarHBondContact OE2-CE 3.36Å; E669-K671 IonicContact OE2-NZ 3.28Å; E669-K671 PolarHBondContact OE2-NZ 3.17Å
670	N	87.7	Confident	89.3	Confident	83 Å²	83	48.7 Å²	48.7	44%	0.444	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	48.1	-167.2	-70.3	-63.7	0	0	0	113.6	Y665 L666 I667 I732	Y665-N670 VanDerWaalsContact OH-CA 3.32Å; Y665-N670 WeakPolarHBondContact OH-CA 3.5Å; L666-N670 PolarHBondContact O-N 2.98Å; I667-N670 PolarHBondContact O-N 3.32Å; N670-I732 CarbonylContact O-C 3.21Å; N670-I732 PolarHBondContact O-N 3.02Å; N670-I732 VanDerWaalsContact O-N 3.09Å; N670-I732 VanDerWaalsContact O-O 3.11Å
671	K	88.2	Confident	89	Confident	62 Å²	62	50 Å²	50	27%	0.27	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	127.4	-179.2	-67.3	175.6	-162.9	161.1	0	112.5	Y665 L666 E669 A729 I730	Y665-K671 WeakPolarHBondContact CA-O 3.39Å; L666-K671 PolarHBondContact N-O 3.4Å; L666-K671 PolarHBondContact O-N 2.64Å; E669-K671 VanDerWaalsContact C-N 3.34Å; E669-K671 HydrophobicContact CB-CB 4.47Å; E669-K671 HydrophobicContact CB-CD 4Å; E669-K671 HydrophobicContact CB-CG 4.09Å; E669-K671 PolarHBondContact O-N 3.18Å; E669-K671 WeakPolarHBondContact OE2-CD 3.29Å; E669-K671 WeakPolarHBondContact OE2-CE 3.36Å; E669-K671 IonicContact OE2-NZ 3.28Å; E669-K671 PolarHBondContact OE2-NZ 3.17Å; K671-A729 HydrophobicContact CD-CB 4.43Å; K671-I730 WeakPolarHBondContact CA-O 3.38Å
672	L	89.2	Confident	88.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	125.5	165.4	-179.9	68.2	0	0	0	109.2	Y665 V674 I700 I730 V737 F768 F771	Y665-L672 HydrophobicContact CD2-CB 3.97Å; Y665-L672 HydrophobicContact CD2-CD1 4.11Å; Y665-L672 HydrophobicContact CE2-CB 4.19Å; L672-V674 HydrophobicContact CD2-CG2 4.15Å; L672-V674 HydrophobicContact CG-CG2 4.17Å; L672-I700 HydrophobicContact CD2-CD1 4.25Å; L672-I730 PolarHBondContact N-O 3.29Å; L672-I730 PolarHBondContact O-N 2.79Å; L672-V737 HydrophobicContact CD2-CG1 4.46Å; L672-F768 HydrophobicContact CD2-CE1 4.25Å; L672-F768 HydrophobicContact CD2-CE2 3.96Å; L672-F768 HydrophobicContact CD2-CZ 3.76Å; L672-F771 HydrophobicContact CD1-CE1 4.12Å; L672-F771 HydrophobicContact CD1-CE2 4.11Å; L672-F771 HydrophobicContact CD1-CZ 3.78Å
673	I	89.6	Confident	87.9	Confident	38 Å²	38	55.9 Å²	55.9	20%	0.195	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	116.1	173.4	-58.3	177.6	0	0	0	108.3	F663 D664 L666 A727 F728 A729	F663-I673 WeakPolarHBondContact CA-O 3.48Å; D664-I673 HydrophobicContact CB-CB 4.26Å; D664-I673 PolarHBondContact N-O 2.72Å; D664-I673 PolarHBondContact O-N 2.82Å; L666-I673 HydrophobicContact CD1-CD1 3.92Å; L666-I673 HydrophobicContact CD2-CD1 4.47Å; L666-I673 HydrophobicContact CG-CD1 3.87Å; I673-A727 HydrophobicContact CG2-CB 4Å; I673-F728 WeakPolarHBondContact CA-O 3.41Å; I673-A729 HydrophobicContact CG1-CB 4.45Å
674	V	92.4	Very high	87.2	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	114.9	172.7	-176.7	0	0	0	0	108.6	V661 F663 L672 F711 A727 F728 I730 L742	V661-V674 HydrophobicContact CG1-CG1 4.06Å; F663-V674 HydrophobicContact CD1-CG1 4.39Å; F663-V674 HydrophobicContact CD1-CG2 4.23Å; F663-V674 HydrophobicContact CE1-CG1 4.04Å; F663-V674 HydrophobicContact CE1-CG2 4.32Å; L672-V674 HydrophobicContact CD2-CG2 4.15Å; L672-V674 HydrophobicContact CG-CG2 4.17Å; V674-F711 HydrophobicContact CB-CZ 4.32Å; V674-F711 HydrophobicContact CG1-CZ 4.02Å; V674-A727 CarbonylContact O-C 3.57Å; V674-A727 WeakPolarHBondContact O-CA 3.42Å; V674-F728 PolarHBondContact N-O 2.73Å; V674-F728 PolarHBondContact O-N 2.96Å; V674-I730 HydrophobicContact CG2-CD1 4.31Å; V674-L742 HydrophobicContact CG1-CD2 3.79Å; V674-L742 HydrophobicContact CG2-CD2 4.41Å
675	S	90	Very high	86.8	Confident	28 Å²	28	56.1 Å²	56.1	20%	0.196	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131	176.8	67	0	0	0	0	111.9	V661 G662 Q726	V661-S675 CarbonylContact C-O 3.51Å; V661-S675 VanDerWaalsContact CA-O 3.28Å; V661-S675 WeakPolarHBondContact CA-O 3.24Å; V661-S675 WeakPolarHBondContact CG1-O 3.47Å; G662-S675 VanDerWaalsContact CA-OG 3.23Å; G662-S675 WeakPolarHBondContact CA-OG 3.31Å; G662-S675 PolarHBondContact N-O 2.95Å; G662-S675 PolarHBondContact N-OG 3.44Å; G662-S675 PolarHBondContact O-N 3.4Å; G662-S675 PolarHBondContact O-OG 3.2Å; S675-Q726 CarbonylContact C-O 3.43Å; S675-Q726 WeakPolarHBondContact CA-O 3.43Å
676	I	94.3	Very high	85.9	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	109.1	174.2	-59.2	-177.4	0	0	0	107.1	L659 V696 F711 T713 F724 K725 Q726 F728 L744	L659-I676 HydrophobicContact CD1-CG2 4.1Å; I676-V696 HydrophobicContact CD1-CB 3.93Å; I676-V696 HydrophobicContact CD1-CG1 3.88Å; I676-V696 HydrophobicContact CG2-CB 4.43Å; I676-V696 HydrophobicContact CG2-CG2 3.92Å; I676-F711 HydrophobicContact CD1-CE2 3.89Å; I676-T713 HydrophobicContact CB-CG2 4.1Å; I676-T713 HydrophobicContact CD1-CG2 3.8Å; I676-T713 HydrophobicContact CG1-CG2 4.48Å; I676-T713 HydrophobicContact CG2-CG2 4.16Å; I676-F724 HydrophobicContact CG2-CB 4.01Å; I676-F724 HydrophobicContact CG2-CD2 3.69Å; I676-F724 HydrophobicContact CG2-CE2 4.48Å; I676-F724 HydrophobicContact CG2-CG 4.05Å; I676-K725 WeakPolarHBondContact O-CA 3.49Å; I676-K725 PolarHBondContact O-N 2.87Å; I676-Q726 PolarHBondContact N-O 2.95Å; I676-Q726 PolarHBondContact O-N 3.43Å; I676-Q726 VanDerWaalsContact O-N 3.08Å; I676-F728 HydrophobicContact CD1-CE2 4.22Å; I676-F728 HydrophobicContact CG1-CE2 4.46Å; I676-L744 HydrophobicContact CD1-CD2 4.11Å
677	E	90.9	Very high	84.8	Confident	71 Å²	71	59.6 Å²	59.6	33%	0.332	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-57.1	-174	-85	-157.4	-141	0	0	113.1	M660 A723 F724 K725	M660-E677 HydrophobicContact CB-CB 4.49Å; M660-E677 HydrophobicContact CE-CB 3.6Å; M660-E677 HydrophobicContact CE-CG 3.98Å; M660-E677 WeakPolarHBondContact CE-OE2 3.47Å; M660-E677 PolarHBondContact O-N 3.21Å; M660-E677 VanDerWaalsContact O-N 3.07Å; E677-A723 CarbonylContact O-C 3.59Å; E677-A723 WeakPolarHBondContact O-CA 3.49Å; E677-F724 PolarHBondContact O-N 2.92Å; E677-K725 PolarHBondContact O-N 3.16Å; E677-K725 VanDerWaalsContact O-N 3.16Å
678	R	90.6	Very high	84.2	Confident	116 Å²	116	55.5 Å²	55.5	44%	0.438	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	161.2	-170.8	57.1	179.1	173.5	-165.4	-8.1	112.8	M660 P722 A723 W780	M660-R678 HydrophobicContact CB-CG 3.9Å; M660-R678 WeakPolarHBondContact CB-O 3.44Å; M660-R678 HydrophobicContact CE-CG 4.14Å; M660-R678 PolarHBondContact N-O 2.69Å; M660-R678 HydrophobicContact SD-CG 4.34Å; M660-R678 PolarHBondContact SD-NE 3.21Å; M660-R678 PolarHBondContact SD-NH2 3.47Å; R678-P722 CarbonylContact C-O 3.58Å; R678-P722 WeakPolarHBondContact CA-O 3.42Å; R678-P722 WeakPolarHBondContact CB-O 3.4Å; R678-A723 HydrophobicContact CB-CB 4.43Å; R678-W780 HydrophobicContact CG-CH2 3.81Å; R678-W780 HydrophobicContact CG-CZ2 4.4Å; R678-W780 HydrophobicContact CG-CZ3 4.46Å
679	A	90.3	Very high	83.6	Confident	5 Å²	5	55.2 Å²	55.2	4%	0.041	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	165.2	168.1	0	0	0	0	0	112.7	Q658 L659 L682 P722 F724	Q658-A679 CarbonylContact O-C 3.47Å; Q658-A679 WeakPolarHBondContact O-CA 3.33Å; Q658-A679 WeakPolarHBondContact O-CB 3.44Å; L659-A679 HydrophobicContact CD1-CB 3.85Å; A679-L682 HydrophobicContact CB-CD1 4.21Å; A679-L682 HydrophobicContact CB-CD2 4.01Å; A679-L682 HydrophobicContact CB-CG 4.35Å; A679-P722 HydrophobicContact CB-CG 3.9Å; A679-P722 PolarHBondContact N-O 3.08Å; A679-F724 HydrophobicContact CB-CE2 4.4Å
680	R	87.1	Confident	83	Confident	95 Å²	95	53.3 Å²	53.3	36%	0.358	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	165	176	68.8	-179.5	179.1	-168.5	-3	111.7	Q658 L682 W780	Q658-R680 HydrophobicContact CB-CG 3.97Å; Q658-R680 PolarHBondContact N-O 2.92Å; Q658-R680 PolarHBondContact O-N 3.19Å; R680-L682 PolarHBondContact O-N 3.01Å; R680-W780 HydrophobicContact CB-CH2 4.19Å; R680-W780 HydrophobicContact CB-CZ3 4.16Å; R680-W780 HydrophobicContact CG-CE3 4.13Å; R680-W780 HydrophobicContact CG-CH2 3.85Å; R680-W780 HydrophobicContact CG-CZ3 3.56Å
681	N	85.6	Confident	82.7	Confident	43 Å²	43	50.2 Å²	50.2	23%	0.23	27%	0.265	C	S	.	.			trans	59.3	27.9	174	-50.1	-25.5	0	0	0	114.6	V655 T656 H683 S684	V655-N681 HydrophobicContact CG1-CB 3.74Å; V655-N681 WeakPolarHBondContact CG1-ND2 3.44Å; T656-N681 VanDerWaalsContact O-CB 3.26Å; T656-N681 WeakPolarHBondContact O-CB 3.5Å; T656-N681 PolarHBondContact O-ND2 3.42Å; T656-N681 VanDerWaalsContact O-ND2 3.17Å; N681-H683 PolarHBondContact O-N 3.27Å; N681-S684 PolarHBondContact O-N 2.89Å; N681-S684 VanDerWaalsContact O-N 3.16Å; N681-S684 PolarHBondContact O-OG 2.86Å
682	L	83.4	Confident	82.5	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.016	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-65.3	-22	-174	-61.1	-173.3	0	0	0	113.4	A657 A679 R680 S684 L685 V688 L694 P722 L746	A657-L682 HydrophobicContact CB-CD2 3.97Å; A679-L682 HydrophobicContact CB-CD1 4.21Å; A679-L682 HydrophobicContact CB-CD2 4.01Å; A679-L682 HydrophobicContact CB-CG 4.35Å; R680-L682 PolarHBondContact O-N 3.01Å; L682-S684 PolarHBondContact O-N 2.86Å; L682-L685 HydrophobicContact CD2-CD1 4.21Å; L682-L685 WeakPolarHBondContact O-CB 3.33Å; L682-L685 PolarHBondContact O-N 3.43Å; L682-V688 HydrophobicContact CB-CG1 4.22Å; L682-V688 VanDerWaalsContact O-CG2 3.31Å; L682-V688 WeakPolarHBondContact O-CG2 3.34Å; L682-L694 HydrophobicContact CD1-CD1 3.33Å; L682-P722 HydrophobicContact CD1-CG 3.69Å; L682-L746 HydrophobicContact CD1-CD2 4.22Å; L682-L746 HydrophobicContact CD2-CD2 3.74Å
683	H	77.1	Confident	82.3	Confident	123 Å²	123	50.4 Å²	50.4	57%	0.569	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-56.2	-12.6	171.7	62.2	-103.3	0	0	0	115	N681	N681-H683 PolarHBondContact O-N 3.27Å
684	S	77	Confident	82.3	Confident	56 Å²	56	48.6 Å²	48.6	39%	0.392	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-83.3	-14.9	173.2	62.4	0	0	0	0	114	V655 A657 N681 L682	V655-S684 WeakPolarHBondContact O-CB 3.3Å; V655-S684 PolarHBondContact O-OG 2.99Å; A657-S684 WeakPolarHBondContact CB-OG 3.39Å; A657-S684 PolarHBondContact N-OG 3.2Å; N681-S684 PolarHBondContact O-N 2.89Å; N681-S684 VanDerWaalsContact O-N 3.16Å; N681-S684 PolarHBondContact O-OG 2.86Å; L682-S684 PolarHBondContact O-N 2.86Å
685	L	80.8	Confident	82.2	Confident	12 Å²	12	48.6 Å²	48.6	6%	0.063	26%	0.262	C	S	.	.	S	Bend	trans	-83.7	145.7	172.7	-63.5	171.9	0	0	0	110.1	A657 L682 V688 L746 L761 V783	A657-L685 HydrophobicContact CB-CD1 3.79Å; A657-L685 HydrophobicContact CB-CD2 4.04Å; A657-L685 HydrophobicContact CB-CG 3.61Å; L682-L685 HydrophobicContact CD2-CD1 4.21Å; L682-L685 WeakPolarHBondContact O-CB 3.33Å; L682-L685 PolarHBondContact O-N 3.43Å; L685-V688 HydrophobicContact CB-CG2 3.81Å; L685-L746 HydrophobicContact CD1-CD2 3.74Å; L685-L761 HydrophobicContact CD1-CB 4.18Å; L685-V783 HydrophobicContact CD1-CG1 4.16Å; L685-V783 HydrophobicContact CD2-CG1 4.43Å
686	P	71.1	Confident	82.4	Confident	61 Å²	61	47.2 Å²	47.2	40%	0.396	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	151.8	175.9	26.2	-33.9	0	0	0	111.8	V688 S785	P686-V688 PolarHBondContact O-N 2.95Å; P686-V688 VanDerWaalsContact O-N 3.1Å; P686-S785 WeakPolarHBondContact CG-OG 3.48Å
687	C	64.2	Low	82.2	Confident	89 Å²	89	47.8 Å²	47.8	60%	0.601	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	6.7	174.5	-56.5	0	0	0	0	117.5	N689 S690 I691	C687-N689 VanDerWaalsContact C-N 3.26Å; C687-N689 PolarHBondContact O-N 3.33Å; C687-S690 PolarHBondContact O-N 2.92Å; C687-S690 PolarHBondContact O-OG 2.89Å; C687-S690 VanDerWaalsContact O-OG 3.08Å; C687-I691 WeakPolarHBondContact O-CG1 3.25Å
688	V	70.6	Confident	82.2	Confident	9 Å²	9	44.4 Å²	44.4	6%	0.055	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-62.7	-28.7	-176.8	172.6	0	0	0	0	114.3	L682 L685 P686 S690 I691 V719 L761	L682-V688 HydrophobicContact CB-CG1 4.22Å; L682-V688 VanDerWaalsContact O-CG2 3.31Å; L682-V688 WeakPolarHBondContact O-CG2 3.34Å; L685-V688 HydrophobicContact CB-CG2 3.81Å; P686-V688 PolarHBondContact O-N 2.95Å; P686-V688 VanDerWaalsContact O-N 3.1Å; V688-S690 PolarHBondContact O-N 2.88Å; V688-S690 VanDerWaalsContact O-N 3.15Å; V688-I691 HydrophobicContact CB-CD1 4.39Å; V688-I691 HydrophobicContact CG2-CD1 4.16Å; V688-I691 WeakPolarHBondContact O-CB 3.47Å; V688-I691 PolarHBondContact O-N 3.04Å; V688-V719 HydrophobicContact CG1-CG1 3.68Å; V688-L761 HydrophobicContact CG2-CD1 4.33Å
689	N	69.6	Low	82	Confident	160 Å²	160	39.3 Å²	39.3	86%	0.856	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-67.7	-12.7	-179.9	-62.4	-3.8	0	0	0	114.5	C687	C687-N689 VanDerWaalsContact C-N 3.26Å; C687-N689 PolarHBondContact O-N 3.33Å
690	S	73.9	Confident	81.9	Confident	66 Å²	66	39.2 Å²	39.2	46%	0.462	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-104.2	15.3	179.2	67.2	0	0	0	0	113.7	C687 V688 S750	C687-S690 PolarHBondContact O-N 2.92Å; C687-S690 PolarHBondContact O-OG 2.89Å; C687-S690 VanDerWaalsContact O-OG 3.08Å; V688-S690 PolarHBondContact O-N 2.88Å; V688-S690 VanDerWaalsContact O-N 3.15Å; S690-S750 PolarHBondContact O-OG 3.32Å
691	I	81.2	Confident	81.6	Confident	18 Å²	18	37.8 Å²	37.8	9%	0.092	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	140.4	-169.3	-58.1	-179.7	0	0	0	111.1	C687 V688 A693 L694 L749 L761	C687-I691 WeakPolarHBondContact O-CG1 3.25Å; V688-I691 HydrophobicContact CB-CD1 4.39Å; V688-I691 HydrophobicContact CG2-CD1 4.16Å; V688-I691 WeakPolarHBondContact O-CB 3.47Å; V688-I691 PolarHBondContact O-N 3.04Å; I691-A693 WeakPolarHBondContact CG2-O 3.48Å; I691-L694 HydrophobicContact CD1-CD2 4.43Å; I691-L694 HydrophobicContact CG2-CD2 3.93Å; I691-L694 HydrophobicContact CG2-CG 4.39Å; I691-L749 WeakPolarHBondContact CA-O 3.45Å; I691-L761 HydrophobicContact CD1-CD1 3.45Å; I691-L761 VanDerWaalsContact CD1-CD1 3.45Å; I691-L761 HydrophobicContact CD1-CD2 3.32Å; I691-L761 HydrophobicContact CD1-CG 3.98Å
692	T	82.6	Confident	80.6	Confident	64 Å²	64	39.7 Å²	39.7	39%	0.393	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-20.5	-178.3	59.8	0	0	0	0	114.1	L749	T692-L749 PolarHBondContact N-O 3.11Å; T692-L749 PolarHBondContact OG1-O 3.01Å
693	A	86	Confident	79.3	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	157.1	174.9	0	0	0	0	0	111.3	I691 W715 S716 G748 L749	I691-A693 WeakPolarHBondContact CG2-O 3.48Å; A693-W715 HydrophobicContact CB-CB 4.43Å; A693-W715 HydrophobicContact CB-CE3 4.25Å; A693-S716 CarbonylContact C-O 3.52Å; A693-S716 WeakPolarHBondContact CA-O 3.46Å; A693-S716 VanDerWaalsContact CB-O 3.28Å; A693-S716 WeakPolarHBondContact CB-O 3.5Å; A693-G748 CarbonylContact O-C 3.45Å; A693-G748 WeakPolarHBondContact O-CA 3.49Å; A693-L749 HydrophobicContact CB-CB 4.37Å; A693-L749 HydrophobicContact CB-CD1 4.12Å; A693-L749 PolarHBondContact O-N 3.44Å
694	L	90.3	Very high	78.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	145.1	-176.4	-65.4	169.7	0	0	0	112	L682 I691 W715 S716 V719 P722 W747 L761	L682-L694 HydrophobicContact CD1-CD1 3.33Å; I691-L694 HydrophobicContact CD1-CD2 4.43Å; I691-L694 HydrophobicContact CG2-CD2 3.93Å; I691-L694 HydrophobicContact CG2-CG 4.39Å; L694-W715 CarbonylContact O-C 3.58Å; L694-W715 WeakPolarHBondContact O-CA 3.31Å; L694-S716 PolarHBondContact N-O 3.11Å; L694-S716 PolarHBondContact O-N 2.79Å; L694-V719 HydrophobicContact CD1-CB 4.41Å; L694-V719 HydrophobicContact CD1-CG1 4.2Å; L694-P722 HydrophobicContact CD1-CB 4.2Å; L694-P722 HydrophobicContact CD1-CG 3.81Å; L694-W747 CarbonylContact C-O 3.6Å; L694-W747 VanDerWaalsContact CA-O 3.31Å; L694-W747 WeakPolarHBondContact CA-O 3.42Å; L694-L761 HydrophobicContact CD2-CD1 3.38Å
695	C	90.7	Very high	76.9	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	164.1	164.5	66.1	0	0	0	0	111.6	V712 T713 W715 W747	C695-V712 HydrophobicContact CB-CG1 4.47Å; C695-T713 VanDerWaalsContact CB-O 3.31Å; C695-T713 WeakPolarHBondContact CB-O 3.46Å; C695-W715 HydrophobicContact CB-CD2 3.88Å; C695-W715 HydrophobicContact CB-CE3 3.79Å; C695-W715 HydrophobicContact CB-CG 4.35Å; C695-W715 HydrophobicContact CB-CZ3 4.18Å; C695-W715 WeakPolarHBondContact SG-CH2 3.36Å; C695-W715 VanDerWaalsContact SG-CZ2 3.59Å; C695-W715 WeakPolarHBondContact SG-CZ3 3.21Å; C695-W747 PolarHBondContact N-O 3.05Å; C695-W747 PolarHBondContact O-N 3.14Å
696	V	92.6	Very high	75.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.7	172.2	-160.5	0	0	0	0	108.8	L659 I676 V712 T713 F724 L744 Y745 L746	L659-V696 HydrophobicContact CD1-CG2 4.12Å; L659-V696 HydrophobicContact CD2-CG1 3.96Å; I676-V696 HydrophobicContact CD1-CB 3.93Å; I676-V696 HydrophobicContact CD1-CG1 3.88Å; I676-V696 HydrophobicContact CG2-CB 4.43Å; I676-V696 HydrophobicContact CG2-CG2 3.92Å; V696-V712 WeakPolarHBondContact O-CA 3.15Å; V696-T713 HydrophobicContact CB-CG2 4.03Å; V696-T713 HydrophobicContact CG2-CG2 4.35Å; V696-T713 PolarHBondContact N-OG1 2.86Å; V696-T713 PolarHBondContact O-N 3.23Å; V696-T713 PolarHBondContact O-OG1 2.89Å; V696-F724 HydrophobicContact CG2-CD1 4.3Å; V696-F724 HydrophobicContact CG2-CD2 3.98Å; V696-F724 HydrophobicContact CG2-CE1 3.95Å; V696-F724 HydrophobicContact CG2-CE2 3.58Å; V696-F724 HydrophobicContact CG2-CG 4.32Å; V696-F724 HydrophobicContact CG2-CZ 3.56Å; V696-L744 HydrophobicContact CG1-CB 4.18Å; V696-L744 HydrophobicContact CG1-CD2 4.43Å; V696-Y745 CarbonylContact C-O 3.58Å; V696-Y745 WeakPolarHBondContact CA-O 3.49Å; V696-L746 HydrophobicContact CG2-CD1 4Å
697	Q	90.4	Very high	74.6	Confident	11 Å²	11	47.2 Å²	47.2	5%	0.051	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.3	169.5	174.2	175	6.4	0	0	108.6	F711 V712 L744 Y745	Q697-F711 CarbonylContact C-O 3.49Å; Q697-F711 WeakPolarHBondContact CA-O 3.47Å; Q697-V712 HydrophobicContact CB-CG2 4.1Å; Q697-V712 HydrophobicContact CG-CG2 3.97Å; Q697-L744 CarbonylContact O-C 3.58Å; Q697-L744 VanDerWaalsContact O-CA 3.31Å; Q697-L744 WeakPolarHBondContact O-CA 3.34Å; Q697-Y745 PolarHBondContact N-O 3.46Å; Q697-Y745 PolarHBondContact O-N 3.37Å
698	G	90.7	Very high	74.5	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	143.8	173.4	0	0	0	0	0	112.2	D710 F711 Q743	G698-D710 CarbonylContact O-C 3.58Å; G698-D710 WeakPolarHBondContact O-CA 3.48Å; G698-F711 PolarHBondContact N-O 3.09Å; G698-F711 PolarHBondContact O-N 2.96Å; G698-Q743 CarbonylContact C-O 3.56Å; G698-Q743 VanDerWaalsContact CA-O 3.24Å; G698-Q743 WeakPolarHBondContact CA-O 3.48Å
699	T	87.8	Confident	74.7	Confident	9 Å²	9	47.8 Å²	47.8	6%	0.055	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	139.8	174.4	68.6	0	0	0	0	109.7	V709 D710 Q743	T699-V709 WeakPolarHBondContact CA-O 3.44Å; T699-D710 WeakPolarHBondContact CB-OD1 3.36Å; T699-D710 HydrophobicContact CG2-CB 4.28Å; T699-D710 VanDerWaalsContact CG2-CG 3.48Å; T699-D710 WeakPolarHBondContact CG2-OD1 3.46Å; T699-Q743 PolarHBondContact N-O 2.96Å; T699-Q743 PolarHBondContact O-N 2.73Å
700	I	86.5	Confident	75.3	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.015	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.9	176	-63.6	-169.2	0	0	0	110.5	L672 V709 I730 I732 R740 I741 L742 F768	L672-I700 HydrophobicContact CD2-CD1 4.25Å; I700-V709 PolarHBondContact N-O 3.15Å; I700-I730 HydrophobicContact CD1-CD1 3.48Å; I700-I730 VanDerWaalsContact CD1-CD1 3.48Å; I700-I730 HydrophobicContact CD1-CG2 4.42Å; I700-I730 HydrophobicContact CG1-CD1 4.28Å; I700-I732 HydrophobicContact CD1-CD1 4.05Å; I700-I732 HydrophobicContact CG2-CD1 4.06Å; I700-R740 HydrophobicContact CG2-CB 3.83Å; I700-R740 HydrophobicContact CG2-CG 4.11Å; I700-I741 WeakPolarHBondContact CA-O 3.28Å; I700-L742 HydrophobicContact CD1-CD1 4.5Å; I700-L742 HydrophobicContact CG1-CD1 3.86Å; I700-F768 HydrophobicContact CD1-CE2 4.45Å
701	L	80.7	Confident	76	Confident	66 Å²	66	41.9 Å²	41.9	35%	0.346	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	151.3	-174.8	-65	173.6	0	0	0	111.9	I741	L701-I741 PolarHBondContact N-O 2.87Å; L701-I741 PolarHBondContact O-N 2.76Å
702	P	65.9	Low	76.4	Confident	82 Å²	82	43.9 Å²	43.9	53%	0.532	28%	0.283	S	S	.	.	S	Bend	cis	-65.6	162.7	-24.5	32.3	-34.5	0	0	0	109.6	R740	P702-R740 WeakPolarHBondContact O-CD 3.49Å; P702-R740 PolarHBondContact O-NH1 3.29Å
703	C	55.7	Low	76.8	Confident	40 Å²	40	41 Å²	41	27%	0.27	27%	0.266	S	S	.	.			trans	-107.5	141.7	170.1	-161.5	0	0	0	0	110.2	T705 D707	C703-T705 VanDerWaalsContact C-N 3.26Å; C703-T705 PolarHBondContact O-N 2.81Å; C703-D707 WeakPolarHBondContact CB-O 3.47Å; C703-D707 PolarHBondContact SG-O 2.94Å
704	A	51.7	Low	76.9	Confident	76 Å²	76	48.7 Å²	48.7	63%	0.628	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-23.4	-174.6	0	0	0	0	0	113.9
705	T	51.8	Low	76.8	Confident	106 Å²	106	51 Å²	51	65%	0.65	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	7.4	-173.2	50.3	0	0	0	0	114.1	C703 D707	C703-T705 VanDerWaalsContact C-N 3.26Å; C703-T705 PolarHBondContact O-N 2.81Å; T705-D707 PolarHBondContact O-N 3.3Å; T705-D707 VanDerWaalsContact O-N 3.13Å
706	G	51.2	Low	76.5	Confident	73 Å²	73	52 Å²	52	75%	0.753	31%	0.314	S	S	*	.	S	Bend	trans	78	-21.2	-175.8	0	0	0	0	0	114.8
707	D	53.7	Low	76.1	Confident	118 Å²	118	61.3 Å²	61.3	63%	0.631	35%	0.35	S	S	*	.			trans	-79.1	115.4	172.5	-65.7	-38.8	0	0	0	111.3	C703 T705 V709	C703-D707 WeakPolarHBondContact CB-O 3.47Å; C703-D707 PolarHBondContact SG-O 2.94Å; T705-D707 PolarHBondContact O-N 3.3Å; T705-D707 VanDerWaalsContact O-N 3.13Å; D707-V709 PolarHBondContact O-N 3.06Å
708	S	60.4	Low	75.7	Confident	57 Å²	57	64.5 Å²	64.5	40%	0.399	37%	0.367	S	S	.	.			trans	-65	125.7	168.6	-172.1	0	0	0	0	109.7	D710	S708-D710 WeakPolarHBondContact CB-OD1 3.4Å; S708-D710 PolarHBondContact O-N 3.04Å; S708-D710 PolarHBondContact OG-OD1 2.91Å
709	V	74.7	Confident	75.2	Confident	54 Å²	54	65.9 Å²	65.9	33%	0.327	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	97.5	172.7	-175.9	0	0	0	0	108.8	T699 I700 D707 I730	T699-V709 WeakPolarHBondContact CA-O 3.44Å; I700-V709 PolarHBondContact N-O 3.15Å; D707-V709 PolarHBondContact O-N 3.06Å; V709-I730 HydrophobicContact CB-CG2 4.36Å; V709-I730 HydrophobicContact CG1-CD1 4.48Å; V709-I730 HydrophobicContact CG1-CG1 4.44Å; V709-I730 HydrophobicContact CG1-CG2 3.83Å; V709-I730 HydrophobicContact CG2-CG2 4.43Å
710	D	82.8	Confident	74.7	Confident	84 Å²	84	71.8 Å²	71.8	45%	0.449	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	137.4	178.1	-70.6	17.1	0	0	0	110.4	G698 T699 S708	G698-D710 CarbonylContact O-C 3.58Å; G698-D710 WeakPolarHBondContact O-CA 3.48Å; T699-D710 WeakPolarHBondContact CB-OD1 3.36Å; T699-D710 HydrophobicContact CG2-CB 4.28Å; T699-D710 VanDerWaalsContact CG2-CG 3.48Å; T699-D710 WeakPolarHBondContact CG2-OD1 3.46Å; S708-D710 WeakPolarHBondContact CB-OD1 3.4Å; S708-D710 PolarHBondContact O-N 3.04Å; S708-D710 PolarHBondContact OG-OD1 2.91Å
711	F	87.8	Confident	74.5	Confident	17 Å²	17	79.2 Å²	79.2	8%	0.075	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	150.1	174.6	61.8	-92.9	0	0	0	111.3	V674 I676 Q697 G698 F728 I730 L742 L744	V674-F711 HydrophobicContact CB-CZ 4.32Å; V674-F711 HydrophobicContact CG1-CZ 4.02Å; I676-F711 HydrophobicContact CD1-CE2 3.89Å; Q697-F711 CarbonylContact C-O 3.49Å; Q697-F711 WeakPolarHBondContact CA-O 3.47Å; G698-F711 PolarHBondContact N-O 3.09Å; G698-F711 PolarHBondContact O-N 2.96Å; F711-F728 HydrophobicContact CB-CD1 3.64Å; F711-F728 HydrophobicContact CB-CE1 3.97Å; F711-F728 HydrophobicContact CB-CG 4.03Å; F711-F728 HydrophobicContact CD2-CB 4.14Å; F711-F728 AromaticContact CD2-CD1 3.78Å; F711-F728 HydrophobicContact CD2-CD1 3.78Å; F711-F728 AromaticContact CD2-CD2 3.29Å; F711-F728 HydrophobicContact CD2-CD2 3.29Å; F711-F728 AromaticContact CD2-CE1 3.95Å; F711-F728 HydrophobicContact CD2-CE1 3.95Å; F711-F728 AromaticContact CD2-CE2 3.49Å; F711-F728 HydrophobicContact CD2-CE2 3.49Å; F711-F728 VanDerWaalsContact CD2-CE2 3.49Å; F711-F728 AromaticContact CD2-CG 3.44Å; F711-F728 HydrophobicContact CD2-CG 3.44Å; F711-F728 VanDerWaalsContact CD2-CG 3.44Å; F711-F728 AromaticContact CD2-CZ 3.81Å; F711-F728 HydrophobicContact CD2-CZ 3.81Å; F711-F728 HydrophobicContact CE2-CB 4.44Å; F711-F728 AromaticContact CE2-CD2 3.44Å; F711-F728 HydrophobicContact CE2-CD2 3.44Å; F711-F728 VanDerWaalsContact CE2-CD2 3.44Å; F711-F728 AromaticContact CE2-CE2 3.79Å; F711-F728 HydrophobicContact CE2-CE2 3.79Å; F711-F728 AromaticContact CE2-CG 3.95Å; F711-F728 HydrophobicContact CE2-CG 3.95Å; F711-F728 HydrophobicContact CG-CB 4.17Å; F711-F728 AromaticContact CG-CD1 3.95Å; F711-F728 HydrophobicContact CG-CD1 3.95Å; F711-F728 HydrophobicContact CG-CD2 4.13Å; F711-F728 HydrophobicContact CG-CE1 4.37Å; F711-F728 AromaticContact CG-CG 3.8Å; F711-F728 HydrophobicContact CG-CG 3.8Å; F711-F728 HydrophobicContact CZ-CD2 4.39Å; F711-I730 HydrophobicContact CD1-CD1 3.89Å; F711-I730 HydrophobicContact CE1-CD1 3.72Å; F711-L742 HydrophobicContact CE1-CD1 3.81Å; F711-L742 HydrophobicContact CZ-CD1 3.74Å; F711-L744 HydrophobicContact CE2-CD2 4.26Å; F711-L744 HydrophobicContact CZ-CD2 4.04Å
712	V	89.7	Confident	74.7	Confident	61 Å²	61	76.1 Å²	76.1	37%	0.37	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	133.9	-177.7	-176.1	0	0	0	0	109.9	C695 V696 Q697 P798	C695-V712 HydrophobicContact CB-CG1 4.47Å; V696-V712 WeakPolarHBondContact O-CA 3.15Å; Q697-V712 HydrophobicContact CB-CG2 4.1Å; Q697-V712 HydrophobicContact CG-CG2 3.97Å; V712-P798 HydrophobicContact CG1-CB 3.96Å; V712-P798 HydrophobicContact CG2-CB 4.49Å
713	T	91.7	Very high	75.6	Confident	3 Å²	3	74.8 Å²	74.8	2%	0.018	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-76.6	147.4	172.6	66.1	0	0	0	0	111.4	I676 C695 V696 F724 Q726 F728	I676-T713 HydrophobicContact CB-CG2 4.1Å; I676-T713 HydrophobicContact CD1-CG2 3.8Å; I676-T713 HydrophobicContact CG1-CG2 4.48Å; I676-T713 HydrophobicContact CG2-CG2 4.16Å; C695-T713 VanDerWaalsContact CB-O 3.31Å; C695-T713 WeakPolarHBondContact CB-O 3.46Å; V696-T713 HydrophobicContact CB-CG2 4.03Å; V696-T713 HydrophobicContact CG2-CG2 4.35Å; V696-T713 PolarHBondContact N-OG1 2.86Å; V696-T713 PolarHBondContact O-N 3.23Å; V696-T713 PolarHBondContact O-OG1 2.89Å; T713-F724 HydrophobicContact CG2-CB 4.18Å; T713-F724 HydrophobicContact CG2-CD1 4.36Å; T713-F724 HydrophobicContact CG2-CG 4.36Å; T713-F724 WeakPolarHBondContact OG1-CD1 3.48Å; T713-Q726 VanDerWaalsContact CA-OE1 3.3Å; T713-F728 HydrophobicContact CG2-CE2 3.92Å; T713-F728 HydrophobicContact CG2-CZ 3.9Å
714	K	88.5	Confident	77.3	Confident	163 Å²	163	73.5 Å²	73.5	71%	0.709	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-49.6	142.9	165.9	-61.8	-179.2	179.9	-173.4	0	112.2	S716	K714-S716 PolarHBondContact O-N 3.1Å
715	W	87.2	Confident	79.1	Confident	49 Å²	49	78 Å²	78	19%	0.186	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-64	119.2	177	-66.9	96.7	0	0	0	112.1	A693 L694 C695 W747 L749 A758 P798	A693-W715 HydrophobicContact CB-CB 4.43Å; A693-W715 HydrophobicContact CB-CE3 4.25Å; L694-W715 CarbonylContact O-C 3.58Å; L694-W715 WeakPolarHBondContact O-CA 3.31Å; C695-W715 HydrophobicContact CB-CD2 3.88Å; C695-W715 HydrophobicContact CB-CE3 3.79Å; C695-W715 HydrophobicContact CB-CG 4.35Å; C695-W715 HydrophobicContact CB-CZ3 4.18Å; C695-W715 WeakPolarHBondContact SG-CH2 3.36Å; C695-W715 VanDerWaalsContact SG-CZ2 3.59Å; C695-W715 WeakPolarHBondContact SG-CZ3 3.21Å; W715-W747 HydrophobicContact CH2-CB 4.31Å; W715-L749 HydrophobicContact CD2-CD1 3.63Å; W715-L749 HydrophobicContact CD2-CG 4.41Å; W715-L749 HydrophobicContact CE3-CD1 3.5Å; W715-L749 HydrophobicContact CE3-CG 3.93Å; W715-L749 HydrophobicContact CG-CD1 4.31Å; W715-L749 HydrophobicContact CH2-CD1 3.91Å; W715-L749 HydrophobicContact CH2-CD2 4.47Å; W715-L749 HydrophobicContact CH2-CG 3.62Å; W715-L749 HydrophobicContact CZ2-CD1 4.01Å; W715-L749 HydrophobicContact CZ2-CG 4.11Å; W715-L749 HydrophobicContact CZ3-CB 4.17Å; W715-L749 HydrophobicContact CZ3-CD1 3.66Å; W715-L749 HydrophobicContact CZ3-CG 3.52Å; W715-A758 HydrophobicContact CH2-CB 4.17Å; W715-P798 HydrophobicContact CH2-CG 4.12Å; W715-P798 HydrophobicContact CZ2-CB 4.19Å; W715-P798 HydrophobicContact CZ2-CG 3.87Å
716	S	86	Confident	81	Confident	20 Å²	20	75 Å²	75	14%	0.14	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-87.9	132.5	171.5	-178.3	0	0	0	0	110.7	A693 L694 K714 D718	A693-S716 CarbonylContact C-O 3.52Å; A693-S716 WeakPolarHBondContact CA-O 3.46Å; A693-S716 VanDerWaalsContact CB-O 3.28Å; A693-S716 WeakPolarHBondContact CB-O 3.5Å; L694-S716 PolarHBondContact N-O 3.11Å; L694-S716 PolarHBondContact O-N 2.79Å; K714-S716 PolarHBondContact O-N 3.1Å; S716-D718 PolarHBondContact OG-N 2.82Å; S716-D718 PolarHBondContact OG-O 3.3Å
717	R	82.8	Confident	82.9	Confident	195 Å²	195	74.7 Å²	74.7	74%	0.736	38%	0.383	S	S	*	.	S	Bend	trans	-84.6	-13.2	175	-58.4	-178.3	-168.8	171	4.3	113.4
718	D	82	Confident	84.7	Confident	79 Å²	79	70.8 Å²	70.8	42%	0.422	36%	0.36	S	S	.	.			trans	-84.8	114.6	174.4	-173.9	-22.5	0	0	0	108.9	S716 D720 K721 P722	S716-D718 PolarHBondContact OG-N 2.82Å; S716-D718 PolarHBondContact OG-O 3.3Å; D718-D720 PolarHBondContact OD1-N 3.2Å; D718-D720 VanDerWaalsContact OD1-N 3.11Å; D718-K721 PolarHBondContact OD1-N 3.15Å; D718-P722 WeakPolarHBondContact O-CA 3.47Å; D718-P722 VanDerWaalsContact O-CB 3.26Å; D718-P722 WeakPolarHBondContact O-CB 3.45Å; D718-P722 WeakPolarHBondContact O-CD 3.46Å
719	V	81.6	Confident	86.1	Confident	28 Å²	28	71.3 Å²	71.3	17%	0.17	37%	0.368	C	S	.	.	S	Bend	trans	-93.1	-28.2	-177.4	-179.7	0	0	0	0	112	V688 L694	V688-V719 HydrophobicContact CG1-CG1 3.68Å; L694-V719 HydrophobicContact CD1-CB 4.41Å; L694-V719 HydrophobicContact CD1-CG1 4.2Å
720	D	76.4	Confident	86.7	Confident	133 Å²	133	69.3 Å²	69.3	71%	0.711	36%	0.356	S	S	*	.	S	Bend	trans	-77	-38.9	-179.1	-79.3	-34.3	0	0	0	112	D718	D718-D720 PolarHBondContact OD1-N 3.2Å; D718-D720 VanDerWaalsContact OD1-N 3.11Å
721	K	81.6	Confident	86.9	Confident	160 Å²	160	69.9 Å²	69.9	70%	0.696	37%	0.366	S	S	*	.	S	Bend	trans	-142.1	56.2	-176.6	-63.6	177.8	-173.5	163.4	0	112.2	D718 A723	D718-K721 PolarHBondContact OD1-N 3.15Å; K721-A723 PolarHBondContact O-N 3.23Å
722	P	85.5	Confident	86.8	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	37%	0.366	C	S	.	.			trans	-56.5	127	179.8	24.1	-35.1	0	0	0	111.6	R678 A679 L682 L694 D718 F724	R678-P722 CarbonylContact C-O 3.58Å; R678-P722 WeakPolarHBondContact CA-O 3.42Å; R678-P722 WeakPolarHBondContact CB-O 3.4Å; A679-P722 HydrophobicContact CB-CG 3.9Å; A679-P722 PolarHBondContact N-O 3.08Å; L682-P722 HydrophobicContact CD1-CG 3.69Å; L694-P722 HydrophobicContact CD1-CB 4.2Å; L694-P722 HydrophobicContact CD1-CG 3.81Å; D718-P722 WeakPolarHBondContact O-CA 3.47Å; D718-P722 VanDerWaalsContact O-CB 3.26Å; D718-P722 WeakPolarHBondContact O-CB 3.45Å; D718-P722 WeakPolarHBondContact O-CD 3.46Å; P722-F724 HydrophobicContact CB-CE1 4.37Å; P722-F724 HydrophobicContact CB-CE2 4.03Å; P722-F724 HydrophobicContact CB-CZ 3.79Å; P722-F724 HydrophobicContact CG-CE2 4.35Å; P722-F724 HydrophobicContact CG-CZ 4.29Å
723	A	85.9	Confident	86.6	Confident	55 Å²	55	68.6 Å²	68.6	46%	0.455	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	117	169.1	0	0	0	0	0	109.3	E677 R678 K721	E677-A723 CarbonylContact O-C 3.59Å; E677-A723 WeakPolarHBondContact O-CA 3.49Å; R678-A723 HydrophobicContact CB-CB 4.43Å; K721-A723 PolarHBondContact O-N 3.23Å
724	F	90.6	Very high	86.2	Confident	12 Å²	12	71.2 Å²	71.2	5%	0.053	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-38.8	-176.9	-56.2	-77.9	0	0	0	112	L659 I676 E677 A679 V696 T713 P722 Q726	L659-F724 HydrophobicContact CD1-CD2 4.47Å; L659-F724 HydrophobicContact CD1-CE2 4.08Å; I676-F724 HydrophobicContact CG2-CB 4.01Å; I676-F724 HydrophobicContact CG2-CD2 3.69Å; I676-F724 HydrophobicContact CG2-CE2 4.48Å; I676-F724 HydrophobicContact CG2-CG 4.05Å; E677-F724 PolarHBondContact O-N 2.92Å; A679-F724 HydrophobicContact CB-CE2 4.4Å; V696-F724 HydrophobicContact CG2-CD1 4.3Å; V696-F724 HydrophobicContact CG2-CD2 3.98Å; V696-F724 HydrophobicContact CG2-CE1 3.95Å; V696-F724 HydrophobicContact CG2-CE2 3.58Å; V696-F724 HydrophobicContact CG2-CG 4.32Å; V696-F724 HydrophobicContact CG2-CZ 3.56Å; T713-F724 HydrophobicContact CG2-CB 4.18Å; T713-F724 HydrophobicContact CG2-CD1 4.36Å; T713-F724 HydrophobicContact CG2-CG 4.36Å; T713-F724 WeakPolarHBondContact OG1-CD1 3.48Å; P722-F724 HydrophobicContact CB-CE1 4.37Å; P722-F724 HydrophobicContact CB-CE2 4.03Å; P722-F724 HydrophobicContact CB-CZ 3.79Å; P722-F724 HydrophobicContact CG-CE2 4.35Å; P722-F724 HydrophobicContact CG-CZ 4.29Å; F724-Q726 WeakPolarHBondContact O-CG 3.41Å; F724-Q726 PolarHBondContact O-N 2.9Å; F724-Q726 VanDerWaalsContact O-N 3.15Å; F724-Q726 PolarHBondContact O-NE2 2.91Å
725	K	89.1	Confident	85.8	Confident	170 Å²	170	68.4 Å²	68.4	74%	0.739	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	40.1	47.8	-179.8	-63.8	-173.7	176.2	-176.4	0	114.1	I676 E677	I676-K725 WeakPolarHBondContact O-CA 3.49Å; I676-K725 PolarHBondContact O-N 2.87Å; E677-K725 PolarHBondContact O-N 3.16Å; E677-K725 VanDerWaalsContact O-N 3.16Å
726	Q	91.5	Very high	85.7	Confident	43 Å²	43	69.6 Å²	69.6	20%	0.201	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	140.9	-180	-84.5	155.9	77.6	0	0	110.3	S675 I676 T713 F724 F728	S675-Q726 CarbonylContact C-O 3.43Å; S675-Q726 WeakPolarHBondContact CA-O 3.43Å; I676-Q726 PolarHBondContact N-O 2.95Å; I676-Q726 PolarHBondContact O-N 3.43Å; I676-Q726 VanDerWaalsContact O-N 3.08Å; T713-Q726 VanDerWaalsContact CA-OE1 3.3Å; F724-Q726 WeakPolarHBondContact O-CG 3.41Å; F724-Q726 PolarHBondContact O-N 2.9Å; F724-Q726 VanDerWaalsContact O-N 3.15Å; F724-Q726 PolarHBondContact O-NE2 2.91Å; Q726-F728 HydrophobicContact CB-CE2 4.05Å; Q726-F728 HydrophobicContact CB-CZ 4.02Å
727	A	90.8	Very high	85.6	Confident	67 Å²	67	68.7 Å²	68.7	55%	0.554	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	136.2	177.2	0	0	0	0	0	109.9	I673 V674	I673-A727 HydrophobicContact CG2-CB 4Å; V674-A727 CarbonylContact O-C 3.57Å; V674-A727 WeakPolarHBondContact O-CA 3.42Å
728	F	91.8	Very high	85.6	Confident	36 Å²	36	61.3 Å²	61.3	16%	0.158	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	117.3	-176.9	-55.8	-84.7	0	0	0	108.2	I673 V674 I676 F711 T713 Q726	I673-F728 WeakPolarHBondContact CA-O 3.41Å; V674-F728 PolarHBondContact N-O 2.73Å; V674-F728 PolarHBondContact O-N 2.96Å; I676-F728 HydrophobicContact CD1-CE2 4.22Å; I676-F728 HydrophobicContact CG1-CE2 4.46Å; F711-F728 HydrophobicContact CB-CD1 3.64Å; F711-F728 HydrophobicContact CB-CE1 3.97Å; F711-F728 HydrophobicContact CB-CG 4.03Å; F711-F728 HydrophobicContact CD2-CB 4.14Å; F711-F728 AromaticContact CD2-CD1 3.78Å; F711-F728 HydrophobicContact CD2-CD1 3.78Å; F711-F728 AromaticContact CD2-CD2 3.29Å; F711-F728 HydrophobicContact CD2-CD2 3.29Å; F711-F728 AromaticContact CD2-CE1 3.95Å; F711-F728 HydrophobicContact CD2-CE1 3.95Å; F711-F728 AromaticContact CD2-CE2 3.49Å; F711-F728 HydrophobicContact CD2-CE2 3.49Å; F711-F728 VanDerWaalsContact CD2-CE2 3.49Å; F711-F728 AromaticContact CD2-CG 3.44Å; F711-F728 HydrophobicContact CD2-CG 3.44Å; F711-F728 VanDerWaalsContact CD2-CG 3.44Å; F711-F728 AromaticContact CD2-CZ 3.81Å; F711-F728 HydrophobicContact CD2-CZ 3.81Å; F711-F728 HydrophobicContact CE2-CB 4.44Å; F711-F728 AromaticContact CE2-CD2 3.44Å; F711-F728 HydrophobicContact CE2-CD2 3.44Å; F711-F728 VanDerWaalsContact CE2-CD2 3.44Å; F711-F728 AromaticContact CE2-CE2 3.79Å; F711-F728 HydrophobicContact CE2-CE2 3.79Å; F711-F728 AromaticContact CE2-CG 3.95Å; F711-F728 HydrophobicContact CE2-CG 3.95Å; F711-F728 HydrophobicContact CG-CB 4.17Å; F711-F728 AromaticContact CG-CD1 3.95Å; F711-F728 HydrophobicContact CG-CD1 3.95Å; F711-F728 HydrophobicContact CG-CD2 4.13Å; F711-F728 HydrophobicContact CG-CE1 4.37Å; F711-F728 AromaticContact CG-CG 3.8Å; F711-F728 HydrophobicContact CG-CG 3.8Å; F711-F728 HydrophobicContact CZ-CD2 4.39Å; T713-F728 HydrophobicContact CG2-CE2 3.92Å; T713-F728 HydrophobicContact CG2-CZ 3.9Å; Q726-F728 HydrophobicContact CB-CE2 4.05Å; Q726-F728 HydrophobicContact CB-CZ 4.02Å
729	A	89.3	Confident	85.6	Confident	69 Å²	69	63.5 Å²	63.5	57%	0.57	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	120.1	177.1	0	0	0	0	0	109.3	K671 I673	K671-A729 HydrophobicContact CD-CB 4.43Å; I673-A729 HydrophobicContact CG1-CB 4.45Å
730	I	88.9	Confident	85.8	Confident	11 Å²	11	63.2 Å²	63.2	6%	0.056	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	118.7	-171.9	-51.9	171.4	0	0	0	108.3	K671 L672 V674 I700 V709 F711 I732	K671-I730 WeakPolarHBondContact CA-O 3.38Å; L672-I730 PolarHBondContact N-O 3.29Å; L672-I730 PolarHBondContact O-N 2.79Å; V674-I730 HydrophobicContact CG2-CD1 4.31Å; I700-I730 HydrophobicContact CD1-CD1 3.48Å; I700-I730 VanDerWaalsContact CD1-CD1 3.48Å; I700-I730 HydrophobicContact CD1-CG2 4.42Å; I700-I730 HydrophobicContact CG1-CD1 4.28Å; V709-I730 HydrophobicContact CB-CG2 4.36Å; V709-I730 HydrophobicContact CG1-CD1 4.48Å; V709-I730 HydrophobicContact CG1-CG1 4.44Å; V709-I730 HydrophobicContact CG1-CG2 3.83Å; V709-I730 HydrophobicContact CG2-CG2 4.43Å; F711-I730 HydrophobicContact CD1-CD1 3.89Å; F711-I730 HydrophobicContact CE1-CD1 3.72Å; I730-I732 HydrophobicContact CG2-CD1 3.86Å; I730-I732 HydrophobicContact CG2-CG1 3.89Å; I730-I732 PolarHBondContact O-N 2.85Å; I730-I732 VanDerWaalsContact O-N 3.13Å
731	S	86.9	Confident	86.3	Confident	96 Å²	96	59.4 Å²	59.4	67%	0.671	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	102	-177.8	-54.6	0	0	0	0	110.7
732	I	85.3	Confident	86.7	Confident	16 Å²	16	51.8 Å²	51.8	8%	0.082	31%	0.305	C	S	.	.			trans	-143.8	129	178.4	-51.6	179.4	0	0	0	107.1	Y665 N670 I700 I730 E736 V737 R740	Y665-I732 WeakPolarHBondContact CE2-O 3.24Å; Y665-I732 PolarHBondContact OH-O 3.23Å; N670-I732 CarbonylContact O-C 3.21Å; N670-I732 PolarHBondContact O-N 3.02Å; N670-I732 VanDerWaalsContact O-N 3.09Å; N670-I732 VanDerWaalsContact O-O 3.11Å; I700-I732 HydrophobicContact CD1-CD1 4.05Å; I700-I732 HydrophobicContact CG2-CD1 4.06Å; I730-I732 HydrophobicContact CG2-CD1 3.86Å; I730-I732 HydrophobicContact CG2-CG1 3.89Å; I730-I732 PolarHBondContact O-N 2.85Å; I730-I732 VanDerWaalsContact O-N 3.13Å; I732-E736 HydrophobicContact CG2-CB 3.78Å; I732-V737 HydrophobicContact CB-CG2 3.96Å; I732-V737 HydrophobicContact CG2-CG2 3.69Å; I732-R740 HydrophobicContact CD1-CG 4.36Å; I732-R740 HydrophobicContact CG2-CG 4.34Å
733	S	85.7	Confident	86.9	Confident	35 Å²	35	53.6 Å²	53.6	25%	0.245	31%	0.313	C	S	.	.			trans	-65.5	144.3	177.3	75.7	0	0	0	0	111.3	P735 E736 V737	S733-P735 VanDerWaalsContact C-CD 3.41Å; S733-P735 VanDerWaalsContact C-N 3.34Å; S733-E736 WeakPolarHBondContact O-CB 3.41Å; S733-E736 PolarHBondContact O-N 3.37Å; S733-E736 VanDerWaalsContact OG-CG 3.26Å; S733-E736 WeakPolarHBondContact OG-CG 3.47Å; S733-E736 PolarHBondContact OG-OE1 2.98Å; S733-V737 PolarHBondContact O-N 3.27Å; S733-V737 VanDerWaalsContact O-N 3.08Å
734	L	82.9	Confident	87.2	Confident	58 Å²	58	51 Å²	51	30%	0.304	29%	0.292	S	S	.	.	H	α-helix	trans	-54.4	-40.5	-175.2	-176.3	60.9	0	0	0	113.8	Y665 E736 V737 F771 A773	Y665-L734 HydrophobicContact CD1-CD1 4.15Å; Y665-L734 HydrophobicContact CD2-CD1 4.5Å; Y665-L734 HydrophobicContact CE1-CB 3.84Å; Y665-L734 HydrophobicContact CE1-CD1 4.11Å; Y665-L734 HydrophobicContact CE1-CG 4.41Å; Y665-L734 HydrophobicContact CE2-CD1 4.49Å; Y665-L734 HydrophobicContact CG-CD1 4.36Å; Y665-L734 PolarHBondContact OH-N 3.48Å; L734-E736 VanDerWaalsContact C-N 3.31Å; L734-E736 PolarHBondContact O-N 2.97Å; L734-V737 PolarHBondContact O-N 2.86Å; L734-F771 HydrophobicContact CD1-CD1 4.13Å; L734-F771 HydrophobicContact CD1-CE1 4.18Å; L734-A773 HydrophobicContact CD1-CB 3.92Å; L734-A773 HydrophobicContact CD2-CB 3.98Å
735	P	81.2	Confident	87.2	Confident	104 Å²	104	51.3 Å²	51.3	68%	0.675	29%	0.293	S	S	*	.	H	α-helix	trans	-65.9	-31.4	176.1	-20	33.5	0	0	0	113.5	S733	S733-P735 VanDerWaalsContact C-CD 3.41Å; S733-P735 VanDerWaalsContact C-N 3.34Å
736	E	83.5	Confident	87.3	Confident	75 Å²	75	43.4 Å²	43.4	35%	0.35	26%	0.259	S	S	.	.	H	α-helix	trans	-74.8	-33.7	177.3	-74.7	169.1	-120.5	0	0	112.3	I732 S733 L734 C738 N739 R740	I732-E736 HydrophobicContact CG2-CB 3.78Å; S733-E736 WeakPolarHBondContact O-CB 3.41Å; S733-E736 PolarHBondContact O-N 3.37Å; S733-E736 VanDerWaalsContact OG-CG 3.26Å; S733-E736 WeakPolarHBondContact OG-CG 3.47Å; S733-E736 PolarHBondContact OG-OE1 2.98Å; L734-E736 VanDerWaalsContact C-N 3.31Å; L734-E736 PolarHBondContact O-N 2.97Å; E736-C738 PolarHBondContact O-N 3.46Å; E736-N739 PolarHBondContact O-N 3.13Å; E736-R740 WeakPolarHBondContact O-CG 3.2Å; E736-R740 IonicContact OE2-CZ 3.8Å; E736-R740 IonicContact OE2-NH2 2.69Å; E736-R740 PolarHBondContact OE2-NH2 3.14Å
737	V	84.3	Confident	87.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-51.3	-42.4	-179.5	172.3	0	0	0	0	110.8	Y665 L672 I732 S733 L734 N739 R740 F768 F771	Y665-V737 HydrophobicContact CD2-CG2 4.39Å; Y665-V737 HydrophobicContact CE2-CG2 3.84Å; L672-V737 HydrophobicContact CD2-CG1 4.46Å; I732-V737 HydrophobicContact CB-CG2 3.96Å; I732-V737 HydrophobicContact CG2-CG2 3.69Å; S733-V737 PolarHBondContact O-N 3.27Å; S733-V737 VanDerWaalsContact O-N 3.08Å; L734-V737 PolarHBondContact O-N 2.86Å; V737-N739 PolarHBondContact O-N 3.04Å; V737-N739 VanDerWaalsContact O-N 3.08Å; V737-R740 WeakPolarHBondContact O-CB 3.07Å; V737-R740 PolarHBondContact O-N 3.43Å; V737-F768 HydrophobicContact CG1-CB 3.87Å; V737-F768 HydrophobicContact CG1-CD1 4.4Å; V737-F768 HydrophobicContact CG1-CG 4.07Å; V737-F768 WeakPolarHBondContact O-CB 3.26Å; V737-F771 HydrophobicContact CB-CD1 4.48Å; V737-F771 HydrophobicContact CG1-CB 4.02Å; V737-F771 HydrophobicContact CG1-CD1 3.6Å; V737-F771 HydrophobicContact CG1-CE1 4.34Å; V737-F771 HydrophobicContact CG1-CG 3.87Å
738	C	82.6	Confident	87.1	Confident	40 Å²	40	38.7 Å²	38.7	27%	0.27	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.7	178.4	-63.8	0	0	0	0	114.7	E736 F768 A769	E736-C738 PolarHBondContact O-N 3.46Å; C738-F768 WeakPolarHBondContact CA-O 3.42Å; C738-A769 WeakPolarHBondContact O-CA 3.38Å; C738-A769 PolarHBondContact O-N 2.86Å
739	N	83	Confident	86.8	Confident	125 Å²	125	37 Å²	37	67%	0.668	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.2	8.9	178.3	-65.3	-33.2	0	0	0	113.1	E736 V737	E736-N739 PolarHBondContact O-N 3.13Å; V737-N739 PolarHBondContact O-N 3.04Å; V737-N739 VanDerWaalsContact O-N 3.08Å
740	R	84.5	Confident	86.3	Confident	23 Å²	23	35.3 Å²	35.3	9%	0.087	20%	0.201	C	C	.	.			trans	-101.6	155.3	179.3	-53.4	-57.1	-179.3	-164.6	-4.3	112	I700 P702 I732 E736 V737 F768	I700-R740 HydrophobicContact CG2-CB 3.83Å; I700-R740 HydrophobicContact CG2-CG 4.11Å; P702-R740 WeakPolarHBondContact O-CD 3.49Å; P702-R740 PolarHBondContact O-NH1 3.29Å; I732-R740 HydrophobicContact CD1-CG 4.36Å; I732-R740 HydrophobicContact CG2-CG 4.34Å; E736-R740 WeakPolarHBondContact O-CG 3.2Å; E736-R740 IonicContact OE2-CZ 3.8Å; E736-R740 IonicContact OE2-NH2 2.69Å; E736-R740 PolarHBondContact OE2-NH2 3.14Å; V737-R740 WeakPolarHBondContact O-CB 3.07Å; V737-R740 PolarHBondContact O-N 3.43Å; R740-F768 HydrophobicContact CB-CD2 4.01Å; R740-F768 WeakPolarHBondContact O-CB 3.37Å; R740-F768 WeakPolarHBondContact O-CD2 3.49Å; R740-F768 PolarHBondContact O-N 3.16Å; R740-F768 VanDerWaalsContact O-N 3.13Å
741	I	88.4	Confident	85.4	Confident	52 Å²	52	36.4 Å²	36.4	27%	0.267	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.5	175.1	-63	176.3	0	0	0	107.4	I700 L701 Q743 Q765 V766	I700-I741 WeakPolarHBondContact CA-O 3.28Å; L701-I741 PolarHBondContact N-O 2.87Å; L701-I741 PolarHBondContact O-N 2.76Å; I741-Q743 HydrophobicContact CG2-CG 4.43Å; I741-Q765 HydrophobicContact CG2-CG 3.29Å; I741-V766 WeakPolarHBondContact CA-O 3.47Å
742	L	89.8	Confident	83.8	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	120.4	169.5	172.6	66.9	0	0	0	109.4	F663 V674 I700 F711 L744 Q765 V766 F768	F663-L742 HydrophobicContact CE1-CD2 3.67Å; F663-L742 HydrophobicContact CZ-CD2 4.1Å; V674-L742 HydrophobicContact CG1-CD2 3.79Å; V674-L742 HydrophobicContact CG2-CD2 4.41Å; I700-L742 HydrophobicContact CD1-CD1 4.5Å; I700-L742 HydrophobicContact CG1-CD1 3.86Å; F711-L742 HydrophobicContact CE1-CD1 3.81Å; F711-L742 HydrophobicContact CZ-CD1 3.74Å; L742-L744 HydrophobicContact CD1-CD2 3.81Å; L742-L744 HydrophobicContact CD1-CG 4.34Å; L742-L744 HydrophobicContact CD2-CD1 4.17Å; L742-L744 HydrophobicContact CD2-CD2 4.02Å; L742-L744 HydrophobicContact CD2-CG 4.06Å; L742-L744 HydrophobicContact CG-CD2 3.97Å; L742-L744 HydrophobicContact CG-CG 3.97Å; L742-Q765 CarbonylContact O-C 3.47Å; L742-Q765 WeakPolarHBondContact O-CA 3.38Å; L742-V766 HydrophobicContact CB-CB 4.39Å; L742-V766 PolarHBondContact N-O 3.11Å; L742-V766 PolarHBondContact O-N 2.65Å; L742-F768 HydrophobicContact CB-CE2 3.57Å; L742-F768 HydrophobicContact CB-CZ 3.78Å; L742-F768 HydrophobicContact CD2-CZ 4.2Å
743	Q	89.7	Confident	82.4	Confident	38 Å²	38	40.4 Å²	40.4	18%	0.178	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	134.5	165.7	-67.9	-176	-18.2	0	0	109.1	G698 T699 I741 Y745 Q765	G698-Q743 CarbonylContact C-O 3.56Å; G698-Q743 VanDerWaalsContact CA-O 3.24Å; G698-Q743 WeakPolarHBondContact CA-O 3.48Å; T699-Q743 PolarHBondContact N-O 2.96Å; T699-Q743 PolarHBondContact O-N 2.73Å; I741-Q743 HydrophobicContact CG2-CG 4.43Å; Q743-Y745 HydrophobicContact CB-CE2 3.86Å; Q743-Y745 PolarHBondContact OE1-OH 3.1Å; Q743-Q765 HydrophobicContact CG-CB 4.41Å; Q743-Q765 HydrophobicContact CG-CG 4.01Å
744	L	92.6	Very high	81	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.8	175.4	-61.3	174.8	0	0	0	109.3	L659 V661 I676 V696 Q697 F711 L742 G763 V764	L659-L744 HydrophobicContact CD2-CB 4.49Å; L659-L744 HydrophobicContact CD2-CD1 3.84Å; V661-L744 HydrophobicContact CG1-CD1 4.37Å; V661-L744 HydrophobicContact CG2-CD1 3.67Å; I676-L744 HydrophobicContact CD1-CD2 4.11Å; V696-L744 HydrophobicContact CG1-CB 4.18Å; V696-L744 HydrophobicContact CG1-CD2 4.43Å; Q697-L744 CarbonylContact O-C 3.58Å; Q697-L744 VanDerWaalsContact O-CA 3.31Å; Q697-L744 WeakPolarHBondContact O-CA 3.34Å; F711-L744 HydrophobicContact CE2-CD2 4.26Å; F711-L744 HydrophobicContact CZ-CD2 4.04Å; L742-L744 HydrophobicContact CD1-CD2 3.81Å; L742-L744 HydrophobicContact CD1-CG 4.34Å; L742-L744 HydrophobicContact CD2-CD1 4.17Å; L742-L744 HydrophobicContact CD2-CD2 4.02Å; L742-L744 HydrophobicContact CD2-CG 4.06Å; L742-L744 HydrophobicContact CG-CD2 3.97Å; L742-L744 HydrophobicContact CG-CG 3.97Å; L744-G763 CarbonylContact O-C 3.37Å; L744-G763 WeakPolarHBondContact O-CA 3.17Å; L744-V764 HydrophobicContact CB-CG1 3.82Å; L744-V764 HydrophobicContact CD1-CG1 4.21Å; L744-V764 HydrophobicContact CG-CG1 4.46Å; L744-V764 PolarHBondContact N-O 3.03Å; L744-V764 PolarHBondContact O-N 3.5Å
745	Y	90.4	Very high	79.8	Confident	18 Å²	18	46 Å²	46	7%	0.071	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.3	178.4	-64.7	-81.8	0	0	0	110.6	V696 Q697 Q743 G762 F789 L795	V696-Y745 CarbonylContact C-O 3.58Å; V696-Y745 WeakPolarHBondContact CA-O 3.49Å; Q697-Y745 PolarHBondContact N-O 3.46Å; Q697-Y745 PolarHBondContact O-N 3.37Å; Q743-Y745 HydrophobicContact CB-CE2 3.86Å; Q743-Y745 PolarHBondContact OE1-OH 3.1Å; Y745-G762 WeakPolarHBondContact CA-O 3.47Å; Y745-F789 AromaticContact CE1-CD1 3.98Å; Y745-F789 HydrophobicContact CE1-CD1 3.98Å; Y745-F789 HydrophobicContact CE1-CE1 4.32Å; Y745-F789 HydrophobicContact CE1-CG 4.28Å; Y745-L795 HydrophobicContact CD1-CD1 3.98Å; Y745-L795 HydrophobicContact CD2-CD1 3.85Å; Y745-L795 HydrophobicContact CE1-CD1 3.92Å; Y745-L795 HydrophobicContact CE2-CD1 3.79Å; Y745-L795 HydrophobicContact CG-CD1 3.94Å
746	L	91.3	Very high	79.2	Confident	3 Å²	3	45.3 Å²	45.3	2%	0.016	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	115.6	176.8	-156.8	84.4	0	0	0	109.1	L682 L685 V696 L761 G762 V783	L682-L746 HydrophobicContact CD1-CD2 4.22Å; L682-L746 HydrophobicContact CD2-CD2 3.74Å; L685-L746 HydrophobicContact CD1-CD2 3.74Å; V696-L746 HydrophobicContact CG2-CD1 4Å; L746-L761 HydrophobicContact CD2-CB 4.42Å; L746-L761 HydrophobicContact CD2-CD1 4.11Å; L746-L761 HydrophobicContact CG-CD1 4.5Å; L746-L761 WeakPolarHBondContact O-CB 3.47Å; L746-L761 PolarHBondContact O-N 3.48Å; L746-G762 PolarHBondContact N-O 2.97Å; L746-V783 HydrophobicContact CB-CG1 4.43Å
747	W	88.4	Confident	78.9	Confident	11 Å²	11	47.7 Å²	47.7	4%	0.042	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	144.6	179.4	-70	93	0	0	0	111.1	L694 C695 W715 A758 V759 C760 L795 P797 P798	L694-W747 CarbonylContact C-O 3.6Å; L694-W747 VanDerWaalsContact CA-O 3.31Å; L694-W747 WeakPolarHBondContact CA-O 3.42Å; C695-W747 PolarHBondContact N-O 3.05Å; C695-W747 PolarHBondContact O-N 3.14Å; W715-W747 HydrophobicContact CH2-CB 4.31Å; W747-A758 HydrophobicContact CE3-CB 3.95Å; W747-A758 HydrophobicContact CZ3-CB 4.33Å; W747-V759 WeakPolarHBondContact CA-O 3.3Å; W747-C760 HydrophobicContact CD2-CB 4.43Å; W747-C760 HydrophobicContact CE3-CB 4.17Å; W747-C760 HydrophobicContact CH2-CB 4.31Å; W747-C760 HydrophobicContact CZ3-CB 4.11Å; W747-L795 HydrophobicContact CH2-CB 4.5Å; W747-L795 HydrophobicContact CZ2-CB 4.01Å; W747-P797 HydrophobicContact CH2-CB 3.94Å; W747-P797 HydrophobicContact CZ3-CB 3.87Å; W747-P798 HydrophobicContact CB-CG 4.12Å; W747-P798 HydrophobicContact CD2-CG 4.08Å; W747-P798 HydrophobicContact CG-CG 3.81Å
748	G	88.7	Confident	78.8	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	141	175.2	0	0	0	0	0	113.4	A693 A758 V759	A693-G748 CarbonylContact O-C 3.45Å; A693-G748 WeakPolarHBondContact O-CA 3.49Å; G748-A758 WeakPolarHBondContact O-CA 3.18Å; G748-V759 PolarHBondContact N-O 2.67Å; G748-V759 PolarHBondContact O-N 2.91Å
749	L	85.8	Confident	78.9	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	108.8	174.5	-90.2	162.2	0	0	0	111.3	I691 T692 A693 W715 R756 P800 F802	I691-L749 WeakPolarHBondContact CA-O 3.45Å; T692-L749 PolarHBondContact N-O 3.11Å; T692-L749 PolarHBondContact OG1-O 3.01Å; A693-L749 HydrophobicContact CB-CB 4.37Å; A693-L749 HydrophobicContact CB-CD1 4.12Å; A693-L749 PolarHBondContact O-N 3.44Å; W715-L749 HydrophobicContact CD2-CD1 3.63Å; W715-L749 HydrophobicContact CD2-CG 4.41Å; W715-L749 HydrophobicContact CE3-CD1 3.5Å; W715-L749 HydrophobicContact CE3-CG 3.93Å; W715-L749 HydrophobicContact CG-CD1 4.31Å; W715-L749 HydrophobicContact CH2-CD1 3.91Å; W715-L749 HydrophobicContact CH2-CD2 4.47Å; W715-L749 HydrophobicContact CH2-CG 3.62Å; W715-L749 HydrophobicContact CZ2-CD1 4.01Å; W715-L749 HydrophobicContact CZ2-CG 4.11Å; W715-L749 HydrophobicContact CZ3-CB 4.17Å; W715-L749 HydrophobicContact CZ3-CD1 3.66Å; W715-L749 HydrophobicContact CZ3-CG 3.52Å; L749-R756 HydrophobicContact CD2-CB 3.66Å; L749-R756 HydrophobicContact CD2-CG 3.96Å; L749-P800 HydrophobicContact CD1-CB 4.3Å; L749-P800 HydrophobicContact CD2-CB 4.23Å; L749-F802 HydrophobicContact CD1-CE2 3.89Å; L749-F802 HydrophobicContact CD1-CZ 4.4Å
750	S	78.6	Confident	79	Confident	34 Å²	34	44.5 Å²	44.5	24%	0.238	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.5	172.9	-168.1	0	0	0	0	110.2	S690 M757	S690-S750 PolarHBondContact O-OG 3.32Å; S750-M757 PolarHBondContact N-O 3.27Å; S750-M757 PolarHBondContact O-N 3.16Å
751	G	70.7	Confident	79.1	Confident	34 Å²	34	43.5 Å²	43.5	35%	0.351	27%	0.274	S	S	.	.	S	Bend	trans	117.8	156	177.6	0	0	0	0	0	115.4
752	A	53.4	Low	79.1	Confident	85 Å²	85	41 Å²	41	70%	0.702	26%	0.261	S	S	*	.			trans	-77.3	164.2	176.5	0	0	0	0	0	111.8	S754 S755	A752-S754 PolarHBondContact O-N 3.43Å; A752-S755 CarbonylContact O-C 3.59Å; A752-S755 PolarHBondContact O-N 2.84Å
753	S	55.7	Low	79	Confident	111 Å²	111	41.1 Å²	41.1	78%	0.776	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.2	-30.7	-159.6	-50.1	0	0	0	0	118
754	S	54.7	Low	79.1	Confident	130 Å²	130	40 Å²	40	91%	0.909	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-14.7	-177.1	-47.2	0	0	0	0	115.1	A752	A752-S754 PolarHBondContact O-N 3.43Å
755	S	59.2	Low	78.9	Confident	81 Å²	81	42 Å²	42	57%	0.566	27%	0.267	S	S	*	.			trans	-142.1	77.6	177.9	-168.8	0	0	0	0	109.6	A752 M757	A752-S755 CarbonylContact O-C 3.59Å; A752-S755 PolarHBondContact O-N 2.84Å; S755-M757 PolarHBondContact O-N 2.93Å
756	R	69	Low	78.8	Confident	89 Å²	89	41.9 Å²	41.9	34%	0.336	27%	0.268	S	S	.	.			trans	-89.7	97.8	179.7	-100.9	178.9	167.8	-179.7	-3.7	109.4	L749 F802	L749-R756 HydrophobicContact CD2-CB 3.66Å; L749-R756 HydrophobicContact CD2-CG 3.96Å; R756-F802 VanDerWaalsContact NH1-CZ 3.27Å
757	M	76.8	Confident	78.6	Confident	125 Å²	125	46.8 Å²	46.8	62%	0.616	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	128.6	178.8	-70.2	-71.2	-81.7	0	0	110.2	S750 S755	S750-M757 PolarHBondContact N-O 3.27Å; S750-M757 PolarHBondContact O-N 3.16Å; S755-M757 PolarHBondContact O-N 2.93Å
758	A	81.8	Confident	78.5	Confident	25 Å²	25	46.5 Å²	46.5	21%	0.207	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	123.5	169.4	0	0	0	0	0	109.3	W715 W747 G748 P797	W715-A758 HydrophobicContact CH2-CB 4.17Å; W747-A758 HydrophobicContact CE3-CB 3.95Å; W747-A758 HydrophobicContact CZ3-CB 4.33Å; G748-A758 WeakPolarHBondContact O-CA 3.18Å; A758-P797 HydrophobicContact CB-CB 4.05Å
759	V	84.7	Confident	78.2	Confident	61 Å²	61	49 Å²	49	37%	0.37	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.7	-179.7	-178.6	0	0	0	0	109	W747 G748 L761	W747-V759 WeakPolarHBondContact CA-O 3.3Å; G748-V759 PolarHBondContact N-O 2.67Å; G748-V759 PolarHBondContact O-N 2.91Å; V759-L761 HydrophobicContact CG1-CD2 4.37Å; V759-L761 PolarHBondContact O-N 2.97Å
760	C	85.8	Confident	77.7	Confident	12 Å²	12	55.2 Å²	55.2	8%	0.081	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	120.4	172.5	-177.4	0	0	0	0	109.6	W747 S786	W747-C760 HydrophobicContact CD2-CB 4.43Å; W747-C760 HydrophobicContact CE3-CB 4.17Å; W747-C760 HydrophobicContact CH2-CB 4.31Å; W747-C760 HydrophobicContact CZ3-CB 4.11Å; C760-S786 WeakPolarHBondContact O-CB 3.33Å; C760-S786 PolarHBondContact O-OG 3.34Å
761	L	85.2	Confident	77.8	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.016	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-32.8	-177.2	-49.7	178	0	0	0	111.6	L685 V688 I691 L694 L746 V759 S786	L685-L761 HydrophobicContact CD1-CB 4.18Å; V688-L761 HydrophobicContact CG2-CD1 4.33Å; I691-L761 HydrophobicContact CD1-CD1 3.45Å; I691-L761 VanDerWaalsContact CD1-CD1 3.45Å; I691-L761 HydrophobicContact CD1-CD2 3.32Å; I691-L761 HydrophobicContact CD1-CG 3.98Å; L694-L761 HydrophobicContact CD2-CD1 3.38Å; L746-L761 HydrophobicContact CD2-CB 4.42Å; L746-L761 HydrophobicContact CD2-CD1 4.11Å; L746-L761 HydrophobicContact CG-CD1 4.5Å; L746-L761 WeakPolarHBondContact O-CB 3.47Å; L746-L761 PolarHBondContact O-N 3.48Å; V759-L761 HydrophobicContact CG1-CD2 4.37Å; V759-L761 PolarHBondContact O-N 2.97Å; L761-S786 PolarHBondContact O-N 2.85Å
762	G	88.5	Confident	78.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.6	-179.6	-176.2	0	0	0	0	0	113.1	Y745 L746 L784	Y745-G762 WeakPolarHBondContact CA-O 3.47Å; L746-G762 PolarHBondContact N-O 2.97Å; G762-L784 CarbonylContact C-O 3.5Å; G762-L784 WeakPolarHBondContact CA-O 3.37Å
763	G	88.5	Confident	79.2	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	169.9	178	0	0	0	0	0	113.3	L744 L784 F789	L744-G763 CarbonylContact O-C 3.37Å; L744-G763 WeakPolarHBondContact O-CA 3.17Å; G763-L784 PolarHBondContact N-O 3.36Å; G763-L784 PolarHBondContact O-N 3.22Å; G763-F789 VanDerWaalsContact C-CZ 3.48Å; G763-F789 WeakPolarHBondContact O-CE2 3.36Å; G763-F789 WeakPolarHBondContact O-CZ 3.36Å
764	V	90.9	Very high	80	Confident	14 Å²	14	55.8 Å²	55.8	9%	0.085	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	149.9	173.9	61.3	0	0	0	0	109.9	L744 L781 N782	L744-V764 HydrophobicContact CB-CG1 3.82Å; L744-V764 HydrophobicContact CD1-CG1 4.21Å; L744-V764 HydrophobicContact CG-CG1 4.46Å; L744-V764 PolarHBondContact N-O 3.03Å; L744-V764 PolarHBondContact O-N 3.5Å; V764-L781 HydrophobicContact CG1-CB 4.46Å; V764-L781 HydrophobicContact CG1-CD1 4.32Å; V764-L781 HydrophobicContact CG2-CB 4.09Å; V764-L781 HydrophobicContact CG2-CD1 4.47Å; V764-N782 WeakPolarHBondContact CB-O 3.46Å; V764-N782 VanDerWaalsContact CG2-O 3.32Å; V764-N782 WeakPolarHBondContact CG2-O 3.39Å
765	Q	89.4	Confident	80.5	Confident	46 Å²	46	54.5 Å²	54.5	22%	0.215	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	133.6	177.9	-174.4	171.3	-49.2	0	0	109.3	A616 I741 L742 Q743	A616-Q765 HydrophobicContact CB-CB 4.36Å; I741-Q765 HydrophobicContact CG2-CG 3.29Å; L742-Q765 CarbonylContact O-C 3.47Å; L742-Q765 WeakPolarHBondContact O-CA 3.38Å; Q743-Q765 HydrophobicContact CG-CB 4.41Å; Q743-Q765 HydrophobicContact CG-CG 4.01Å
766	V	87.8	Confident	81	Confident	15 Å²	15	56.2 Å²	56.2	9%	0.091	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	125.2	179.3	-174.5	0	0	0	0	108.4	F663 I741 L742 L781	F663-V766 HydrophobicContact CE2-CG1 4.27Å; F663-V766 HydrophobicContact CZ-CB 4.47Å; F663-V766 HydrophobicContact CZ-CG1 3.97Å; F663-V766 HydrophobicContact CZ-CG2 4.36Å; I741-V766 WeakPolarHBondContact CA-O 3.47Å; L742-V766 HydrophobicContact CB-CB 4.39Å; L742-V766 PolarHBondContact N-O 3.11Å; L742-V766 PolarHBondContact O-N 2.65Å; V766-L781 HydrophobicContact CG2-CD1 3.46Å; V766-L781 VanDerWaalsContact CG2-CD1 3.46Å; V766-L781 HydrophobicContact CG2-CD2 4.04Å; V766-L781 HydrophobicContact CG2-CG 4.42Å
767	N	87.5	Confident	81.3	Confident	106 Å²	106	55.9 Å²	55.9	57%	0.567	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	137.6	173.4	-174	10.9	0	0	0	109.7	A769	N767-A769 PolarHBondContact OD1-N 3.39Å
768	F	86.7	Confident	81.6	Confident	5 Å²	5	53.6 Å²	53.6	2%	0.022	29%	0.291	C	S	.	.			trans	-98.4	5.7	178.2	-69.4	-62.2	0	0	0	114.3	F663 L672 I700 V737 C738 R740 L742 E770 F771	F663-F768 AromaticContact CD1-CE1 3.63Å; F663-F768 HydrophobicContact CD1-CE1 3.63Å; F663-F768 HydrophobicContact CD1-CZ 4Å; F663-F768 AromaticContact CE1-CE1 3.6Å; F663-F768 HydrophobicContact CE1-CE1 3.6Å; F663-F768 AromaticContact CE1-CZ 3.71Å; F663-F768 HydrophobicContact CE1-CZ 3.71Å; F663-F768 HydrophobicContact CG-CE1 4.28Å; F663-F768 HydrophobicContact CZ-CE1 4.23Å; L672-F768 HydrophobicContact CD2-CE1 4.25Å; L672-F768 HydrophobicContact CD2-CE2 3.96Å; L672-F768 HydrophobicContact CD2-CZ 3.76Å; I700-F768 HydrophobicContact CD1-CE2 4.45Å; V737-F768 HydrophobicContact CG1-CB 3.87Å; V737-F768 HydrophobicContact CG1-CD1 4.4Å; V737-F768 HydrophobicContact CG1-CG 4.07Å; V737-F768 WeakPolarHBondContact O-CB 3.26Å; C738-F768 WeakPolarHBondContact CA-O 3.42Å; R740-F768 HydrophobicContact CB-CD2 4.01Å; R740-F768 WeakPolarHBondContact O-CB 3.37Å; R740-F768 WeakPolarHBondContact O-CD2 3.49Å; R740-F768 PolarHBondContact O-N 3.16Å; R740-F768 VanDerWaalsContact O-N 3.13Å; L742-F768 HydrophobicContact CB-CE2 3.57Å; L742-F768 HydrophobicContact CB-CZ 3.78Å; L742-F768 HydrophobicContact CD2-CZ 4.2Å; F768-E770 PolarHBondContact O-N 3.42Å; F768-F771 HydrophobicContact CB-CB 4.13Å; F768-F771 HydrophobicContact CD1-CB 4.26Å; F768-F771 HydrophobicContact CD1-CD2 4.13Å; F768-F771 HydrophobicContact CD1-CG 4.35Å; F768-F771 WeakPolarHBondContact O-CB 3.31Å; F768-F771 PolarHBondContact O-N 3.32Å
769	A	82.2	Confident	81.8	Confident	51 Å²	51	56 Å²	56	42%	0.421	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-35.8	179	0	0	0	0	0	115.2	C738 N767	C738-A769 WeakPolarHBondContact O-CA 3.38Å; C738-A769 PolarHBondContact O-N 2.86Å; N767-A769 PolarHBondContact OD1-N 3.39Å
770	E	73.9	Confident	82	Confident	131 Å²	131	56.8 Å²	56.8	61%	0.612	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	20.3	179.7	-63.9	167.3	-168.5	0	0	113.2	F768	F768-E770 PolarHBondContact O-N 3.42Å
771	F	82	Confident	82.2	Confident	21 Å²	21	57 Å²	57	9%	0.092	29%	0.294	C	S	.	.			trans	-68.9	131.9	178.4	-174.8	-99.1	0	0	0	111.1	F663 Y665 L672 L734 V737 F768	F663-F771 HydrophobicContact CB-CE2 3.86Å; Y665-F771 HydrophobicContact CD2-CE1 4.01Å; Y665-F771 HydrophobicContact CG-CE1 4.01Å; L672-F771 HydrophobicContact CD1-CE1 4.12Å; L672-F771 HydrophobicContact CD1-CE2 4.11Å; L672-F771 HydrophobicContact CD1-CZ 3.78Å; L734-F771 HydrophobicContact CD1-CD1 4.13Å; L734-F771 HydrophobicContact CD1-CE1 4.18Å; V737-F771 HydrophobicContact CB-CD1 4.48Å; V737-F771 HydrophobicContact CG1-CB 4.02Å; V737-F771 HydrophobicContact CG1-CD1 3.6Å; V737-F771 HydrophobicContact CG1-CE1 4.34Å; V737-F771 HydrophobicContact CG1-CG 3.87Å; F768-F771 HydrophobicContact CB-CB 4.13Å; F768-F771 HydrophobicContact CD1-CB 4.26Å; F768-F771 HydrophobicContact CD1-CD2 4.13Å; F768-F771 HydrophobicContact CD1-CG 4.35Å; F768-F771 WeakPolarHBondContact O-CB 3.31Å; F768-F771 PolarHBondContact O-N 3.32Å
772	S	77.3	Confident	82.4	Confident	51 Å²	51	59.8 Å²	59.8	36%	0.357	31%	0.309	S	S	.	.			trans	-128.6	121.7	176.4	175.9	0	0	0	0	110.2	Q774 M775	S772-Q774 PolarHBondContact O-N 3.34Å; S772-Q774 VanDerWaalsContact O-N 3.07Å; S772-M775 PolarHBondContact O-N 2.87Å
773	A	76.5	Confident	82.4	Confident	17 Å²	17	60.2 Å²	60.2	14%	0.14	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-15.5	178.8	0	0	0	0	0	114.1	Y665 I667 L734 M775	Y665-A773 HydrophobicContact CD1-CB 3.84Å; Y665-A773 HydrophobicContact CG-CB 4.18Å; I667-A773 HydrophobicContact CD1-CB 3.95Å; I667-A773 HydrophobicContact CG1-CB 3.92Å; L734-A773 HydrophobicContact CD1-CB 3.92Å; L734-A773 HydrophobicContact CD2-CB 3.98Å; A773-M775 VanDerWaalsContact C-N 3.3Å
774	Q	72.3	Confident	82.3	Confident	187 Å²	187	62.8 Å²	62.8	87%	0.874	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-5.9	177.2	-63.5	177.3	2.3	0	0	113.2	S772	S772-Q774 PolarHBondContact O-N 3.34Å; S772-Q774 VanDerWaalsContact O-N 3.07Å
775	M	64.3	Low	81.9	Confident	104 Å²	104	63.1 Å²	63.1	51%	0.512	33%	0.328	S	S	.	.			trans	-127	97.8	-173.3	-167.4	-179.2	-168.4	0	0	111.3	S772 A773 R777	S772-M775 PolarHBondContact O-N 2.87Å; A773-M775 VanDerWaalsContact C-N 3.3Å; M775-R777 HydrophobicContact CG-CG 3.94Å; M775-R777 PolarHBondContact O-N 3.29Å; M775-R777 HydrophobicContact SD-CG 4.11Å; M775-R777 PolarHBondContact SD-NE 3.17Å
776	I	70.5	Confident	81.5	Confident	117 Å²	117	62.5 Å²	62.5	60%	0.6	33%	0.329	S	S	*	.			trans	-61.4	117.8	167.2	-56	175.3	0	0	0	107.9
777	R	74.5	Confident	80.7	Confident	82 Å²	82	66.1 Å²	66.1	31%	0.309	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	112.6	-176.3	-74.9	-175.1	177.4	-175.2	0.4	110.4	G662 F663 M775	G662-R777 CarbonylContact C-O 3.59Å; G662-R777 VanDerWaalsContact CA-O 3.27Å; G662-R777 WeakPolarHBondContact CA-O 3.2Å; F663-R777 PolarHBondContact N-O 3.29Å; F663-R777 PolarHBondContact O-N 2.89Å; M775-R777 HydrophobicContact CG-CG 3.94Å; M775-R777 PolarHBondContact O-N 3.29Å; M775-R777 HydrophobicContact SD-CG 4.11Å; M775-R777 PolarHBondContact SD-NE 3.17Å
778	C	84.1	Confident	80.1	Confident	77 Å²	77	67.7 Å²	67.7	52%	0.52	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	120.2	165.2	-69.4	0	0	0	0	109.9	V661	V661-C778 WeakPolarHBondContact O-CA 3.42Å
779	Q	85.1	Confident	79.3	Confident	76 Å²	76	69.1 Å²	69.1	36%	0.355	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	157.4	-174.6	66.9	-171.9	28.8	0	0	113.3	M660 V661 L781	M660-Q779 WeakPolarHBondContact CA-O 3.41Å; V661-Q779 PolarHBondContact N-O 2.94Å; V661-Q779 PolarHBondContact O-N 3.37Å; Q779-L781 HydrophobicContact CG-CD2 4.32Å; Q779-L781 HydrophobicContact CG-CG 4.42Å
780	W	89.4	Confident	77.9	Confident	77 Å²	77	70.9 Å²	70.9	29%	0.292	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.8	170.7	-72.6	97.8	0	0	0	109.5	Q658 M660 R678 R680	Q658-W780 HydrophobicContact CB-CE3 3.82Å; Q658-W780 HydrophobicContact CB-CZ3 4.41Å; M660-W780 HydrophobicContact CB-CD2 3.92Å; M660-W780 HydrophobicContact CB-CE3 3.73Å; M660-W780 HydrophobicContact CB-CH2 3.99Å; M660-W780 HydrophobicContact CB-CZ2 4.14Å; M660-W780 HydrophobicContact CB-CZ3 3.76Å; M660-W780 HydrophobicContact CG-CD2 3.96Å; M660-W780 HydrophobicContact CG-CE3 4.3Å; M660-W780 HydrophobicContact CG-CG 4.36Å; M660-W780 HydrophobicContact CG-CZ2 4.23Å; M660-W780 HydrophobicContact SD-CD2 4.31Å; M660-W780 HydrophobicContact SD-CH2 4.35Å; M660-W780 HydrophobicContact SD-CZ2 3.65Å; R678-W780 HydrophobicContact CG-CH2 3.81Å; R678-W780 HydrophobicContact CG-CZ2 4.4Å; R678-W780 HydrophobicContact CG-CZ3 4.46Å; R680-W780 HydrophobicContact CB-CH2 4.19Å; R680-W780 HydrophobicContact CB-CZ3 4.16Å; R680-W780 HydrophobicContact CG-CE3 4.13Å; R680-W780 HydrophobicContact CG-CH2 3.85Å; R680-W780 HydrophobicContact CG-CZ3 3.56Å
781	L	89.7	Confident	76.9	Confident	15 Å²	15	71.5 Å²	71.5	8%	0.079	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.5	176.8	-67.4	172.3	0	0	0	109.9	Q658 L659 V661 V764 V766 Q779	Q658-L781 CarbonylContact C-O 3.55Å; Q658-L781 WeakPolarHBondContact CA-O 3.47Å; L659-L781 PolarHBondContact N-O 3.23Å; L659-L781 PolarHBondContact O-N 3.35Å; V661-L781 HydrophobicContact CB-CD1 3.98Å; V661-L781 HydrophobicContact CG2-CD1 3.77Å; V764-L781 HydrophobicContact CG1-CB 4.46Å; V764-L781 HydrophobicContact CG1-CD1 4.32Å; V764-L781 HydrophobicContact CG2-CB 4.09Å; V764-L781 HydrophobicContact CG2-CD1 4.47Å; V766-L781 HydrophobicContact CG2-CD1 3.46Å; V766-L781 VanDerWaalsContact CG2-CD1 3.46Å; V766-L781 HydrophobicContact CG2-CD2 4.04Å; V766-L781 HydrophobicContact CG2-CG 4.42Å; Q779-L781 HydrophobicContact CG-CD2 4.32Å; Q779-L781 HydrophobicContact CG-CG 4.42Å
782	N	89.1	Confident	75.6	Confident	62 Å²	62	70.8 Å²	70.8	33%	0.332	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	132.9	171.9	-71	-43.4	0	0	0	110.3	T656 Q658 V764	T656-N782 PolarHBondContact OG1-OD1 3Å; Q658-N782 VanDerWaalsContact CG-OD1 3.32Å; Q658-N782 WeakPolarHBondContact CG-OD1 3.5Å; Q658-N782 PolarHBondContact NE2-OD1 2.8Å; V764-N782 WeakPolarHBondContact CB-O 3.46Å; V764-N782 VanDerWaalsContact CG2-O 3.32Å; V764-N782 WeakPolarHBondContact CG2-O 3.39Å
783	V	89.2	Confident	74.2	Confident	9 Å²	9	76.2 Å²	76.2	6%	0.055	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-98.6	120.8	175.6	-176.7	0	0	0	0	108.5	A657 L659 L685 L746	A657-V783 HydrophobicContact CB-CB 4.14Å; A657-V783 PolarHBondContact O-N 2.93Å; L659-V783 HydrophobicContact CB-CG2 3.85Å; L685-V783 HydrophobicContact CD1-CG1 4.16Å; L685-V783 HydrophobicContact CD2-CG1 4.43Å; L746-V783 HydrophobicContact CB-CG1 4.43Å
784	L	86.7	Confident	72.8	Confident	56 Å²	56	86.4 Å²	86.4	29%	0.293	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	145.4	176.3	-63	175.8	0	0	0	110.2	G762 G763 F788 F789	G762-L784 CarbonylContact C-O 3.5Å; G762-L784 WeakPolarHBondContact CA-O 3.37Å; G763-L784 PolarHBondContact N-O 3.36Å; G763-L784 PolarHBondContact O-N 3.22Å; L784-F788 HydrophobicContact CB-CB 4.46Å; L784-F788 HydrophobicContact CB-CD2 4.18Å; L784-F789 HydrophobicContact CB-CE2 3.98Å
785	S	82.7	Confident	72.3	Confident	20 Å²	20	79.8 Å²	79.8	14%	0.14	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	147.2	175.1	167.2	0	0	0	0	112.5	P686 S787 F788	P686-S785 WeakPolarHBondContact CG-OG 3.48Å; S785-S787 WeakPolarHBondContact CB-OG 3.27Å; S785-S787 PolarHBondContact O-N 2.95Å; S785-S787 PolarHBondContact OG-N 3.17Å; S785-S787 PolarHBondContact OG-OG 2.98Å; S785-F788 WeakPolarHBondContact O-CB 3.42Å; S785-F788 WeakPolarHBondContact O-CD2 3.47Å; S785-F788 PolarHBondContact O-N 3.42Å
786	S	79.3	Confident	72.3	Confident	34 Å²	34	83 Å²	83	24%	0.238	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-57.2	-21.3	175.5	49.3	0	0	0	0	113.8	C760 L761 F788 F789	C760-S786 WeakPolarHBondContact O-CB 3.33Å; C760-S786 PolarHBondContact O-OG 3.34Å; L761-S786 PolarHBondContact O-N 2.85Å; S786-F788 PolarHBondContact O-N 3.26Å; S786-F788 VanDerWaalsContact O-N 3.15Å; S786-F789 CarbonylContact O-C 3.49Å; S786-F789 WeakPolarHBondContact O-CA 3.21Å; S786-F789 PolarHBondContact O-N 2.88Å
787	S	71.1	Confident	72.1	Confident	91 Å²	91	80.6 Å²	80.6	64%	0.636	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-57.6	-22.6	169.9	59.1	0	0	0	0	114.7	S785 F789	S785-S787 WeakPolarHBondContact CB-OG 3.27Å; S785-S787 PolarHBondContact O-N 2.95Å; S785-S787 PolarHBondContact OG-N 3.17Å; S785-S787 PolarHBondContact OG-OG 2.98Å; S787-F789 VanDerWaalsContact C-N 3.33Å
788	F	74.7	Confident	71.8	Confident	138 Å²	138	77.4 Å²	77.4	61%	0.605	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-85.7	-5.5	173.9	-65.9	-82.6	0	0	0	113.2	L784 S785 S786 P790	L784-F788 HydrophobicContact CB-CB 4.46Å; L784-F788 HydrophobicContact CB-CD2 4.18Å; S785-F788 WeakPolarHBondContact O-CB 3.42Å; S785-F788 WeakPolarHBondContact O-CD2 3.47Å; S785-F788 PolarHBondContact O-N 3.42Å; S786-F788 PolarHBondContact O-N 3.26Å; S786-F788 VanDerWaalsContact O-N 3.15Å; F788-P790 WeakPolarHBondContact O-CD 3.48Å
789	F	71.3	Confident	70.8	Confident	35 Å²	35	77.3 Å²	77.3	15%	0.154	39%	0.393	C	S	.	.			trans	-121.1	73.4	-178.7	-60.7	-86.4	0	0	0	110.2	Y745 G763 L784 S786 S787 H791 S792	Y745-F789 AromaticContact CE1-CD1 3.98Å; Y745-F789 HydrophobicContact CE1-CD1 3.98Å; Y745-F789 HydrophobicContact CE1-CE1 4.32Å; Y745-F789 HydrophobicContact CE1-CG 4.28Å; G763-F789 VanDerWaalsContact C-CZ 3.48Å; G763-F789 WeakPolarHBondContact O-CE2 3.36Å; G763-F789 WeakPolarHBondContact O-CZ 3.36Å; L784-F789 HydrophobicContact CB-CE2 3.98Å; S786-F789 CarbonylContact O-C 3.49Å; S786-F789 WeakPolarHBondContact O-CA 3.21Å; S786-F789 PolarHBondContact O-N 2.88Å; S787-F789 VanDerWaalsContact C-N 3.33Å; F789-H791 PolarHBondContact O-N 2.62Å; F789-S792 VanDerWaalsContact CB-OG 3.25Å; F789-S792 WeakPolarHBondContact CB-OG 3.39Å; F789-S792 PolarHBondContact O-N 2.75Å; F789-S792 PolarHBondContact O-OG 2.9Å
790	P	51.7	Low	69.5	Low	88 Å²	88	76.5 Å²	76.5	57%	0.571	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	11.6	-176.6	29.9	-37.8	0	0	0	115	F788	F788-P790 WeakPolarHBondContact O-CD 3.48Å
791	H	53.4	Low	67.3	Low	144 Å²	144	80.4 Å²	80.4	67%	0.667	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.7	2.8	177	-60.4	-22.2	0	0	0	112.9	F789 D793 R794	F789-H791 PolarHBondContact O-N 2.62Å; H791-D793 PolarHBondContact O-N 2.86Å; H791-R794 PolarHBondContact O-N 3.07Å; H791-R794 VanDerWaalsContact O-N 3.09Å
792	S	54.4	Low	65	Low	6 Å²	6	83.3 Å²	83.3	4%	0.042	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-57.4	-32.9	177.6	-64.9	0	0	0	0	113.3	F789 R794 L795	F789-S792 VanDerWaalsContact CB-OG 3.25Å; F789-S792 WeakPolarHBondContact CB-OG 3.39Å; F789-S792 PolarHBondContact O-N 2.75Å; F789-S792 PolarHBondContact O-OG 2.9Å; S792-R794 PolarHBondContact O-N 2.87Å; S792-R794 VanDerWaalsContact O-N 3.11Å; S792-L795 WeakPolarHBondContact O-CB 3.25Å; S792-L795 PolarHBondContact O-N 3.25Å
793	D	49.2	Very low	62.2	Low	165 Å²	165	87.2 Å²	87.2	88%	0.882	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-65.1	-13.1	179.2	-62	-21.9	0	0	0	113.8	H791	H791-D793 PolarHBondContact O-N 2.86Å
794	R	47.2	Very low	59.4	Low	231 Å²	231	91.6 Å²	91.6	87%	0.872	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-93	-9.2	173.4	-67.4	-168.6	176.5	-155.9	0.3	113.7	H791 S792	H791-R794 PolarHBondContact O-N 3.07Å; H791-R794 VanDerWaalsContact O-N 3.09Å; S792-R794 PolarHBondContact O-N 2.87Å; S792-R794 VanDerWaalsContact O-N 3.11Å
795	L	60.1	Low	56.6	Low	48 Å²	48	98 Å²	98	25%	0.251	51%	0.509	S	S	.	.	S	Bend	trans	-73.1	135.7	175	-61.8	175.4	0	0	0	109.2	Y745 W747 S792 P797	Y745-L795 HydrophobicContact CD1-CD1 3.98Å; Y745-L795 HydrophobicContact CD2-CD1 3.85Å; Y745-L795 HydrophobicContact CE1-CD1 3.92Å; Y745-L795 HydrophobicContact CE2-CD1 3.79Å; Y745-L795 HydrophobicContact CG-CD1 3.94Å; W747-L795 HydrophobicContact CH2-CB 4.5Å; W747-L795 HydrophobicContact CZ2-CB 4.01Å; S792-L795 WeakPolarHBondContact O-CB 3.25Å; S792-L795 PolarHBondContact O-N 3.25Å; L795-P797 VanDerWaalsContact O-CD 3.26Å; L795-P797 WeakPolarHBondContact O-CD 3.36Å; L795-P797 VanDerWaalsContact O-N 3.15Å
796	K	64.1	Low	54	Low	171 Å²	171	102.7 Å²	102.7	74%	0.743	53%	0.528	S	S	*	.			trans	-63.1	115.4	173.4	-176.8	-178.1	179.3	-175.4	0	108.3
797	P	68	Low	51.3	Low	67 Å²	67	107.5 Å²	107.5	44%	0.435	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-64.6	141.2	-179.3	25.3	-33.2	0	0	0	110.2	W747 A758 L795 S799	W747-P797 HydrophobicContact CH2-CB 3.94Å; W747-P797 HydrophobicContact CZ3-CB 3.87Å; A758-P797 HydrophobicContact CB-CB 4.05Å; L795-P797 VanDerWaalsContact O-CD 3.26Å; L795-P797 WeakPolarHBondContact O-CD 3.36Å; L795-P797 VanDerWaalsContact O-N 3.15Å; P797-S799 PolarHBondContact O-N 2.91Å
798	P	67.9	Low	49.1	Very low	15 Å²	15	105.4 Å²	105.4	10%	0.097	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-63.2	125.2	177.5	24	-31.9	0	0	0	110.2	V712 W715 W747	V712-P798 HydrophobicContact CG1-CB 3.96Å; V712-P798 HydrophobicContact CG2-CB 4.49Å; W715-P798 HydrophobicContact CH2-CG 4.12Å; W715-P798 HydrophobicContact CZ2-CB 4.19Å; W715-P798 HydrophobicContact CZ2-CG 3.87Å; W747-P798 HydrophobicContact CB-CG 4.12Å; W747-P798 HydrophobicContact CD2-CG 4.08Å; W747-P798 HydrophobicContact CG-CG 3.81Å
799	S	63.1	Low	46.7	Very low	75 Å²	75	105.6 Å²	105.6	52%	0.524	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-62.6	132.9	179.2	-56	0	0	0	0	110.6	P797 E801	P797-S799 PolarHBondContact O-N 2.91Å; S799-E801 PolarHBondContact O-N 2.85Å
800	P	56.6	Low	44.3	Very low	60 Å²	60	108.7 Å²	108.7	39%	0.39	57%	0.569	S	S	.	*			trans	-78.2	75.2	175.8	32	-34.5	0	0	0	110.6	L749 F802	L749-P800 HydrophobicContact CD1-CB 4.3Å; L749-P800 HydrophobicContact CD2-CB 4.23Å; P800-F802 HydrophobicContact CB-CD2 4.13Å; P800-F802 HydrophobicContact CB-CE2 4.27Å; P800-F802 PolarHBondContact O-N 3.08Å
801	E	44.2	Very low	43	Very low	159 Å²	159	111.3 Å²	111.3	74%	0.743	58%	0.583	S	S	*	*			trans	-67.8	78.1	169.9	-70.1	-176.1	-174.3	0	0	110.8	S799 N803	S799-E801 PolarHBondContact O-N 2.85Å; E801-N803 PolarHBondContact O-N 3.45Å
802	F	40.6	Very low	41.5	Very low	76 Å²	76	109.1 Å²	109.1	33%	0.333	59%	0.59	S	S	.	*			trans	-83.4	88.9	163	-79.9	-97.5	0	0	0	108.6	L749 R756 P800 S804	L749-F802 HydrophobicContact CD1-CE2 3.89Å; L749-F802 HydrophobicContact CD1-CZ 4.4Å; R756-F802 VanDerWaalsContact NH1-CZ 3.27Å; P800-F802 HydrophobicContact CB-CD2 4.13Å; P800-F802 HydrophobicContact CB-CE2 4.27Å; P800-F802 PolarHBondContact O-N 3.08Å; F802-S804 PolarHBondContact O-N 2.89Å
803	N	31	Very low	40	Very low	143 Å²	143	114.6 Å²	114.6	77%	0.765	63%	0.629	S	S	*	*			trans	-58.5	110.3	159.6	-75.5	-24.4	0	0	0	107.6	E801 E805	E801-N803 PolarHBondContact O-N 3.45Å; N803-E805 VanDerWaalsContact C-N 3.35Å; N803-E805 PolarHBondContact O-N 3.37Å
804	S	30.6	Very low	38.8	Very low	102 Å²	102	117.8 Å²	117.8	71%	0.713	63%	0.628	S	S	*	*			trans	-76.3	87.6	178.9	57.6	0	0	0	0	109.6	F802 H806	F802-S804 PolarHBondContact O-N 2.89Å; S804-H806 PolarHBondContact O-N 2.91Å; S804-H806 VanDerWaalsContact O-N 3.17Å
805	E	27.1	Very low	37.7	Very low	191 Å²	191	111.1 Å²	111.1	89%	0.893	62%	0.617	S	S	*	*			trans	-56.9	113.9	159.8	-66	174.4	149.7	0	0	107.6	N803	N803-E805 VanDerWaalsContact C-N 3.35Å; N803-E805 PolarHBondContact O-N 3.37Å
806	H	27.8	Very low	36.1	Very low	117 Å²	117	116.6 Å²	116.6	54%	0.542	65%	0.646	S	S	.	*			trans	-144.1	127.9	-177	-135.7	-70.8	0	0	0	108.6	G570 G571 S804	G570-H806 CarbonylContact C-O 3.59Å; G570-H806 VanDerWaalsContact C-O 3.23Å; G570-H806 WeakPolarHBondContact CA-O 3.48Å; G570-H806 PolarHBondContact N-O 2.97Å; G571-H806 VanDerWaalsContact N-C 3.32Å; G571-H806 PolarHBondContact N-O 3.48Å; G571-H806 PolarHBondContact O-ND1 3.37Å; S804-H806 PolarHBondContact O-N 2.91Å; S804-H806 VanDerWaalsContact O-N 3.17Å
807	D	23.6	Very low	34.3	Very low	136 Å²	136	112.6 Å²	112.6	73%	0.727	65%	0.645	S	S	*	*	B	Isolated β-bridge	trans	-94.5	164.9	-177.8	-58.9	-57	0	0	0	113.1	K569 G570 G571	K569-D807 CarbonylContact O-C 3.49Å; K569-D807 VanDerWaalsContact O-C 3.23Å; K569-D807 VanDerWaalsContact O-CA 3.24Å; K569-D807 WeakPolarHBondContact O-CA 3.43Å; G570-D807 CarbonylContact C-O 3.5Å; G570-D807 VanDerWaalsContact N-CA 3.32Å; G570-D807 CarbonylContact O-C 3.54Å; G571-D807 PolarHBondContact N-O 3.04Å; G571-D807 VanDerWaalsContact O-O 3.06Å
808	G	24.7	Very low	32.2	Very low	46 Å²	46	119 Å²	119	47%	0.474	67%	0.666	S	S	.	*			trans	123.2	97.1	-154	0	0	0	0	0	116.9	K569 G570	K569-G808 VanDerWaalsContact C-C 3.46Å; K569-G808 CarbonylContact C-O 3.57Å; K569-G808 VanDerWaalsContact C-O 3.28Å; K569-G808 CarbonylContact O-C 3.52Å; K569-G808 WeakPolarHBondContact O-CA 3.17Å; K569-G808 PolarHBondContact O-N 2.91Å; K569-G808 VanDerWaalsContact O-O 3.11Å; G570-G808 CarbonylContact C-O 3.43Å; G570-G808 WeakPolarHBondContact CA-O 3.49Å; G570-G808 PolarHBondContact N-O 2.77Å; G570-G808 CarbonylContact O-C 3.59Å; G570-G808 VanDerWaalsContact O-C 3.23Å; G570-G808 WeakPolarHBondContact O-CA 3.47Å; G570-G808 PolarHBondContact O-N 3.22Å
809	E	23.6	Very low	30.1	Very low	143 Å²	143	126.3 Å²	126.3	67%	0.668	71%	0.705	S	S	*	*			trans	-76.5	171.3	-170.4	-160.9	179.6	160	0	0	116.7	K569	K569-E809 PolarHBondContact O-N 3.4Å
810	T	21.3	Very low	28.3	Very low	100 Å²	100	129.2 Å²	129.2	61%	0.613	72%	0.719	S	S	*	*			trans	96.7	137.7	146.9	-5.1	0	0	0	0	124.6
811	T	24.1	Very low	26.6	Very low	142 Å²	142	132.2 Å²	132.2	87%	0.871	74%	0.736	S	S	*	*			trans	84.3	138.1	157.1	69.7	0	0	0	0	120.7
812	A	21.4	Very low	25.6	Very low	98 Å²	98	134.4 Å²	134.4	81%	0.81	74%	0.743	S	S	*	*			trans	-119.2	139.8	-172.6	0	0	0	0	0	112
813	S	24.7	Very low	24.5	Very low	122 Å²	122	134.2 Å²	134.2	85%	0.853	76%	0.763	S	S	*	*			trans	169.4	152.1	150.4	46.8	0	0	0	0	106.8
814	R	22.5	Very low	25.1	Very low	232 Å²	232	133.8 Å²	133.8	88%	0.875	77%	0.768	S	S	*	*			cis	173.7	154	-14.3	-180	173.7	-180	-178.1	0.3	102.6
815	S	25.1	Very low	24.6	Very low	91 Å²	91	133.5 Å²	133.5	64%	0.636	77%	0.772	S	S	*	*			trans	66.3	109.8	167.8	36.3	0	0	0	0	119.9
816	D	25.8	Very low	24.2	Very low	162 Å²	162	133.1 Å²	133.1	87%	0.866	77%	0.767	S	S	*	*				88.3	136.1	121.7	-58.3	-35.1	0	0	0	124.4
817	A	25.9	Very low	23.7	Very low	87 Å²	87	134.3 Å²	134.3	72%	0.719	78%	0.777	S	S	*	*			trans	85.2	89.4	151.3	0	0	0	0	0	121.1
818	K	25.2	Very low	23.5	Very low	201 Å²	201	137 Å²	137	87%	0.874	79%	0.785	S	S	*	*				60.9	92.1	129.3	-60.6	175.7	-177.9	177.9	0	118.8
819	N	24	Very low	23.2	Very low	169 Å²	169	140.6 Å²	140.6	90%	0.904	80%	0.801	S	S	*	*				-148.2	140.9	123.1	-141	-12	0	0	0	110.3
820	V	23.8	Very low	23.1	Very low	136 Å²	136	139.3 Å²	139.3	82%	0.824	81%	0.809	S	S	*	*			trans	-116.5	98.2	-163.3	178.2	0	0	0	0	111.3
821	V	22.2	Very low	23.6	Very low	123 Å²	123	140.3 Å²	140.3	75%	0.745	82%	0.816	S	S	*	*			trans	-147.1	111.7	170.2	168.9	0	0	0	0	109.8
822	F	22	Very low	23.4	Very low	205 Å²	205	141 Å²	141	90%	0.899	81%	0.814	S	S	*	*			trans	47.5	120.5	153.5	-68.2	-97.2	0	0	0	122.1
823	G	18.9	Very low	23.5	Very low	73 Å²	73	144.5 Å²	144.5	75%	0.753	81%	0.814	S	S	*	*			trans	-152.6	163.3	165.6	0	0	0	0	0	110.7
824	P	41.9	Very low	23.3	Very low	134 Å²	134	147.8 Å²	147.8	87%	0.87	82%	0.815	S	S	*	*			trans	-113.7	150.9	-137.8	38.7	-33.4	0	0	0	116.9
825	A	20.2	Very low	23.5	Very low	96 Å²	96	144.7 Å²	144.7	79%	0.793	82%	0.816	S	S	*	*			trans	-162	121	159.6	0	0	0	0	0	115.1
826	K	18.4	Very low	23.4	Very low	182 Å²	182	144.4 Å²	144.4	79%	0.791	82%	0.819	S	S	*	*				20.9	127.5	121.8	-168	176.5	-174.5	-179.9	0	120
827	L	18.5	Very low	23.4	Very low	143 Å²	143	146.3 Å²	146.3	75%	0.749	82%	0.82	S	S	*	*			trans	53.7	116.8	153.8	-66.1	169.8	0	0	0	119.3
828	Q	19.8	Very low	23.2	Very low	192 Å²	192	148.4 Å²	148.4	90%	0.897	82%	0.824	S	S	*	*				174.6	155.8	107.9	-98.8	177.2	-49.3	0	0	112.9
829	C	18.4	Very low	23.1	Very low	121 Å²	121	144 Å²	144	82%	0.818	82%	0.818	S	S	*	*			trans	-78.6	139.1	163.1	-62.9	0	0	0	0	110.8
830	S	20.9	Very low	23.1	Very low	117 Å²	117	142.2 Å²	142.2	82%	0.818	82%	0.817	S	S	*	*				-174.9	149.2	125.6	30.3	0	0	0	0	110.7
831	P	31.4	Very low	23.2	Very low	120 Å²	120	142.1 Å²	142.1	78%	0.779	82%	0.817	S	S	*	*			trans	-105.1	136.1	-179.1	36.4	-28.1	0	0	0	112.2
832	L	20.9	Very low	23.2	Very low	157 Å²	157	143.8 Å²	143.8	82%	0.822	82%	0.822	S	S	*	*			trans	-148	133	158.7	-82	-176.7	0	0	0	112.6
833	E	23.7	Very low	23.4	Very low	172 Å²	172	140.8 Å²	140.8	80%	0.804	82%	0.82	S	S	*	*			trans	76.2	137.9	141.9	-71	174	-173.4	0	0	122.9
834	E	20.7	Very low	23.7	Very low	190 Å²	190	148.5 Å²	148.5	89%	0.888	83%	0.826	S	S	*	*			trans	-57.3	145	172.5	-56.3	166.6	112.5	0	0	111.7
835	D	25.4	Very low	22.7	Very low	167 Å²	167	150 Å²	150	89%	0.893	82%	0.822	S	S	*	*			trans	-152	142.8	131.5	-138	-23	0	0	0	111.8
836	A	23	Very low	23	Very low	85 Å²	85	151.3 Å²	151.3	70%	0.702	83%	0.825	S	S	*	*			trans	-98.2	127.8	-170.8	0	0	0	0	0	112
837	K	25.9	Very low	23.3	Very low	202 Å²	202	147.4 Å²	147.4	88%	0.878	82%	0.816	S	S	*	*			trans	-155	88.8	159.5	-124.9	161.4	-171	166.6	0	116.2
838	V	22.1	Very low	23.5	Very low	132 Å²	132	148.2 Å²	148.2	80%	0.8	81%	0.814	S	S	*	*				18.5	116.6	129.1	-173.9	0	0	0	0	117.3
839	S	23.5	Very low	23.9	Very low	107 Å²	107	147.2 Å²	147.2	75%	0.748	82%	0.815	S	S	*	*				-175.5	98.1	111.4	43.5	0	0	0	0	112.2
840	C	23.6	Very low	24.1	Very low	132 Å²	132	149.2 Å²	149.2	89%	0.892	81%	0.81	S	S	*	*			trans	-95.8	146.2	156.7	-72	0	0	0	0	108.6
841	V	26.6	Very low	24.2	Very low	135 Å²	135	150.2 Å²	150.2	82%	0.818	81%	0.806	S	S	*	*			trans	-98.1	114.1	-174.4	177.5	0	0	0	0	109.9	V843	V841-V843 PolarHBondContact O-N 2.85Å
842	D	21.3	Very low	24.1	Very low	158 Å²	158	152.5 Å²	152.5	85%	0.845	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-66.7	127	171.1	-75.8	-49	0	0	0	111.3
843	V	27	Very low	24.1	Very low	142 Å²	142	151.4 Å²	151.4	86%	0.861	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-100.3	128.8	160.2	177.4	0	0	0	0	108.2	V841	V841-V843 PolarHBondContact O-N 2.85Å
844	R	24.6	Very low	24.2	Very low	234 Å²	234	153.5 Å²	153.5	88%	0.883	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-84.2	130.5	-151.6	-162.6	169.9	176.5	133.4	-8.2	113.3
845	E	21.2	Very low	24.6	Very low	166 Å²	166	152.4 Å²	152.4	78%	0.776	81%	0.807	S	S	*	*			trans	-20.9	129.2	158.7	-169.1	179.5	-153.8	0	0	115.7	V847	E845-V847 HydrophobicContact CG-CG2 3.87Å
846	S	27.1	Very low	24.6	Very low	123 Å²	123	152.3 Å²	152.3	86%	0.86	81%	0.806	S	S	*	*			trans	-121.6	134.6	157.5	70	0	0	0	0	110.2
847	V	23.4	Very low	25	Very low	101 Å²	101	153.6 Å²	153.6	61%	0.612	81%	0.807	S	S	*	*			trans	-105.2	132.3	-158.7	171.3	0	0	0	0	110	E845	E845-V847 HydrophobicContact CG-CG2 3.87Å
848	F	22.9	Very low	24.9	Very low	159 Å²	159	153.3 Å²	153.3	70%	0.697	80%	0.801	S	S	*	*			trans	59.1	119.1	165.2	-80.6	-131	0	0	0	118.2	K850	F848-K850 HydrophobicContact CE1-CD 4.42Å
849	N	27.7	Very low	25.3	Very low	172 Å²	172	156.2 Å²	156.2	92%	0.92	81%	0.805	S	S	*	*				-136.6	97.6	128.4	-99.6	-43.2	0	0	0	109.3
850	K	22.9	Very low	25.5	Very low	162 Å²	162	158.3 Å²	158.3	70%	0.704	80%	0.803	S	S	*	*			trans	-76.9	120.3	155.8	-83.1	177.5	171.7	176.3	0	106.5	F848	F848-K850 HydrophobicContact CE1-CD 4.42Å
851	D	23.9	Very low	25.9	Very low	139 Å²	139	156.8 Å²	156.8	74%	0.743	79%	0.794	S	S	*	*			trans	171.5	99.1	131.8	-87.4	-16.2	0	0	0	110.6
852	N	28.1	Very low	26.2	Very low	167 Å²	167	155.2 Å²	155.2	89%	0.893	79%	0.789	S	S	*	*			trans	-158.1	83.2	142	-106.2	-43.4	0	0	0	109.4	R854	N852-R854 PolarHBondContact O-N 3.23Å
853	V	22.5	Very low	26.8	Very low	135 Å²	135	154.6 Å²	154.6	82%	0.818	79%	0.786	S	S	*	*			trans	-73	105	170.5	175	0	0	0	0	108.7
854	R	25.9	Very low	27.5	Very low	216 Å²	216	154.9 Å²	154.9	82%	0.815	78%	0.778	S	S	*	*			trans	-141.6	126.3	153	-82.8	-156	166.4	-165.8	-4.1	112.4	N852	N852-R854 PolarHBondContact O-N 3.23Å
855	Q	29	Very low	28.1	Very low	167 Å²	167	148.9 Å²	148.9	78%	0.78	77%	0.771	S	S	*	*			trans	65.5	94	153.4	-65.2	173.7	-50	0	0	118
856	N	23.5	Very low	29	Very low	165 Å²	165	145.9 Å²	145.9	88%	0.882	77%	0.765	S	S	*	*				48.7	152.9	120.8	-79.1	9.7	0	0	0	122.4
857	P	31.7	Very low	29.4	Very low	111 Å²	111	144.8 Å²	144.8	72%	0.721	75%	0.748	S	S	*	*			trans	-119.7	161.8	-146.8	41.4	-29.1	0	0	0	115.4
858	R	24.9	Very low	29.7	Very low	197 Å²	197	145.8 Å²	145.8	74%	0.743	75%	0.749	S	S	*	*			trans	60.3	96.2	139.4	-166.7	-176.4	-163.2	173.2	6.6	117.9	E860	R858-E860 HydrophobicContact CG-CG 4.4Å; R858-E860 IonicContact CZ-OE2 2.69Å; R858-E860 IonicContact NE-OE2 2.97Å; R858-E860 PolarHBondContact NE-OE2 2.87Å; R858-E860 IonicContact NH2-OE2 3.76Å; R858-E860 PolarHBondContact NH2-OE2 3.08Å
859	E	31	Very low	30.5	Very low	193 Å²	193	143.3 Å²	143.3	90%	0.902	75%	0.751	S	S	*	*			trans	-121.9	105.5	139.9	-74	-169.7	147.1	0	0	109
860	E	27.7	Very low	31.1	Very low	151 Å²	151	139.1 Å²	139.1	71%	0.706	74%	0.735	S	S	*	*			trans	-91.5	95.2	168.3	-69	168.7	110.7	0	0	108.1	R858	R858-E860 HydrophobicContact CG-CG 4.4Å; R858-E860 IonicContact CZ-OE2 2.69Å; R858-E860 IonicContact NE-OE2 2.97Å; R858-E860 PolarHBondContact NE-OE2 2.87Å; R858-E860 IonicContact NH2-OE2 3.76Å; R858-E860 PolarHBondContact NH2-OE2 3.08Å
861	S	30.3	Very low	31.8	Very low	100 Å²	100	140.7 Å²	140.7	70%	0.699	74%	0.737	S	S	*	*			trans	-161.3	131.4	161.5	58.1	0	0	0	0	114.9
862	S	33.1	Very low	32.6	Very low	102 Å²	102	140.8 Å²	140.8	71%	0.713	74%	0.738	S	S	*	*			trans	74.3	61.8	156.2	59.1	0	0	0	0	120.9	E864	S862-E864 PolarHBondContact O-N 3.14Å; S862-E864 VanDerWaalsContact O-N 3.07Å
863	D	34.8	Very low	33.1	Very low	144 Å²	144	138 Å²	138	77%	0.77	73%	0.731	S	S	*	*			trans	-74.4	39.2	153.9	-80.1	-49.5	0	0	0	113.2	S865	D863-S865 VanDerWaalsContact C-N 3.34Å; D863-S865 PolarHBondContact O-N 2.97Å
864	E	42.2	Very low	33.4	Very low	149 Å²	149	137.1 Å²	137.1	70%	0.696	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-11.1	-171.4	-159.6	158.9	148.7	0	0	114.1	S862	S862-E864 PolarHBondContact O-N 3.14Å; S862-E864 VanDerWaalsContact O-N 3.07Å
865	S	36.2	Very low	33.5	Very low	107 Å²	107	135.1 Å²	135.1	75%	0.748	73%	0.73	S	S	*	*	H	α-helix	trans	-76.4	-22.5	174.3	-64.3	0	0	0	0	113.7	D863	D863-S865 VanDerWaalsContact C-N 3.34Å; D863-S865 PolarHBondContact O-N 2.97Å
866	T	39.3	Very low	33.6	Very low	103 Å²	103	133.2 Å²	133.2	63%	0.632	73%	0.731	S	S	*	*	H	α-helix	trans	-79.4	-21.4	-175.5	-52.1	0	0	0	0	112.7
867	I	37.2	Very low	33.7	Very low	100 Å²	100	130.8 Å²	130.8	51%	0.513	73%	0.726	S	S	.	*	H	α-helix	trans	-89.1	-20.8	-176.7	-61	-178.6	0	0	0	112.7	S870	I867-S870 PolarHBondContact O-OG 2.98Å
868	I	29.6	Very low	33.6	Very low	122 Å²	122	133.4 Å²	133.4	63%	0.626	73%	0.733	S	S	*	*	H	α-helix	trans	-77.1	-37.3	178.9	-58.3	179.2	0	0	0	110.9	S870 R871	I868-S870 PolarHBondContact O-N 2.8Å; I868-R871 PolarHBondContact O-N 3.18Å
869	S	39.7	Very low	33.7	Very low	107 Å²	107	136.4 Å²	136.4	75%	0.748	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-14.4	-177.4	-150.4	0	0	0	0	114.4
870	S	40.2	Very low	33.5	Very low	84 Å²	84	129.9 Å²	129.9	59%	0.587	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-6.8	-179.1	58.9	0	0	0	0	114.6	I867 I868	I867-S870 PolarHBondContact O-OG 2.98Å; I868-S870 PolarHBondContact O-N 2.8Å
871	R	36.8	Very low	33.5	Very low	195 Å²	195	134.9 Å²	134.9	74%	0.736	74%	0.741	S	S	*	*	S	Bend	trans	-95.2	-13	-176.6	-97.9	-173.1	169.1	99.1	-1.3	116.2	I868	I868-R871 PolarHBondContact O-N 3.18Å
872	N	39.9	Very low	33.5	Very low	142 Å²	142	134.5 Å²	134.5	76%	0.759	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	6.1	-174.5	-72.2	28.6	0	0	0	114.5
873	S	38.6	Very low	33.2	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	33.8	179.6	-59.2	0	0	0	0	114.2
874	T	30.6	Very low	32.7	Very low	117 Å²	117	135.5 Å²	135.5	72%	0.718	76%	0.759	S	S	*	*			trans	-152.1	70.3	164.1	-33.3	0	0	0	0	113.1	T876	T874-T876 PolarHBondContact O-N 3.16Å
875	L	27.3	Very low	32.1	Very low	174 Å²	174	133.3 Å²	133.3	91%	0.911	77%	0.767	S	S	*	*			trans	-88.3	80.4	165.9	-81	177.6	0	0	0	111.1
876	T	30.9	Very low	31.5	Very low	128 Å²	128	136.4 Å²	136.4	79%	0.785	77%	0.774	S	S	*	*	S	Bend	trans	-154.5	130.7	150.4	-1.6	0	0	0	0	111.2	T874	T874-T876 PolarHBondContact O-N 3.16Å
877	S	24.8	Very low	31.1	Very low	113 Å²	113	137.4 Å²	137.4	79%	0.79	78%	0.78	S	S	*	*			trans	59.6	92.5	169.5	-176.5	0	0	0	0	118.4
878	L	29.8	Very low	30.6	Very low	166 Å²	166	140.3 Å²	140.3	87%	0.869	80%	0.796	S	S	*	*			trans	-159.4	69.3	132.5	-108.5	171.2	0	0	0	111.3
879	R	27.3	Very low	30.5	Very low	261 Å²	261	138 Å²	138	99%	0.985	80%	0.802	S	S	*	*			trans	-107.4	75	167.6	-163.4	-175.9	-167	-151.6	5.2	109.8
880	G	27.8	Very low	29.7	Very low	55 Å²	55	141.7 Å²	141.7	57%	0.567	81%	0.808	S	S	*	*			trans	-174	105.2	177.8	0	0	0	0	0	114.6
881	R	26.7	Very low	29	Very low	256 Å²	256	145.1 Å²	145.1	97%	0.966	82%	0.82	S	S	*	*			trans	59.8	135.4	176	-72.4	176.1	164	167.3	-6.1	115.1
882	A	31.3	Very low	28.2	Very low	92 Å²	92	147.3 Å²	147.3	76%	0.76	83%	0.828	S	S	*	*			cis	-152.3	136.3	24.8	0	0	0	0	0	111.4
883	L	25.6	Very low	27.5	Very low	188 Å²	188	144.4 Å²	144.4	98%	0.984	82%	0.824	S	S	*	*			trans	-80.9	133.8	157.3	-76.5	163.5	0	0	0	108.2
884	G	24.8	Very low	26.8	Very low	79 Å²	79	146.8 Å²	146.8	81%	0.814	83%	0.828	S	S	*	*			trans	115.1	88.3	166.1	0	0	0	0	0	115.7
885	A	29	Very low	26.5	Very low	103 Å²	103	148.8 Å²	148.8	85%	0.851	83%	0.829	S	S	*	*			trans	-174.8	70.9	149.9	0	0	0	0	0	110.5
886	L	23.9	Very low	26.3	Very low	173 Å²	173	147.6 Å²	147.6	91%	0.906	82%	0.819	S	S	*	*			trans	-143.2	103.1	165.6	-115.4	172	0	0	0	107
887	V	31.1	Very low	25.9	Very low	124 Å²	124	150.4 Å²	150.4	75%	0.752	82%	0.821	S	S	*	*			trans	163.1	122.5	161.2	149.3	0	0	0	0	107.1
888	D	27.1	Very low	25.9	Very low	160 Å²	160	148.5 Å²	148.5	86%	0.856	81%	0.811	S	S	*	*			trans	47.6	146.5	159	-52.7	-21.1	0	0	0	120.7
889	G	26.6	Very low	25.6	Very low	73 Å²	73	147 Å²	147	75%	0.753	81%	0.805	S	S	*	*			cis	-171.4	177.6	2.7	0	0	0	0	0	111.2
890	Q	22.8	Very low	25.5	Very low	186 Å²	186	142.8 Å²	142.8	87%	0.869	80%	0.795	S	S	*	*			trans	-75	166.5	-175.7	-64.9	167.4	-35	0	0	113.6
891	N	25.4	Very low	25.5	Very low	156 Å²	156	149 Å²	149	83%	0.834	81%	0.81	S	S	*	*			trans	111.6	109.3	175.2	-58.9	-34.3	0	0	0	111.4
892	R	20.3	Very low	25.2	Very low	240 Å²	240	140.6 Å²	140.6	91%	0.906	80%	0.795	S	S	*	*			cis	76.9	128.8	43.5	-162	-178.1	-173.9	178.3	3.5	113.6
893	A	26.1	Very low	25.2	Very low	82 Å²	82	142.4 Å²	142.4	68%	0.678	80%	0.799	S	S	*	*			trans	82.4	104.1	170.5	0	0	0	0	0	117.6
894	D	22.6	Very low	25	Very low	157 Å²	157	141.6 Å²	141.6	84%	0.84	79%	0.79	S	S	*	*				29.9	156.5	119.6	-60.4	-68.1	0	0	0	123.6
895	E	26.2	Very low	25.3	Very low	159 Å²	159	145.1 Å²	145.1	74%	0.743	80%	0.795	S	S	*	*			trans	94.2	103.5	159.3	-57.1	-137.4	107.1	0	0	120.4
896	Q	22	Very low	25	Very low	149 Å²	149	145.6 Å²	145.6	70%	0.696	79%	0.793	S	S	*	*				45.6	137.5	122	-55.6	-171.1	27.6	0	0	122.4
897	K	22.8	Very low	25.3	Very low	187 Å²	187	142.3 Å²	142.3	81%	0.813	79%	0.79	S	S	*	*			trans	87	125.6	136.8	-104.5	176.5	176.7	169	0	121.1
898	A	24.3	Very low	24.8	Very low	72 Å²	72	144.7 Å²	144.7	60%	0.595	79%	0.793	S	S	*	*				82.4	111.8	127.9	0	0	0	0	0	121.7
899	N	23.7	Very low	24.9	Very low	136 Å²	136	144 Å²	144	73%	0.727	79%	0.794	S	S	*	*				78.9	136.2	122	-61.5	-2.4	0	0	0	122.6
900	H	25.3	Very low	24.6	Very low	171 Å²	171	146.2 Å²	146.2	79%	0.792	79%	0.793	S	S	*	*			trans	63.8	153.5	164.5	-55.6	-62.9	0	0	0	115.5
901	E	27	Very low	24.7	Very low	187 Å²	187	142.6 Å²	142.6	87%	0.874	79%	0.789	S	S	*	*			cis	-148.2	168	16.2	-155.5	169.1	142.3	0	0	111.2
902	A	21.2	Very low	25	Very low	79 Å²	79	140.7 Å²	140.7	65%	0.653	79%	0.787	S	S	*	*			trans	-81	168.9	177.2	0	0	0	0	0	112.5
903	P	32.3	Very low	25.1	Very low	129 Å²	129	135.4 Å²	135.4	84%	0.838	79%	0.787	S	S	*	*				-138	145.6	106.5	36.1	-25.2	0	0	0	114.8
904	E	19.7	Very low	25.3	Very low	172 Å²	172	142.6 Å²	142.6	80%	0.804	80%	0.797	S	S	*	*			trans	-82.1	148	170.8	-59	175.7	122.3	0	0	111.7
905	V	31.8	Very low	25.3	Very low	153 Å²	153	139.5 Å²	139.5	93%	0.927	79%	0.793	S	S	*	*			trans	-150.3	127.2	140.3	-104.3	0	0	0	0	109.4
906	S	22.4	Very low	25.6	Very low	113 Å²	113	139.6 Å²	139.6	79%	0.79	80%	0.798	S	S	*	*			trans	-88.9	144.8	-169.9	-40.1	0	0	0	0	113.2
907	A	30.1	Very low	26	Very low	103 Å²	103	137.3 Å²	137.3	85%	0.851	80%	0.804	S	S	*	*			trans	-155.8	100.2	151.5	0	0	0	0	0	110.1
908	E	20.6	Very low	26.1	Very low	175 Å²	175	133.3 Å²	133.3	82%	0.818	81%	0.806	S	S	*	*			trans	-74.7	140.1	170.7	-59	172.7	103.9	0	0	110.9
909	V	29.1	Very low	26.5	Very low	145 Å²	145	138.7 Å²	138.7	88%	0.879	82%	0.819	S	S	*	*				-145.2	108	121.7	178.4	0	0	0	0	108.2
910	T	20.7	Very low	26.7	Very low	120 Å²	120	137.8 Å²	137.8	74%	0.736	82%	0.821	S	S	*	*			trans	-92.5	131.2	171.1	-58	0	0	0	0	109.7
911	S	26	Very low	26.9	Very low	110 Å²	110	139.1 Å²	139.1	77%	0.769	82%	0.824	S	S	*	*			trans	-164.7	121.3	150.7	-88.3	0	0	0	0	114.7
912	S	31.8	Very low	27	Very low	115 Å²	115	138.7 Å²	138.7	80%	0.804	83%	0.827	S	S	*	*			trans	71.6	82.1	148	-59.7	0	0	0	0	120.4
913	S	22.4	Very low	27	Very low	129 Å²	129	145.3 Å²	145.3	90%	0.902	84%	0.835	S	S	*	*			trans	-51.3	135.3	142.1	-53.6	0	0	0	0	112.6
914	R	28.6	Very low	26.6	Very low	234 Å²	234	147.3 Å²	147.3	88%	0.883	84%	0.838	S	S	*	*			trans	-152.2	117.2	138.3	-167.2	162.7	-177.5	153.4	-0.6	111.6
915	A	24	Very low	26.6	Very low	92 Å²	92	143.5 Å²	143.5	76%	0.76	83%	0.826	S	S	*	*			trans	-81.6	141.2	173.9	0	0	0	0	0	111.6
916	L	31.6	Very low	26.1	Very low	161 Å²	161	143.7 Å²	143.7	84%	0.843	82%	0.82	S	S	*	*			trans	-150.6	129.4	152.4	-90	-175	0	0	0	111
917	A	30.6	Very low	26.2	Very low	101 Å²	101	143.3 Å²	143.3	84%	0.835	82%	0.817	S	S	*	*			trans	42.6	127.9	152.2	0	0	0	0	0	121.1
918	A	25.7	Very low	25.9	Very low	103 Å²	103	144 Å²	144	85%	0.851	82%	0.815	S	S	*	*			trans	-88.5	148.5	176.6	0	0	0	0	0	113.7
919	E	31.3	Very low	26	Very low	184 Å²	184	142.1 Å²	142.1	86%	0.86	81%	0.811	S	S	*	*			trans	-147.8	134.9	135	-112.3	-164.2	-173	0	0	109.1
920	P	29.2	Very low	26	Very low	118 Å²	118	145.4 Å²	145.4	77%	0.766	81%	0.814	S	S	*	*			trans	-88.8	118	-169.7	32.8	-33.1	0	0	0	113
921	K	29.1	Very low	26.3	Very low	199 Å²	199	147.6 Å²	147.6	87%	0.865	82%	0.821	S	S	*	*			trans	-120.4	87.1	160.1	-83.3	176.7	178.2	162.4	0	109.9	R923	K921-R923 VanDerWaalsContact C-N 3.31Å; K921-R923 PolarHBondContact O-N 3.27Å
922	L	29.1	Very low	26.2	Very low	177 Å²	177	146 Å²	146	93%	0.927	82%	0.821	S	S	*	*			trans	-72.3	89	170.2	-70.4	178.4	0	0	0	109.9	L924	L922-L924 PolarHBondContact O-N 2.92Å
923	R	22.2	Very low	26.1	Very low	218 Å²	218	146.3 Å²	146.3	82%	0.823	82%	0.824	S	S	*	*			trans	-84.5	99.6	167.7	177.5	-176.1	178.8	151.8	1.4	108.2	K921	K921-R923 VanDerWaalsContact C-N 3.31Å; K921-R923 PolarHBondContact O-N 3.27Å
924	L	23.5	Very low	26.2	Very low	171 Å²	171	144.9 Å²	144.9	90%	0.895	82%	0.82	S	S	*	*			trans	-75.9	137.5	165.7	-139.6	75.1	0	0	0	109	L922	L922-L924 PolarHBondContact O-N 2.92Å
925	T	19.2	Very low	26.2	Very low	92 Å²	92	141.7 Å²	141.7	56%	0.564	82%	0.819	S	S	*	*			trans	-145.4	163.8	178.9	-61.5	0	0	0	0	106.7
926	I	21.2	Very low	26.2	Very low	157 Å²	157	141.8 Å²	141.8	81%	0.805	82%	0.819	S	S	*	*			trans	78.4	132.9	-176.2	-38.5	159.4	0	0	0	110
927	C	24.1	Very low	26.2	Very low	106 Å²	106	143.3 Å²	143.3	72%	0.716	82%	0.822	S	S	*	*			cis	-114.7	152.3	15.9	-43.5	0	0	0	0	113.2
928	S	23.3	Very low	26.1	Very low	116 Å²	116	143.7 Å²	143.7	81%	0.811	82%	0.819	S	S	*	*			trans	-138.3	82	168.8	57	0	0	0	0	108.2
929	D	23.5	Very low	26.8	Very low	136 Å²	136	144.3 Å²	144.3	73%	0.727	81%	0.814	S	S	*	*			trans	-117.7	103.4	178.5	-58.1	-45.5	0	0	0	108.8
930	F	30.2	Very low	26.9	Very low	215 Å²	215	142.4 Å²	142.4	94%	0.943	82%	0.815	S	S	*	*			trans	-159.9	111.9	148.9	-115	-72.4	0	0	0	108.9
931	D	25.8	Very low	26.7	Very low	165 Å²	165	140.1 Å²	140.1	88%	0.882	81%	0.813	S	S	*	*			trans	-74.8	153.2	-177.6	-88.4	-52.4	0	0	0	113.3
932	G	23.5	Very low	26.6	Very low	76 Å²	76	135.2 Å²	135.2	78%	0.784	81%	0.81	S	S	*	*			trans	77.9	87.2	133.6	0	0	0	0	0	118.8
933	S	29.4	Very low	26.5	Very low	123 Å²	123	130.9 Å²	130.9	86%	0.86	80%	0.799	S	S	*	*				-153.8	117.4	123.4	-153	0	0	0	0	111.3
934	A	24.6	Very low	26.6	Very low	98 Å²	98	126.7 Å²	126.7	81%	0.81	80%	0.798	S	S	*	*			trans	-99.9	128.2	179.2	0	0	0	0	0	110.1
935	I	29.3	Very low	26.5	Very low	168 Å²	168	123.8 Å²	123.8	86%	0.862	79%	0.792	S	S	*	*			trans	-129.3	116.6	158.8	-55.8	-179.5	0	0	0	106.7
936	A	24.7	Very low	26.6	Very low	93 Å²	93	122.6 Å²	122.6	77%	0.769	80%	0.798	S	S	*	*			trans	-127.7	116.3	-178.1	0	0	0	0	0	109.8
937	E	31.4	Very low	26.8	Very low	193 Å²	193	125.4 Å²	125.4	90%	0.902	81%	0.805	S	S	*	*			trans	-152.4	154.8	158.9	-71.6	-161.5	163.1	0	0	107.1
938	S	27.4	Very low	26.6	Very low	110 Å²	110	125.3 Å²	125.3	77%	0.769	81%	0.805	S	S	*	*			cis	-171.9	152.4	-27.5	-170.3	0	0	0	0	105.7
939	P	40.2	Very low	26.5	Very low	115 Å²	115	127.9 Å²	127.9	75%	0.747	80%	0.804	S	S	*	*			trans	-109.3	163.1	-150.9	39.9	-35	0	0	0	117.1
940	T	34	Very low	26.5	Very low	144 Å²	144	127.7 Å²	127.7	88%	0.883	80%	0.803	S	S	*	*			trans	-128.2	116.9	154.2	-35.7	0	0	0	0	105.1
941	G	25.4	Very low	26.1	Very low	70 Å²	70	121.8 Å²	121.8	72%	0.722	79%	0.788	S	S	*	*				83.3	114.6	57.3	0	0	0	0	0	108.8
942	A	26.4	Very low	25.8	Very low	97 Å²	97	125 Å²	125	80%	0.802	79%	0.788	S	S	*	*			cis	-157.3	171.7	4.7	0	0	0	0	0	112.2
943	A	26.3	Very low	25.8	Very low	86 Å²	86	127 Å²	127	71%	0.711	79%	0.789	S	S	*	*			trans	16.1	147.2	140	0	0	0	0	0	121
944	T	24.4	Very low	25.5	Very low	130 Å²	130	126 Å²	126	80%	0.798	78%	0.783	S	S	*	*			cis	-166.2	157.8	-3	15.2	0	0	0	0	109.7
945	S	22.4	Very low	25.4	Very low	110 Å²	110	126.9 Å²	126.9	77%	0.769	78%	0.783	S	S	*	*			trans	-13.8	131.2	161.4	55.1	0	0	0	0	120.7
946	G	20.7	Very low	25.2	Very low	67 Å²	67	124.8 Å²	124.8	69%	0.691	78%	0.778	S	S	*	*				92.5	116.6	127.7	0	0	0	0	0	118.5
947	F	25.1	Very low	25.1	Very low	216 Å²	216	127.5 Å²	127.5	95%	0.947	78%	0.779	S	S	*	*				-159.1	149.9	103.6	-110.6	-78.3	0	0	0	110.4
948	S	21.5	Very low	24.9	Very low	103 Å²	103	124.4 Å²	124.4	72%	0.72	78%	0.778	S	S	*	*			trans	-86	173.3	-179.6	-57.7	0	0	0	0	112.4
949	E	20.6	Very low	24.7	Very low	170 Å²	170	124.7 Å²	124.7	79%	0.794	78%	0.776	S	S	*	*			trans	95.3	133.4	137.6	-94.1	-169.6	137.4	0	0	122.2
950	L	23.7	Very low	24.1	Very low	133 Å²	133	129.3 Å²	129.3	70%	0.696	78%	0.784	S	S	*	*			trans	80.1	96.5	144.3	-63	165.6	0	0	0	121.1
951	S	20.4	Very low	23.5	Very low	91 Å²	91	128.1 Å²	128.1	64%	0.636	78%	0.777	S	S	*	*				81.5	125.8	106.8	-66.6	0	0	0	0	122.8
952	R	19.7	Very low	23.4	Very low	233 Å²	233	132 Å²	132	88%	0.879	78%	0.776	S	S	*	*			trans	58.5	108.9	134.2	-69.2	179.1	165.2	178.1	-3.7	119.7
953	S	24.1	Very low	23.5	Very low	116 Å²	116	135.3 Å²	135.3	81%	0.811	77%	0.772	S	S	*	*				-173.9	126.8	107.3	24.2	0	0	0	0	107.7
954	S	22.6	Very low	23.2	Very low	104 Å²	104	139.9 Å²	139.9	73%	0.727	78%	0.779	S	S	*	*				78.1	109.1	58.1	-75.1	0	0	0	0	114.8
955	S	22.3	Very low	23.3	Very low	115 Å²	115	140.3 Å²	140.3	80%	0.804	78%	0.782	S	S	*	*			trans	66.7	153	157.5	71.1	0	0	0	0	116.7
956	T	26.2	Very low	23.4	Very low	125 Å²	125	139 Å²	139	77%	0.767	78%	0.778	S	S	*	*			cis	-141	169.4	28.4	42.4	0	0	0	0	114.6
957	L	22.4	Very low	23.4	Very low	150 Å²	150	142.7 Å²	142.7	79%	0.785	79%	0.786	S	S	*	*			trans	-64	159.3	176.7	-54.3	82.2	0	0	0	113.1
958	S	27.4	Very low	23.5	Very low	127 Å²	127	136 Å²	136	89%	0.888	78%	0.778	S	S	*	*				-153.3	120.7	127.4	-141	0	0	0	0	112.8
959	T	22.3	Very low	23.4	Very low	117 Å²	117	142.2 Å²	142.2	72%	0.718	79%	0.786	S	S	*	*			trans	-82.6	147.3	174.5	47.9	0	0	0	0	111.4
960	K	28.8	Very low	23.7	Very low	211 Å²	211	141.9 Å²	141.9	92%	0.917	79%	0.789	S	S	*	*			trans	-137.3	120.7	157	-152.5	171.2	-173.6	179	0	112
961	V	20.9	Very low	23.8	Very low	120 Å²	120	141.2 Å²	141.2	73%	0.727	79%	0.79	S	S	*	*			trans	-90.9	144.5	176.5	168.4	0	0	0	0	108.6
962	E	24	Very low	24.1	Very low	150 Å²	150	142.3 Å²	142.3	70%	0.701	80%	0.795	S	S	*	*				-180	149.9	126.6	-104.3	-168.5	170.1	0	0	115.9
963	K	27	Very low	24.3	Very low	168 Å²	168	137.1 Å²	137.1	73%	0.73	79%	0.791	S	S	*	*			trans	81.9	95.4	150.4	-77.4	165.6	177.8	131.3	0	121.1
964	E	20.1	Very low	24.2	Very low	182 Å²	182	136.8 Å²	136.8	85%	0.85	80%	0.795	S	S	*	*			trans	-46.9	148.7	135.4	-53	163.8	101.4	0	0	112.4
965	T	26.2	Very low	24.4	Very low	139 Å²	139	135.9 Å²	135.9	85%	0.853	79%	0.794	S	S	*	*				-163.4	135.4	114.8	-9	0	0	0	0	114.2
966	A	24.4	Very low	24.6	Very low	83 Å²	83	135.7 Å²	135.7	69%	0.686	79%	0.793	S	S	*	*			trans	31.3	119.8	145.5	0	0	0	0	0	123.7
967	V	22.6	Very low	24.6	Very low	144 Å²	144	135 Å²	135	87%	0.873	80%	0.799	S	S	*	*				44.8	101.9	122.8	-169.7	0	0	0	0	118.8
968	G	25.8	Very low	24.9	Very low	75 Å²	75	132.7 Å²	132.7	77%	0.773	80%	0.802	S	S	*	*			trans	-133.7	87.2	161.6	0	0	0	0	0	112	L970	G968-L970 PolarHBondContact O-N 3.09Å
969	R	20.1	Very low	25	Very low	233 Å²	233	131.3 Å²	131.3	88%	0.879	80%	0.799	S	S	*	*			trans	-72.2	105.6	172.2	174.4	-167.9	-96.2	-150	-3.6	109.1
970	L	25.8	Very low	25.4	Very low	164 Å²	164	129.2 Å²	129.2	86%	0.859	80%	0.801	S	S	*	*			trans	-120	114.8	165.5	-78.8	170.8	0	0	0	110.7	G968	G968-L970 PolarHBondContact O-N 3.09Å
971	V	26.1	Very low	25.4	Very low	119 Å²	119	131.1 Å²	131.1	72%	0.721	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-66.7	128.2	167.2	173.9	0	0	0	0	107.6
972	P	26.8	Very low	25.9	Very low	114 Å²	114	128.5 Å²	128.5	74%	0.74	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-69.5	127.4	179.4	27.5	-33.2	0	0	0	110.2
973	P	24.8	Very low	26.3	Very low	123 Å²	123	126.8 Å²	126.8	80%	0.799	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71.9	138.7	176.4	29.5	-33.6	0	0	0	110.6	A975	P973-A975 PolarHBondContact O-N 3.33Å
974	A	21.5	Very low	26.5	Very low	109 Å²	109	126.1 Å²	126.1	90%	0.901	80%	0.802	S	S	*	*			trans	-77.8	111.7	173.5	0	0	0	0	0	110.7
975	A	26.9	Very low	26.9	Very low	86 Å²	86	125.9 Å²	125.9	71%	0.711	80%	0.8	S	S	*	*			trans	-149.5	116.7	163.7	0	0	0	0	0	112.3	P973	P973-A975 PolarHBondContact O-N 3.33Å
976	S	26.7	Very low	26.9	Very low	111 Å²	111	129.2 Å²	129.2	78%	0.776	80%	0.797	S	S	*	*			trans	43.5	100.3	150.5	57.4	0	0	0	0	120.5
977	A	26.6	Very low	27.1	Very low	109 Å²	109	129.7 Å²	129.7	90%	0.901	80%	0.796	S	S	*	*				48.6	75	117.6	0	0	0	0	0	119.2
978	A	28.6	Very low	27.6	Very low	102 Å²	102	128.8 Å²	128.8	84%	0.843	79%	0.79	S	S	*	*			trans	-102.9	120.3	149.6	0	0	0	0	0	109.2	G980	A978-G980 PolarHBondContact O-N 3.12Å; A978-G980 VanDerWaalsContact O-N 3.13Å
979	A	29.8	Very low	27.7	Very low	99 Å²	99	134.5 Å²	134.5	82%	0.818	79%	0.789	S	S	*	*			trans	-66.5	111.6	-167.9	0	0	0	0	0	113.2	R981	A979-R981 PolarHBondContact O-N 2.89Å
980	G	29.4	Very low	28.2	Very low	73 Å²	73	130.5 Å²	130.5	75%	0.753	78%	0.784	S	S	*	*			trans	-57.1	122.1	168.7	0	0	0	0	0	110.8	A978 G982	A978-G980 PolarHBondContact O-N 3.12Å; A978-G980 VanDerWaalsContact O-N 3.13Å; G980-G982 PolarHBondContact O-N 3.49Å
981	R	29.2	Very low	28.4	Very low	251 Å²	251	129.5 Å²	129.5	95%	0.947	78%	0.78	S	S	*	*			trans	-67.7	100.8	-174.2	-65.1	-179	179.5	-143.6	0.4	110.5	A979 C983	A979-R981 PolarHBondContact O-N 2.89Å; R981-C983 PolarHBondContact O-N 3.34Å
982	G	32.3	Very low	28.7	Very low	64 Å²	64	135 Å²	135	66%	0.66	79%	0.787	S	S	*	*			trans	-61.8	120.8	171.2	0	0	0	0	0	110.9	G980 Q984	G980-G982 PolarHBondContact O-N 3.49Å; G982-Q984 PolarHBondContact O-N 2.91Å; G982-Q984 VanDerWaalsContact O-N 3.12Å
983	C	31.6	Very low	28.9	Very low	114 Å²	114	134.4 Å²	134.4	77%	0.77	79%	0.786	S	S	*	*			trans	-52.1	115.7	176	-179.7	0	0	0	0	110.5	R981 Q985	R981-C983 PolarHBondContact O-N 3.34Å; C983-Q985 PolarHBondContact O-N 3.04Å
984	Q	30.3	Very low	29	Very low	155 Å²	155	132 Å²	132	72%	0.724	78%	0.784	S	S	*	*			trans	-76.8	79	176.4	-66.8	-173.5	21.7	0	0	109.6	G982 R986	G982-Q984 PolarHBondContact O-N 2.91Å; G982-Q984 VanDerWaalsContact O-N 3.12Å; Q984-R986 PolarHBondContact O-N 3.34Å
985	Q	30	Very low	29.5	Very low	176 Å²	176	130.5 Å²	130.5	82%	0.822	77%	0.767	S	S	*	*			trans	-62.8	86.1	157.7	-81.1	177.2	-30.8	0	0	108.2	C983 S987	C983-Q985 PolarHBondContact O-N 3.04Å; Q985-S987 PolarHBondContact O-N 3.05Å
986	R	25.9	Very low	29.6	Very low	209 Å²	209	132.1 Å²	132.1	79%	0.789	76%	0.763	S	S	*	*			trans	-63.8	92.3	163.3	-74.7	-177.6	177.7	176.3	-1.6	106.6	Q984 V988	Q984-R986 PolarHBondContact O-N 3.34Å; R986-V988 VanDerWaalsContact C-N 3.32Å; R986-V988 PolarHBondContact O-N 3.26Å
987	S	28.4	Very low	30	Very low	93 Å²	93	129.1 Å²	129.1	65%	0.65	74%	0.743	S	S	*	*			trans	-60.4	100.5	164.9	40.4	0	0	0	0	107.5	Q985 R989	Q985-S987 PolarHBondContact O-N 3.05Å; S987-R989 VanDerWaalsContact C-N 3.32Å; S987-R989 PolarHBondContact O-N 3.13Å
988	V	32.8	Very low	30.2	Very low	126 Å²	126	127.4 Å²	127.4	76%	0.764	72%	0.724	S	S	*	*			trans	-59.7	100.1	172.6	177.4	0	0	0	0	106.5	R986 L990	R986-V988 VanDerWaalsContact C-N 3.32Å; R986-V988 PolarHBondContact O-N 3.26Å; V988-L990 PolarHBondContact O-N 2.97Å; V988-L990 VanDerWaalsContact O-N 3.09Å
989	R	29.1	Very low	30.6	Very low	194 Å²	194	124.8 Å²	124.8	73%	0.732	70%	0.697	S	S	*	*			trans	-71.3	101.5	164.7	-76.3	-175.8	168.9	89.2	-7.4	105.6	S987 N991	S987-R989 VanDerWaalsContact C-N 3.32Å; S987-R989 PolarHBondContact O-N 3.13Å; R989-N991 PolarHBondContact O-N 3.31Å
990	L	29.8	Very low	30.8	Very low	149 Å²	149	125.1 Å²	125.1	78%	0.78	69%	0.691	S	S	*	*			trans	-56.8	92.1	162.3	-94.9	145.1	0	0	0	107.9	V988 R992	V988-L990 PolarHBondContact O-N 2.97Å; V988-L990 VanDerWaalsContact O-N 3.09Å; L990-R992 PolarHBondContact O-N 2.87Å
991	N	30.1	Very low	31.1	Very low	144 Å²	144	123.5 Å²	123.5	77%	0.77	67%	0.668	S	S	*	*			trans	-64.1	115.2	152.8	-73.2	-16.1	0	0	0	104.7	R989 S993	R989-N991 PolarHBondContact O-N 3.31Å; N991-S993 PolarHBondContact O-N 3.28Å
992	R	31.5	Very low	31.7	Very low	233 Å²	233	118.2 Å²	118.2	88%	0.879	66%	0.664	S	S	*	*			trans	-53.8	125.2	-179.5	-69.1	-179.5	166.6	-149.1	-8.4	108.9	L990 G994	L990-R992 PolarHBondContact O-N 2.87Å; R992-G994 PolarHBondContact O-N 3.49Å
993	S	30.5	Very low	31.9	Very low	102 Å²	102	118.7 Å²	118.7	71%	0.713	65%	0.651	S	S	*	*			trans	-56.4	128.3	171.8	-56.8	0	0	0	0	108.5	N991 S995	N991-S993 PolarHBondContact O-N 3.28Å; S993-S995 PolarHBondContact O-N 2.98Å
994	G	28.7	Very low	32.1	Very low	74 Å²	74	125.2 Å²	125.2	76%	0.763	66%	0.66	S	S	*	*			trans	-74.7	55.3	-179.2	0	0	0	0	0	112.7	R992	R992-G994 PolarHBondContact O-N 3.49Å
995	S	30.6	Very low	32.5	Very low	76 Å²	76	123.3 Å²	123.3	53%	0.531	66%	0.659	S	S	.	*			trans	-84.2	121.4	167.3	-61.2	0	0	0	0	108.6	S993	S993-S995 PolarHBondContact O-N 2.98Å
996	D	29.9	Very low	33	Very low	120 Å²	120	118.1 Å²	118.1	64%	0.642	64%	0.635	S	S	*	*	S	Bend	trans	67	158	-175.8	-147.9	7.8	0	0	0	118.3	S998	D996-S998 VanDerWaalsContact C-N 3.26Å; D996-S998 PolarHBondContact O-N 2.88Å
997	S	34.3	Very low	33.6	Very low	49 Å²	49	113.4 Å²	113.4	34%	0.343	63%	0.631	S	S	.	*	S	Bend	trans	-87.2	32.6	-140.7	-50.1	0	0	0	0	113.7	R1015	S997-R1015 PolarHBondContact OG-NH1 3.03Å; S997-R1015 PolarHBondContact OG-NH2 2.77Å; S997-R1015 VanDerWaalsContact OG-NH2 3.16Å
998	S	31.8	Very low	33.9	Very low	72 Å²	72	116.7 Å²	116.7	50%	0.503	63%	0.634	S	S	.	*			trans	-97.8	99.5	-175.5	61.2	0	0	0	0	112	D996 P1000	D996-S998 VanDerWaalsContact C-N 3.26Å; D996-S998 PolarHBondContact O-N 2.88Å; S998-P1000 WeakPolarHBondContact O-CD 3.43Å
999	V	37.6	Very low	34.3	Very low	47 Å²	47	118.9 Å²	118.9	29%	0.285	63%	0.628	S	S	.	*			trans	-63.7	123	149.4	-173.6	0	0	0	0	105.5	S1001 E1014	V999-S1001 PolarHBondContact O-N 3.34Å; V999-E1014 WeakPolarHBondContact CG2-O 3.3Å
1000	P	32.6	Very low	34.6	Very low	106 Å²	106	117.8 Å²	117.8	69%	0.688	62%	0.624	S	S	*	*			trans	-60.7	118.1	171	-17.1	30	0	0	0	107.1	S998 T1002	S998-P1000 WeakPolarHBondContact O-CD 3.43Å; P1000-T1002 PolarHBondContact O-N 2.64Å
1001	S	36.3	Very low	35.3	Very low	40 Å²	40	116.1 Å²	116.1	28%	0.28	62%	0.616	S	S	.	*			trans	-44.1	132.4	167.4	-76.9	0	0	0	0	107.7	V999 N1003 E1006	V999-S1001 PolarHBondContact O-N 3.34Å; S1001-N1003 WeakPolarHBondContact CB-O 3.49Å; S1001-N1003 CarbonylContact O-C 3.46Å; S1001-N1003 VanDerWaalsContact O-C 3.28Å; S1001-N1003 PolarHBondContact O-N 3.44Å; S1001-E1006 WeakPolarHBondContact CB-OE2 3.44Å; S1001-E1006 PolarHBondContact OG-OE2 2.89Å
1002	T	42.2	Very low	36.2	Very low	140 Å²	140	112 Å²	112	86%	0.859	59%	0.594	S	S	*	*	S	Bend	trans	-56.4	-22.7	-177.4	47.6	0	0	0	0	111.9	P1000	P1000-T1002 PolarHBondContact O-N 2.64Å
1003	N	35.3	Very low	37	Very low	73 Å²	73	103 Å²	103	39%	0.39	57%	0.565	S	S	.	*	S	Bend	trans	-94.4	117.2	163.2	-64.1	-24.8	0	0	0	111.5	S1001 T1005	S1001-N1003 WeakPolarHBondContact CB-O 3.49Å; S1001-N1003 CarbonylContact O-C 3.46Å; S1001-N1003 VanDerWaalsContact O-C 3.28Å; S1001-N1003 PolarHBondContact O-N 3.44Å; N1003-T1005 PolarHBondContact O-N 3.25Å
1004	R	37.1	Very low	38.1	Very low	252 Å²	252	100.5 Å²	100.5	95%	0.951	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	6.4	177.5	-87.3	-172.7	171.9	-161.1	-2.5	115.9
1005	T	38.7	Very low	39.1	Very low	115 Å²	115	104.3 Å²	104.3	71%	0.706	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	-10	-170.9	-38.3	0	0	0	0	112.6	N1003	N1003-T1005 PolarHBondContact O-N 3.25Å
1006	E	40.7	Very low	40	Very low	66 Å²	66	105.1 Å²	105.1	31%	0.308	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-82.9	130.2	179.6	-68.3	177.4	176.4	0	0	111.5	S1001 R1112	S1001-E1006 WeakPolarHBondContact CB-OE2 3.44Å; S1001-E1006 PolarHBondContact OG-OE2 2.89Å; E1006-R1112 IonicContact OE1-CZ 2.85Å; E1006-R1112 IonicContact OE1-NE 2.73Å; E1006-R1112 PolarHBondContact OE1-NE 3.13Å; E1006-R1112 IonicContact OE1-NH2 3.9Å; E1006-R1112 PolarHBondContact OE1-NH2 2.68Å; E1006-R1112 IonicContact OE2-NH2 2.73Å
1007	P	36.8	Very low	41	Very low	110 Å²	110	100 Å²	100	71%	0.714	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-70.1	159.5	171	29	-33.7	0	0	0	112	R1009	P1007-R1009 PolarHBondContact O-N 2.69Å
1008	F	36.3	Very low	41.5	Very low	162 Å²	162	103.3 Å²	103.3	71%	0.711	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-55.5	122.7	-176.1	-178.6	-93.3	0	0	0	112.5
1009	R	39.7	Very low	42.1	Very low	172 Å²	172	102.9 Å²	102.9	65%	0.649	50%	0.5	S	S	*	.			trans	-112.4	129.1	170.6	-73.5	-165.4	177.5	-168	1.9	110.9	P1007 I1012	P1007-R1009 PolarHBondContact O-N 2.69Å; R1009-I1012 HydrophobicContact CB-CG1 4.23Å; R1009-I1012 WeakPolarHBondContact O-CD1 3.42Å; R1009-I1012 WeakPolarHBondContact O-CG1 3.25Å
1010	R	36.5	Very low	41.8	Very low	171 Å²	171	106.4 Å²	106.4	65%	0.645	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	148.3	160.7	50.9	-179.2	168.4	164.5	-5.8	110.2
1011	N	44	Very low	41.9	Very low	115 Å²	115	107.7 Å²	107.7	62%	0.615	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	33.6	174.1	-54.1	-19.6	0	0	0	117
1012	I	49.1	Very low	41.9	Very low	58 Å²	58	114.7 Å²	114.7	30%	0.297	52%	0.523	S	S	.	.			trans	-56.3	131.5	167.6	-61.6	165.8	0	0	0	109.3	R1009 E1014	R1009-I1012 HydrophobicContact CB-CG1 4.23Å; R1009-I1012 WeakPolarHBondContact O-CD1 3.42Å; R1009-I1012 WeakPolarHBondContact O-CG1 3.25Å; I1012-E1014 HydrophobicContact CG2-CB 4.09Å; I1012-E1014 HydrophobicContact CG2-CG 4.43Å; I1012-E1014 PolarHBondContact O-N 3.22Å
1013	P	49.2	Very low	41.4	Very low	43 Å²	43	114 Å²	114	28%	0.279	51%	0.513	S	S	.	.	S	Bend	trans	-60.3	-26.6	179.8	15.5	-24.9	0	0	0	113.9	R1015 R1070	P1013-R1015 PolarHBondContact O-N 2.88Å; P1013-R1070 VanDerWaalsContact CB-NH1 3.29Å
1014	E	52.2	Low	41.1	Very low	49 Å²	49	113.1 Å²	113.1	23%	0.229	52%	0.521	C	S	.	.			trans	-76.9	42.9	-177.2	-54.3	-161	140.3	0	0	114.1	V999 I1012 R1016 K1067	V999-E1014 WeakPolarHBondContact CG2-O 3.3Å; I1012-E1014 HydrophobicContact CG2-CB 4.09Å; I1012-E1014 HydrophobicContact CG2-CG 4.43Å; I1012-E1014 PolarHBondContact O-N 3.22Å; E1014-R1016 PolarHBondContact O-N 3.14Å; E1014-K1067 HydrophobicContact CG-CD 4.16Å; E1014-K1067 WeakPolarHBondContact OE1-CD 3.44Å; E1014-K1067 WeakPolarHBondContact OE1-CE 3.35Å; E1014-K1067 IonicContact OE1-NZ 3.52Å; E1014-K1067 PolarHBondContact OE1-NZ 3.41Å
1015	R	49.9	Very low	40.9	Very low	155 Å²	155	107.1 Å²	107.1	59%	0.585	52%	0.515	S	S	*	.			trans	-70.7	86.3	159.9	-79.8	-167.7	174.4	-85.2	-1.1	108.8	S997 P1013 A1063	S997-R1015 PolarHBondContact OG-NH1 3.03Å; S997-R1015 PolarHBondContact OG-NH2 2.77Å; S997-R1015 VanDerWaalsContact OG-NH2 3.16Å; P1013-R1015 PolarHBondContact O-N 2.88Å; R1015-A1063 WeakPolarHBondContact O-CB 3.27Å
1016	R	49	Very low	40.4	Very low	92 Å²	92	107.4 Å²	107.4	35%	0.347	52%	0.52	S	S	.	.			trans	-89.1	151.5	167.4	-63.3	-179.1	177.8	-138.4	-5.9	109.9	E1014 L1018	E1014-R1016 PolarHBondContact O-N 3.14Å; R1016-L1018 PolarHBondContact O-N 3.49Å; R1016-L1018 VanDerWaalsContact O-N 3.15Å
1017	S	51.4	Low	39.8	Very low	14 Å²	14	115.7 Å²	115.7	10%	0.098	55%	0.549	C	S	.	.			trans	-55.2	119.4	164.5	60.1	0	0	0	0	109.1	R1019 W1020 D1056 D1060	S1017-R1019 PolarHBondContact O-N 3.33Å; S1017-W1020 PolarHBondContact O-NE1 3.32Å; S1017-D1056 WeakPolarHBondContact CB-OD1 3.35Å; S1017-D1060 WeakPolarHBondContact CB-OD1 3.38Å; S1017-D1060 PolarHBondContact N-OD1 3.11Å; S1017-D1060 PolarHBondContact OG-OD1 3.02Å
1018	L	44.6	Very low	39.4	Very low	118 Å²	118	122 Å²	122	62%	0.618	56%	0.558	S	S	*	*			trans	-82.5	12.4	-179.8	-73.9	175.1	0	0	0	112.7	R1016 W1020	R1016-L1018 PolarHBondContact O-N 3.49Å; R1016-L1018 VanDerWaalsContact O-N 3.15Å; L1018-W1020 PolarHBondContact O-N 3.03Å
1019	R	45.1	Very low	39	Very low	63 Å²	63	125.4 Å²	125.4	24%	0.238	57%	0.566	C	S	.	*			trans	-77.9	31.9	-170.3	-153.9	-179.5	158	81.7	49.2	114.5	S101 D102 S1017 K1021 F1051	S101-R1019 PolarHBondContact O-NH1 3.41Å; D102-R1019 IonicContact OD1-CZ 3.17Å; D102-R1019 IonicContact OD1-NH1 3.72Å; D102-R1019 PolarHBondContact OD1-NH1 3.3Å; D102-R1019 IonicContact OD1-NH2 2.69Å; D102-R1019 PolarHBondContact OD1-NH2 2.87Å; D102-R1019 IonicContact OD2-NH2 2.66Å; D102-R1019 PolarHBondContact OD2-NH2 2.87Å; D102-R1019 VanDerWaalsContact OD2-NH2 3.07Å; S1017-R1019 PolarHBondContact O-N 3.33Å; R1019-K1021 PolarHBondContact O-N 3.44Å; R1019-K1021 VanDerWaalsContact O-N 3.11Å; R1019-F1051 WeakPolarHBondContact CD-O 3.25Å; R1019-F1051 WeakPolarHBondContact CG-O 3.29Å; R1019-F1051 PolarHBondContact NE-O 2.93Å
1020	W	31.4	Very low	38.4	Very low	121 Å²	121	122.2 Å²	122.2	46%	0.458	58%	0.577	S	S	.	*			trans	-89.1	69	-175.4	-61.9	71.7	0	0	0	112.4	S1017 L1018 R1022	S1017-W1020 PolarHBondContact O-NE1 3.32Å; L1018-W1020 PolarHBondContact O-N 3.03Å; W1020-R1022 VanDerWaalsContact C-N 3.3Å; W1020-R1022 PolarHBondContact O-N 3.44Å
1021	K	34.4	Very low	37.9	Very low	133 Å²	133	117.3 Å²	117.3	58%	0.578	58%	0.58	S	S	*	*			trans	-69.1	88.2	163.6	-89.5	-177.8	179	169.5	0	109.4	R1019 L1023	R1019-K1021 PolarHBondContact O-N 3.44Å; R1019-K1021 VanDerWaalsContact O-N 3.11Å; K1021-L1023 PolarHBondContact O-N 2.88Å
1022	R	36.2	Very low	37.1	Very low	187 Å²	187	117 Å²	117	71%	0.706	59%	0.593	S	S	*	*			trans	-63.7	119.2	169.7	-78.7	-160.3	-80.3	-96.2	-0.5	110.7	W1020 G1024 D1048	W1020-R1022 VanDerWaalsContact C-N 3.3Å; W1020-R1022 PolarHBondContact O-N 3.44Å; R1022-G1024 PolarHBondContact O-N 3.11Å; R1022-G1024 VanDerWaalsContact O-N 3.12Å; R1022-D1048 WeakPolarHBondContact CB-OD2 3.47Å; R1022-D1048 WeakPolarHBondContact CD-OD2 3.46Å; R1022-D1048 WeakPolarHBondContact CG-OD2 3.43Å
1023	L	32.3	Very low	36	Very low	125 Å²	125	124 Å²	124	65%	0.654	62%	0.621	S	S	*	*			trans	-81.4	94.1	172.5	-74.7	176.6	0	0	0	108	K1021 D1048 F1051	K1021-L1023 PolarHBondContact O-N 2.88Å; L1023-D1048 PolarHBondContact N-OD1 3.33Å; L1023-F1051 HydrophobicContact CD1-CE2 4.44Å
1024	G	28.8	Very low	35	Very low	54 Å²	54	129.9 Å²	129.9	56%	0.557	65%	0.649	S	S	*	*			trans	-50	135.4	-175	0	0	0	0	0	112.5	R1022 C1026	R1022-G1024 PolarHBondContact O-N 3.11Å; R1022-G1024 VanDerWaalsContact O-N 3.12Å; G1024-C1026 PolarHBondContact O-N 3.45Å
1025	P	33.3	Very low	33.9	Very low	126 Å²	126	133 Å²	133	82%	0.818	67%	0.674	S	S	*	*			trans	-61.9	114.4	-167.1	22.7	-33.9	0	0	0	111.4	R1027	P1025-R1027 PolarHBondContact O-N 3.38Å
1026	C	27	Very low	32.7	Very low	121 Å²	121	135.2 Å²	135.2	82%	0.818	68%	0.684	S	S	*	*			trans	-58.1	106.5	174.7	-70.7	0	0	0	0	109.2	G1024 R1028	G1024-C1026 PolarHBondContact O-N 3.45Å; C1026-R1028 VanDerWaalsContact C-N 3.3Å; C1026-R1028 PolarHBondContact O-N 2.92Å
1027	R	27.7	Very low	31.7	Very low	240 Å²	240	138.1 Å²	138.1	91%	0.906	70%	0.701	S	S	*	*			trans	-60.9	93.1	171.3	-90.2	-172.3	175.3	-111.6	3.5	108.8	P1025 R1029	P1025-R1027 PolarHBondContact O-N 3.38Å; R1027-R1029 PolarHBondContact O-N 3.45Å
1028	R	29.1	Very low	30.5	Very low	242 Å²	242	141.5 Å²	141.5	91%	0.913	73%	0.73	S	S	*	*			trans	-56.6	106.3	162.5	-78.9	-164.6	-93.9	-161.6	-6.6	107.5	C1026 A1030	C1026-R1028 VanDerWaalsContact C-N 3.3Å; C1026-R1028 PolarHBondContact O-N 2.92Å; R1028-A1030 PolarHBondContact O-N 3.32Å; R1028-A1030 VanDerWaalsContact O-N 3.14Å
1029	R	27.5	Very low	29.9	Very low	234 Å²	234	141.8 Å²	141.8	88%	0.883	74%	0.741	S	S	*	*			trans	-66.8	110.3	172.3	179.8	179.7	-68.2	-155.9	0.2	106.5	R1027 G1031	R1027-R1029 PolarHBondContact O-N 3.45Å; R1029-G1031 PolarHBondContact O-N 3.35Å
1030	A	27.2	Very low	29	Very low	106 Å²	106	145.2 Å²	145.2	88%	0.876	78%	0.775	S	S	*	*			trans	-56.8	122.9	178.3	0	0	0	0	0	110.1	R1028	R1028-A1030 PolarHBondContact O-N 3.32Å; R1028-A1030 VanDerWaalsContact O-N 3.14Å
1031	G	25.6	Very low	29	Very low	68 Å²	68	144.5 Å²	144.5	70%	0.701	79%	0.789	S	S	*	*			trans	-159.6	132.1	-179.6	0	0	0	0	0	110.3	R1029	R1029-G1031 PolarHBondContact O-N 3.35Å
1032	A	28.4	Very low	28.6	Very low	107 Å²	107	150.3 Å²	150.3	88%	0.884	81%	0.807	S	S	*	*			trans	57.6	116.2	178.8	0	0	0	0	0	117.2
1033	K	24.8	Very low	28.1	Very low	205 Å²	205	152.6 Å²	152.6	89%	0.891	82%	0.815	S	S	*	*			trans	-73.8	134.2	167.1	-58.9	169.2	178.9	176.7	0	109.1
1034	L	29	Very low	27.8	Very low	168 Å²	168	150.3 Å²	150.3	88%	0.88	82%	0.822	S	S	*	*			trans	-132.2	146.1	148.5	-78.5	179.2	0	0	0	109.4
1035	P	28.7	Very low	27.9	Very low	114 Å²	114	151.2 Å²	151.2	74%	0.74	83%	0.832	S	S	*	*			trans	-100.6	164.9	-165.8	39.3	-35.2	0	0	0	113.9
1036	Y	24.9	Very low	27.9	Very low	202 Å²	202	153.2 Å²	153.2	79%	0.792	84%	0.835	S	S	*	*			trans	71.4	94.1	152.2	-148.2	-100.9	0	0	0	118.3
1037	E	29.1	Very low	28.2	Very low	153 Å²	153	155.6 Å²	155.6	72%	0.715	83%	0.834	S	S	*	*				-163.5	155.7	106.9	-104.4	-62.1	176.2	0	0	109.8
1038	A	25.9	Very low	28.5	Very low	84 Å²	84	147.4 Å²	147.4	69%	0.694	81%	0.808	S	S	*	*			trans	-93.7	121.8	-168.9	0	0	0	0	0	112.8
1039	S	31.1	Very low	28.8	Very low	124 Å²	124	141.4 Å²	141.4	87%	0.867	80%	0.798	S	S	*	*			trans	-145.6	109.8	158.3	-83.6	0	0	0	0	110.4	S1041	S1039-S1041 PolarHBondContact O-N 3.21Å
1040	S	27.4	Very low	29.6	Very low	136 Å²	136	130.4 Å²	130.4	95%	0.951	76%	0.757	S	S	*	*			trans	-87	86.5	-169.8	-165.8	0	0	0	0	111.4
1041	S	29.9	Very low	30.6	Very low	105 Å²	105	130.1 Å²	130.1	73%	0.734	74%	0.736	S	S	*	*			trans	-144.7	67.8	164.3	-160.6	0	0	0	0	112.2	S1039 R1043	S1039-S1041 PolarHBondContact O-N 3.21Å; S1041-R1043 VanDerWaalsContact C-N 3.34Å; S1041-R1043 PolarHBondContact O-N 3.5Å
1042	R	26	Very low	32.1	Very low	255 Å²	255	128.6 Å²	128.6	96%	0.962	72%	0.715	S	S	*	*			trans	-93.8	63.9	165.3	-61.6	-172.3	-148.6	-173.4	7.6	110.2
1043	R	26.2	Very low	33.7	Very low	235 Å²	235	125.1 Å²	125.1	89%	0.887	68%	0.683	S	S	*	*			trans	-140.3	131	167.8	-109.5	-170	-73.6	-126.7	2	109	S1041	S1041-R1043 VanDerWaalsContact C-N 3.34Å; S1041-R1043 PolarHBondContact O-N 3.5Å
1044	G	25.9	Very low	35.8	Very low	77 Å²	77	117.7 Å²	117.7	79%	0.794	66%	0.657	S	S	*	*			trans	89	81.4	-172.9	0	0	0	0	0	112.1	L1046	G1044-L1046 PolarHBondContact O-N 2.88Å
1045	G	30.5	Very low	37.7	Very low	74 Å²	74	111.6 Å²	111.6	76%	0.763	63%	0.625	S	S	*	*			trans	-63.6	117.8	154	0	0	0	0	0	106.9	Q1047	G1045-Q1047 PolarHBondContact O-N 3.31Å
1046	L	33.3	Very low	39.7	Very low	168 Å²	168	107.8 Å²	107.8	88%	0.88	60%	0.598	S	S	*	*			trans	-51.3	114.6	177.2	-161	72.7	0	0	0	107.5	G1044	G1044-L1046 PolarHBondContact O-N 2.88Å
1047	Q	34.2	Very low	42.1	Very low	171 Å²	171	100.3 Å²	100.3	80%	0.799	57%	0.571	S	S	*	*			trans	-60.4	142.8	-179.9	-79.1	-179	2.2	0	0	108.6	G1045 V1049	G1045-Q1047 PolarHBondContact O-N 3.31Å; Q1047-V1049 VanDerWaalsContact C-N 3.28Å; Q1047-V1049 WeakPolarHBondContact O-CG2 3.3Å; Q1047-V1049 PolarHBondContact O-N 2.85Å
1048	D	33.8	Very low	44.4	Very low	67 Å²	67	93.2 Å²	93.2	36%	0.358	54%	0.538	S	S	.	.			trans	-58.7	83.8	-179.9	-172.4	8.9	0	0	0	110	R1022 L1023 G1050	R1022-D1048 WeakPolarHBondContact CB-OD2 3.47Å; R1022-D1048 WeakPolarHBondContact CD-OD2 3.46Å; R1022-D1048 WeakPolarHBondContact CG-OD2 3.43Å; L1023-D1048 PolarHBondContact N-OD1 3.33Å; D1048-G1050 PolarHBondContact O-N 3.38Å; D1048-G1050 VanDerWaalsContact O-N 3.15Å
1049	V	36.4	Very low	46.9	Very low	116 Å²	116	91.8 Å²	91.8	70%	0.703	52%	0.521	S	S	*	.			trans	-75.3	102.1	-176.6	-162.7	0	0	0	0	108.2	Q1047	Q1047-V1049 VanDerWaalsContact C-N 3.28Å; Q1047-V1049 WeakPolarHBondContact O-CG2 3.3Å; Q1047-V1049 PolarHBondContact O-N 2.85Å
1050	G	42.8	Very low	49.2	Very low	3 Å²	3	86 Å²	86	3%	0.031	48%	0.48	C	S	.	.			trans	-63.5	140.3	166.2	0	0	0	0	0	110.2	D1048 C1052	D1048-G1050 PolarHBondContact O-N 3.38Å; D1048-G1050 VanDerWaalsContact O-N 3.15Å; G1050-C1052 PolarHBondContact O-N 3.23Å; G1050-C1052 PolarHBondContact O-SG 3.25Å; G1050-C1052 VanDerWaalsContact O-SG 3.36Å
1051	F	48.3	Very low	51.9	Low	100 Å²	100	79.6 Å²	79.6	44%	0.439	44%	0.435	S	S	.	.			trans	-60.3	102.9	177.9	-63.7	-88.7	0	0	0	111.3	R1019 L1023	R1019-F1051 WeakPolarHBondContact CD-O 3.25Å; R1019-F1051 WeakPolarHBondContact CG-O 3.29Å; R1019-F1051 PolarHBondContact NE-O 2.93Å; L1023-F1051 HydrophobicContact CD1-CE2 4.44Å
1052	C	56.9	Low	54.4	Low	37 Å²	37	75.3 Å²	75.3	25%	0.25	40%	0.404	C	S	.	.			trans	-110.1	137.1	172.5	-58	0	0	0	0	108.9	G1050 D1056 I1057	G1050-C1052 PolarHBondContact O-N 3.23Å; G1050-C1052 PolarHBondContact O-SG 3.25Å; G1050-C1052 VanDerWaalsContact O-SG 3.36Å; C1052-D1056 HydrophobicContact CB-CB 3.98Å; C1052-I1057 HydrophobicContact CB-CG1 4.14Å
1053	T	61.7	Low	57	Low	33 Å²	33	63.9 Å²	63.9	20%	0.202	36%	0.364	C	S	.	.			trans	-73.8	168.6	169.9	63.3	0	0	0	0	111	S101 L1055 D1056 I1057	S101-T1053 WeakPolarHBondContact O-CG2 3.32Å; T1053-L1055 PolarHBondContact O-N 3.15Å; T1053-D1056 WeakPolarHBondContact CB-OD2 3.26Å; T1053-D1056 PolarHBondContact N-OD2 2.86Å; T1053-D1056 PolarHBondContact O-N 3.07Å; T1053-D1056 PolarHBondContact OG1-N 2.93Å; T1053-D1056 PolarHBondContact OG1-OD2 3.47Å; T1053-I1057 WeakPolarHBondContact O-CG1 3.18Å; T1053-I1057 PolarHBondContact O-N 2.8Å
1054	S	68.9	Low	59.8	Low	50 Å²	50	53.8 Å²	53.8	35%	0.35	33%	0.329	S	S	.	.	H	α-helix	trans	-56.6	-41.7	170.2	44.8	0	0	0	0	111.8	Y278 I1057 D1058	Y278-S1054 WeakPolarHBondContact CE2-O 3.02Å; Y278-S1054 PolarHBondContact OH-O 3.14Å; S1054-I1057 PolarHBondContact O-N 3.19Å; S1054-D1058 PolarHBondContact O-N 2.78Å
1055	L	70.2	Confident	62.7	Low	40 Å²	40	54.3 Å²	54.3	21%	0.209	31%	0.306	C	S	.	.	H	α-helix	trans	-59.6	-46.8	174.6	176.4	60.7	0	0	0	112.4	I267 T1053 I1057 D1058 V1059	I267-L1055 HydrophobicContact CD1-CD1 4.18Å; I267-L1055 HydrophobicContact CG2-CD1 3.32Å; T1053-L1055 PolarHBondContact O-N 3.15Å; L1055-I1057 VanDerWaalsContact C-N 3.25Å; L1055-I1057 PolarHBondContact O-N 3.43Å; L1055-D1058 PolarHBondContact O-N 3.3Å; L1055-V1059 HydrophobicContact CD1-CG2 4.03Å; L1055-V1059 WeakPolarHBondContact O-CG2 3.46Å; L1055-V1059 PolarHBondContact O-N 3.1Å
1056	D	70.9	Confident	65.2	Low	33 Å²	33	52.9 Å²	52.9	18%	0.176	28%	0.281	C	S	.	.	H	α-helix	trans	-58.8	-37.9	178.2	-70	-62.6	0	0	0	112	S1017 C1052 T1053 D1060	S1017-D1056 WeakPolarHBondContact CB-OD1 3.35Å; C1052-D1056 HydrophobicContact CB-CB 3.98Å; T1053-D1056 WeakPolarHBondContact CB-OD2 3.26Å; T1053-D1056 PolarHBondContact N-OD2 2.86Å; T1053-D1056 PolarHBondContact O-N 3.07Å; T1053-D1056 PolarHBondContact OG1-N 2.93Å; T1053-D1056 PolarHBondContact OG1-OD2 3.47Å; D1056-D1060 VanDerWaalsContact O-CB 3.25Å; D1056-D1060 WeakPolarHBondContact O-CB 3.42Å; D1056-D1060 PolarHBondContact O-N 3.5Å
1057	I	74.3	Confident	67.7	Low	45 Å²	45	46.2 Å²	46.2	23%	0.231	25%	0.245	C	C	.	.	H	α-helix	trans	-67.6	-44	-179.3	-65.4	165.5	0	0	0	111	Y278 L286 C1052 T1053 S1054 L1055 D1060 L1061	Y278-I1057 HydrophobicContact CE2-CB 4.28Å; Y278-I1057 HydrophobicContact CE2-CG2 4.47Å; L286-I1057 HydrophobicContact CB-CG2 4.35Å; L286-I1057 HydrophobicContact CD1-CG2 4.1Å; C1052-I1057 HydrophobicContact CB-CG1 4.14Å; T1053-I1057 WeakPolarHBondContact O-CG1 3.18Å; T1053-I1057 PolarHBondContact O-N 2.8Å; S1054-I1057 PolarHBondContact O-N 3.19Å; L1055-I1057 VanDerWaalsContact C-N 3.25Å; L1055-I1057 PolarHBondContact O-N 3.43Å; I1057-D1060 PolarHBondContact O-N 2.77Å; I1057-L1061 HydrophobicContact CG2-CD1 4.06Å; I1057-L1061 WeakPolarHBondContact O-CB 3.28Å; I1057-L1061 WeakPolarHBondContact O-CG 3.31Å; I1057-L1061 PolarHBondContact O-N 3.3Å
1058	D	77.4	Confident	70.4	Confident	5 Å²	5	39 Å²	39	3%	0.027	21%	0.212	C	C	.	.	H	α-helix	trans	-67.5	-43.2	179.1	-108.7	2.1	0	0	0	111.6	R270 Y278 S1054 L1055 L1061 Q1062	R270-D1058 WeakPolarHBondContact CD-OD2 3.4Å; R270-D1058 IonicContact CZ-OD2 3.85Å; R270-D1058 IonicContact NE-OD2 2.76Å; R270-D1058 IonicContact NH1-OD1 2.74Å; R270-D1058 PolarHBondContact NH1-OD1 3.33Å; R270-D1058 IonicContact NH1-OD2 3.15Å; R270-D1058 PolarHBondContact NH1-OD2 2.94Å; Y278-D1058 WeakPolarHBondContact OH-CB 3.38Å; Y278-D1058 PolarHBondContact OH-OD1 3.17Å; Y278-D1058 PolarHBondContact OH-OD2 2.9Å; S1054-D1058 PolarHBondContact O-N 2.78Å; L1055-D1058 PolarHBondContact O-N 3.3Å; D1058-L1061 PolarHBondContact O-N 2.86Å; D1058-Q1062 WeakPolarHBondContact O-CB 3.38Å; D1058-Q1062 WeakPolarHBondContact O-CG 3.32Å; D1058-Q1062 PolarHBondContact O-N 3.29Å
1059	V	79.5	Confident	73	Confident	54 Å²	54	38.9 Å²	38.9	33%	0.327	21%	0.209	S	C	.	.	H	α-helix	trans	-62.8	-44.4	175	173.5	0	0	0	0	111.2	I267 L1055 L1061 A1063	I267-V1059 HydrophobicContact CD1-CG2 3.7Å; L1055-V1059 HydrophobicContact CD1-CG2 4.03Å; L1055-V1059 WeakPolarHBondContact O-CG2 3.46Å; L1055-V1059 PolarHBondContact O-N 3.1Å; V1059-L1061 VanDerWaalsContact C-N 3.32Å; V1059-L1061 PolarHBondContact O-N 3.05Å; V1059-A1063 VanDerWaalsContact O-CB 3.24Å; V1059-A1063 WeakPolarHBondContact O-CB 3.39Å; V1059-A1063 PolarHBondContact O-N 3.13Å
1060	D	78.7	Confident	75.3	Confident	3 Å²	3	35.8 Å²	35.8	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-59.3	-42.2	174.3	-102.4	21.7	0	0	0	111.7	K290 S1017 D1056 I1057 T1064	K290-D1060 IonicContact NZ-OD2 2.87Å; K290-D1060 PolarHBondContact NZ-OD2 3.45Å; S1017-D1060 WeakPolarHBondContact CB-OD1 3.38Å; S1017-D1060 PolarHBondContact N-OD1 3.11Å; S1017-D1060 PolarHBondContact OG-OD1 3.02Å; D1056-D1060 VanDerWaalsContact O-CB 3.25Å; D1056-D1060 WeakPolarHBondContact O-CB 3.42Å; D1056-D1060 PolarHBondContact O-N 3.5Å; I1057-D1060 PolarHBondContact O-N 2.77Å; D1060-T1064 WeakPolarHBondContact O-CG2 3.48Å; D1060-T1064 PolarHBondContact O-N 3.07Å; D1060-T1064 PolarHBondContact O-OG1 2.86Å
1061	L	83.6	Confident	77.4	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-66.5	-52.3	179.8	-82.7	169.1	0	0	0	111.3	L286 E289 K290 L293 I1057 D1058 V1059 A1063 T1064 R1065	L286-L1061 HydrophobicContact CB-CD1 3.92Å; L286-L1061 HydrophobicContact CD2-CD1 3.42Å; L286-L1061 VanDerWaalsContact CD2-CD1 3.42Å; L286-L1061 HydrophobicContact CG-CD1 4.17Å; E289-L1061 HydrophobicContact CB-CD2 4.49Å; K290-L1061 HydrophobicContact CB-CD2 3.86Å; K290-L1061 HydrophobicContact CG-CD2 4.3Å; L293-L1061 HydrophobicContact CD1-CD2 4.11Å; I1057-L1061 HydrophobicContact CG2-CD1 4.06Å; I1057-L1061 WeakPolarHBondContact O-CB 3.28Å; I1057-L1061 WeakPolarHBondContact O-CG 3.31Å; I1057-L1061 PolarHBondContact O-N 3.3Å; D1058-L1061 PolarHBondContact O-N 2.86Å; V1059-L1061 VanDerWaalsContact C-N 3.32Å; V1059-L1061 PolarHBondContact O-N 3.05Å; L1061-A1063 VanDerWaalsContact C-N 3.29Å; L1061-A1063 PolarHBondContact O-N 2.9Å; L1061-T1064 WeakPolarHBondContact CA-OG1 3.42Å; L1061-T1064 CarbonylContact O-C 3.56Å; L1061-T1064 PolarHBondContact O-N 3.1Å; L1061-T1064 PolarHBondContact O-OG1 3.34Å; L1061-R1065 WeakPolarHBondContact O-CG 3.38Å; L1061-R1065 PolarHBondContact O-N 3.29Å
1062	Q	82.3	Confident	79.5	Confident	14 Å²	14	36 Å²	36	7%	0.065	19%	0.186	C	C	.	.	H	α-helix	trans	-55.6	-43.4	174.3	-73.7	173.8	-17.7	0	0	111.2	T263 E266 D1058 T1064 R1065 I1066	T263-Q1062 HydrophobicContact CG2-CG 4.3Å; E266-Q1062 PolarHBondContact OE2-NE2 2.74Å; D1058-Q1062 WeakPolarHBondContact O-CB 3.38Å; D1058-Q1062 WeakPolarHBondContact O-CG 3.32Å; D1058-Q1062 PolarHBondContact O-N 3.29Å; Q1062-T1064 VanDerWaalsContact C-N 3.34Å; Q1062-T1064 PolarHBondContact O-N 3.41Å; Q1062-R1065 PolarHBondContact O-N 3.15Å; Q1062-I1066 WeakPolarHBondContact O-CG1 3.46Å; Q1062-I1066 PolarHBondContact O-N 3.42Å
1063	A	81.3	Confident	81	Confident	16 Å²	16	38.5 Å²	38.5	13%	0.132	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-38.8	175	0	0	0	0	0	112.6	R1015 V1059 L1061 K1067	R1015-A1063 WeakPolarHBondContact O-CB 3.27Å; V1059-A1063 VanDerWaalsContact O-CB 3.24Å; V1059-A1063 WeakPolarHBondContact O-CB 3.39Å; V1059-A1063 PolarHBondContact O-N 3.13Å; L1061-A1063 VanDerWaalsContact C-N 3.29Å; L1061-A1063 PolarHBondContact O-N 2.9Å; A1063-K1067 WeakPolarHBondContact O-CB 3.09Å; A1063-K1067 PolarHBondContact O-N 2.94Å
1064	T	84.1	Confident	82.1	Confident	23 Å²	23	39.9 Å²	39.9	14%	0.141	20%	0.2	C	C	.	.	H	α-helix	trans	-70.8	-33.9	173.9	53	0	0	0	0	113.9	L293 D1060 L1061 Q1062 K1067 L1068	L293-T1064 WeakPolarHBondContact CD1-OG1 3.17Å; D1060-T1064 WeakPolarHBondContact O-CG2 3.48Å; D1060-T1064 PolarHBondContact O-N 3.07Å; D1060-T1064 PolarHBondContact O-OG1 2.86Å; L1061-T1064 WeakPolarHBondContact CA-OG1 3.42Å; L1061-T1064 CarbonylContact O-C 3.56Å; L1061-T1064 PolarHBondContact O-N 3.1Å; L1061-T1064 PolarHBondContact O-OG1 3.34Å; Q1062-T1064 VanDerWaalsContact C-N 3.34Å; Q1062-T1064 PolarHBondContact O-N 3.41Å; T1064-K1067 PolarHBondContact O-N 2.98Å; T1064-L1068 PolarHBondContact O-N 3.25Å
1065	R	87.6	Confident	83.2	Confident	87 Å²	87	37.6 Å²	37.6	33%	0.328	18%	0.184	S	C	.	.	H	α-helix	trans	-64.4	-49.5	172.6	-67.7	176.2	-174.3	161.2	0.8	111	E289 L293 L1061 Q1062 K1067 L1068 E1069	E289-R1065 IonicContact OE1-CZ 3.81Å; E289-R1065 IonicContact OE1-NE 2.78Å; E289-R1065 PolarHBondContact OE1-NE 3.42Å; E289-R1065 IonicContact OE1-NH2 3.2Å; E289-R1065 PolarHBondContact OE1-NH2 3.04Å; E289-R1065 IonicContact OE2-CZ 3.11Å; E289-R1065 IonicContact OE2-NH2 3.76Å; E289-R1065 PolarHBondContact OE2-NH2 3.47Å; L293-R1065 HydrophobicContact CD1-CG 3.73Å; L293-R1065 HydrophobicContact CD2-CG 4.2Å; L1061-R1065 WeakPolarHBondContact O-CG 3.38Å; L1061-R1065 PolarHBondContact O-N 3.29Å; Q1062-R1065 PolarHBondContact O-N 3.15Å; R1065-K1067 VanDerWaalsContact C-N 3.29Å; R1065-K1067 PolarHBondContact O-N 2.9Å; R1065-L1068 WeakPolarHBondContact O-CB 3.28Å; R1065-L1068 PolarHBondContact O-N 3.38Å; R1065-L1068 VanDerWaalsContact O-N 3.1Å; R1065-E1069 PolarHBondContact O-N 2.61Å
1066	I	84.1	Confident	84.2	Confident	45 Å²	45	39.5 Å²	39.5	23%	0.231	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-35.9	176.9	-66.2	165.3	0	0	0	111.3	Q1062 R1070	Q1062-I1066 WeakPolarHBondContact O-CG1 3.46Å; Q1062-I1066 PolarHBondContact O-N 3.42Å; I1066-R1070 WeakPolarHBondContact O-CB 3.45Å; I1066-R1070 WeakPolarHBondContact O-CG 3.28Å; I1066-R1070 PolarHBondContact O-N 2.85Å; I1066-R1070 VanDerWaalsContact O-N 3.11Å
1067	K	85.7	Confident	84.9	Confident	28 Å²	28	42.1 Å²	42.1	12%	0.122	21%	0.205	C	C	.	.	H	α-helix	trans	-63.5	-46.3	172.8	-171.4	-175	177.6	-176.3	0	111.3	L297 E1014 A1063 T1064 R1065 R1070 E1071	L297-K1067 HydrophobicContact CD1-CD 4.01Å; L297-K1067 HydrophobicContact CD1-CG 4.13Å; L297-K1067 HydrophobicContact CD2-CD 3.89Å; E1014-K1067 HydrophobicContact CG-CD 4.16Å; E1014-K1067 WeakPolarHBondContact OE1-CD 3.44Å; E1014-K1067 WeakPolarHBondContact OE1-CE 3.35Å; E1014-K1067 IonicContact OE1-NZ 3.52Å; E1014-K1067 PolarHBondContact OE1-NZ 3.41Å; A1063-K1067 WeakPolarHBondContact O-CB 3.09Å; A1063-K1067 PolarHBondContact O-N 2.94Å; T1064-K1067 PolarHBondContact O-N 2.98Å; R1065-K1067 VanDerWaalsContact C-N 3.29Å; R1065-K1067 PolarHBondContact O-N 2.9Å; K1067-R1070 PolarHBondContact O-N 3.38Å; K1067-E1071 HydrophobicContact CG-CG 4.23Å; K1067-E1071 WeakPolarHBondContact O-CB 3.34Å; K1067-E1071 VanDerWaalsContact O-CG 3.28Å; K1067-E1071 WeakPolarHBondContact O-CG 3.46Å; K1067-E1071 PolarHBondContact O-N 3.5Å
1068	L	89.4	Confident	85.5	Confident	19 Å²	19	40.2 Å²	40.2	10%	0.099	20%	0.196	C	C	.	.	H	α-helix	trans	-59.8	-51.5	179.6	-177.1	64.6	0	0	0	110.7	L293 L297 V300 T1064 R1065 R1070 E1071 E1072	L293-L1068 HydrophobicContact CD2-CD2 3.82Å; L297-L1068 HydrophobicContact CB-CD1 4.34Å; L297-L1068 HydrophobicContact CD1-CD1 4.48Å; V300-L1068 HydrophobicContact CB-CD1 4.38Å; V300-L1068 HydrophobicContact CG2-CD1 3.76Å; T1064-L1068 PolarHBondContact O-N 3.25Å; R1065-L1068 WeakPolarHBondContact O-CB 3.28Å; R1065-L1068 PolarHBondContact O-N 3.38Å; R1065-L1068 VanDerWaalsContact O-N 3.1Å; L1068-R1070 VanDerWaalsContact C-N 3.35Å; L1068-R1070 PolarHBondContact O-N 2.96Å; L1068-E1071 PolarHBondContact O-N 3.17Å; L1068-E1071 VanDerWaalsContact O-N 3.12Å; L1068-E1072 HydrophobicContact CD1-CG 4.46Å; L1068-E1072 WeakPolarHBondContact O-CG 3.49Å; L1068-E1072 PolarHBondContact O-N 2.68Å
1069	E	88.5	Confident	86.1	Confident	65 Å²	65	42.3 Å²	42.3	30%	0.304	21%	0.205	S	C	.	.	H	α-helix	trans	-52.3	-49	177.1	-174	-164.5	169.4	0	0	112	R259 R1065 E1071 E1072 E1073	R259-E1069 IonicContact CZ-OE1 2.76Å; R259-E1069 IonicContact CZ-OE2 2.75Å; R259-E1069 IonicContact NH1-OE1 2.86Å; R259-E1069 PolarHBondContact NH1-OE1 3.12Å; R259-E1069 IonicContact NH1-OE2 3.4Å; R259-E1069 PolarHBondContact NH1-OE2 3.46Å; R259-E1069 IonicContact NH2-OE1 3.77Å; R259-E1069 PolarHBondContact NH2-OE1 3.11Å; R1065-E1069 PolarHBondContact O-N 2.61Å; E1069-E1071 PolarHBondContact O-N 3.49Å; E1069-E1072 WeakPolarHBondContact O-CB 3.48Å; E1069-E1072 PolarHBondContact O-N 2.85Å; E1069-E1073 WeakPolarHBondContact O-CG 3.4Å; E1069-E1073 PolarHBondContact O-N 3.25Å
1070	R	84.8	Confident	86.6	Confident	51 Å²	51	44.5 Å²	44.5	19%	0.192	22%	0.215	C	C	.	.	H	α-helix	trans	-66.7	-36.6	178.8	-74.1	179.3	179.9	179.4	4.5	113.6	H256 P1013 I1066 K1067 L1068 E1072 L1074	H256-R1070 PolarHBondContact CD2-NH2 3.19Å; H256-R1070 PolarHBondContact NE2-NH2 2.95Å; P1013-R1070 VanDerWaalsContact CB-NH1 3.29Å; I1066-R1070 WeakPolarHBondContact O-CB 3.45Å; I1066-R1070 WeakPolarHBondContact O-CG 3.28Å; I1066-R1070 PolarHBondContact O-N 2.85Å; I1066-R1070 VanDerWaalsContact O-N 3.11Å; K1067-R1070 PolarHBondContact O-N 3.38Å; L1068-R1070 VanDerWaalsContact C-N 3.35Å; L1068-R1070 PolarHBondContact O-N 2.96Å; R1070-E1072 VanDerWaalsContact C-N 3.3Å; R1070-L1074 WeakPolarHBondContact O-CB 3.42Å; R1070-L1074 VanDerWaalsContact O-CG 3.25Å; R1070-L1074 WeakPolarHBondContact O-CG 3.47Å; R1070-L1074 PolarHBondContact O-N 3.06Å
1071	E	87.8	Confident	87	Confident	22 Å²	22	45.2 Å²	45.2	10%	0.103	22%	0.22	C	C	.	.	H	α-helix	trans	-72.1	-29.5	177.2	-68.7	-76.8	-170.1	0	0	110.9	L297 V300 K304 K1067 L1068 E1069 V1075	L297-E1071 HydrophobicContact CD1-CB 4.41Å; L297-E1071 HydrophobicContact CD1-CG 4.13Å; V300-E1071 HydrophobicContact CG1-CB 3.69Å; V300-E1071 WeakPolarHBondContact CG1-O 3.29Å; K304-E1071 IonicContact NZ-OE1 3.11Å; K304-E1071 PolarHBondContact NZ-OE1 3.02Å; K304-E1071 IonicContact NZ-OE2 3.05Å; K304-E1071 PolarHBondContact NZ-OE2 3.18Å; K1067-E1071 HydrophobicContact CG-CG 4.23Å; K1067-E1071 WeakPolarHBondContact O-CB 3.34Å; K1067-E1071 VanDerWaalsContact O-CG 3.28Å; K1067-E1071 WeakPolarHBondContact O-CG 3.46Å; K1067-E1071 PolarHBondContact O-N 3.5Å; L1068-E1071 PolarHBondContact O-N 3.17Å; L1068-E1071 VanDerWaalsContact O-N 3.12Å; E1069-E1071 PolarHBondContact O-N 3.49Å; E1071-V1075 WeakPolarHBondContact O-CB 3.34Å; E1071-V1075 VanDerWaalsContact O-CG2 3.3Å; E1071-V1075 WeakPolarHBondContact O-CG2 3.26Å; E1071-V1075 PolarHBondContact O-N 3.42Å
1072	E	91.6	Very high	87.3	Confident	85 Å²	85	45.9 Å²	45.9	40%	0.397	22%	0.224	S	C	.	.	H	α-helix	trans	-68.6	-48.1	169.4	-70.3	171.3	164.4	0	0	111.2	V300 L1068 E1069 R1070 L1074 V1075 D1076	V300-E1072 HydrophobicContact CG1-CG 4.13Å; V300-E1072 HydrophobicContact CG2-CG 3.7Å; L1068-E1072 HydrophobicContact CD1-CG 4.46Å; L1068-E1072 WeakPolarHBondContact O-CG 3.49Å; L1068-E1072 PolarHBondContact O-N 2.68Å; E1069-E1072 WeakPolarHBondContact O-CB 3.48Å; E1069-E1072 PolarHBondContact O-N 2.85Å; R1070-E1072 VanDerWaalsContact C-N 3.3Å; E1072-L1074 VanDerWaalsContact C-N 3.29Å; E1072-L1074 PolarHBondContact O-N 2.87Å; E1072-V1075 WeakPolarHBondContact O-CB 3.3Å; E1072-V1075 PolarHBondContact O-N 3.08Å; E1072-V1075 VanDerWaalsContact O-N 3.07Å; E1072-D1076 PolarHBondContact O-N 2.89Å
1073	E	87.9	Confident	87.7	Confident	90 Å²	90	49.2 Å²	49.2	42%	0.421	24%	0.242	S	C	.	.	H	α-helix	trans	-55	-42.4	172.5	-73.7	179.7	159.8	0	0	112.3	E1069 D1076 Q1077	E1069-E1073 WeakPolarHBondContact O-CG 3.4Å; E1069-E1073 PolarHBondContact O-N 3.25Å; E1073-D1076 PolarHBondContact O-N 3.22Å; E1073-Q1077 VanDerWaalsContact O-CG 3.28Å; E1073-Q1077 WeakPolarHBondContact O-CG 3.23Å; E1073-Q1077 PolarHBondContact O-N 3.17Å
1074	L	86.2	Confident	88	Confident	62 Å²	62	51.4 Å²	51.4	33%	0.325	26%	0.256	S	S	.	.	H	α-helix	trans	-68.9	-35.9	176.6	-74.5	173.2	0	0	0	112.4	R1070 E1072 L1078	R1070-L1074 WeakPolarHBondContact O-CB 3.42Å; R1070-L1074 VanDerWaalsContact O-CG 3.25Å; R1070-L1074 WeakPolarHBondContact O-CG 3.47Å; R1070-L1074 PolarHBondContact O-N 3.06Å; E1072-L1074 VanDerWaalsContact C-N 3.29Å; E1072-L1074 PolarHBondContact O-N 2.87Å; L1074-L1078 WeakPolarHBondContact O-CB 3.27Å; L1074-L1078 VanDerWaalsContact O-CG 3.29Å; L1074-L1078 WeakPolarHBondContact O-CG 3.2Å; L1074-L1078 PolarHBondContact O-N 2.92Å
1075	V	90.9	Very high	88.1	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.012	25%	0.25	C	C	.	.	H	α-helix	trans	-65.2	-39.6	173.4	156.5	0	0	0	0	111.3	V300 R303 K304 L307 E1071 E1072 L1078 Q1079	V300-V1075 HydrophobicContact CG1-CG2 3.89Å; R303-V1075 HydrophobicContact CB-CG1 4.5Å; R303-V1075 HydrophobicContact CG-CG1 3.8Å; R303-V1075 VanDerWaalsContact CZ-CG1 3.48Å; K304-V1075 HydrophobicContact CB-CG2 3.68Å; K304-V1075 HydrophobicContact CG-CG2 4.47Å; L307-V1075 HydrophobicContact CD1-CG1 4.01Å; L307-V1075 WeakPolarHBondContact CD1-O 3.24Å; E1071-V1075 WeakPolarHBondContact O-CB 3.34Å; E1071-V1075 VanDerWaalsContact O-CG2 3.3Å; E1071-V1075 WeakPolarHBondContact O-CG2 3.26Å; E1071-V1075 PolarHBondContact O-N 3.42Å; E1072-V1075 WeakPolarHBondContact O-CB 3.3Å; E1072-V1075 PolarHBondContact O-N 3.08Å; E1072-V1075 VanDerWaalsContact O-N 3.07Å; V1075-L1078 PolarHBondContact O-N 3.07Å; V1075-Q1079 WeakPolarHBondContact O-CB 3.24Å; V1075-Q1079 PolarHBondContact O-N 3.21Å
1076	D	91.1	Very high	88	Confident	80 Å²	80	47.3 Å²	47.3	43%	0.428	25%	0.245	S	C	.	.	H	α-helix	trans	-72.8	-36.3	177.4	-70.4	-17.8	0	0	0	111.8	R303 E1072 E1073 Q1079 N1080	R303-D1076 IonicContact NH1-OD1 2.73Å; R303-D1076 IonicContact NH2-OD1 2.69Å; E1072-D1076 PolarHBondContact O-N 2.89Å; E1073-D1076 PolarHBondContact O-N 3.22Å; D1076-Q1079 PolarHBondContact O-N 2.92Å; D1076-N1080 VanDerWaalsContact O-CG 3.26Å; D1076-N1080 PolarHBondContact O-N 3.45Å; D1076-N1080 PolarHBondContact O-ND2 3.5Å
1077	Q	86	Confident	88.2	Confident	87 Å²	87	49.1 Å²	49.1	41%	0.407	26%	0.262	S	S	.	.	H	α-helix	trans	-60.3	-46.5	168.7	-73.4	169	37.9	0	0	111.7	E1073 Q1079 N1080 V1081	E1073-Q1077 VanDerWaalsContact O-CG 3.28Å; E1073-Q1077 WeakPolarHBondContact O-CG 3.23Å; E1073-Q1077 PolarHBondContact O-N 3.17Å; Q1077-Q1079 PolarHBondContact O-N 3.2Å; Q1077-N1080 PolarHBondContact O-N 2.96Å; Q1077-V1081 WeakPolarHBondContact O-CG2 3.39Å; Q1077-V1081 PolarHBondContact O-N 3.38Å; Q1077-V1081 VanDerWaalsContact O-N 3.09Å
1078	L	86.7	Confident	88	Confident	5 Å²	5	51 Å²	51	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-59.9	-43.2	174.7	-82	166.6	0	0	0	112.2	K304 L307 V308 L311 L1074 V1075 V1081 V1082 I1109	K304-L1078 HydrophobicContact CG-CD1 3.74Å; L307-L1078 HydrophobicContact CB-CB 4.18Å; L307-L1078 HydrophobicContact CD1-CB 3.99Å; V308-L1078 HydrophobicContact CG2-CD1 4.19Å; V308-L1078 HydrophobicContact CG2-CD2 4.22Å; L311-L1078 HydrophobicContact CD1-CD2 4.22Å; L1074-L1078 WeakPolarHBondContact O-CB 3.27Å; L1074-L1078 VanDerWaalsContact O-CG 3.29Å; L1074-L1078 WeakPolarHBondContact O-CG 3.2Å; L1074-L1078 PolarHBondContact O-N 2.92Å; V1075-L1078 PolarHBondContact O-N 3.07Å; L1078-V1081 PolarHBondContact O-N 2.96Å; L1078-V1082 WeakPolarHBondContact O-CB 3.39Å; L1078-V1082 WeakPolarHBondContact O-CG2 3.35Å; L1078-V1082 PolarHBondContact O-N 3.43Å; L1078-I1109 HydrophobicContact CD2-CD1 4.1Å; L1078-I1109 HydrophobicContact CD2-CG2 3.64Å; L1078-I1109 HydrophobicContact CG-CD1 4.43Å
1079	Q	91.5	Very high	87.8	Confident	49 Å²	49	54.1 Å²	54.1	23%	0.229	28%	0.281	C	S	.	.	H	α-helix	trans	-59.3	-49.5	176.8	-173.6	72.5	68.4	0	0	110.4	L307 V1075 D1076 Q1077 V1081 V1082 D1083	L307-Q1079 HydrophobicContact CD1-CB 4.18Å; V1075-Q1079 WeakPolarHBondContact O-CB 3.24Å; V1075-Q1079 PolarHBondContact O-N 3.21Å; D1076-Q1079 PolarHBondContact O-N 2.92Å; Q1077-Q1079 PolarHBondContact O-N 3.2Å; Q1079-V1081 VanDerWaalsContact C-N 3.29Å; Q1079-V1081 PolarHBondContact O-N 2.74Å; Q1079-V1082 PolarHBondContact O-N 2.82Å; Q1079-D1083 PolarHBondContact NE2-OD1 3.25Å; Q1079-D1083 PolarHBondContact NE2-OD2 3.32Å; Q1079-D1083 WeakPolarHBondContact O-CB 3.37Å; Q1079-D1083 PolarHBondContact O-N 2.84Å
1080	N	89.5	Confident	87.5	Confident	101 Å²	101	56.3 Å²	56.3	54%	0.54	30%	0.303	S	S	.	.	H	α-helix	trans	-58.5	-38.2	177.9	-71.1	-38.1	0	0	0	112.7	D1076 Q1077 S1084	D1076-N1080 VanDerWaalsContact O-CG 3.26Å; D1076-N1080 PolarHBondContact O-N 3.45Å; D1076-N1080 PolarHBondContact O-ND2 3.5Å; Q1077-N1080 PolarHBondContact O-N 2.96Å; N1080-S1084 VanDerWaalsContact O-CB 3.23Å; N1080-S1084 WeakPolarHBondContact O-CB 3.38Å; N1080-S1084 PolarHBondContact O-N 3.41Å; N1080-S1084 PolarHBondContact O-OG 3.19Å
1081	V	86.5	Confident	87.5	Confident	18 Å²	18	56.6 Å²	56.6	11%	0.109	32%	0.323	C	S	.	.	H	α-helix	trans	-70.7	-43.4	176.6	174.6	0	0	0	0	111.5	L311 Q1077 L1078 Q1079 S1084 L1085 W1099 V1106	L311-V1081 HydrophobicContact CD1-CB 4.41Å; L311-V1081 HydrophobicContact CD1-CG1 3.72Å; Q1077-V1081 WeakPolarHBondContact O-CG2 3.39Å; Q1077-V1081 PolarHBondContact O-N 3.38Å; Q1077-V1081 VanDerWaalsContact O-N 3.09Å; L1078-V1081 PolarHBondContact O-N 2.96Å; Q1079-V1081 VanDerWaalsContact C-N 3.29Å; Q1079-V1081 PolarHBondContact O-N 2.74Å; V1081-S1084 PolarHBondContact O-N 2.97Å; V1081-L1085 WeakPolarHBondContact O-CB 3.47Å; V1081-L1085 PolarHBondContact O-N 3.32Å; V1081-W1099 HydrophobicContact CG1-CH2 4.47Å; V1081-V1106 HydrophobicContact CG1-CG1 4.16Å; V1081-V1106 HydrophobicContact CG1-CG2 3.91Å; V1081-V1106 HydrophobicContact CG2-CG2 3.78Å
1082	V	89.8	Confident	86.9	Confident	14 Å²	14	58.2 Å²	58.2	9%	0.085	35%	0.345	C	S	.	.	H	α-helix	trans	-61.2	-45	175.3	167.9	0	0	0	0	111	L307 L311 L314 L1078 Q1079 L1085 G1086	L307-V1082 HydrophobicContact CB-CG2 4.47Å; L307-V1082 HydrophobicContact CD2-CG2 4.35Å; L311-V1082 HydrophobicContact CB-CG2 3.82Å; L311-V1082 HydrophobicContact CD1-CG2 4.17Å; L311-V1082 HydrophobicContact CG-CG2 4.34Å; L314-V1082 HydrophobicContact CD1-CG1 4.09Å; L1078-V1082 WeakPolarHBondContact O-CB 3.39Å; L1078-V1082 WeakPolarHBondContact O-CG2 3.35Å; L1078-V1082 PolarHBondContact O-N 3.43Å; Q1079-V1082 PolarHBondContact O-N 2.82Å; V1082-L1085 PolarHBondContact O-N 3.31Å; V1082-G1086 PolarHBondContact O-N 3.34Å
1083	D	90.8	Very high	86.2	Confident	85 Å²	85	58 Å²	58	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-68.7	-40.2	-179.5	-65.2	-11.2	0	0	0	111.2	Q1079 G1086 S1087	Q1079-D1083 PolarHBondContact NE2-OD1 3.25Å; Q1079-D1083 PolarHBondContact NE2-OD2 3.32Å; Q1079-D1083 WeakPolarHBondContact O-CB 3.37Å; Q1079-D1083 PolarHBondContact O-N 2.84Å; D1083-G1086 PolarHBondContact O-N 3.3Å; D1083-S1087 VanDerWaalsContact O-CB 3.29Å; D1083-S1087 WeakPolarHBondContact O-CB 3.25Å; D1083-S1087 PolarHBondContact O-N 2.93Å
1084	S	88.4	Confident	85.6	Confident	61 Å²	61	61.9 Å²	61.9	43%	0.427	36%	0.362	S	S	.	.	H	α-helix	trans	-61.9	-43.7	173.7	-62.7	0	0	0	0	111.8	N1080 V1081 W1088	N1080-S1084 VanDerWaalsContact O-CB 3.23Å; N1080-S1084 WeakPolarHBondContact O-CB 3.38Å; N1080-S1084 PolarHBondContact O-N 3.41Å; N1080-S1084 PolarHBondContact O-OG 3.19Å; V1081-S1084 PolarHBondContact O-N 2.97Å; S1084-W1088 WeakPolarHBondContact O-CB 3.42Å; S1084-W1088 PolarHBondContact O-N 3.13Å
1085	L	85.3	Confident	85	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-72	-36.6	178.7	-168.7	58.9	0	0	0	112.2	L314 L318 V1081 V1082 W1088 K1089 P1097 I1100	L314-L1085 HydrophobicContact CB-CD2 3.71Å; L314-L1085 HydrophobicContact CB-CG 4.16Å; L314-L1085 HydrophobicContact CD1-CB 4.36Å; L314-L1085 HydrophobicContact CD1-CD2 4.42Å; L314-L1085 HydrophobicContact CD1-CG 4.44Å; L318-L1085 HydrophobicContact CD1-CD1 3.34Å; L318-L1085 HydrophobicContact CD1-CD2 4.33Å; L318-L1085 HydrophobicContact CD1-CG 3.86Å; V1081-L1085 WeakPolarHBondContact O-CB 3.47Å; V1081-L1085 PolarHBondContact O-N 3.32Å; V1082-L1085 PolarHBondContact O-N 3.31Å; L1085-W1088 PolarHBondContact O-N 3.43Å; L1085-K1089 WeakPolarHBondContact O-CB 3.19Å; L1085-K1089 PolarHBondContact O-N 3.03Å; L1085-P1097 HydrophobicContact CD1-CG 4.08Å; L1085-I1100 HydrophobicContact CD1-CD1 3.77Å; L1085-I1100 HydrophobicContact CD2-CD1 4.39Å
1086	G	86.7	Confident	84.3	Confident	22 Å²	22	63 Å²	63	23%	0.227	37%	0.372	C	S	.	.	H	α-helix	trans	-62.4	-47.1	172.6	0	0	0	0	0	111.8	V1082 D1083 W1088 K1089 S1090	V1082-G1086 PolarHBondContact O-N 3.34Å; D1083-G1086 PolarHBondContact O-N 3.3Å; G1086-W1088 VanDerWaalsContact C-N 3.34Å; G1086-W1088 PolarHBondContact O-N 3.39Å; G1086-K1089 PolarHBondContact O-N 2.69Å; G1086-S1090 PolarHBondContact O-N 2.93Å; G1086-S1090 PolarHBondContact O-OG 3.31Å
1087	S	86.9	Confident	83.4	Confident	83 Å²	83	59.5 Å²	59.5	58%	0.58	35%	0.354	S	S	*	.	H	α-helix	trans	-58.1	-44.8	173.1	-174.3	0	0	0	0	111.7	D1083 K1089 S1090 G1091	D1083-S1087 VanDerWaalsContact O-CB 3.29Å; D1083-S1087 WeakPolarHBondContact O-CB 3.25Å; D1083-S1087 PolarHBondContact O-N 2.93Å; S1087-K1089 PolarHBondContact O-N 2.97Å; S1087-S1090 PolarHBondContact O-N 3.01Å; S1087-G1091 PolarHBondContact O-N 3.33Å
1088	W	82.7	Confident	82.8	Confident	67 Å²	67	59.8 Å²	59.8	25%	0.254	37%	0.366	S	S	.	.	H	α-helix	trans	-64	-39.1	178.7	-154.5	85.4	0	0	0	112.7	L318 S1084 L1085 G1086 G1091 N1093 G1095 P1097	L318-W1088 HydrophobicContact CD2-CE3 4.49Å; L318-W1088 HydrophobicContact CD2-CZ3 4.5Å; S1084-W1088 WeakPolarHBondContact O-CB 3.42Å; S1084-W1088 PolarHBondContact O-N 3.13Å; L1085-W1088 PolarHBondContact O-N 3.43Å; G1086-W1088 VanDerWaalsContact C-N 3.34Å; G1086-W1088 PolarHBondContact O-N 3.39Å; W1088-G1091 PolarHBondContact O-N 3.33Å; W1088-N1093 HydrophobicContact CD2-CB 3.67Å; W1088-N1093 HydrophobicContact CE3-CB 3.56Å; W1088-N1093 HydrophobicContact CG-CB 4.49Å; W1088-N1093 HydrophobicContact CH2-CB 3.67Å; W1088-N1093 HydrophobicContact CZ2-CB 3.76Å; W1088-N1093 HydrophobicContact CZ3-CB 3.53Å; W1088-N1093 PolarHBondContact NE1-ND2 2.98Å; W1088-G1095 WeakPolarHBondContact CZ3-O 3.44Å; W1088-P1097 HydrophobicContact CD2-CG 3.68Å; W1088-P1097 HydrophobicContact CE3-CG 3.98Å; W1088-P1097 HydrophobicContact CG-CG 4.05Å; W1088-P1097 HydrophobicContact CH2-CG 4.38Å; W1088-P1097 HydrophobicContact CZ2-CB 4.25Å; W1088-P1097 HydrophobicContact CZ2-CG 4.11Å; W1088-P1097 HydrophobicContact CZ3-CG 4.34Å
1089	K	84.1	Confident	82.3	Confident	86 Å²	86	63.8 Å²	63.8	37%	0.374	38%	0.38	S	S	.	.	H	α-helix	trans	-65	-44	172.3	-176	-178.6	176.8	-172	0	111.7	L314 D317 L318 L1085 G1086 S1087 G1091 G1092	L314-K1089 HydrophobicContact CD2-CD 3.67Å; D317-K1089 IonicContact OD2-NZ 2.68Å; D317-K1089 PolarHBondContact OD2-NZ 3.04Å; L318-K1089 HydrophobicContact CD2-CB 4.31Å; L318-K1089 HydrophobicContact CD2-CG 4.3Å; L1085-K1089 WeakPolarHBondContact O-CB 3.19Å; L1085-K1089 PolarHBondContact O-N 3.03Å; G1086-K1089 PolarHBondContact O-N 2.69Å; S1087-K1089 PolarHBondContact O-N 2.97Å; K1089-G1091 VanDerWaalsContact C-N 3.26Å; K1089-G1091 PolarHBondContact O-N 2.78Å; K1089-G1092 PolarHBondContact O-N 3.29Å
1090	S	83.1	Confident	81.4	Confident	110 Å²	110	61.7 Å²	61.7	77%	0.769	37%	0.371	S	S	*	.	H	α-helix	trans	-65	-27.7	175.2	-72.8	0	0	0	0	113.3	G1086 S1087 G1092	G1086-S1090 PolarHBondContact O-N 2.93Å; G1086-S1090 PolarHBondContact O-OG 3.31Å; S1087-S1090 PolarHBondContact O-N 3.01Å; S1090-G1092 PolarHBondContact O-N 2.92Å
1091	G	83.4	Confident	80.3	Confident	58 Å²	58	60.3 Å²	60.3	60%	0.598	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-2.9	172.8	0	0	0	0	0	115	S1087 W1088 K1089 N1093	S1087-G1091 PolarHBondContact O-N 3.33Å; W1088-G1091 PolarHBondContact O-N 3.33Å; K1089-G1091 VanDerWaalsContact C-N 3.26Å; K1089-G1091 PolarHBondContact O-N 2.78Å; G1091-N1093 VanDerWaalsContact C-N 3.28Å; G1091-N1093 PolarHBondContact O-N 2.96Å
1092	G	76.9	Confident	79.2	Confident	55 Å²	55	65.6 Å²	65.6	57%	0.567	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	5.8	178.5	0	0	0	0	0	114.8	K1089 S1090	K1089-G1092 PolarHBondContact O-N 3.29Å; S1090-G1092 PolarHBondContact O-N 2.92Å
1093	N	75.4	Confident	78.1	Confident	80 Å²	80	67.3 Å²	67.3	43%	0.428	41%	0.41	S	S	.	.			trans	-70.5	134.5	176.8	-68.5	-28.8	0	0	0	110.7	W1088 G1091	W1088-N1093 HydrophobicContact CD2-CB 3.67Å; W1088-N1093 HydrophobicContact CE3-CB 3.56Å; W1088-N1093 HydrophobicContact CG-CB 4.49Å; W1088-N1093 HydrophobicContact CH2-CB 3.67Å; W1088-N1093 HydrophobicContact CZ2-CB 3.76Å; W1088-N1093 HydrophobicContact CZ3-CB 3.53Å; W1088-N1093 PolarHBondContact NE1-ND2 2.98Å; G1091-N1093 VanDerWaalsContact C-N 3.28Å; G1091-N1093 PolarHBondContact O-N 2.96Å
1094	K	76.6	Confident	76.8	Confident	173 Å²	173	70.1 Å²	70.1	75%	0.752	42%	0.42	S	S	*	.			trans	-103.1	139.3	178.9	-58	-177.1	-177	-177.5	0	110.1
1095	G	72.3	Confident	75.6	Confident	19 Å²	19	70.7 Å²	70.7	20%	0.196	42%	0.421	C	S	.	.	S	Bend	trans	100.4	-160	-179.4	0	0	0	0	0	113.8	L318 W1088	L318-G1095 WeakPolarHBondContact CB-O 3.32Å; W1088-G1095 WeakPolarHBondContact CZ3-O 3.44Å
1096	L	76.5	Confident	74.8	Confident	68 Å²	68	70.8 Å²	70.8	36%	0.356	42%	0.422	S	S	.	.			trans	-108.5	137.6	178.1	-132.5	72.1	0	0	0	109.8	K315 L318 I1100	K315-L1096 HydrophobicContact CG-CD1 4.18Å; L318-L1096 HydrophobicContact CB-CD1 4.17Å; L318-L1096 HydrophobicContact CD1-CD1 4.41Å; L1096-I1100 HydrophobicContact CD2-CG2 3.94Å
1097	P	73	Confident	73.7	Confident	6 Å²	6	73.2 Å²	73.2	4%	0.039	43%	0.427	C	S	.	.			trans	-57.5	140.9	171.2	-17.6	23.6	0	0	0	112.2	L1085 W1088 W1099 I1100	L1085-P1097 HydrophobicContact CD1-CG 4.08Å; W1088-P1097 HydrophobicContact CD2-CG 3.68Å; W1088-P1097 HydrophobicContact CE3-CG 3.98Å; W1088-P1097 HydrophobicContact CG-CG 4.05Å; W1088-P1097 HydrophobicContact CH2-CG 4.38Å; W1088-P1097 HydrophobicContact CZ2-CB 4.25Å; W1088-P1097 HydrophobicContact CZ2-CG 4.11Å; W1088-P1097 HydrophobicContact CZ3-CG 4.34Å; P1097-W1099 VanDerWaalsContact C-N 3.29Å; P1097-W1099 HydrophobicContact CB-CD2 4.34Å; P1097-W1099 HydrophobicContact CB-CG 4.16Å; P1097-W1099 HydrophobicContact CB-CZ2 4.45Å; P1097-W1099 HydrophobicContact CG-CZ2 4.35Å; P1097-W1099 PolarHBondContact O-N 2.97Å; P1097-I1100 HydrophobicContact CB-CG1 4.31Å; P1097-I1100 HydrophobicContact CG-CD1 3.97Å; P1097-I1100 HydrophobicContact CG-CG1 4.28Å; P1097-I1100 PolarHBondContact O-N 3.29Å; P1097-I1100 VanDerWaalsContact O-N 3.16Å
1098	S	71.8	Confident	72.6	Confident	94 Å²	94	72 Å²	72	66%	0.657	42%	0.419	S	S	*	.	H	α-helix	trans	-59.7	-38.9	177.9	60.6	0	0	0	0	112.5	I1100 A1101 D1102	S1098-I1100 PolarHBondContact O-N 3.09Å; S1098-I1100 VanDerWaalsContact O-N 3.12Å; S1098-A1101 WeakPolarHBondContact O-CA 3.39Å; S1098-A1101 WeakPolarHBondContact O-CB 3.43Å; S1098-A1101 PolarHBondContact O-N 3.04Å; S1098-D1102 PolarHBondContact O-N 3.34Å
1099	W	77.4	Confident	71.8	Confident	88 Å²	88	70.1 Å²	70.1	33%	0.333	41%	0.414	S	S	.	.	H	α-helix	trans	-62	-21.8	180	66.5	-101.5	0	0	0	113.6	V1081 P1097 A1101 D1102 D1103 V1106	V1081-W1099 HydrophobicContact CG1-CH2 4.47Å; P1097-W1099 VanDerWaalsContact C-N 3.29Å; P1097-W1099 HydrophobicContact CB-CD2 4.34Å; P1097-W1099 HydrophobicContact CB-CG 4.16Å; P1097-W1099 HydrophobicContact CB-CZ2 4.45Å; P1097-W1099 HydrophobicContact CG-CZ2 4.35Å; P1097-W1099 PolarHBondContact O-N 2.97Å; W1099-A1101 VanDerWaalsContact C-N 3.28Å; W1099-A1101 PolarHBondContact O-N 3.35Å; W1099-D1102 PolarHBondContact O-N 3.26Å; W1099-D1103 HydrophobicContact CE3-CB 4.49Å; W1099-D1103 VanDerWaalsContact O-CB 3.24Å; W1099-D1103 WeakPolarHBondContact O-CB 3.38Å; W1099-D1103 PolarHBondContact O-N 2.85Å; W1099-V1106 HydrophobicContact CZ3-CG2 4.29Å
1100	I	73.4	Confident	70.9	Confident	5 Å²	5	66.5 Å²	66.5	3%	0.026	40%	0.398	C	S	.	.	H	α-helix	trans	-70.2	-27.6	173.1	-69	-173.3	0	0	0	111.2	L1085 L1096 P1097 S1098 V1106 Q1107	L1085-I1100 HydrophobicContact CD1-CD1 3.77Å; L1085-I1100 HydrophobicContact CD2-CD1 4.39Å; L1096-I1100 HydrophobicContact CD2-CG2 3.94Å; P1097-I1100 HydrophobicContact CB-CG1 4.31Å; P1097-I1100 HydrophobicContact CG-CD1 3.97Å; P1097-I1100 HydrophobicContact CG-CG1 4.28Å; P1097-I1100 PolarHBondContact O-N 3.29Å; P1097-I1100 VanDerWaalsContact O-N 3.16Å; S1098-I1100 PolarHBondContact O-N 3.09Å; S1098-I1100 VanDerWaalsContact O-N 3.12Å; I1100-V1106 HydrophobicContact CG2-CG1 4.06Å; I1100-Q1107 PolarHBondContact O-NE2 3.29Å
1101	A	64.7	Low	69.9	Low	73 Å²	73	66.6 Å²	66.6	60%	0.603	39%	0.39	S	S	*	.	H	α-helix	trans	-75.9	-34.3	171.6	0	0	0	0	0	112	S1098 W1099	S1098-A1101 WeakPolarHBondContact O-CA 3.39Å; S1098-A1101 WeakPolarHBondContact O-CB 3.43Å; S1098-A1101 PolarHBondContact O-N 3.04Å; W1099-A1101 VanDerWaalsContact C-N 3.28Å; W1099-A1101 PolarHBondContact O-N 3.35Å
1102	D	63.3	Low	68.7	Low	128 Å²	128	69.1 Å²	69.1	68%	0.684	38%	0.382	S	S	*	.	H	α-helix	trans	-79.4	-25.9	-179.9	-57	-43.8	0	0	0	113.4	S1098 W1099 E1104	S1098-D1102 PolarHBondContact O-N 3.34Å; W1099-D1102 PolarHBondContact O-N 3.26Å; D1102-E1104 PolarHBondContact O-N 3.48Å
1103	D	67.4	Low	67.7	Low	51 Å²	51	69 Å²	69	27%	0.273	37%	0.365	S	S	.	.			trans	-84.4	96.5	-176.7	-165.5	-25.2	0	0	0	112.4	W1099 T1105 V1106 Q1107	W1099-D1103 HydrophobicContact CE3-CB 4.49Å; W1099-D1103 VanDerWaalsContact O-CB 3.24Å; W1099-D1103 WeakPolarHBondContact O-CB 3.38Å; W1099-D1103 PolarHBondContact O-N 2.85Å; D1103-T1105 PolarHBondContact O-N 2.83Å; D1103-T1105 VanDerWaalsContact O-N 3.11Å; D1103-T1105 WeakPolarHBondContact OD1-CA 3.37Å; D1103-T1105 VanDerWaalsContact OD1-CB 3.3Å; D1103-T1105 WeakPolarHBondContact OD1-CB 3.48Å; D1103-T1105 PolarHBondContact OD1-N 3.04Å; D1103-T1105 PolarHBondContact OD1-OG1 3.38Å; D1103-V1106 HydrophobicContact CB-CB 4.32Å; D1103-V1106 HydrophobicContact CB-CG2 4.14Å; D1103-V1106 PolarHBondContact O-N 3.09Å; D1103-V1106 VanDerWaalsContact O-N 3.17Å; D1103-V1106 PolarHBondContact OD1-N 3.26Å; D1103-Q1107 PolarHBondContact O-N 2.9Å
1104	E	64.5	Low	66.7	Low	144 Å²	144	69.4 Å²	69.4	67%	0.673	36%	0.36	S	S	*	.	H	α-helix	trans	-51.7	-29	173.8	-65.2	179.8	167.3	0	0	113.4	D1102 S1108	D1102-E1104 PolarHBondContact O-N 3.48Å; E1104-S1108 WeakPolarHBondContact O-CB 3.21Å; E1104-S1108 PolarHBondContact O-N 3.14Å
1105	T	62.2	Low	65.3	Low	73 Å²	73	65.7 Å²	65.7	45%	0.448	35%	0.353	S	S	.	.	H	α-helix	trans	-72.5	-45.4	-179.8	73.2	0	0	0	0	111	D1103 S1108 I1109	D1103-T1105 PolarHBondContact O-N 2.83Å; D1103-T1105 VanDerWaalsContact O-N 3.11Å; D1103-T1105 WeakPolarHBondContact OD1-CA 3.37Å; D1103-T1105 VanDerWaalsContact OD1-CB 3.3Å; D1103-T1105 WeakPolarHBondContact OD1-CB 3.48Å; D1103-T1105 PolarHBondContact OD1-N 3.04Å; D1103-T1105 PolarHBondContact OD1-OG1 3.38Å; T1105-S1108 PolarHBondContact O-N 3.34Å; T1105-I1109 WeakPolarHBondContact O-CB 3.49Å; T1105-I1109 WeakPolarHBondContact O-CD1 3.23Å; T1105-I1109 VanDerWaalsContact O-CG1 3.23Å; T1105-I1109 WeakPolarHBondContact O-CG1 3.4Å; T1105-I1109 PolarHBondContact O-N 2.87Å
1106	V	68.4	Low	64	Low	3 Å²	3	68.9 Å²	68.9	2%	0.018	37%	0.368	C	S	.	.	H	α-helix	trans	-67	-40.1	177.4	-179.1	0	0	0	0	110.7	V1081 W1099 I1100 D1103 I1109 L1110	V1081-V1106 HydrophobicContact CG1-CG1 4.16Å; V1081-V1106 HydrophobicContact CG1-CG2 3.91Å; V1081-V1106 HydrophobicContact CG2-CG2 3.78Å; W1099-V1106 HydrophobicContact CZ3-CG2 4.29Å; I1100-V1106 HydrophobicContact CG2-CG1 4.06Å; D1103-V1106 HydrophobicContact CB-CB 4.32Å; D1103-V1106 HydrophobicContact CB-CG2 4.14Å; D1103-V1106 PolarHBondContact O-N 3.09Å; D1103-V1106 VanDerWaalsContact O-N 3.17Å; D1103-V1106 PolarHBondContact OD1-N 3.26Å; V1106-I1109 PolarHBondContact O-N 3.18Å; V1106-L1110 HydrophobicContact CG1-CD1 4.08Å; V1106-L1110 WeakPolarHBondContact O-CB 3.34Å; V1106-L1110 WeakPolarHBondContact O-CG 3.37Å; V1106-L1110 PolarHBondContact O-N 3.04Å
1107	Q	64	Low	62.1	Low	73 Å²	73	71 Å²	71	34%	0.341	38%	0.376	S	S	.	.	H	α-helix	trans	-64	-47.5	173.6	-67.3	-63.5	-21.4	0	0	111.8	I1100 D1103 I1109 L1110 D1111	I1100-Q1107 PolarHBondContact O-NE2 3.29Å; D1103-Q1107 PolarHBondContact O-N 2.9Å; Q1107-I1109 VanDerWaalsContact C-N 3.27Å; Q1107-I1109 PolarHBondContact O-N 3.14Å; Q1107-L1110 PolarHBondContact O-N 3.39Å; Q1107-D1111 WeakPolarHBondContact O-CB 3.39Å; Q1107-D1111 PolarHBondContact O-N 2.88Å
1108	S	63.9	Low	60	Low	58 Å²	58	78 Å²	78	41%	0.406	41%	0.414	S	S	.	.	H	α-helix	trans	-63.8	-31.7	178.2	-179	0	0	0	0	112.8	E1104 T1105 R1112	E1104-S1108 WeakPolarHBondContact O-CB 3.21Å; E1104-S1108 PolarHBondContact O-N 3.14Å; T1105-S1108 PolarHBondContact O-N 3.34Å; S1108-R1112 WeakPolarHBondContact O-CB 3.37Å; S1108-R1112 PolarHBondContact O-N 3.16Å
1109	I	65.6	Low	58.4	Low	28 Å²	28	77.8 Å²	77.8	14%	0.144	41%	0.41	C	S	.	.	H	α-helix	trans	-68.2	-53.5	172.4	-75.7	166.7	0	0	0	109.6	L1078 T1105 V1106 Q1107 D1111 R1112 Y1113	L1078-I1109 HydrophobicContact CD2-CD1 4.1Å; L1078-I1109 HydrophobicContact CD2-CG2 3.64Å; L1078-I1109 HydrophobicContact CG-CD1 4.43Å; T1105-I1109 WeakPolarHBondContact O-CB 3.49Å; T1105-I1109 WeakPolarHBondContact O-CD1 3.23Å; T1105-I1109 VanDerWaalsContact O-CG1 3.23Å; T1105-I1109 WeakPolarHBondContact O-CG1 3.4Å; T1105-I1109 PolarHBondContact O-N 2.87Å; V1106-I1109 PolarHBondContact O-N 3.18Å; Q1107-I1109 VanDerWaalsContact C-N 3.27Å; Q1107-I1109 PolarHBondContact O-N 3.14Å; I1109-D1111 PolarHBondContact O-N 3.34Å; I1109-R1112 WeakPolarHBondContact O-CB 3.34Å; I1109-R1112 PolarHBondContact O-N 3.12Å; I1109-Y1113 HydrophobicContact CG2-CD2 4.45Å; I1109-Y1113 VanDerWaalsContact O-CD2 3.27Å; I1109-Y1113 WeakPolarHBondContact O-CD2 3.25Å; I1109-Y1113 PolarHBondContact O-N 3.39Å
1110	L	65.1	Low	56.3	Low	10 Å²	10	80.5 Å²	80.5	5%	0.052	44%	0.436	C	S	.	.	H	α-helix	trans	-57.3	-50.2	-178.2	-84.2	170.9	0	0	0	112.2	L311 K315 V1106 Q1107 R1112 Y1113 Y1114	L311-L1110 HydrophobicContact CD2-CD1 4.37Å; L311-L1110 HydrophobicContact CD2-CD2 3.31Å; L311-L1110 HydrophobicContact CD2-CG 3.89Å; K315-L1110 HydrophobicContact CD-CD1 4.01Å; K315-L1110 HydrophobicContact CD-CD2 4.09Å; V1106-L1110 HydrophobicContact CG1-CD1 4.08Å; V1106-L1110 WeakPolarHBondContact O-CB 3.34Å; V1106-L1110 WeakPolarHBondContact O-CG 3.37Å; V1106-L1110 PolarHBondContact O-N 3.04Å; Q1107-L1110 PolarHBondContact O-N 3.39Å; L1110-R1112 VanDerWaalsContact C-N 3.28Å; L1110-R1112 PolarHBondContact O-N 3.33Å; L1110-Y1113 PolarHBondContact O-N 3.29Å; L1110-Y1113 VanDerWaalsContact O-N 3.07Å; L1110-Y1114 HydrophobicContact CB-CD2 4.23Å; L1110-Y1114 HydrophobicContact CB-CE2 4.15Å; L1110-Y1114 HydrophobicContact CD2-CE2 3.91Å; L1110-Y1114 VanDerWaalsContact O-CD2 3.24Å; L1110-Y1114 WeakPolarHBondContact O-CD2 3.48Å; L1110-Y1114 PolarHBondContact O-N 3.49Å
1111	D	62.7	Low	54.3	Low	112 Å²	112	84.7 Å²	84.7	60%	0.599	47%	0.471	S	S	*	.	H	α-helix	trans	-62.7	-36.4	-176.5	-161.5	52.2	0	0	0	111.8	Q1107 I1109 Y1113 Y1114	Q1107-D1111 WeakPolarHBondContact O-CB 3.39Å; Q1107-D1111 PolarHBondContact O-N 2.88Å; I1109-D1111 PolarHBondContact O-N 3.34Å; D1111-Y1113 VanDerWaalsContact C-N 3.25Å; D1111-Y1113 PolarHBondContact O-N 3.08Å; D1111-Y1114 PolarHBondContact O-N 2.76Å
1112	R	56.7	Low	52.8	Low	111 Å²	111	88.1 Å²	88.1	42%	0.419	48%	0.479	S	S	.	.	H	α-helix	trans	-57.9	-35.8	174.1	-165.5	179.4	-164.1	-164.2	3	112.8	E1006 S1108 I1109 L1110 T1115	E1006-R1112 IonicContact OE1-CZ 2.85Å; E1006-R1112 IonicContact OE1-NE 2.73Å; E1006-R1112 PolarHBondContact OE1-NE 3.13Å; E1006-R1112 IonicContact OE1-NH2 3.9Å; E1006-R1112 PolarHBondContact OE1-NH2 2.68Å; E1006-R1112 IonicContact OE2-NH2 2.73Å; S1108-R1112 WeakPolarHBondContact O-CB 3.37Å; S1108-R1112 PolarHBondContact O-N 3.16Å; I1109-R1112 WeakPolarHBondContact O-CB 3.34Å; I1109-R1112 PolarHBondContact O-N 3.12Å; L1110-R1112 VanDerWaalsContact C-N 3.28Å; L1110-R1112 PolarHBondContact O-N 3.33Å; R1112-T1115 PolarHBondContact O-OG1 3.02Å
1113	Y	57.2	Low	51.9	Low	53 Å²	53	88.4 Å²	88.4	21%	0.208	49%	0.492	C	S	.	.	H	α-helix	trans	-97	-24.3	-176.6	-72.8	-75.1	0	0	0	114.5	V308 I1109 L1110 D1111 T1115 T1116	V308-Y1113 HydrophobicContact CB-CD2 4.34Å; V308-Y1113 HydrophobicContact CB-CE2 4.34Å; V308-Y1113 HydrophobicContact CG1-CD1 3.69Å; V308-Y1113 HydrophobicContact CG1-CD2 3.6Å; V308-Y1113 HydrophobicContact CG1-CE1 4.08Å; V308-Y1113 HydrophobicContact CG1-CE2 4.05Å; V308-Y1113 HydrophobicContact CG1-CG 3.41Å; V308-Y1113 VanDerWaalsContact CG1-CG 3.41Å; V308-Y1113 HydrophobicContact CG2-CD2 3.75Å; V308-Y1113 HydrophobicContact CG2-CE1 4.28Å; V308-Y1113 HydrophobicContact CG2-CE2 3.4Å; V308-Y1113 VanDerWaalsContact CG2-CE2 3.4Å; V308-Y1113 HydrophobicContact CG2-CG 4.36Å; I1109-Y1113 HydrophobicContact CG2-CD2 4.45Å; I1109-Y1113 VanDerWaalsContact O-CD2 3.27Å; I1109-Y1113 WeakPolarHBondContact O-CD2 3.25Å; I1109-Y1113 PolarHBondContact O-N 3.39Å; L1110-Y1113 PolarHBondContact O-N 3.29Å; L1110-Y1113 VanDerWaalsContact O-N 3.07Å; D1111-Y1113 VanDerWaalsContact C-N 3.25Å; D1111-Y1113 PolarHBondContact O-N 3.08Å; Y1113-T1115 PolarHBondContact O-N 3.31Å; Y1113-T1116 PolarHBondContact O-N 3.36Å; Y1113-T1116 PolarHBondContact O-OG1 2.91Å
1114	Y	53.9	Low	50.8	Low	87 Å²	87	90 Å²	90	34%	0.341	51%	0.512	S	S	.	.	H	α-helix	trans	-60.5	-26.6	173.3	-91.5	-66.6	0	0	0	113.4	L312 K315 L1110 D1111 T1116	L312-Y1114 HydrophobicContact CD1-CE1 3.72Å; L312-Y1114 HydrophobicContact CD1-CE2 4.48Å; K315-Y1114 VanDerWaalsContact CD-OH 3.28Å; K315-Y1114 WeakPolarHBondContact CD-OH 3.2Å; K315-Y1114 WeakPolarHBondContact CE-OH 3.5Å; K315-Y1114 VanDerWaalsContact NZ-CE2 3.34Å; K315-Y1114 PolarHBondContact NZ-OH 3.3Å; L1110-Y1114 HydrophobicContact CB-CD2 4.23Å; L1110-Y1114 HydrophobicContact CB-CE2 4.15Å; L1110-Y1114 HydrophobicContact CD2-CE2 3.91Å; L1110-Y1114 VanDerWaalsContact O-CD2 3.24Å; L1110-Y1114 WeakPolarHBondContact O-CD2 3.48Å; L1110-Y1114 PolarHBondContact O-N 3.49Å; D1111-Y1114 PolarHBondContact O-N 2.76Å; Y1114-T1116 PolarHBondContact O-N 2.88Å
1115	T	48.3	Very low	49.5	Very low	96 Å²	96	87.1 Å²	87.1	59%	0.589	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-11	179.5	63	0	0	0	0	114.5	R1112 Y1113	R1112-T1115 PolarHBondContact O-OG1 3.02Å; Y1113-T1115 PolarHBondContact O-N 3.31Å
1116	T	44.8	Very low	48.4	Very low	86 Å²	86	94.4 Å²	94.4	53%	0.528	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-20.6	-173.5	31	0	0	0	0	116.6	Y1113 Y1114	Y1113-T1116 PolarHBondContact O-N 3.36Å; Y1113-T1116 PolarHBondContact O-OG1 2.91Å; Y1114-T1116 PolarHBondContact O-N 2.88Å
1117	E	35.7	Very low	46.9	Very low	111 Å²	111	99.3 Å²	99.3	52%	0.519	58%	0.581	S	S	.	*			trans	-123.3	95.2	-172.5	-64	-163.3	-177.8	0	0	113.4
1118	N	30.1	Very low	46	Very low	155 Å²	155	100.1 Å²	100.1	83%	0.829	59%	0.586	S	S	*	*			trans	-156.9	74.4	161.5	-98.7	-52.8	0	0	0	111.8
1119	P	37.5	Very low	45.1	Very low	89 Å²	89	103 Å²	103	58%	0.578	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-88.4	121	171.2	33.1	-29.1	0	0	0	111.4	A1121 L1133	P1119-A1121 PolarHBondContact O-N 3.47Å; P1119-L1133 HydrophobicContact CB-CD2 3.99Å; P1119-L1133 HydrophobicContact CG-CD2 4.29Å
1120	V	32.3	Very low	44	Very low	145 Å²	145	106.7 Å²	106.7	88%	0.879	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-64.2	125.7	173.4	178.6	0	0	0	0	110.1
1121	A	33	Very low	43.4	Very low	92 Å²	92	110.2 Å²	110.2	76%	0.76	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-81.3	125.7	175.7	0	0	0	0	0	111.4	P1119	P1119-A1121 PolarHBondContact O-N 3.47Å
1122	D	32.6	Very low	43.4	Very low	145 Å²	145	108.7 Å²	108.7	78%	0.775	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-74.9	147.6	168.8	-93.8	-36.5	0	0	0	110.8	A1124	D1122-A1124 PolarHBondContact O-N 2.88Å
1123	S	44	Very low	43.6	Very low	135 Å²	135	106.6 Å²	106.6	94%	0.944	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	18.9	-170.1	-43.4	0	0	0	0	116.9
1124	A	44.5	Very low	43.4	Very low	84 Å²	84	112.1 Å²	112.1	69%	0.694	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	21.7	-173.7	0	0	0	0	0	114.4	D1122 R1126	D1122-A1124 PolarHBondContact O-N 2.88Å; A1124-R1126 PolarHBondContact O-N 2.95Å
1125	G	36	Very low	43.9	Very low	83 Å²	83	111.6 Å²	111.6	86%	0.856	66%	0.66	S	S	*	*			trans	60.6	4.2	151	0	0	0	0	0	119.7
1126	R	40.6	Very low	44.6	Very low	226 Å²	226	111 Å²	111	85%	0.853	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-95.2	126	174.2	-69.5	-168.5	-175.7	-150.7	1.6	110.3	A1124 I1128	A1124-R1126 PolarHBondContact O-N 2.95Å; R1126-I1128 PolarHBondContact O-N 3.06Å
1127	A	36.5	Very low	45.6	Very low	107 Å²	107	110 Å²	110	88%	0.884	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-58.7	125.5	164.8	0	0	0	0	0	109.1
1128	I	44.8	Very low	46.8	Very low	89 Å²	89	105.8 Å²	105.8	46%	0.456	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-100.8	126.2	175.2	-60.9	176.3	0	0	0	106.7	R1126 D1132	R1126-I1128 PolarHBondContact O-N 3.06Å; I1128-D1132 HydrophobicContact CG2-CB 3.56Å
1129	D	45.5	Very low	48.7	Very low	118 Å²	118	103.2 Å²	103.2	63%	0.631	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-57.1	146.1	178.7	-92.2	-46.4	0	0	0	111.6	S1131 D1132 L1133	D1129-S1131 PolarHBondContact O-N 3.37Å; D1129-S1131 VanDerWaalsContact O-N 3.12Å; D1129-D1132 HydrophobicContact CB-CB 4.48Å; D1129-D1132 WeakPolarHBondContact O-CA 3.27Å; D1129-D1132 WeakPolarHBondContact O-CB 3.47Å; D1129-D1132 PolarHBondContact O-N 3.05Å; D1129-L1133 PolarHBondContact O-N 3.32Å
1130	P	43.1	Very low	50.2	Low	107 Å²	107	105.5 Å²	105.5	70%	0.695	61%	0.608	S	S	*	*	H	α-helix	trans	-55.4	-35.3	-179.8	-26.6	34.5	0	0	0	113.4	L1133 Y1134	P1130-L1133 PolarHBondContact O-N 3Å; P1130-Y1134 PolarHBondContact O-N 3.41Å
1131	S	52.3	Low	52	Low	84 Å²	84	103.4 Å²	103.4	59%	0.587	59%	0.59	S	S	*	*	H	α-helix	trans	-62.7	-39	172.9	-70.5	0	0	0	0	112.8	D1129 Y1134 Q1135	D1129-S1131 PolarHBondContact O-N 3.37Å; D1129-S1131 VanDerWaalsContact O-N 3.12Å; S1131-Y1134 PolarHBondContact O-N 3.45Å; S1131-Q1135 WeakPolarHBondContact O-CB 3.49Å; S1131-Q1135 WeakPolarHBondContact O-CG 3.38Å; S1131-Q1135 PolarHBondContact O-N 3.47Å
1132	D	61.7	Low	53.6	Low	79 Å²	79	101 Å²	101	42%	0.422	57%	0.566	S	S	.	*	H	α-helix	trans	-74.6	-33	177.3	-93.6	-0	0	0	0	111.9	I1128 D1129 Q1135 Q1136	I1128-D1132 HydrophobicContact CG2-CB 3.56Å; D1129-D1132 HydrophobicContact CB-CB 4.48Å; D1129-D1132 WeakPolarHBondContact O-CA 3.27Å; D1129-D1132 WeakPolarHBondContact O-CB 3.47Å; D1129-D1132 PolarHBondContact O-N 3.05Å; D1132-Q1135 PolarHBondContact O-N 2.82Å; D1132-Q1136 WeakPolarHBondContact O-CB 3.48Å; D1132-Q1136 WeakPolarHBondContact O-CG 3.42Å; D1132-Q1136 PolarHBondContact O-N 3Å
1133	L	61.8	Low	55.5	Low	68 Å²	68	102.5 Å²	102.5	36%	0.356	56%	0.561	S	S	.	*	H	α-helix	trans	-65.5	-41.8	170.8	-177.1	63.7	0	0	0	111.6	P1119 D1129 P1130 Q1136 T1137	P1119-L1133 HydrophobicContact CB-CD2 3.99Å; P1119-L1133 HydrophobicContact CG-CD2 4.29Å; D1129-L1133 PolarHBondContact O-N 3.32Å; P1130-L1133 PolarHBondContact O-N 3Å; L1133-Q1136 PolarHBondContact O-N 3.37Å; L1133-T1137 WeakPolarHBondContact O-CB 3.33Å; L1133-T1137 PolarHBondContact O-N 2.95Å; L1133-T1137 PolarHBondContact O-OG1 3.34Å
1134	Y	53.5	Low	56.4	Low	168 Å²	168	103 Å²	103	66%	0.659	55%	0.548	S	S	*	.	H	α-helix	trans	-62	-45.3	172.7	-177.1	-99.4	0	0	0	111.2	P1130 S1131 Q1136 T1137 A1138	P1130-Y1134 PolarHBondContact O-N 3.41Å; S1131-Y1134 PolarHBondContact O-N 3.45Å; Y1134-Q1136 PolarHBondContact O-N 2.88Å; Y1134-T1137 PolarHBondContact O-N 2.69Å; Y1134-A1138 WeakPolarHBondContact O-CB 3.33Å; Y1134-A1138 PolarHBondContact O-N 2.96Å
1135	Q	62.7	Low	57.1	Low	76 Å²	76	101.9 Å²	101.9	36%	0.355	54%	0.535	S	S	.	.	H	α-helix	trans	-62.5	-41.1	174.1	-75	-172.9	52.2	0	0	112.8	S1131 D1132 R1139	S1131-Q1135 WeakPolarHBondContact O-CB 3.49Å; S1131-Q1135 WeakPolarHBondContact O-CG 3.38Å; S1131-Q1135 PolarHBondContact O-N 3.47Å; D1132-Q1135 PolarHBondContact O-N 2.82Å; Q1135-R1139 VanDerWaalsContact O-CB 3.27Å; Q1135-R1139 WeakPolarHBondContact O-CB 3.17Å; Q1135-R1139 WeakPolarHBondContact O-CD 3.23Å; Q1135-R1139 WeakPolarHBondContact O-CG 3.28Å; Q1135-R1139 PolarHBondContact O-N 3.18Å
1136	Q	64.5	Low	58.6	Low	84 Å²	84	98.7 Å²	98.7	39%	0.393	50%	0.501	S	S	.	.	H	α-helix	trans	-63.8	-41.8	175.2	-81.9	-161.2	16.5	0	0	111.7	D1132 L1133 Y1134 R1139 K1140	D1132-Q1136 WeakPolarHBondContact O-CB 3.48Å; D1132-Q1136 WeakPolarHBondContact O-CG 3.42Å; D1132-Q1136 PolarHBondContact O-N 3Å; L1133-Q1136 PolarHBondContact O-N 3.37Å; Y1134-Q1136 PolarHBondContact O-N 2.88Å; Q1136-R1139 CarbonylContact O-C 3.58Å; Q1136-R1139 PolarHBondContact O-N 2.69Å; Q1136-K1140 WeakPolarHBondContact O-CB 3.41Å; Q1136-K1140 PolarHBondContact O-N 3.38Å
1137	T	65.4	Low	60.1	Low	66 Å²	66	92.7 Å²	92.7	41%	0.405	48%	0.482	S	S	.	.	H	α-helix	trans	-65.7	-47.1	179	-58.7	0	0	0	0	110.5	L1133 Y1134 R1139 K1140 I1141	L1133-T1137 WeakPolarHBondContact O-CB 3.33Å; L1133-T1137 PolarHBondContact O-N 2.95Å; L1133-T1137 PolarHBondContact O-OG1 3.34Å; Y1134-T1137 PolarHBondContact O-N 2.69Å; T1137-R1139 PolarHBondContact O-N 2.8Å; T1137-K1140 PolarHBondContact O-N 2.87Å; T1137-I1141 HydrophobicContact CG2-CD1 4Å; T1137-I1141 WeakPolarHBondContact O-CG1 3.36Å; T1137-I1141 PolarHBondContact O-N 2.9Å
1138	A	59.5	Low	61.3	Low	21 Å²	21	96.7 Å²	96.7	17%	0.174	47%	0.474	C	S	.	.	H	α-helix	trans	-57.7	-45.1	171.5	0	0	0	0	0	111.8	Y1134 K1140 I1141 V1142 I1178	Y1134-A1138 WeakPolarHBondContact O-CB 3.33Å; Y1134-A1138 PolarHBondContact O-N 2.96Å; A1138-K1140 PolarHBondContact O-N 2.73Å; A1138-I1141 PolarHBondContact O-N 3.43Å; A1138-V1142 WeakPolarHBondContact O-CB 3.36Å; A1138-V1142 VanDerWaalsContact O-CG2 3.27Å; A1138-V1142 WeakPolarHBondContact O-CG2 3.26Å; A1138-V1142 PolarHBondContact O-N 2.87Å; A1138-I1178 HydrophobicContact CB-CD1 4.47Å
1139	R	71.2	Confident	62.3	Low	102 Å²	102	95.5 Å²	95.5	39%	0.385	47%	0.471	S	S	.	.	H	α-helix	trans	-62.6	-39.5	175.5	-72	165.9	-169.5	-172.4	7.7	112.1	Q1135 Q1136 T1137 R1143	Q1135-R1139 VanDerWaalsContact O-CB 3.27Å; Q1135-R1139 WeakPolarHBondContact O-CB 3.17Å; Q1135-R1139 WeakPolarHBondContact O-CD 3.23Å; Q1135-R1139 WeakPolarHBondContact O-CG 3.28Å; Q1135-R1139 PolarHBondContact O-N 3.18Å; Q1136-R1139 CarbonylContact O-C 3.58Å; Q1136-R1139 PolarHBondContact O-N 2.69Å; T1137-R1139 PolarHBondContact O-N 2.8Å; R1139-R1143 WeakPolarHBondContact O-CB 3.32Å; R1139-R1143 WeakPolarHBondContact O-CD 3.34Å; R1139-R1143 WeakPolarHBondContact O-CG 3.45Å; R1139-R1143 PolarHBondContact O-N 2.99Å
1140	K	68.7	Low	63.2	Low	137 Å²	137	96.4 Å²	96.4	60%	0.596	47%	0.466	S	S	*	.	H	α-helix	trans	-63.3	-49.3	174.2	-88.9	179.6	175.4	171.7	0	110.8	Q1136 T1137 A1138 V1142 R1143 Q1144	Q1136-K1140 WeakPolarHBondContact O-CB 3.41Å; Q1136-K1140 PolarHBondContact O-N 3.38Å; T1137-K1140 PolarHBondContact O-N 2.87Å; A1138-K1140 PolarHBondContact O-N 2.73Å; K1140-V1142 PolarHBondContact O-N 3.11Å; K1140-R1143 PolarHBondContact O-N 2.97Å; K1140-Q1144 WeakPolarHBondContact O-CB 3.42Å; K1140-Q1144 PolarHBondContact O-N 3.49Å
1141	I	69.6	Low	64.5	Low	100 Å²	100	100 Å²	100	51%	0.513	47%	0.466	S	S	.	.	H	α-helix	trans	-60.9	-44.1	177.9	-66	165.3	0	0	0	111.2	T1137 A1138 Q1144 S1145	T1137-I1141 HydrophobicContact CG2-CD1 4Å; T1137-I1141 WeakPolarHBondContact O-CG1 3.36Å; T1137-I1141 PolarHBondContact O-N 2.9Å; A1138-I1141 PolarHBondContact O-N 3.43Å; I1141-Q1144 PolarHBondContact O-N 3.31Å; I1141-S1145 VanDerWaalsContact O-CB 3.31Å; I1141-S1145 WeakPolarHBondContact O-CB 3.33Å; I1141-S1145 PolarHBondContact O-N 2.74Å; I1141-S1145 PolarHBondContact O-OG 2.8Å
1142	V	67.9	Low	65.1	Low	41 Å²	41	100.9 Å²	100.9	25%	0.248	46%	0.463	C	S	.	.	H	α-helix	trans	-63.4	-42	176.3	171.2	0	0	0	0	111.4	A1138 K1140 S1145 A1146 L1169 L1173	A1138-V1142 WeakPolarHBondContact O-CB 3.36Å; A1138-V1142 VanDerWaalsContact O-CG2 3.27Å; A1138-V1142 WeakPolarHBondContact O-CG2 3.26Å; A1138-V1142 PolarHBondContact O-N 2.87Å; K1140-V1142 PolarHBondContact O-N 3.11Å; V1142-S1145 WeakPolarHBondContact CA-OG 3.49Å; V1142-S1145 PolarHBondContact O-OG 3.22Å; V1142-A1146 WeakPolarHBondContact O-CB 3.38Å; V1142-A1146 PolarHBondContact O-N 2.95Å; V1142-L1169 HydrophobicContact CG1-CD2 4.27Å; V1142-L1173 HydrophobicContact CG1-CD1 4.41Å; V1142-L1173 HydrophobicContact CG1-CD2 4.41Å; V1142-L1173 HydrophobicContact CG2-CD2 3.98Å
1143	R	72.8	Confident	65.3	Low	178 Å²	178	101.3 Å²	101.3	67%	0.672	46%	0.463	S	S	*	.	H	α-helix	trans	-65.1	-43.7	175.2	-74.1	167.8	-178.6	167	-1.2	112.1	R1139 K1140 A1146 H1147	R1139-R1143 WeakPolarHBondContact O-CB 3.32Å; R1139-R1143 WeakPolarHBondContact O-CD 3.34Å; R1139-R1143 WeakPolarHBondContact O-CG 3.45Å; R1139-R1143 PolarHBondContact O-N 2.99Å; K1140-R1143 PolarHBondContact O-N 2.97Å; R1143-A1146 PolarHBondContact O-N 3.39Å; R1143-H1147 WeakPolarHBondContact O-CB 3.39Å; R1143-H1147 PolarHBondContact O-N 2.73Å
1144	Q	63	Low	65.6	Low	145 Å²	145	100.6 Å²	100.6	68%	0.678	47%	0.467	S	S	*	.	H	α-helix	trans	-69.1	-41.2	-178.1	-160.4	179.4	24.3	0	0	111.5	K1140 I1141 H1147 R1148	K1140-Q1144 WeakPolarHBondContact O-CB 3.42Å; K1140-Q1144 PolarHBondContact O-N 3.49Å; I1141-Q1144 PolarHBondContact O-N 3.31Å; Q1144-H1147 PolarHBondContact O-N 3.4Å; Q1144-R1148 WeakPolarHBondContact O-CB 3.4Å; Q1144-R1148 PolarHBondContact O-N 2.72Å
1145	S	58.7	Low	66	Low	61 Å²	61	96.8 Å²	96.8	43%	0.427	47%	0.471	S	S	.	.	H	α-helix	trans	-65.3	-43.3	173.3	64	0	0	0	0	111.9	I1141 V1142 H1147 R1148 V1149	I1141-S1145 VanDerWaalsContact O-CB 3.31Å; I1141-S1145 WeakPolarHBondContact O-CB 3.33Å; I1141-S1145 PolarHBondContact O-N 2.74Å; I1141-S1145 PolarHBondContact O-OG 2.8Å; V1142-S1145 WeakPolarHBondContact CA-OG 3.49Å; V1142-S1145 PolarHBondContact O-OG 3.22Å; S1145-H1147 VanDerWaalsContact C-N 3.33Å; S1145-H1147 PolarHBondContact O-N 2.98Å; S1145-R1148 PolarHBondContact O-N 3.49Å; S1145-V1149 WeakPolarHBondContact O-CG2 3.33Å; S1145-V1149 PolarHBondContact O-N 3.17Å
1146	A	67.9	Low	66.2	Low	16 Å²	16	100.6 Å²	100.6	13%	0.132	49%	0.486	C	S	.	.	H	α-helix	trans	-60.7	-39.2	172.5	0	0	0	0	0	112.6	V1142 R1143 R1150 F1165 L1169	V1142-A1146 WeakPolarHBondContact O-CB 3.38Å; V1142-A1146 PolarHBondContact O-N 2.95Å; R1143-A1146 PolarHBondContact O-N 3.39Å; A1146-R1150 WeakPolarHBondContact O-CB 3.43Å; A1146-R1150 PolarHBondContact O-N 2.79Å; A1146-F1165 HydrophobicContact CB-CE1 4.49Å; A1146-F1165 HydrophobicContact CB-CZ 4.35Å; A1146-L1169 HydrophobicContact CB-CD1 4.08Å
1147	H	70.9	Confident	65.5	Low	100 Å²	100	100 Å²	100	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-68.8	-38.6	176.3	-162.6	-73.3	0	0	0	112.2	R1143 Q1144 S1145 R1150 R1151	R1143-H1147 WeakPolarHBondContact O-CB 3.39Å; R1143-H1147 PolarHBondContact O-N 2.73Å; Q1144-H1147 PolarHBondContact O-N 3.4Å; S1145-H1147 VanDerWaalsContact C-N 3.33Å; S1145-H1147 PolarHBondContact O-N 2.98Å; H1147-R1150 PolarHBondContact O-N 3.31Å; H1147-R1151 PolarHBondContact O-N 2.96Å
1148	R	61.3	Low	65.1	Low	190 Å²	190	103.4 Å²	103.4	72%	0.717	51%	0.514	S	S	*	.	H	α-helix	trans	-64.8	-43.9	174.2	-169.8	174.6	-175.1	167.5	2.4	111.3	Q1144 S1145 R1151 L1152	Q1144-R1148 WeakPolarHBondContact O-CB 3.4Å; Q1144-R1148 PolarHBondContact O-N 2.72Å; S1145-R1148 PolarHBondContact O-N 3.49Å; R1148-R1151 PolarHBondContact O-N 2.96Å; R1148-L1152 HydrophobicContact CG-CD1 4.28Å; R1148-L1152 WeakPolarHBondContact O-CB 3.29Å; R1148-L1152 WeakPolarHBondContact O-CG 3.44Å; R1148-L1152 PolarHBondContact O-N 3.46Å
1149	V	65.7	Low	64.3	Low	64 Å²	64	109 Å²	109	39%	0.388	54%	0.54	S	S	.	.	H	α-helix	trans	-62.2	-43.4	172.9	171.5	0	0	0	0	110.8	S1145 L1152 M1153	S1145-V1149 WeakPolarHBondContact O-CG2 3.33Å; S1145-V1149 PolarHBondContact O-N 3.17Å; V1149-L1152 PolarHBondContact O-N 2.85Å; V1149-M1153 HydrophobicContact CG1-CG 4.23Å; V1149-M1153 WeakPolarHBondContact O-CB 3.19Å; V1149-M1153 VanDerWaalsContact O-CG 3.3Å; V1149-M1153 WeakPolarHBondContact O-CG 3.3Å; V1149-M1153 PolarHBondContact O-N 2.94Å
1150	R	65.8	Low	63.3	Low	138 Å²	138	107.9 Å²	107.9	52%	0.521	55%	0.546	S	S	.	.	H	α-helix	trans	-63.1	-42.6	177.2	-166.8	-176.9	-65	165.2	-1.8	112.2	A1146 H1147 M1153 A1154	A1146-R1150 WeakPolarHBondContact O-CB 3.43Å; A1146-R1150 PolarHBondContact O-N 2.79Å; H1147-R1150 PolarHBondContact O-N 3.31Å; R1150-M1153 PolarHBondContact O-N 2.73Å; R1150-A1154 WeakPolarHBondContact O-CB 3.45Å; R1150-A1154 PolarHBondContact O-N 2.98Å
1151	R	69.9	Low	62.4	Low	183 Å²	183	105.4 Å²	105.4	69%	0.691	54%	0.544	S	S	*	.	H	α-helix	trans	-59.7	-46	171.5	-88.6	-169.2	176.7	175.4	0.5	111.8	H1147 R1148 M1153 A1154 A1155	H1147-R1151 PolarHBondContact O-N 2.96Å; R1148-R1151 PolarHBondContact O-N 2.96Å; R1151-M1153 VanDerWaalsContact C-N 3.33Å; R1151-M1153 PolarHBondContact O-N 2.76Å; R1151-A1154 PolarHBondContact O-N 2.85Å; R1151-A1155 WeakPolarHBondContact O-CB 3.43Å; R1151-A1155 PolarHBondContact O-N 3.42Å
1152	L	64	Low	61.4	Low	102 Å²	102	104.6 Å²	104.6	53%	0.534	55%	0.552	S	S	.	*	H	α-helix	trans	-65.1	-33	178.4	-74.1	167	0	0	0	113.1	R1148 V1149 K1156	R1148-L1152 HydrophobicContact CG-CD1 4.28Å; R1148-L1152 WeakPolarHBondContact O-CB 3.29Å; R1148-L1152 WeakPolarHBondContact O-CG 3.44Å; R1148-L1152 PolarHBondContact O-N 3.46Å; V1149-L1152 PolarHBondContact O-N 2.85Å; L1152-K1156 WeakPolarHBondContact O-CG 3.49Å; L1152-K1156 PolarHBondContact O-N 3.46Å
1153	M	67.3	Low	60.7	Low	87 Å²	87	106.5 Å²	106.5	43%	0.429	57%	0.567	S	S	.	*	H	α-helix	trans	-79.4	-33.8	175.9	-67	-60	-172.6	0	0	112.7	V1149 R1150 R1151 K1156 G1157 Q1158	V1149-M1153 HydrophobicContact CG1-CG 4.23Å; V1149-M1153 WeakPolarHBondContact O-CB 3.19Å; V1149-M1153 VanDerWaalsContact O-CG 3.3Å; V1149-M1153 WeakPolarHBondContact O-CG 3.3Å; V1149-M1153 PolarHBondContact O-N 2.94Å; R1150-M1153 PolarHBondContact O-N 2.73Å; R1151-M1153 VanDerWaalsContact C-N 3.33Å; R1151-M1153 PolarHBondContact O-N 2.76Å; M1153-K1156 CarbonylContact O-C 3.21Å; M1153-K1156 WeakPolarHBondContact O-CA 3.4Å; M1153-K1156 PolarHBondContact O-N 3.37Å; M1153-K1156 VanDerWaalsContact O-N 3.1Å; M1153-K1156 HydrophobicContact SD-CD 4.48Å; M1153-G1157 PolarHBondContact O-N 3.45Å; M1153-G1157 VanDerWaalsContact O-N 3.14Å; M1153-Q1158 PolarHBondContact O-N 2.89Å; M1153-Q1158 VanDerWaalsContact O-N 3.1Å
1154	A	67.3	Low	59.6	Low	53 Å²	53	102.7 Å²	102.7	44%	0.438	56%	0.56	S	S	.	*	H	α-helix	trans	-64.1	-43.2	170.2	0	0	0	0	0	111.3	R1150 R1151 K1156 G1157	R1150-A1154 WeakPolarHBondContact O-CB 3.45Å; R1150-A1154 PolarHBondContact O-N 2.98Å; R1151-A1154 PolarHBondContact O-N 2.85Å; A1154-K1156 PolarHBondContact O-N 3.29Å; A1154-G1157 PolarHBondContact O-N 3.34Å
1155	A	61.7	Low	59.1	Low	89 Å²	89	98.8 Å²	98.8	74%	0.736	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-17	171.1	0	0	0	0	0	113.6	R1151	R1151-A1155 WeakPolarHBondContact O-CB 3.43Å; R1151-A1155 PolarHBondContact O-N 3.42Å
1156	K	67.1	Low	58.7	Low	156 Å²	156	102.8 Å²	102.8	68%	0.678	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	5.5	171.8	-74.3	-177.9	174.1	-167.9	0	113.8	L1152 M1153 A1154 Q1158	L1152-K1156 WeakPolarHBondContact O-CG 3.49Å; L1152-K1156 PolarHBondContact O-N 3.46Å; M1153-K1156 CarbonylContact O-C 3.21Å; M1153-K1156 WeakPolarHBondContact O-CA 3.4Å; M1153-K1156 PolarHBondContact O-N 3.37Å; M1153-K1156 VanDerWaalsContact O-N 3.1Å; M1153-K1156 HydrophobicContact SD-CD 4.48Å; A1154-K1156 PolarHBondContact O-N 3.29Å; K1156-Q1158 PolarHBondContact O-N 2.94Å
1157	G	50.6	Low	57.9	Low	70 Å²	70	105.7 Å²	105.7	72%	0.722	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.8	16.3	178	0	0	0	0	0	115.6	M1153 A1154	M1153-G1157 PolarHBondContact O-N 3.45Å; M1153-G1157 VanDerWaalsContact O-N 3.14Å; A1154-G1157 PolarHBondContact O-N 3.34Å
1158	Q	56.3	Low	56.8	Low	138 Å²	138	108.4 Å²	108.4	65%	0.645	58%	0.581	S	S	*	*			trans	-119	95.2	-176.3	-68.6	-177.7	10.4	0	0	111.4	M1153 K1156 P1160	M1153-Q1158 PolarHBondContact O-N 2.89Å; M1153-Q1158 VanDerWaalsContact O-N 3.1Å; K1156-Q1158 PolarHBondContact O-N 2.94Å; Q1158-P1160 WeakPolarHBondContact O-CD 3.5Å
1159	L	43.4	Very low	56.3	Low	139 Å²	139	101.3 Å²	101.3	73%	0.728	56%	0.557	S	S	*	*			trans	-103	95.4	174.1	-92.9	154.3	0	0	0	110.6
1160	P	50.5	Low	55.5	Low	78 Å²	78	102.8 Å²	102.8	51%	0.506	56%	0.562	S	S	.	*			trans	-76	150	172.8	31	-34.6	0	0	0	111.7	Q1158	Q1158-P1160 WeakPolarHBondContact O-CD 3.5Å
1161	P	48.8	Very low	54.7	Low	86 Å²	86	100 Å²	100	56%	0.558	56%	0.564	S	S	*	*			trans	-61.3	144	-179.5	23.8	-33.7	0	0	0	112.7	S1163 N1164	P1161-S1163 VanDerWaalsContact C-N 3.29Å; P1161-S1163 PolarHBondContact O-N 3.36Å; P1161-S1163 VanDerWaalsContact O-N 3.13Å; P1161-N1164 PolarHBondContact O-N 3.47Å
1162	A	49.1	Very low	53.3	Low	83 Å²	83	96.3 Å²	96.3	69%	0.686	56%	0.557	S	S	*	*	H	α-helix	trans	-59.6	-30.9	-163.4	0	0	0	0	0	115.2	N1164 F1165 K1166	A1162-N1164 PolarHBondContact O-N 2.72Å; A1162-F1165 PolarHBondContact O-N 2.99Å; A1162-K1166 PolarHBondContact O-N 3.49Å; A1162-K1166 VanDerWaalsContact O-N 3.16Å
1163	S	53.3	Low	52.2	Low	81 Å²	81	92.9 Å²	92.9	57%	0.566	54%	0.539	S	S	*	.	H	α-helix	trans	-58.1	-45	178	52.5	0	0	0	0	112.4	P1161 F1165 K1166 S1167	P1161-S1163 VanDerWaalsContact C-N 3.29Å; P1161-S1163 PolarHBondContact O-N 3.36Å; P1161-S1163 VanDerWaalsContact O-N 3.13Å; S1163-F1165 VanDerWaalsContact C-N 3.32Å; S1163-F1165 PolarHBondContact O-N 3.42Å; S1163-K1166 PolarHBondContact O-N 2.62Å; S1163-S1167 PolarHBondContact O-N 3.06Å; S1163-S1167 PolarHBondContact O-OG 3.41Å
1164	N	50.2	Low	50.9	Low	98 Å²	98	93 Å²	93	52%	0.524	55%	0.553	S	S	.	*	H	α-helix	trans	-70.1	-27.8	179.6	-76.3	-24.5	0	0	0	112.9	P1161 A1162 K1168	P1161-N1164 PolarHBondContact O-N 3.47Å; A1162-N1164 PolarHBondContact O-N 2.72Å; N1164-K1168 PolarHBondContact O-N 2.9Å
1165	F	51.3	Low	49.7	Very low	63 Å²	63	95.8 Å²	95.8	28%	0.276	57%	0.565	S	S	.	*	H	α-helix	trans	-72.4	-45.1	176.5	-173.5	-103.2	0	0	0	111.5	A1146 A1162 S1163 S1167 K1168 L1169	A1146-F1165 HydrophobicContact CB-CE1 4.49Å; A1146-F1165 HydrophobicContact CB-CZ 4.35Å; A1162-F1165 PolarHBondContact O-N 2.99Å; S1163-F1165 VanDerWaalsContact C-N 3.32Å; S1163-F1165 PolarHBondContact O-N 3.42Å; F1165-S1167 VanDerWaalsContact C-N 3.32Å; F1165-S1167 PolarHBondContact O-N 3.34Å; F1165-K1168 PolarHBondContact O-N 3.08Å; F1165-L1169 HydrophobicContact CE1-CD1 3.74Å; F1165-L1169 HydrophobicContact CZ-CD1 4.06Å; F1165-L1169 WeakPolarHBondContact O-CB 3.35Å; F1165-L1169 PolarHBondContact O-N 3.16Å
1166	K	49.7	Very low	48.4	Very low	144 Å²	144	95.1 Å²	95.1	63%	0.626	55%	0.552	S	S	*	*	H	α-helix	trans	-58.7	-43.4	177.3	-165.4	172.9	-179.4	-178.3	0	111.1	A1162 S1163 L1169 N1170	A1162-K1166 PolarHBondContact O-N 3.49Å; A1162-K1166 VanDerWaalsContact O-N 3.16Å; S1163-K1166 PolarHBondContact O-N 2.62Å; K1166-L1169 PolarHBondContact O-N 3.37Å; K1166-N1170 WeakPolarHBondContact O-CB 3.48Å; K1166-N1170 PolarHBondContact O-N 3.07Å
1167	S	51.4	Low	46.9	Very low	78 Å²	78	93 Å²	93	55%	0.545	56%	0.564	S	S	.	*	H	α-helix	trans	-63.5	-43.2	176.2	-58.1	0	0	0	0	113.6	S1163 F1165 C1171	S1163-S1167 PolarHBondContact O-N 3.06Å; S1163-S1167 PolarHBondContact O-OG 3.41Å; F1165-S1167 VanDerWaalsContact C-N 3.32Å; F1165-S1167 PolarHBondContact O-N 3.34Å; S1167-C1171 WeakPolarHBondContact O-CB 3.4Å; S1167-C1171 PolarHBondContact O-N 3.41Å
1168	K	48.7	Very low	45.9	Very low	157 Å²	157	92.9 Å²	92.9	68%	0.683	55%	0.546	S	S	*	.	H	α-helix	trans	-68.2	-36.6	176.6	-78.1	-177.3	176.8	179.8	0	112.8	N1164 F1165 C1171 L1172	N1164-K1168 PolarHBondContact O-N 2.9Å; F1165-K1168 PolarHBondContact O-N 3.08Å; K1168-C1171 PolarHBondContact O-N 2.97Å; K1168-L1172 PolarHBondContact O-N 2.88Å; K1168-L1172 VanDerWaalsContact O-N 3.07Å
1169	L	50	Low	44.7	Very low	41 Å²	41	92.2 Å²	92.2	22%	0.215	56%	0.556	C	S	.	*	H	α-helix	trans	-70.8	-42.9	177.8	-139.5	179.1	0	0	0	111.1	V1142 A1146 F1165 K1166 C1171 L1172 L1173	V1142-L1169 HydrophobicContact CG1-CD2 4.27Å; A1146-L1169 HydrophobicContact CB-CD1 4.08Å; F1165-L1169 HydrophobicContact CE1-CD1 3.74Å; F1165-L1169 HydrophobicContact CZ-CD1 4.06Å; F1165-L1169 WeakPolarHBondContact O-CB 3.35Å; F1165-L1169 PolarHBondContact O-N 3.16Å; K1166-L1169 PolarHBondContact O-N 3.37Å; L1169-C1171 VanDerWaalsContact C-N 3.27Å; L1169-C1171 PolarHBondContact O-N 3.17Å; L1169-L1172 PolarHBondContact O-N 2.97Å; L1169-L1172 VanDerWaalsContact O-N 3.15Å; L1169-L1173 HydrophobicContact CD2-CD1 3.77Å; L1169-L1173 HydrophobicContact CD2-CD2 4.49Å; L1169-L1173 HydrophobicContact CD2-CG 3.8Å; L1169-L1173 WeakPolarHBondContact O-CG 3.36Å; L1169-L1173 PolarHBondContact O-N 3.03Å
1170	N	49.3	Very low	44	Very low	94 Å²	94	89.7 Å²	89.7	50%	0.503	54%	0.543	S	S	.	.	H	α-helix	trans	-59.7	-37.9	172.1	-77.5	9	0	0	0	111.9	K1166 L1173 A1174	K1166-N1170 WeakPolarHBondContact O-CB 3.48Å; K1166-N1170 PolarHBondContact O-N 3.07Å; N1170-L1173 PolarHBondContact O-N 3.26Å; N1170-A1174 WeakPolarHBondContact O-CB 3.48Å; N1170-A1174 PolarHBondContact O-N 2.87Å
1171	C	49.5	Very low	42.8	Very low	81 Å²	81	93.3 Å²	93.3	55%	0.547	56%	0.557	S	S	.	*	H	α-helix	trans	-66.3	-36.5	175.8	-168.7	0	0	0	0	112.8	S1167 K1168 L1169	S1167-C1171 WeakPolarHBondContact O-CB 3.4Å; S1167-C1171 PolarHBondContact O-N 3.41Å; K1168-C1171 PolarHBondContact O-N 2.97Å; L1169-C1171 VanDerWaalsContact C-N 3.27Å; L1169-C1171 PolarHBondContact O-N 3.17Å
1172	L	39.9	Very low	42.1	Very low	104 Å²	104	94.1 Å²	94.1	55%	0.545	56%	0.562	S	S	.	*	H	α-helix	trans	-68.1	-46.9	172.1	-81.4	162.3	0	0	0	111.9	K1168 L1169 A1174 T1175	K1168-L1172 PolarHBondContact O-N 2.88Å; K1168-L1172 VanDerWaalsContact O-N 3.07Å; L1169-L1172 PolarHBondContact O-N 2.97Å; L1169-L1172 VanDerWaalsContact O-N 3.15Å; L1172-A1174 VanDerWaalsContact C-N 3.3Å; L1172-A1174 PolarHBondContact O-N 3.36Å; L1172-T1175 PolarHBondContact O-N 3.4Å; L1172-T1175 PolarHBondContact O-OG1 3.23Å
1173	L	41.2	Very low	41.1	Very low	31 Å²	31	95.7 Å²	95.7	16%	0.162	57%	0.566	C	S	.	*	H	α-helix	trans	-62.4	-36.3	177.8	-70.9	172.3	0	0	0	112	V1142 L1169 N1170 T1175 T1176	V1142-L1173 HydrophobicContact CG1-CD1 4.41Å; V1142-L1173 HydrophobicContact CG1-CD2 4.41Å; V1142-L1173 HydrophobicContact CG2-CD2 3.98Å; L1169-L1173 HydrophobicContact CD2-CD1 3.77Å; L1169-L1173 HydrophobicContact CD2-CD2 4.49Å; L1169-L1173 HydrophobicContact CD2-CG 3.8Å; L1169-L1173 WeakPolarHBondContact O-CG 3.36Å; L1169-L1173 PolarHBondContact O-N 3.03Å; N1170-L1173 PolarHBondContact O-N 3.26Å; L1173-T1175 PolarHBondContact O-N 3.21Å; L1173-T1175 VanDerWaalsContact O-N 3.1Å; L1173-T1176 CarbonylContact O-C 3.28Å; L1173-T1176 PolarHBondContact O-N 3.43Å; L1173-T1176 PolarHBondContact O-OG1 3.43Å
1174	A	40.6	Very low	39.8	Very low	88 Å²	88	97.3 Å²	97.3	73%	0.727	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-15.9	174.6	0	0	0	0	0	114.1	N1170 L1172	N1170-A1174 WeakPolarHBondContact O-CB 3.48Å; N1170-A1174 PolarHBondContact O-N 2.87Å; L1172-A1174 VanDerWaalsContact C-N 3.3Å; L1172-A1174 PolarHBondContact O-N 3.36Å
1175	T	41.4	Very low	38.8	Very low	112 Å²	112	100.9 Å²	100.9	69%	0.687	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-7.6	174	60.7	0	0	0	0	114.3	L1172 L1173	L1172-T1175 PolarHBondContact O-N 3.4Å; L1172-T1175 PolarHBondContact O-OG1 3.23Å; L1173-T1175 PolarHBondContact O-N 3.21Å; L1173-T1175 VanDerWaalsContact O-N 3.1Å
1176	T	34.7	Very low	37.5	Very low	76 Å²	76	107.4 Å²	107.4	47%	0.466	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-122.3	108	175.9	51.3	0	0	0	0	108.2	L1173 I1178	L1173-T1176 CarbonylContact O-C 3.28Å; L1173-T1176 PolarHBondContact O-N 3.43Å; L1173-T1176 PolarHBondContact O-OG1 3.43Å; T1176-I1178 VanDerWaalsContact C-N 3.28Å; T1176-I1178 PolarHBondContact O-N 3.17Å
1177	A	35	Very low	36.6	Very low	112 Å²	112	106.3 Å²	106.3	93%	0.926	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	74.3	-163.2	0	0	0	0	0	116.7
1178	I	29.4	Very low	35.3	Very low	67 Å²	67	110 Å²	110	34%	0.344	64%	0.641	S	S	.	*			trans	-134.7	86.3	174.6	-51	179.4	0	0	0	106.4	A1138 T1176 I1180	A1138-I1178 HydrophobicContact CB-CD1 4.47Å; T1176-I1178 VanDerWaalsContact C-N 3.28Å; T1176-I1178 PolarHBondContact O-N 3.17Å; I1178-I1180 VanDerWaalsContact C-N 3.3Å; I1178-I1180 HydrophobicContact CG2-CD1 4.35Å; I1178-I1180 HydrophobicContact CG2-CG1 3.87Å; I1178-I1180 PolarHBondContact O-N 3.12Å
1179	S	31.2	Very low	34.2	Very low	123 Å²	123	107.6 Å²	107.6	86%	0.86	65%	0.651	S	S	*	*			trans	-71.4	83	176.6	-63.6	0	0	0	0	110.6	L1181	S1179-L1181 PolarHBondContact O-N 3.43Å; S1179-L1181 VanDerWaalsContact O-N 3.14Å
1180	I	28.1	Very low	33.2	Very low	87 Å²	87	114.4 Å²	114.4	45%	0.446	68%	0.681	S	S	.	*			trans	-77.4	96	168.6	-52	-179.4	0	0	0	107.6	I1178	I1178-I1180 VanDerWaalsContact C-N 3.3Å; I1178-I1180 HydrophobicContact CG2-CD1 4.35Å; I1178-I1180 HydrophobicContact CG2-CG1 3.87Å; I1178-I1180 PolarHBondContact O-N 3.12Å
1181	L	26.9	Very low	32	Very low	154 Å²	154	115.1 Å²	115.1	81%	0.806	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-54.8	129.9	163.8	-95.3	138.8	0	0	0	108.5	S1179	S1179-L1181 PolarHBondContact O-N 3.43Å; S1179-L1181 VanDerWaalsContact O-N 3.14Å
1182	P	33.4	Very low	31.1	Very low	102 Å²	102	119.5 Å²	119.5	66%	0.662	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-65.5	144.5	178.8	28.5	-34	0	0	0	109.7	S1184	P1182-S1184 PolarHBondContact O-N 3.3Å
1183	P	27.3	Very low	30.2	Very low	117 Å²	117	124.6 Å²	124.6	76%	0.76	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-63.4	129.1	171.5	28.4	-33.1	0	0	0	108.6	E1185	P1183-E1185 PolarHBondContact O-N 3.25Å
1184	S	27	Very low	29.7	Very low	115 Å²	115	131.3 Å²	131.3	80%	0.804	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-57.9	119.7	171.5	-50.8	0	0	0	0	108.9	P1182 E1186	P1182-S1184 PolarHBondContact O-N 3.3Å; S1184-E1186 PolarHBondContact O-N 3.03Å
1185	E	28.3	Very low	28.9	Very low	173 Å²	173	133.5 Å²	133.5	81%	0.808	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-70.2	118	168.4	-73.1	176.8	166.4	0	0	107.6	P1183 T1187	P1183-E1185 PolarHBondContact O-N 3.25Å; E1185-T1187 PolarHBondContact O-N 3.35Å
1186	E	24.9	Very low	28.1	Very low	200 Å²	200	136.6 Å²	136.6	94%	0.935	77%	0.767	S	S	*	*			trans	-62.5	99	179.1	-66.3	177.1	139.3	0	0	109.5	S1184	S1184-E1186 PolarHBondContact O-N 3.03Å
1187	T	29.3	Very low	27.8	Very low	121 Å²	121	137.5 Å²	137.5	74%	0.742	78%	0.777	S	S	*	*			trans	-126.4	103	166.7	40.2	0	0	0	0	109.5	E1185	E1185-T1187 PolarHBondContact O-N 3.35Å
1188	D	26	Very low	27.4	Very low	154 Å²	154	137.4 Å²	137.4	82%	0.824	77%	0.769	S	S	*	*			trans	42.7	114.1	161.8	-59.7	-34.6	0	0	0	120.3	Q1190	D1188-Q1190 PolarHBondContact O-N 3.34Å
1189	A	25.4	Very low	27.2	Very low	108 Å²	108	143.4 Å²	143.4	89%	0.893	80%	0.796	S	S	*	*			trans	-61.4	113.3	170.5	0	0	0	0	0	112.3
1190	Q	28.1	Very low	27.4	Very low	184 Å²	184	143.7 Å²	143.7	86%	0.86	80%	0.795	S	S	*	*			trans	-116.9	115.1	156	-68.4	-165.3	0.8	0	0	110	D1188 L1192	D1188-Q1190 PolarHBondContact O-N 3.34Å; Q1190-L1192 PolarHBondContact O-N 3.38Å
1191	S	25.3	Very low	27.7	Very low	108 Å²	108	148.1 Å²	148.1	76%	0.755	85%	0.845	S	S	*	*			trans	-61.9	117.5	-179.9	-74	0	0	0	0	111.6
1192	L	29	Very low	27.7	Very low	174 Å²	174	147.9 Å²	147.9	91%	0.911	85%	0.847	S	S	*	*			trans	-104.4	74.5	154.4	-70.3	178.4	0	0	0	109.4	Q1190	Q1190-L1192 PolarHBondContact O-N 3.38Å
1193	R	22.6	Very low	27.5	Very low	211 Å²	211	150.3 Å²	150.3	80%	0.796	86%	0.857	S	S	*	*			trans	-67	124	153.9	-76.4	179.5	172.4	167.3	-3.9	107.6
1194	L	28.6	Very low	27.5	Very low	172 Å²	172	152.1 Å²	152.1	90%	0.901	86%	0.862	S	S	*	*			trans	-130.8	129	145.2	-77.2	179.2	0	0	0	108.1
1195	N	25.2	Very low	27.5	Very low	133 Å²	133	154.3 Å²	154.3	71%	0.711	87%	0.865	S	S	*	*			trans	-77.3	142.8	-164.6	-63.6	-34	0	0	0	111.6
1196	I	24.7	Very low	27.4	Very low	177 Å²	177	153.1 Å²	153.1	91%	0.908	87%	0.869	S	S	*	*			trans	-90.2	100.5	157.1	-59.8	173.5	0	0	0	106.2
1197	S	27.7	Very low	27.6	Very low	95 Å²	95	150 Å²	150	66%	0.664	86%	0.864	S	S	*	*			trans	-129.5	110.6	170.6	-71.8	0	0	0	0	109.9
1198	S	26	Very low	27.5	Very low	110 Å²	110	152.1 Å²	152.1	77%	0.769	87%	0.873	S	S	*	*			trans	21.7	118.2	144	57.3	0	0	0	0	119.7
1199	E	26.9	Very low	27.6	Very low	194 Å²	194	151.9 Å²	151.9	91%	0.907	88%	0.877	S	S	*	*			trans	-138.8	143.2	135.7	-117.9	179	179.9	0	0	108.8
1200	P	34.7	Very low	27.8	Very low	128 Å²	128	155.6 Å²	155.6	83%	0.831	88%	0.876	S	S	*	*			trans	-107.8	145	-164.2	38.3	-31.6	0	0	0	115.3
1201	A	34.5	Very low	27.7	Very low	181 Å²	181	153 Å²	153	100%	1.496	88%	0.877	S	S	*	*			trans	-152.5	0	155.5	0	0	0	0	0	108.9

Retrieved 1,201 of 1,201 residues in 514.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).