A0A087XJR3_POEFO Loading...

F-box DNA helicase 1

AlphaFold DB , UniProt , Accession A0A087XJR3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,057 aa.

						>A0A087XJR3_POEFO|A0A087XJR3
MEVAVKGRAKRKHLNAQECDELQRREDGTDALTRRNAARGRRDPNWGLYPRTPTKQRRKGPFVLGSPSGQQKAIHDFFSVTKVISSSPHKSSAMPSTSTHRAGPGVVFEDDEEEEDDDDVSLLANPTAAEVIAEDEIDDDSLLAAEMLPEKVSSAEARLLEADYLEGMTAEMFGDDEDFDDFEEEEGEVEPLPDVHFGLLSSDKVLLRPQGCVDDLPEEVLREVLCLVPAADLYRNVCLVCHRWRNIVLDPKFVPFKKQYFRYMMKEKETVLEVCSTLKNSNITCPAPSEHSIRNLVVLMAQHKVGERVKPDDVLSCVKKHRLFPQAEATIRLRIPDIQKFLPLGIEGPNPYAAMAVILVLSESVGDVQALVSLLSRCMSLTTITEYLSHMAMMLLALERNKIKISYRLHYNIYYVLYLLENGPFCTNSNQNGLPQIHLTREQQEILSHDIQDDHVVKIVAFAGTGKTTTLVRYAAQRPHLRFLYVAFNNSVASEARRRFPPNVDCKTAHSLAYSEVGRRYKTHEKLTFNVKPFSINLALTPGAGGYSRAKVVATILNTFMASADQTIGPQHVPYDYAICKGRRKIIDPDEQQFFIAEAKGIWNKMKDVREKSKQAYYMPHDGYLKLWQLRDPKPCLTERYDAIFIDEAQDCTPAIMDVLLAQHCGKILVGDPHQQIYTFKGAVNALRAVHHTHIFYLTQSFRFGAEIAFVGAAILKVCKGVKKILVGGMQKSGVCDETAEKALEAMKKGESCNRGKIGVLSRCNLGVFKGAVQLTDANQQCRIHFIGGVKNIGLEKIMDIYHLMTHGGQESKRRAIKDPLIRTFFSSKRDPYLTFKEYIIQTEDKELDGKLSIVEKYRERIPELVARLKACAETDFHQADFIVGTVHKAKGLEFDTVIVTDDFVTVPASGHNLCRIQDFSFSKIPDDEWNLLYVAVTRAMSSLVITKNILRILTVAGEYFLKSKMPSSLAAGGGPLPCSISECPNCVTPGSAFVMARQKMQCTECVTNEGPLCERCVWTRIGPTAFLMTDDVLSMAEIPQQLHVPIHHPFFLELFF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.4	Very low	29.7	Very low	232 Å²	232	164.7 Å²	164.7	100%	1.143	86%	0.86	S	S	*	*				0	96.8	0	-69.2	175.1	-159.7	0	0	106
2	E	26.8	Very low	30	Very low	183 Å²	183	165.3 Å²	165.3	86%	0.855	85%	0.85	S	S	*	*				81.3	135.9	115.1	-68.7	-167.1	157.1	0	0	111.6
3	V	28.9	Very low	30.6	Very low	120 Å²	120	166.2 Å²	166.2	73%	0.727	85%	0.848	S	S	*	*			cis	-169.1	137.8	-2.5	139.8	0	0	0	0	103.8
4	A	27.9	Very low	32	Very low	86 Å²	86	161.8 Å²	161.8	71%	0.711	83%	0.827	S	S	*	*			trans	54.6	152.9	149.5	0	0	0	0	0	121.1
5	V	31.3	Very low	33.8	Very low	121 Å²	121	156.5 Å²	156.5	73%	0.733	80%	0.801	S	S	*	*			cis	-176.8	157.1	-1.7	138.1	0	0	0	0	106
6	K	32.1	Very low	34.9	Very low	199 Å²	199	151.8 Å²	151.8	87%	0.865	79%	0.792	S	S	*	*			trans	85.7	88.3	166.6	-77.6	159.2	-173.9	-178.9	0	118.7
7	G	29.8	Very low	35.6	Very low	84 Å²	84	151.5 Å²	151.5	87%	0.866	79%	0.786	S	S	*	*			trans	-91.8	112.9	158.6	0	0	0	0	0	112
8	R	30.5	Very low	36.6	Very low	239 Å²	239	146.2 Å²	146.2	90%	0.902	76%	0.757	S	S	*	*			trans	-83.7	124	160.5	-73.4	175.7	171.6	176.1	-3.2	107.7	K10	R8-K10 PolarHBondContact O-N 3.07Å
9	A	30.7	Very low	37.3	Very low	105 Å²	105	141.9 Å²	141.9	87%	0.868	74%	0.74	S	S	*	*			trans	-74.1	111.2	168.2	0	0	0	0	0	109.2
10	K	29.6	Very low	38	Very low	203 Å²	203	138.6 Å²	138.6	88%	0.883	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-76.4	124.8	169.9	-73.3	-179.5	176.3	179.1	0	108.6	R8 K12	R8-K10 PolarHBondContact O-N 3.07Å; K10-K12 PolarHBondContact O-N 2.76Å
11	R	33.3	Very low	38.6	Very low	240 Å²	240	138.1 Å²	138.1	91%	0.906	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-67	119.8	162.7	-73.8	-179.9	176.9	176.3	-2.1	107.8
12	K	33.7	Very low	39.8	Very low	171 Å²	171	132.8 Å²	132.8	74%	0.743	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-87.1	118.9	173.2	-153	-171.9	-177.3	-149.5	0	107.2	K10 E18	K10-K12 PolarHBondContact O-N 2.76Å; K12-E18 IonicContact NZ-OE1 2.76Å
13	H	37.4	Very low	40.6	Very low	177 Å²	177	131.7 Å²	131.7	82%	0.819	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-80.3	125.4	168	-86.7	-70.7	0	0	0	108.2
14	L	51.3	Low	41.5	Very low	105 Å²	105	135.5 Å²	135.5	55%	0.55	69%	0.689	S	S	.	*	P	Polyproline II helix	trans	-68.1	136.3	171.2	-65.1	168.7	0	0	0	108.7	E18	L14-E18 WeakPolarHBondContact CA-OE2 3.26Å; L14-E18 HydrophobicContact CD2-CB 4.2Å; L14-E18 WeakPolarHBondContact CD2-OE2 2.91Å
15	N	58.6	Low	42.2	Very low	82 Å²	82	140.6 Å²	140.6	44%	0.439	69%	0.69	S	S	.	*	P	Polyproline II helix	trans	-86.9	165.3	174.8	61.3	27.1	0	0	0	110.6	Q17 E18 C19	N15-Q17 PolarHBondContact O-N 3.25Å; N15-Q17 VanDerWaalsContact O-N 3.1Å; N15-Q17 PolarHBondContact OD1-N 3.49Å; N15-E18 PolarHBondContact N-OE2 3.46Å; N15-E18 PolarHBondContact O-N 3.46Å; N15-E18 VanDerWaalsContact O-N 3.12Å; N15-E18 WeakPolarHBondContact OD1-CB 3.46Å; N15-E18 WeakPolarHBondContact OD1-CG 3.39Å; N15-E18 PolarHBondContact OD1-N 3.19Å; N15-C19 PolarHBondContact O-N 3.33Å
16	A	50.5	Low	42.8	Very low	81 Å²	81	143.7 Å²	143.7	67%	0.669	70%	0.697	S	S	*	*	H	α-helix	trans	-57.7	-28	-176.1	0	0	0	0	0	113	D20	A16-D20 PolarHBondContact O-N 3.26Å; A16-D20 VanDerWaalsContact O-N 3.09Å
17	Q	48	Very low	43.4	Very low	147 Å²	147	142.1 Å²	142.1	69%	0.687	70%	0.698	S	S	*	*	H	α-helix	trans	-76	-37.3	-179.7	-144	172	-4	0	0	112.2	N15 C19 D20 E21	N15-Q17 PolarHBondContact O-N 3.25Å; N15-Q17 VanDerWaalsContact O-N 3.1Å; N15-Q17 PolarHBondContact OD1-N 3.49Å; Q17-C19 VanDerWaalsContact C-N 3.33Å; Q17-D20 PolarHBondContact O-N 3.08Å; Q17-E21 PolarHBondContact O-N 3.48Å; Q17-E21 VanDerWaalsContact O-N 3.14Å
18	E	52.3	Low	44	Very low	57 Å²	57	141.2 Å²	141.2	27%	0.266	69%	0.688	S	S	.	*	H	α-helix	trans	-69.8	-28.6	173.1	-73.2	170.6	157.9	0	0	112	K12 L14 N15 L22	K12-E18 IonicContact NZ-OE1 2.76Å; L14-E18 WeakPolarHBondContact CA-OE2 3.26Å; L14-E18 HydrophobicContact CD2-CB 4.2Å; L14-E18 WeakPolarHBondContact CD2-OE2 2.91Å; N15-E18 PolarHBondContact N-OE2 3.46Å; N15-E18 PolarHBondContact O-N 3.46Å; N15-E18 VanDerWaalsContact O-N 3.12Å; N15-E18 WeakPolarHBondContact OD1-CB 3.46Å; N15-E18 WeakPolarHBondContact OD1-CG 3.39Å; N15-E18 PolarHBondContact OD1-N 3.19Å; E18-L22 PolarHBondContact O-N 3.34Å
19	C	51.2	Low	44.4	Very low	64 Å²	64	135.6 Å²	135.6	43%	0.432	68%	0.681	S	S	.	*	H	α-helix	trans	-73	-39.4	171.7	-74.1	0	0	0	0	112.6	N15 Q17 E21 L22 Q23	N15-C19 PolarHBondContact O-N 3.33Å; Q17-C19 VanDerWaalsContact C-N 3.33Å; C19-E21 VanDerWaalsContact C-N 3.31Å; C19-E21 PolarHBondContact O-N 3.3Å; C19-L22 PolarHBondContact O-N 2.99Å; C19-Q23 PolarHBondContact O-N 3.08Å
20	D	50.9	Low	44.5	Very low	76 Å²	76	138.2 Å²	138.2	41%	0.406	68%	0.68	S	S	.	*	H	α-helix	trans	-67.2	-30.4	176.6	-88.7	7.7	0	0	0	112.5	A16 Q17 Q23 R24	A16-D20 PolarHBondContact O-N 3.26Å; A16-D20 VanDerWaalsContact O-N 3.09Å; Q17-D20 PolarHBondContact O-N 3.08Å; D20-Q23 PolarHBondContact O-N 2.97Å; D20-R24 WeakPolarHBondContact O-CG 2.87Å
21	E	50.5	Low	44.7	Very low	128 Å²	128	133.2 Å²	133.2	60%	0.598	68%	0.677	S	S	*	*	H	α-helix	trans	-72.3	-31	173.9	-78.2	-177.4	173.4	0	0	113.1	Q17 C19 Q23 R24	Q17-E21 PolarHBondContact O-N 3.48Å; Q17-E21 VanDerWaalsContact O-N 3.14Å; C19-E21 VanDerWaalsContact C-N 3.31Å; C19-E21 PolarHBondContact O-N 3.3Å; E21-Q23 VanDerWaalsContact C-N 3.33Å; E21-R24 PolarHBondContact O-N 3.17Å
22	L	50	Low	44.7	Very low	120 Å²	120	129.6 Å²	129.6	63%	0.628	67%	0.674	S	S	*	*	H	α-helix	trans	-71.4	-29.1	172.9	-98.6	151.1	0	0	0	112.3	E18 C19 R24	E18-L22 PolarHBondContact O-N 3.34Å; C19-L22 PolarHBondContact O-N 2.99Å; L22-R24 VanDerWaalsContact C-N 3.28Å; L22-R24 PolarHBondContact O-N 2.71Å
23	Q	44.6	Very low	44.6	Very low	160 Å²	160	127.8 Å²	127.8	75%	0.748	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-16	177.3	-158.6	176.5	6.3	0	0	113.3	C19 D20 E21	C19-Q23 PolarHBondContact O-N 3.08Å; D20-Q23 PolarHBondContact O-N 2.97Å; E21-Q23 VanDerWaalsContact C-N 3.33Å
24	R	48.3	Very low	44.1	Very low	200 Å²	200	131.2 Å²	131.2	76%	0.755	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	6.2	-175.7	-67.8	-177.6	-166.2	157.9	8.4	115	D20 E21 L22	D20-R24 WeakPolarHBondContact O-CG 2.87Å; E21-R24 PolarHBondContact O-N 3.17Å; L22-R24 VanDerWaalsContact C-N 3.28Å; L22-R24 PolarHBondContact O-N 2.71Å
25	R	42.6	Very low	43.1	Very low	193 Å²	193	137.3 Å²	137.3	73%	0.728	70%	0.699	S	S	*	*			trans	-94	130.3	173.3	-71.2	-172.4	175.2	-167.7	-1.2	110.4	D27 G28	R25-D27 PolarHBondContact O-N 3.02Å; R25-D27 VanDerWaalsContact O-N 3.14Å; R25-G28 PolarHBondContact O-N 2.72Å
26	E	43.8	Very low	41.6	Very low	187 Å²	187	141.4 Å²	141.4	87%	0.874	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-69.2	-3.9	-177.4	-72	-173.2	152	0	0	114.8	G28	E26-G28 VanDerWaalsContact C-N 3.3Å; E26-G28 PolarHBondContact O-N 2.88Å
27	D	44.1	Very low	40.6	Very low	165 Å²	165	142.1 Å²	142.1	88%	0.882	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-86.3	7.8	176.6	-65.5	-27.5	0	0	0	113.9	R25	R25-D27 PolarHBondContact O-N 3.02Å; R25-D27 VanDerWaalsContact O-N 3.14Å
28	G	42.3	Very low	39.5	Very low	65 Å²	65	140.1 Å²	140.1	67%	0.67	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-92.7	-5.5	-171.5	0	0	0	0	0	116.9	R25 E26	R25-G28 PolarHBondContact O-N 2.72Å; E26-G28 VanDerWaalsContact C-N 3.3Å; E26-G28 PolarHBondContact O-N 2.88Å
29	T	38.2	Very low	38.4	Very low	121 Å²	121	149.7 Å²	149.7	74%	0.742	77%	0.77	S	S	*	*	S	Bend	trans	-114	-5.2	-165.3	28	0	0	0	0	117.1
30	D	33.9	Very low	37.3	Very low	161 Å²	161	150.5 Å²	150.5	86%	0.861	79%	0.788	S	S	*	*	S	Bend	trans	-107.4	7.3	-168.8	-93	-6.4	0	0	0	117.2
31	A	33.1	Very low	36.3	Very low	98 Å²	98	158.5 Å²	158.5	81%	0.81	81%	0.813	S	S	*	*	S	Bend	trans	-95.3	5.7	-175.1	0	0	0	0	0	116.1
32	L	33.2	Very low	35.4	Very low	163 Å²	163	163.5 Å²	163.5	85%	0.853	83%	0.827	S	S	*	*	S	Bend	trans	-139.1	55.2	-175.6	-72.5	171.8	0	0	0	113.1
33	T	32.4	Very low	34.9	Very low	133 Å²	133	164.9 Å²	164.9	82%	0.816	83%	0.834	S	S	*	*	S	Bend	trans	-164.1	127.1	149.8	27.5	0	0	0	0	113.5
34	R	27.1	Very low	34.3	Very low	250 Å²	250	162.7 Å²	162.7	94%	0.943	83%	0.834	S	S	*	*			trans	88.2	131.3	157.6	-72	-174.8	167.7	-173.9	-3.5	121.5
35	R	29.2	Very low	33.5	Very low	232 Å²	232	158.8 Å²	158.8	88%	0.875	83%	0.828	S	S	*	*			trans	-70	145.1	169.2	-70.2	172.5	168.3	171.3	-4.8	111.2
36	N	27.7	Very low	32.8	Very low	168 Å²	168	161.2 Å²	161.2	90%	0.898	84%	0.838	S	S	*	*				-172.2	157.3	120.8	-96.6	-13	0	0	0	113.6
37	A	28.7	Very low	32.1	Very low	96 Å²	96	155.5 Å²	155.5	79%	0.793	83%	0.829	S	S	*	*			trans	-53.4	150	-167.8	0	0	0	0	0	118.2
38	A	26.3	Very low	31.3	Very low	106 Å²	106	156 Å²	156	88%	0.876	83%	0.831	S	S	*	*				177.1	149	117.5	0	0	0	0	0	112.2
39	R	29.4	Very low	30.6	Very low	258 Å²	258	163.7 Å²	163.7	97%	0.974	84%	0.841	S	S	*	*			trans	-56.1	147.6	-179.1	-71.9	168.6	164.4	175.3	-4.2	114.7
40	G	26.3	Very low	30.2	Very low	80 Å²	80	163.9 Å²	163.9	83%	0.825	84%	0.844	S	S	*	*			trans	-171.6	114.1	158	0	0	0	0	0	112.9
41	R	31.8	Very low	30	Very low	245 Å²	245	167.7 Å²	167.7	93%	0.925	85%	0.847	S	S	*	*			trans	-67.8	156.3	178.5	-73.1	-179.4	176	-131.8	3.1	112.5
42	R	29.6	Very low	29.9	Very low	233 Å²	233	169.2 Å²	169.2	88%	0.879	85%	0.846	S	S	*	*			trans	99.5	104.1	157.3	-66	-173.5	177.3	-179.6	-0.1	116.2	P44	R42-P44 WeakPolarHBondContact O-CD 3.39Å
43	D	41.1	Very low	29.8	Very low	148 Å²	148	167.5 Å²	167.5	79%	0.791	85%	0.845	S	S	*	*			trans	-45.9	130	149.4	-166.5	-4.3	0	0	0	112.4	N45	D43-N45 PolarHBondContact OD1-N 3.35Å; D43-N45 VanDerWaalsContact OD1-N 3.13Å
44	P	32	Very low	29.7	Very low	115 Å²	115	167.7 Å²	167.7	75%	0.747	85%	0.846	S	S	*	*			trans	-127.7	82.4	154.9	34.8	-16.5	0	0	0	109.8	R42	R42-P44 WeakPolarHBondContact O-CD 3.39Å
45	N	30.8	Very low	29.7	Very low	117 Å²	117	165.2 Å²	165.2	63%	0.626	84%	0.842	S	S	*	*			trans	63.3	122.5	132.4	-92.4	-7.3	0	0	0	119.6	D43	D43-N45 PolarHBondContact OD1-N 3.35Å; D43-N45 VanDerWaalsContact OD1-N 3.13Å
46	W	28.9	Very low	29.6	Very low	245 Å²	245	162.8 Å²	162.8	93%	0.928	84%	0.84	S	S	*	*				55.7	108.2	120.9	-92	-21.3	0	0	0	118.5
47	G	28.4	Very low	29.5	Very low	67 Å²	67	165.5 Å²	165.5	69%	0.691	84%	0.838	S	S	*	*			trans	173.5	129	144.1	0	0	0	0	0	111.8
48	L	27	Very low	29.4	Very low	176 Å²	176	173 Å²	173	92%	0.921	85%	0.846	S	S	*	*			trans	89.5	67.9	159.5	-46.5	172.8	0	0	0	117.2
49	Y	28	Very low	29.5	Very low	226 Å²	226	177.3 Å²	177.3	89%	0.886	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-80	142.1	146.1	-79.2	-83.8	0	0	0	110.9
50	P	29.8	Very low	29.2	Very low	125 Å²	125	168.5 Å²	168.5	81%	0.812	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-96.9	122.6	143.4	-6.8	25.1	0	0	0	110.5
51	R	29.2	Very low	29.4	Very low	241 Å²	241	170.8 Å²	170.8	91%	0.909	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-72.3	141.2	172.7	-71.8	178.6	169.2	175.3	-3.1	111.4
52	T	31.7	Very low	29	Very low	130 Å²	130	168.5 Å²	168.5	80%	0.798	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-80	148	163.4	42.2	0	0	0	0	111.2
53	P	31.2	Very low	28.8	Very low	127 Å²	127	164.3 Å²	164.3	83%	0.825	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-81.6	130.7	175.6	29.8	-28.9	0	0	0	111.8
54	T	29.8	Very low	28.2	Very low	136 Å²	136	165.1 Å²	165.1	83%	0.834	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-64	143.9	173.1	28.1	0	0	0	0	113.3
55	K	27.8	Very low	27.9	Very low	199 Å²	199	162.9 Å²	162.9	87%	0.865	83%	0.833	S	S	*	*			trans	-136.6	103.5	149.3	-99.1	-173.1	178.9	-179.3	0	112.4
56	Q	27.2	Very low	27.8	Very low	181 Å²	181	163.3 Å²	163.3	85%	0.846	85%	0.845	S	S	*	*			trans	43.4	109	141.8	-76.7	174.6	-20.7	0	0	121.3
57	R	25.5	Very low	27.8	Very low	224 Å²	224	156.9 Å²	156.9	85%	0.845	84%	0.835	S	S	*	*			trans	-61.1	137.6	151	-75.6	174.4	164.5	174.1	-6.2	111.5
58	R	26.1	Very low	27.8	Very low	255 Å²	255	159 Å²	159	96%	0.962	84%	0.839	S	S	*	*			trans	-104.7	133.1	145.6	-90.1	-177.1	171.7	179	-3	108.3
59	K	27.6	Very low	27.8	Very low	196 Å²	196	154.7 Å²	154.7	85%	0.852	84%	0.837	S	S	*	*			trans	-104.1	146.6	178	-89.7	-175.3	172.3	-175.9	0	110.1
60	G	24	Very low	27.9	Very low	72 Å²	72	152.8 Å²	152.8	74%	0.742	84%	0.837	S	S	*	*			trans	147.3	146	146.8	0	0	0	0	0	113.9
61	P	29.5	Very low	27.8	Very low	129 Å²	129	155.7 Å²	155.7	84%	0.838	84%	0.839	S	S	*	*			cis	-119.9	166.6	-37.3	35.2	-19.7	0	0	0	112.5
62	F	24.7	Very low	27.8	Very low	196 Å²	196	151.5 Å²	151.5	86%	0.86	83%	0.827	S	S	*	*			trans	-68.4	135.2	177.2	-85.1	-106.2	0	0	0	112.3
63	V	25.2	Very low	27.8	Very low	145 Å²	145	147.9 Å²	147.9	88%	0.879	81%	0.811	S	S	*	*			trans	-115.3	126.7	151.1	176.1	0	0	0	0	107.3
64	L	28.2	Very low	27.9	Very low	166 Å²	166	147.3 Å²	147.3	87%	0.869	80%	0.8	S	S	*	*			trans	-92.5	119.8	-176.2	-151.1	88.7	0	0	0	108
65	G	26.1	Very low	28.3	Very low	68 Å²	68	146.4 Å²	146.4	70%	0.701	79%	0.786	S	S	*	*			trans	161.9	116.9	169.3	0	0	0	0	0	114.8
66	S	26.8	Very low	28.7	Very low	125 Å²	125	141.4 Å²	141.4	87%	0.874	77%	0.768	S	S	*	*			trans	107.8	144.9	156.6	-58.2	0	0	0	0	119.3
67	P	29.8	Very low	29	Very low	111 Å²	111	140.6 Å²	140.6	72%	0.721	76%	0.763	S	S	*	*			trans	-101.3	163.8	-146.7	38.4	-31.3	0	0	0	114.6
68	S	28.8	Very low	29.6	Very low	110 Å²	110	135.2 Å²	135.2	77%	0.769	75%	0.745	S	S	*	*			trans	45.7	98.5	158.7	56.9	0	0	0	0	117.5	Q70	S68-Q70 PolarHBondContact O-N 3.5Å
69	G	26.4	Very low	29.7	Very low	87 Å²	87	128.8 Å²	128.8	90%	0.897	74%	0.739	S	S	*	*			trans	-67.2	109.5	173.9	0	0	0	0	0	112.9
70	Q	30.2	Very low	29.9	Very low	186 Å²	186	125 Å²	125	87%	0.869	73%	0.733	S	S	*	*			trans	-70.8	132.9	153.3	-78.4	175.5	-32	0	0	108.9	S68 K72	S68-Q70 PolarHBondContact O-N 3.5Å; Q70-K72 PolarHBondContact O-N 3.31Å
71	Q	28.5	Very low	30.2	Very low	185 Å²	185	127.8 Å²	127.8	86%	0.864	74%	0.736	S	S	*	*			trans	-72.8	113.8	175	-158.3	173.1	6	0	0	108.2
72	K	27.7	Very low	30	Very low	153 Å²	153	130.5 Å²	130.5	67%	0.665	73%	0.734	S	S	*	*			trans	-69	140.2	179.5	-72.6	-172.7	177.5	-169.2	0	111.3	Q70 D76	Q70-K72 PolarHBondContact O-N 3.31Å; K72-D76 VanDerWaalsContact CA-OD2 3.27Å; K72-D76 WeakPolarHBondContact CA-OD2 3.42Å; K72-D76 HydrophobicContact CB-CB 3.94Å; K72-D76 VanDerWaalsContact CB-OD2 3.24Å; K72-D76 WeakPolarHBondContact CB-OD2 3.45Å; K72-D76 HydrophobicContact CD-CB 4.1Å; K72-D76 HydrophobicContact CG-CB 4.3Å
73	A	31.7	Very low	30.1	Very low	55 Å²	55	128.1 Å²	128.1	46%	0.455	74%	0.735	S	S	.	*			trans	-70.7	155.8	173.5	0	0	0	0	0	109.9	H75 D76	A73-H75 PolarHBondContact O-N 3.04Å; A73-D76 PolarHBondContact N-OD2 2.87Å; A73-D76 WeakPolarHBondContact O-CB 3.47Å; A73-D76 PolarHBondContact O-N 3.05Å
74	I	34.9	Very low	30.1	Very low	115 Å²	115	128.4 Å²	128.4	59%	0.59	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-53.4	-27	178.3	-90.4	171.8	0	0	0	112.5	D76 F78	I74-D76 VanDerWaalsContact C-N 3.35Å; I74-F78 HydrophobicContact CG2-CE2 4.31Å; I74-F78 WeakPolarHBondContact O-CD2 3.49Å; I74-F78 VanDerWaalsContact O-CE2 3.28Å; I74-F78 WeakPolarHBondContact O-CE2 3.43Å
75	H	37.9	Very low	30.1	Very low	117 Å²	117	125.8 Å²	125.8	54%	0.542	73%	0.726	S	S	.	*	G	3₁₀ helix	trans	-72.5	-22.8	179	-60.6	-69.7	0	0	0	114	A73 F77 F78	A73-H75 PolarHBondContact O-N 3.04Å; H75-F77 PolarHBondContact O-N 3.36Å; H75-F77 VanDerWaalsContact O-N 3.07Å; H75-F78 PolarHBondContact O-N 3.16Å; H75-F78 VanDerWaalsContact O-N 3.09Å
76	D	36.5	Very low	30.2	Very low	93 Å²	93	128.2 Å²	128.2	50%	0.497	73%	0.732	S	S	.	*	G	3₁₀ helix	trans	-71.5	-4.2	-179.7	-60.1	-30.2	0	0	0	113.3	K72 A73 I74	K72-D76 VanDerWaalsContact CA-OD2 3.27Å; K72-D76 WeakPolarHBondContact CA-OD2 3.42Å; K72-D76 HydrophobicContact CB-CB 3.94Å; K72-D76 VanDerWaalsContact CB-OD2 3.24Å; K72-D76 WeakPolarHBondContact CB-OD2 3.45Å; K72-D76 HydrophobicContact CD-CB 4.1Å; K72-D76 HydrophobicContact CG-CB 4.3Å; A73-D76 PolarHBondContact N-OD2 2.87Å; A73-D76 WeakPolarHBondContact O-CB 3.47Å; A73-D76 PolarHBondContact O-N 3.05Å; I74-D76 VanDerWaalsContact C-N 3.35Å
77	F	33.2	Very low	30.2	Very low	165 Å²	165	127.1 Å²	127.1	72%	0.724	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-89	-3.9	172.9	-78.1	-85.6	0	0	0	113.6	H75	H75-F77 PolarHBondContact O-N 3.36Å; H75-F77 VanDerWaalsContact O-N 3.07Å
78	F	37.8	Very low	30.2	Very low	110 Å²	110	126.5 Å²	126.5	48%	0.482	72%	0.72	S	S	.	*			trans	-123	88.2	-172.2	-57.7	-77	0	0	0	112.5	I74 H75 V80	I74-F78 HydrophobicContact CG2-CE2 4.31Å; I74-F78 WeakPolarHBondContact O-CD2 3.49Å; I74-F78 VanDerWaalsContact O-CE2 3.28Å; I74-F78 WeakPolarHBondContact O-CE2 3.43Å; H75-F78 PolarHBondContact O-N 3.16Å; H75-F78 VanDerWaalsContact O-N 3.09Å; F78-V80 HydrophobicContact CB-CG2 4.11Å; F78-V80 PolarHBondContact O-N 3.06Å
79	S	27.9	Very low	30.1	Very low	120 Å²	120	128.5 Å²	128.5	84%	0.839	72%	0.717	S	S	*	*			trans	-81.4	96.5	156	53.9	0	0	0	0	108.4	T81	S79-T81 PolarHBondContact O-N 3.41Å
80	V	32.6	Very low	30.1	Very low	118 Å²	118	134.5 Å²	134.5	72%	0.715	72%	0.719	S	S	*	*			trans	-90.7	94.8	-178.6	-176.2	0	0	0	0	110.4	F78	F78-V80 HydrophobicContact CB-CG2 4.11Å; F78-V80 PolarHBondContact O-N 3.06Å
81	T	29	Very low	29.8	Very low	130 Å²	130	131.3 Å²	131.3	80%	0.798	72%	0.717	S	S	*	*			trans	-96.3	93.8	151.2	31.2	0	0	0	0	108.3	S79	S79-T81 PolarHBondContact O-N 3.41Å
82	K	25.9	Very low	29.6	Very low	186 Å²	186	128.4 Å²	128.4	81%	0.809	72%	0.717	S	S	*	*			trans	164.8	122.4	142.2	-93	165.8	-178.7	176.2	0	112.1
83	V	26.6	Very low	29.4	Very low	146 Å²	146	125.3 Å²	125.3	89%	0.885	72%	0.72	S	S	*	*			trans	-67.5	126.9	168.1	175.8	0	0	0	0	109.8
84	I	25.7	Very low	29	Very low	151 Å²	151	131.1 Å²	131.1	77%	0.774	74%	0.74	S	S	*	*			trans	-133.1	114.8	160	-59.8	-179.6	0	0	0	109.4	S86	I84-S86 PolarHBondContact O-N 3.17Å
85	S	28.9	Very low	28.6	Very low	111 Å²	111	130.4 Å²	130.4	78%	0.776	74%	0.743	S	S	*	*			trans	-64	119.1	164.9	55.4	0	0	0	0	110.5
86	S	27.8	Very low	27.8	Very low	119 Å²	119	129.9 Å²	129.9	83%	0.832	75%	0.752	S	S	*	*			trans	-99.6	105.6	180	60.2	0	0	0	0	112.1	I84	I84-S86 PolarHBondContact O-N 3.17Å
87	S	26.8	Very low	27.1	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	77%	0.766	S	S	*	*			trans	-102.2	142.1	147.5	89	0	0	0	0	108.2	H89	S87-H89 PolarHBondContact O-N 3.3Å
88	P	29.1	Very low	26.6	Very low	97 Å²	97	128.6 Å²	128.6	63%	0.63	77%	0.766	S	S	*	*			trans	-97.5	94.3	-173.9	34.4	-27.2	0	0	0	110.9
89	H	27.3	Very low	25.9	Very low	153 Å²	153	129.4 Å²	129.4	71%	0.708	78%	0.78	S	S	*	*			trans	-148.8	117.5	158.4	-76.8	-42.3	0	0	0	110.9	S87 E269	S87-H89 PolarHBondContact O-N 3.3Å; H89-E269 IonicContact CE1-OE1 3.88Å
90	K	26	Very low	25.7	Very low	213 Å²	213	132.2 Å²	132.2	93%	0.926	78%	0.78	S	S	*	*			trans	-174.7	117.9	131.9	-110.4	173.7	178.2	176.5	0	111.5
91	S	24.9	Very low	25.3	Very low	119 Å²	119	138 Å²	138	83%	0.832	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-94	160.8	154	46.7	0	0	0	0	109.9
92	S	24.4	Very low	25	Very low	123 Å²	123	136.5 Å²	136.5	86%	0.86	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-70.9	159.5	-167.8	47.5	0	0	0	0	116.5
93	A	22.5	Very low	24.8	Very low	89 Å²	89	131.2 Å²	131.2	74%	0.736	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-62.3	161.5	-170.1	0	0	0	0	0	119.3
94	M	23	Very low	25.1	Very low	176 Å²	176	130.8 Å²	130.8	87%	0.867	79%	0.788	S	S	*	*				165.7	168.2	123.5	-84.8	-63.4	-157.6	0	0	110.5
95	P	26.8	Very low	25	Very low	101 Å²	101	127 Å²	127	66%	0.656	79%	0.786	S	S	*	*				-128.2	175.3	-94.5	32.4	-9	0	0	0	116.5
96	S	21.2	Very low	24.9	Very low	106 Å²	106	128.1 Å²	128.1	74%	0.741	79%	0.788	S	S	*	*			trans	65.3	134.1	158.2	49.7	0	0	0	0	118
97	T	22.2	Very low	24.7	Very low	127 Å²	127	127.8 Å²	127.8	78%	0.779	78%	0.781	S	S	*	*				-167.7	147.3	57.5	30.6	0	0	0	0	112.4
98	S	22.3	Very low	24.6	Very low	103 Å²	103	130.9 Å²	130.9	72%	0.72	78%	0.782	S	S	*	*			trans	33.8	132.3	146.9	69.3	0	0	0	0	120.7
99	T	24.2	Very low	24.3	Very low	127 Å²	127	134 Å²	134	78%	0.779	79%	0.788	S	S	*	*				-173.3	149.9	64.6	17.3	0	0	0	0	112.4
100	H	23.8	Very low	24.2	Very low	180 Å²	180	133.4 Å²	133.4	83%	0.833	79%	0.79	S	S	*	*			trans	-15	150.6	165.3	-56.1	-83.3	0	0	0	120.6
101	R	23.6	Very low	24.1	Very low	238 Å²	238	131.3 Å²	131.3	90%	0.898	79%	0.788	S	S	*	*				-170.4	144	61.9	-102.9	-179.6	179.3	172.4	-0.5	112.5
102	A	23.1	Very low	24.1	Very low	100 Å²	100	134.4 Å²	134.4	83%	0.826	79%	0.79	S	S	*	*			trans	32.8	128.4	147.1	0	0	0	0	0	120.3
103	G	21.1	Very low	24.1	Very low	74 Å²	74	136.7 Å²	136.7	76%	0.763	79%	0.787	S	S	*	*			cis	83.7	149.7	43.5	0	0	0	0	0	111.4
104	P	32.8	Very low	24.3	Very low	137 Å²	137	140.3 Å²	140.3	89%	0.89	79%	0.789	S	S	*	*			cis	-129.2	163.1	-4	38.9	-20.6	0	0	0	114
105	G	24.2	Very low	24.4	Very low	71 Å²	71	139.8 Å²	139.8	73%	0.732	78%	0.784	S	S	*	*				121.5	131.1	82.7	0	0	0	0	0	108
106	V	25.2	Very low	24.3	Very low	135 Å²	135	142.5 Å²	142.5	82%	0.818	79%	0.793	S	S	*	*				172.3	121.9	82.3	163.7	0	0	0	0	103.6
107	V	23.6	Very low	24.6	Very low	113 Å²	113	144.5 Å²	144.5	69%	0.685	80%	0.796	S	S	*	*				97.7	109	60.9	149.9	0	0	0	0	112.1
108	F	25.1	Very low	24.8	Very low	167 Å²	167	146.6 Å²	146.6	73%	0.732	80%	0.802	S	S	*	*			trans	57.2	158.1	147.5	-59.8	-94.3	0	0	0	120
109	E	23.8	Very low	25	Very low	163 Å²	163	149.2 Å²	149.2	76%	0.762	81%	0.808	S	S	*	*			cis	-161.7	164.6	9	-134.9	144.9	-152.3	0	0	110.6
110	D	24.1	Very low	25.1	Very low	140 Å²	140	149.9 Å²	149.9	75%	0.749	81%	0.812	S	S	*	*			trans	-55.7	162.5	169.4	-64.5	-53.2	0	0	0	115
111	D	23.9	Very low	25.2	Very low	168 Å²	168	146.1 Å²	146.1	90%	0.898	81%	0.806	S	S	*	*				-171	141.9	123.2	-89.9	-26	0	0	0	112.9
112	E	24.8	Very low	25.3	Very low	185 Å²	185	143 Å²	143	86%	0.864	81%	0.805	S	S	*	*			trans	-92.3	-168.2	179.6	-64.9	-172.4	145.7	0	0	112.3
113	E	25.7	Very low	25.3	Very low	170 Å²	170	146.2 Å²	146.2	79%	0.794	81%	0.808	S	S	*	*			trans	90.3	141.3	166.3	-54.6	-176.2	-179.2	0	0	116.9
114	E	25.4	Very low	25.4	Very low	165 Å²	165	147.8 Å²	147.8	77%	0.771	81%	0.814	S	S	*	*			cis	-161.4	173.1	-10.7	-115.4	-175.9	-177.9	0	0	109.7
115	E	25.7	Very low	25	Very low	165 Å²	165	149.1 Å²	149.1	77%	0.771	81%	0.813	S	S	*	*			trans	-52.8	155.3	176.5	-70.4	165.5	166.3	0	0	116.3
116	D	25.4	Very low	25.1	Very low	158 Å²	158	151 Å²	151	85%	0.845	81%	0.813	S	S	*	*				180	147.6	110.7	-97.3	-24.4	0	0	0	114.6
117	D	25.8	Very low	25	Very low	149 Å²	149	151.2 Å²	151.2	80%	0.797	82%	0.815	S	S	*	*			trans	-67.6	160	-177.7	-75.7	-44.3	0	0	0	115.5
118	D	26.4	Very low	25	Very low	170 Å²	170	151 Å²	151	91%	0.909	83%	0.825	S	S	*	*			trans	-166.7	125.1	130.7	-104	-24.3	0	0	0	113.3
119	D	27	Very low	24.9	Very low	158 Å²	158	147.9 Å²	147.9	85%	0.845	83%	0.83	S	S	*	*			trans	-87.9	131.6	175.1	-112.3	-20.9	0	0	0	111
120	V	26.6	Very low	24.8	Very low	142 Å²	142	148.6 Å²	148.6	86%	0.861	83%	0.833	S	S	*	*			trans	-149.9	117.8	150	-178.5	0	0	0	0	111.7
121	S	26.1	Very low	24.7	Very low	101 Å²	101	149.1 Å²	149.1	71%	0.706	84%	0.841	S	S	*	*			trans	-63.9	152.8	168.7	62.2	0	0	0	0	114.2
122	L	24.7	Very low	24.7	Very low	171 Å²	171	147.7 Å²	147.7	90%	0.895	83%	0.832	S	S	*	*			trans	-165.2	141.3	136.1	-100.4	175.7	0	0	0	113
123	L	24	Very low	24.6	Very low	169 Å²	169	143.4 Å²	143.4	89%	0.885	83%	0.828	S	S	*	*			trans	-78.7	146.6	-170.8	-64.9	151	0	0	0	114.1
124	A	24	Very low	24.6	Very low	106 Å²	106	141.8 Å²	141.8	88%	0.876	82%	0.821	S	S	*	*			trans	-170.6	149	134.8	0	0	0	0	0	113
125	N	23.9	Very low	24.5	Very low	165 Å²	165	141.3 Å²	141.3	88%	0.882	82%	0.823	S	S	*	*			trans	-87.9	177.9	-158.3	-110.8	-4.4	0	0	0	115.7
126	P	27	Very low	24.6	Very low	111 Å²	111	139 Å²	139	72%	0.721	81%	0.812	S	S	*	*			trans	-95.6	158.5	-152	38.2	-36.1	0	0	0	114.8
127	T	21.2	Very low	25.1	Very low	140 Å²	140	135.5 Å²	135.5	86%	0.859	79%	0.793	S	S	*	*			trans	-125.8	126.6	162.8	45.8	0	0	0	0	110.6
128	A	24.6	Very low	25.1	Very low	109 Å²	109	133.3 Å²	133.3	90%	0.901	78%	0.781	S	S	*	*			trans	-57.7	147.8	179.5	0	0	0	0	0	113
129	A	23	Very low	25.4	Very low	101 Å²	101	126.8 Å²	126.8	84%	0.835	75%	0.746	S	S	*	*			trans	-128.7	132.6	169.6	0	0	0	0	0	110.3
130	E	21.6	Very low	25.7	Very low	177 Å²	177	123.6 Å²	123.6	83%	0.827	73%	0.729	S	S	*	*			trans	-69.3	150.3	-170.9	-65.5	167.2	143.4	0	0	113.5
131	V	21.6	Very low	26.2	Very low	152 Å²	152	119.8 Å²	119.8	92%	0.921	71%	0.709	S	S	*	*			trans	-77.6	117.2	170.4	179.5	0	0	0	0	108.3
132	I	23.2	Very low	26.5	Very low	138 Å²	138	118.1 Å²	118.1	71%	0.708	69%	0.692	S	S	*	*			trans	-118.2	125.2	172.9	-59.6	177.3	0	0	0	108.3
133	A	23.1	Very low	26.9	Very low	94 Å²	94	114 Å²	114	78%	0.777	67%	0.67	S	S	*	*			trans	-58.9	133.1	177.8	0	0	0	0	0	111.8
134	E	25.6	Very low	27	Very low	137 Å²	137	108.1 Å²	108.1	64%	0.64	65%	0.646	S	S	*	*			trans	-93.3	116.8	179.1	-61.5	-161.5	130.3	0	0	110.7	E136 R519	E134-E136 PolarHBondContact O-N 3.04Å; E134-R519 IonicContact OE1-NH2 3.07Å; E134-R519 PolarHBondContact OE1-NH2 3.16Å; E134-R519 VanDerWaalsContact OE1-NH2 3.07Å
135	D	24.7	Very low	27.2	Very low	154 Å²	154	106.3 Å²	106.3	82%	0.824	63%	0.631	S	S	*	*			trans	-73.3	107.5	166.7	-74.4	-34.5	0	0	0	109.8
136	E	27	Very low	27.5	Very low	117 Å²	117	101.9 Å²	101.9	55%	0.547	61%	0.605	S	S	.	*			trans	-80.5	136.4	176.7	-62.2	-159.8	125	0	0	112.1	E134 R497	E134-E136 PolarHBondContact O-N 3.04Å; E136-R497 IonicContact OE1-CZ 3.74Å; E136-R497 IonicContact OE1-NH1 3.9Å; E136-R497 PolarHBondContact OE1-NH1 3Å; E136-R497 IonicContact OE1-NH2 3.4Å; E136-R497 PolarHBondContact OE1-NH2 3.4Å; E136-R497 IonicContact OE2-NH1 2.71Å; E136-R497 PolarHBondContact OE2-NH1 2.94Å
137	I	35.3	Very low	27.4	Very low	84 Å²	84	104.2 Å²	104.2	43%	0.431	61%	0.608	S	S	.	*			trans	-105.4	133.5	175.7	-56.3	171.5	0	0	0	108.1	K522	I137-K522 HydrophobicContact CD1-CD 3.9Å
138	D	26.8	Very low	27.6	Very low	103 Å²	103	104 Å²	104	55%	0.551	60%	0.601	S	S	*	*			trans	-79.9	111.8	-173.6	-160.9	9.7	0	0	0	112.9	D140	D138-D140 PolarHBondContact O-N 3.48Å
139	D	33.2	Very low	27.8	Very low	33 Å²	33	104.2 Å²	104.2	18%	0.176	59%	0.593	C	S	.	*	G	3₁₀ helix	trans	-73.8	-4.6	-178.8	-72.3	-37.2	0	0	0	114.1	S141 L142 N490	D139-S141 PolarHBondContact O-N 2.97Å; D139-L142 HydrophobicContact CB-CD1 4.36Å; D139-L142 WeakPolarHBondContact O-CG 3.35Å; D139-L142 PolarHBondContact O-N 3.05Å; D139-N490 HydrophobicContact CB-CB 3.56Å
140	D	32	Very low	27.7	Very low	92 Å²	92	109 Å²	109	49%	0.492	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-65.7	-10	178.8	-102.9	8.9	0	0	0	113.2	D138 L142	D138-D140 PolarHBondContact O-N 3.48Å; D140-L142 VanDerWaalsContact C-N 3.33Å; D140-L142 PolarHBondContact O-N 2.92Å
141	S	36.8	Very low	27.8	Very low	62 Å²	62	110.6 Å²	110.6	43%	0.434	60%	0.602	S	S	.	*	G	3₁₀ helix	trans	-80.2	-3.9	175.5	-65.9	0	0	0	0	114.8	D139 L143 A144	D139-S141 PolarHBondContact O-N 2.97Å; S141-L143 PolarHBondContact O-N 2.63Å; S141-A144 PolarHBondContact O-N 3.07Å
142	L	33.2	Very low	27.7	Very low	66 Å²	66	110.2 Å²	110.2	35%	0.346	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-68.8	0.2	175.1	-68.6	174	0	0	0	114.2	D139 D140	D139-L142 HydrophobicContact CB-CD1 4.36Å; D139-L142 WeakPolarHBondContact O-CG 3.35Å; D139-L142 PolarHBondContact O-N 3.05Å; D140-L142 VanDerWaalsContact C-N 3.33Å; D140-L142 PolarHBondContact O-N 2.92Å
143	L	32.6	Very low	27.6	Very low	84 Å²	84	108.5 Å²	108.5	44%	0.44	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-113.9	5.1	-177.8	-64.1	179.6	0	0	0	114.9	S141	S141-L143 PolarHBondContact O-N 2.63Å
144	A	27.7	Very low	27.5	Very low	45 Å²	45	109.6 Å²	109.6	37%	0.372	60%	0.603	S	S	.	*			trans	-150.6	126.6	178.2	0	0	0	0	0	113.8	S141 N792	S141-A144 PolarHBondContact O-N 3.07Å; A144-N792 HydrophobicContact CB-CB 4.42Å; A144-N792 VanDerWaalsContact CB-CG 3.47Å; A144-N792 WeakPolarHBondContact CB-OD1 3.45Å
145	A	26.8	Very low	27.3	Very low	68 Å²	68	108 Å²	108	56%	0.562	61%	0.613	S	S	*	*			trans	-90.7	136.4	177.7	0	0	0	0	0	112.7
146	E	30.6	Very low	27.3	Very low	73 Å²	73	110.2 Å²	110.2	34%	0.341	62%	0.618	S	S	.	*			trans	91.5	122.6	160.8	-68.1	175.9	162.2	0	0	119.6	K532 K797 D819	E146-K532 VanDerWaalsContact CD-NZ 3.31Å; E146-K532 IonicContact OE1-NZ 3.46Å; E146-K532 PolarHBondContact OE1-NZ 2.84Å; E146-K797 WeakPolarHBondContact OE2-CE 3.41Å; E146-K797 IonicContact OE2-NZ 3.28Å; E146-K797 PolarHBondContact OE2-NZ 3.47Å; E146-D819 VanDerWaalsContact OE2-CG 3.29Å
147	M	24.6	Very low	27	Very low	159 Å²	159	109.3 Å²	109.3	78%	0.783	63%	0.63	S	S	*	*			trans	-148	154.3	138.6	-78.8	-106.2	70.3	0	0	109.1
148	L	25	Very low	26.4	Very low	135 Å²	135	117 Å²	117	71%	0.707	65%	0.654	S	S	*	*			trans	-104.4	159.3	167.7	-84	167.8	0	0	0	110.3	P820	L148-P820 HydrophobicContact CD1-CG 3.79Å
149	P	28.7	Very low	26.3	Very low	114 Å²	114	119.9 Å²	119.9	74%	0.74	67%	0.669	S	S	*	*			trans	-101.8	145.9	-171.3	37.3	-28.9	0	0	0	113.1
150	E	21.6	Very low	25.7	Very low	202 Å²	202	126.5 Å²	126.5	94%	0.944	70%	0.703	S	S	*	*			trans	-138	136.6	155.1	-80.6	-166.9	163.2	0	0	111.8
151	K	23	Very low	25.3	Very low	210 Å²	210	131.2 Å²	131.2	91%	0.913	72%	0.722	S	S	*	*			trans	-79.7	133.9	178.6	-71	175.1	172.8	179.3	0	110.4
152	V	21.2	Very low	24.6	Very low	144 Å²	144	131.5 Å²	131.5	87%	0.873	73%	0.729	S	S	*	*			trans	-140.5	145.1	149.6	-173.8	0	0	0	0	109.7
153	S	20.6	Very low	24.3	Very low	103 Å²	103	135.7 Å²	135.7	72%	0.72	75%	0.751	S	S	*	*			trans	-69.3	157	-165.4	51.7	0	0	0	0	117.5
154	S	21.2	Very low	24	Very low	117 Å²	117	141.6 Å²	141.6	82%	0.818	77%	0.769	S	S	*	*			trans	-26.7	133.3	164.6	56.2	0	0	0	0	118.9
155	A	21.7	Very low	23.9	Very low	103 Å²	103	145 Å²	145	85%	0.851	78%	0.781	S	S	*	*			trans	-160.4	138.1	135.7	0	0	0	0	0	110.3
156	E	23.2	Very low	23.8	Very low	200 Å²	200	150.5 Å²	150.5	94%	0.935	80%	0.795	S	S	*	*			trans	-66.2	136	-174.8	-62.1	164.1	137.2	0	0	113.6
157	A	22	Very low	23.5	Very low	98 Å²	98	150.6 Å²	150.6	81%	0.81	82%	0.815	S	S	*	*			trans	-164.8	104.1	151	0	0	0	0	0	112.5
158	R	21.3	Very low	23.5	Very low	247 Å²	247	151.1 Å²	151.1	93%	0.932	82%	0.817	S	S	*	*			trans	42.2	115.6	146	-68.9	179.2	177.3	156.2	-0	120.3
159	L	24.9	Very low	23.7	Very low	163 Å²	163	151.9 Å²	151.9	85%	0.853	83%	0.828	S	S	*	*			trans	-45.7	123.8	160.6	-68.6	155.5	0	0	0	113.5
160	L	21.2	Very low	23.6	Very low	172 Å²	172	150.2 Å²	150.2	90%	0.901	82%	0.824	S	S	*	*			trans	-142	97.9	148.5	-86	168.4	0	0	0	106.3	A162	L160-A162 PolarHBondContact O-N 3.36Å
161	E	22.7	Very low	23.8	Very low	190 Å²	190	149.5 Å²	149.5	89%	0.888	82%	0.82	S	S	*	*			trans	-64.5	124	162.7	-78.3	171.8	148.4	0	0	107.9
162	A	22.2	Very low	24	Very low	69 Å²	69	148 Å²	148	57%	0.57	82%	0.819	S	S	*	*			trans	-120.9	106.9	169.6	0	0	0	0	0	107.9	L160 Y164	L160-A162 PolarHBondContact O-N 3.36Å; A162-Y164 HydrophobicContact CB-CD2 4.19Å; A162-Y164 HydrophobicContact CB-CE2 3.62Å; A162-Y164 WeakPolarHBondContact O-CD2 3.49Å
163	D	26.8	Very low	24.3	Very low	154 Å²	154	150.5 Å²	150.5	82%	0.824	82%	0.818	S	S	*	*			trans	-53.4	124.8	166.9	-99.6	-35.4	0	0	0	110.5
164	Y	26.5	Very low	24.6	Very low	207 Å²	207	149.2 Å²	149.2	81%	0.812	82%	0.821	S	S	*	*			trans	-136.3	80.3	168.2	-74.9	-77	0	0	0	109.9	A162	A162-Y164 HydrophobicContact CB-CD2 4.19Å; A162-Y164 HydrophobicContact CB-CE2 3.62Å; A162-Y164 WeakPolarHBondContact O-CD2 3.49Å
165	L	26.4	Very low	24.9	Very low	118 Å²	118	151 Å²	151	62%	0.618	82%	0.821	S	S	*	*			trans	-141.1	80	173.2	-89.9	154.6	0	0	0	108.9	R498	L165-R498 VanDerWaalsContact CD1-NH1 3.27Å
166	E	25.5	Very low	25.2	Very low	183 Å²	183	153.9 Å²	153.9	86%	0.855	82%	0.823	S	S	*	*			trans	-143	118.7	167.1	-147.5	163.8	-154.7	0	0	109.8
167	G	23.7	Very low	25.3	Very low	74 Å²	74	153 Å²	153	76%	0.763	82%	0.819	S	S	*	*			trans	-159.6	41.1	-179.4	0	0	0	0	0	108.7
168	M	24.4	Very low	25.6	Very low	170 Å²	170	156.3 Å²	156.3	84%	0.837	82%	0.823	S	S	*	*	S	Bend	trans	-112.7	133.1	158.5	-75	-164.7	-169.5	0	0	107.4	A170	M168-A170 PolarHBondContact O-N 3.2Å; M168-A170 VanDerWaalsContact O-N 3.08Å
169	T	28.6	Very low	25.7	Very low	152 Å²	152	153.6 Å²	153.6	93%	0.933	82%	0.818	S	S	*	*			trans	-62.5	104.2	176	48.4	0	0	0	0	110.5
170	A	27.5	Very low	25.7	Very low	79 Å²	79	153.4 Å²	153.4	65%	0.653	82%	0.818	S	S	*	*			trans	-124.9	56.4	164.8	0	0	0	0	0	109.7	M168	M168-A170 PolarHBondContact O-N 3.2Å; M168-A170 VanDerWaalsContact O-N 3.08Å
171	E	26.1	Very low	26.1	Very low	186 Å²	186	151.2 Å²	151.2	87%	0.869	81%	0.807	S	S	*	*			trans	-143.2	79.4	169.3	-67.7	-169.7	-178.3	0	0	110.4
172	M	25.5	Very low	26.2	Very low	178 Å²	178	152.2 Å²	152.2	88%	0.877	81%	0.809	S	S	*	*			trans	-118.7	69.5	146.4	-75.6	-158.4	-47.8	0	0	106.9
173	F	27.6	Very low	26.5	Very low	198 Å²	198	157.7 Å²	157.7	87%	0.868	82%	0.823	S	S	*	*			trans	-135.4	92.7	166.1	-70.3	-74.4	0	0	0	106.5
174	G	27	Very low	26.5	Very low	75 Å²	75	159.3 Å²	159.3	77%	0.773	83%	0.825	S	S	*	*			trans	-103.1	125	159.9	0	0	0	0	0	106.6
175	D	27.9	Very low	26.7	Very low	154 Å²	154	159.1 Å²	159.1	82%	0.824	83%	0.832	S	S	*	*			trans	-57	128.4	174.2	-61.3	-51.4	0	0	0	110.7
176	D	28.1	Very low	26.7	Very low	165 Å²	165	162.6 Å²	162.6	88%	0.882	85%	0.845	S	S	*	*			trans	-141	94.1	151.3	-81.4	-38.5	0	0	0	106.2
177	E	26.3	Very low	26.9	Very low	182 Å²	182	156.8 Å²	156.8	85%	0.85	83%	0.834	S	S	*	*			trans	-66.5	120.9	154.3	-70.1	-178.9	156.7	0	0	107.2
178	D	27	Very low	27	Very low	167 Å²	167	163 Å²	163	89%	0.893	84%	0.843	S	S	*	*			trans	-173.3	122.5	135.8	-90.2	-27.3	0	0	0	110.1
179	F	24.7	Very low	27.4	Very low	190 Å²	190	161.3 Å²	161.3	83%	0.833	84%	0.842	S	S	*	*			trans	-65.8	141.9	168.8	-92.8	-111.4	0	0	0	110.6
180	D	24.9	Very low	27.2	Very low	158 Å²	158	162.4 Å²	162.4	85%	0.845	84%	0.837	S	S	*	*				-166.8	142.4	123.6	-101.6	-18.7	0	0	0	113
181	D	28	Very low	27.2	Very low	126 Å²	126	164.4 Å²	164.4	67%	0.674	84%	0.843	S	S	*	*			trans	-54.7	138	-170.3	-72.7	-43.6	0	0	0	116.6
182	F	25.9	Very low	27.3	Very low	211 Å²	211	161.8 Å²	161.8	93%	0.925	84%	0.835	S	S	*	*			trans	-145.2	105.4	139.1	-87.3	-79.3	0	0	0	109.8
183	E	28.4	Very low	27.7	Very low	185 Å²	185	158.3 Å²	158.3	86%	0.864	83%	0.825	S	S	*	*			trans	-66.8	121	164.2	-69.1	-179.6	149.1	0	0	109.9
184	E	27.3	Very low	27.9	Very low	188 Å²	188	154.5 Å²	154.5	88%	0.879	81%	0.814	S	S	*	*			trans	-133.1	122.7	151	-79.6	-168.3	164.6	0	0	108.9	E186	E184-E186 PolarHBondContact O-N 3.27Å; E184-E186 VanDerWaalsContact O-N 3.07Å
185	E	30	Very low	28.3	Very low	203 Å²	203	156.8 Å²	156.8	95%	0.949	81%	0.813	S	S	*	*			trans	-57.6	101.9	-176.7	-67.2	175.2	142.6	0	0	112.4
186	E	27.5	Very low	28.5	Very low	190 Å²	190	155.6 Å²	155.6	89%	0.888	80%	0.802	S	S	*	*			trans	-83.7	108.8	160.3	-78.4	-168	160.4	0	0	109.5	E184 E188	E184-E186 PolarHBondContact O-N 3.27Å; E184-E186 VanDerWaalsContact O-N 3.07Å; E186-E188 PolarHBondContact O-N 2.8Å
187	G	27.8	Very low	28.8	Very low	62 Å²	62	157.8 Å²	157.8	64%	0.639	80%	0.804	S	S	*	*			trans	-59.9	132.3	172	0	0	0	0	0	111.5	V189	G187-V189 PolarHBondContact O-N 2.68Å
188	E	27.6	Very low	29.4	Very low	204 Å²	204	151.6 Å²	151.6	95%	0.953	79%	0.789	S	S	*	*			trans	-48.7	107.8	172.2	-74	179.3	147.4	0	0	111.1	E186	E186-E188 PolarHBondContact O-N 2.8Å
189	V	31.1	Very low	30.1	Very low	135 Å²	135	150.9 Å²	150.9	82%	0.818	78%	0.784	S	S	*	*			trans	-99.7	107	163.4	-176.1	0	0	0	0	107	G187	G187-V189 PolarHBondContact O-N 2.68Å
190	E	25.9	Very low	30.9	Very low	175 Å²	175	144.8 Å²	144.8	82%	0.818	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-48.7	128.6	171	-82	-176.3	146.9	0	0	110.4	L192	E190-L192 PolarHBondContact O-N 2.84Å
191	P	27	Very low	31.5	Very low	121 Å²	121	142.6 Å²	142.6	79%	0.786	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-68.6	120.4	175.4	27.1	-30.7	0	0	0	109.3
192	L	27.2	Very low	31.9	Very low	131 Å²	131	139 Å²	139	69%	0.686	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-62.7	134.8	170.7	-77.3	163.7	0	0	0	110	E190 D194	E190-L192 PolarHBondContact O-N 2.84Å; L192-D194 PolarHBondContact O-N 3.39Å; L192-D194 VanDerWaalsContact O-N 3.13Å
193	P	35.1	Very low	32.6	Very low	104 Å²	104	134.8 Å²	134.8	68%	0.675	73%	0.729	S	S	*	*			trans	-84	85.7	175.1	33.1	-30.2	0	0	0	109.3
194	D	31.4	Very low	33.3	Very low	119 Å²	119	135.2 Å²	135.2	64%	0.636	73%	0.728	S	S	*	*			trans	-95.7	94.3	175.7	-99.6	-17.1	0	0	0	111.2	L192	L192-D194 PolarHBondContact O-N 3.39Å; L192-D194 VanDerWaalsContact O-N 3.13Å
195	V	35	Very low	34.3	Very low	123 Å²	123	132.6 Å²	132.6	75%	0.745	73%	0.725	S	S	*	*			trans	-90.8	-3.3	174.3	-173.6	0	0	0	0	111.7
196	H	33.1	Very low	34.8	Very low	128 Å²	128	126.3 Å²	126.3	59%	0.593	70%	0.697	S	S	*	*			trans	-133.2	87.9	-173.9	-65.1	-20.4	0	0	0	112.1	G198	H196-G198 PolarHBondContact O-N 3.3Å; H196-G198 VanDerWaalsContact O-N 3.16Å
197	F	34.8	Very low	35.8	Very low	211 Å²	211	125.9 Å²	125.9	93%	0.925	70%	0.7	S	S	*	*			trans	-66.7	109.2	162.8	-83.5	-89.9	0	0	0	109.7
198	G	37.6	Very low	36.6	Very low	53 Å²	53	132.8 Å²	132.8	55%	0.546	71%	0.707	S	S	.	*			trans	-157.6	131.7	170	0	0	0	0	0	110.2	H196 L200	H196-G198 PolarHBondContact O-N 3.3Å; H196-G198 VanDerWaalsContact O-N 3.16Å; G198-L200 PolarHBondContact O-N 3.16Å
199	L	41.8	Very low	37.5	Very low	151 Å²	151	127 Å²	127	79%	0.791	69%	0.687	S	S	*	*	S	Bend	trans	-58	5	178.3	-126.9	91	0	0	0	114.9
200	L	42.2	Very low	38.2	Very low	62 Å²	62	127.4 Å²	127.4	33%	0.325	68%	0.68	S	S	.	*	S	Bend	trans	-131.8	98.9	-179.6	-62.7	169.8	0	0	0	106	G198 S202 G211 L216	G198-L200 PolarHBondContact O-N 3.16Å; L200-S202 PolarHBondContact O-N 3.37Å; L200-G211 WeakPolarHBondContact CD1-O 3.39Å; L200-L216 HydrophobicContact CD2-CD2 4.27Å
201	S	36.5	Very low	39.5	Very low	112 Å²	112	120.6 Å²	120.6	78%	0.783	66%	0.656	S	S	*	*			trans	-47	134.1	-171.9	-54.7	0	0	0	0	113.1
202	S	37.8	Very low	41.3	Very low	50 Å²	50	117.8 Å²	117.8	35%	0.35	64%	0.639	S	S	.	*			trans	-86	106.4	159.9	57.9	0	0	0	0	108.6	L200	L200-S202 PolarHBondContact O-N 3.37Å
203	D	40	Very low	43.2	Very low	124 Å²	124	115 Å²	115	66%	0.663	63%	0.627	S	S	*	*			trans	-63.6	142.4	161.2	-102.8	-31.3	0	0	0	108.9	V205 L206	D203-V205 PolarHBondContact O-N 3.12Å; D203-L206 PolarHBondContact O-N 2.84Å
204	K	42.7	Very low	44.7	Very low	194 Å²	194	113.4 Å²	113.4	84%	0.843	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-3	-176.3	-71.5	-176.6	176.1	-178.8	0	115.7
205	V	48.3	Very low	46.6	Very low	133 Å²	133	113.5 Å²	113.5	81%	0.806	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-13.3	-179.6	-174.3	0	0	0	0	112.4	D203	D203-V205 PolarHBondContact O-N 3.12Å
206	L	41.7	Very low	48.7	Very low	71 Å²	71	108.7 Å²	108.7	37%	0.372	58%	0.584	S	S	.	*			trans	-113.8	101.8	-171	-70.4	164.3	0	0	0	111.8	D203 R208 Q210	D203-L206 PolarHBondContact O-N 2.84Å; L206-R208 PolarHBondContact O-N 3.4Å; L206-Q210 HydrophobicContact CD1-CG 4Å
207	L	47.3	Very low	51.2	Low	180 Å²	180	105.9 Å²	105.9	94%	0.942	58%	0.576	S	S	*	*	S	Bend	trans	-65	4.6	174.6	-85.2	149.3	0	0	0	114.9
208	R	44.2	Very low	53.4	Low	208 Å²	208	99.4 Å²	99.4	79%	0.785	55%	0.549	S	S	*	.	S	Bend	trans	-141.1	136.4	174.9	-70.2	-174.1	179.2	178.6	-0.9	109.7	L206 Q210	L206-R208 PolarHBondContact O-N 3.4Å; R208-Q210 PolarHBondContact O-N 3.36Å
209	P	47.8	Very low	55.6	Low	83 Å²	83	103.3 Å²	103.3	54%	0.539	55%	0.553	S	S	.	*			trans	-59	125.1	174.5	22.9	-30.6	0	0	0	109.8	G211	P209-G211 VanDerWaalsContact C-N 3.31Å; P209-G211 PolarHBondContact O-N 3.13Å; P209-G211 VanDerWaalsContact O-N 3.11Å
210	Q	44.7	Very low	57.7	Low	143 Å²	143	98.7 Å²	98.7	67%	0.668	53%	0.531	S	S	*	.	S	Bend	trans	-83.6	78.8	174.3	-78	-169.1	-1.6	0	0	109.5	L206 R208	L206-Q210 HydrophobicContact CD1-CG 4Å; R208-Q210 PolarHBondContact O-N 3.36Å
211	G	54.7	Low	59.7	Low	31 Å²	31	95.8 Å²	95.8	32%	0.32	52%	0.516	S	S	.	.			trans	148.6	149.8	163	0	0	0	0	0	113.5	L200 P209 D215	L200-G211 WeakPolarHBondContact CD1-O 3.39Å; P209-G211 VanDerWaalsContact C-N 3.31Å; P209-G211 PolarHBondContact O-N 3.13Å; P209-G211 VanDerWaalsContact O-N 3.11Å; G211-D215 WeakPolarHBondContact CA-OD2 3.14Å
212	C	62.9	Low	62.1	Low	63 Å²	63	93.4 Å²	93.4	43%	0.426	49%	0.49	S	S	.	.			trans	-98	156.7	172.7	-170.1	0	0	0	0	109.5	D214 D215	C212-D214 HydrophobicContact CB-CB 4.35Å; C212-D214 PolarHBondContact O-N 2.76Å; C212-D214 VanDerWaalsContact O-N 3.08Å; C212-D215 PolarHBondContact N-OD2 3.21Å; C212-D215 WeakPolarHBondContact O-CB 3.48Å; C212-D215 PolarHBondContact O-N 3.12Å
213	V	67.3	Low	64.3	Low	72 Å²	72	96.6 Å²	96.6	44%	0.436	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-54.3	-28.3	169.2	177.7	0	0	0	0	110.8	D215 L216 L221 W244	V213-D215 PolarHBondContact O-N 3.39Å; V213-L216 HydrophobicContact CG1-CD1 4.06Å; V213-L216 VanDerWaalsContact O-CB 3.32Å; V213-L216 WeakPolarHBondContact O-CB 3.49Å; V213-L216 WeakPolarHBondContact O-CG 3.4Å; V213-L216 PolarHBondContact O-N 3.21Å; V213-L221 HydrophobicContact CG1-CD1 4.18Å; V213-W244 HydrophobicContact CB-CZ2 4.39Å; V213-W244 HydrophobicContact CG1-CH2 4.29Å; V213-W244 HydrophobicContact CG1-CZ2 3.7Å
214	D	66.5	Low	66.4	Low	71 Å²	71	93.8 Å²	93.8	38%	0.38	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-68.4	-16	174.7	-69.5	-38.9	0	0	0	114.5	C212 L216 R243 W244	C212-D214 HydrophobicContact CB-CB 4.35Å; C212-D214 PolarHBondContact O-N 2.76Å; C212-D214 VanDerWaalsContact O-N 3.08Å; D214-L216 VanDerWaalsContact C-N 3.33Å; D214-R243 PolarHBondContact O-NH1 2.86Å; D214-W244 PolarHBondContact OD1-NE1 3.39Å; D214-W244 VanDerWaalsContact OD1-NE1 3.12Å
215	D	71.9	Confident	68.5	Low	120 Å²	120	84.8 Å²	84.8	64%	0.642	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-83.7	-10.3	174.3	-60.7	-40.5	0	0	0	112.3	G211 C212 V213	G211-D215 WeakPolarHBondContact CA-OD2 3.14Å; C212-D215 PolarHBondContact N-OD2 3.21Å; C212-D215 WeakPolarHBondContact O-CB 3.48Å; C212-D215 PolarHBondContact O-N 3.12Å; V213-D215 PolarHBondContact O-N 3.39Å
216	L	78.9	Confident	70.3	Confident	23 Å²	23	78.7 Å²	78.7	12%	0.12	41%	0.411	C	S	.	.	S	Bend	trans	-67.7	144.5	177.7	-65.2	174.5	0	0	0	111	L200 V213 D214 V220 R243	L200-L216 HydrophobicContact CD2-CD2 4.27Å; V213-L216 HydrophobicContact CG1-CD1 4.06Å; V213-L216 VanDerWaalsContact O-CB 3.32Å; V213-L216 WeakPolarHBondContact O-CB 3.49Å; V213-L216 WeakPolarHBondContact O-CG 3.4Å; V213-L216 PolarHBondContact O-N 3.21Å; D214-L216 VanDerWaalsContact C-N 3.33Å; L216-V220 HydrophobicContact CB-CB 4.49Å; L216-V220 HydrophobicContact CD1-CG1 4.26Å; L216-V220 HydrophobicContact CD2-CG1 4.36Å; L216-R243 VanDerWaalsContact O-CZ 3.32Å; L216-R243 PolarHBondContact O-NH1 3.5Å; L216-R243 PolarHBondContact O-NH2 3.23Å
217	P	85.2	Confident	72.3	Confident	68 Å²	68	79.9 Å²	79.9	44%	0.442	42%	0.417	S	S	.	.			trans	-56.5	153.6	169.1	-23.5	33.5	0	0	0	112.3	E219 V220 L221 R243	P217-E219 VanDerWaalsContact CB-OE2 3.32Å; P217-E219 WeakPolarHBondContact CB-OE2 3.24Å; P217-E219 PolarHBondContact O-N 3.42Å; P217-V220 HydrophobicContact CB-CG2 4.33Å; P217-V220 HydrophobicContact CG-CG2 4.3Å; P217-V220 PolarHBondContact O-N 2.89Å; P217-L221 PolarHBondContact O-N 2.85Å; P217-R243 VanDerWaalsContact C-NH2 3.31Å
218	E	82.7	Confident	74.1	Confident	76 Å²	76	73 Å²	73	36%	0.355	38%	0.382	S	S	.	.	H	α-helix	trans	-62.9	-33.1	-177.3	-171.8	179.9	144.2	0	0	111.6	L221 R222 I247	E218-L221 PolarHBondContact O-N 3.13Å; E218-R222 WeakPolarHBondContact O-CB 3.49Å; E218-R222 VanDerWaalsContact O-CG 3.29Å; E218-R222 WeakPolarHBondContact O-CG 3.36Å; E218-R222 PolarHBondContact O-N 3.26Å; E218-R222 IonicContact OE1-CZ 2.73Å; E218-R222 VanDerWaalsContact OE1-CZ 3.28Å; E218-R222 IonicContact OE1-NE 2.95Å; E218-R222 PolarHBondContact OE1-NE 3.4Å; E218-R222 IonicContact OE1-NH2 3.97Å; E218-R222 PolarHBondContact OE1-NH2 3.41Å; E218-I247 HydrophobicContact CG-CD1 3.75Å; E218-I247 HydrophobicContact CG-CG1 3.95Å
219	E	83.6	Confident	76	Confident	134 Å²	134	63.5 Å²	63.5	63%	0.626	35%	0.347	S	S	*	.	H	α-helix	trans	-62	-46.3	177.6	-59.4	78.2	-173.2	0	0	111.1	P217 R222 E223	P217-E219 VanDerWaalsContact CB-OE2 3.32Å; P217-E219 WeakPolarHBondContact CB-OE2 3.24Å; P217-E219 PolarHBondContact O-N 3.42Å; E219-R222 WeakPolarHBondContact O-CB 3.44Å; E219-R222 PolarHBondContact O-N 3.39Å; E219-E223 PolarHBondContact O-N 2.9Å; E219-E223 VanDerWaalsContact O-N 3.14Å
220	V	84.2	Confident	77.8	Confident	55 Å²	55	59.8 Å²	59.8	33%	0.333	32%	0.324	S	S	.	.	H	α-helix	trans	-67.3	-41.5	177.4	-178.5	0	0	0	0	110.3	L216 P217 R222 E223 V224	L216-V220 HydrophobicContact CB-CB 4.49Å; L216-V220 HydrophobicContact CD1-CG1 4.26Å; L216-V220 HydrophobicContact CD2-CG1 4.36Å; P217-V220 HydrophobicContact CB-CG2 4.33Å; P217-V220 HydrophobicContact CG-CG2 4.3Å; P217-V220 PolarHBondContact O-N 2.89Å; V220-R222 VanDerWaalsContact C-N 3.29Å; V220-R222 PolarHBondContact O-N 3.14Å; V220-E223 PolarHBondContact O-N 3.34Å; V220-E223 VanDerWaalsContact O-N 3.14Å; V220-V224 WeakPolarHBondContact O-CG2 3.09Å; V220-V224 PolarHBondContact O-N 3.13Å
221	L	85.2	Confident	79.7	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-63.1	-37.2	177.6	-173.3	61.6	0	0	0	111.6	V213 P217 E218 V224 L225 W244 I247	V213-L221 HydrophobicContact CG1-CD1 4.18Å; P217-L221 PolarHBondContact O-N 2.85Å; E218-L221 PolarHBondContact O-N 3.13Å; L221-V224 PolarHBondContact O-N 2.93Å; L221-L225 HydrophobicContact CD1-CD1 4.15Å; L221-L225 HydrophobicContact CD1-CG 4.07Å; L221-L225 HydrophobicContact CG-CD1 3.91Å; L221-L225 HydrophobicContact CG-CG 4.22Å; L221-L225 VanDerWaalsContact O-CB 3.31Å; L221-L225 WeakPolarHBondContact O-CB 3.48Å; L221-L225 WeakPolarHBondContact O-CG 3.26Å; L221-L225 PolarHBondContact O-N 3.01Å; L221-W244 HydrophobicContact CD1-CZ2 4.26Å; L221-W244 VanDerWaalsContact CD2-CD1 3.5Å; L221-W244 HydrophobicContact CD2-CG 4.27Å; L221-I247 HydrophobicContact CB-CD1 4.31Å; L221-I247 HydrophobicContact CD2-CD1 3.44Å; L221-I247 VanDerWaalsContact CD2-CD1 3.44Å; L221-I247 HydrophobicContact CG-CD1 3.89Å
222	R	87.1	Confident	81	Confident	62 Å²	62	54 Å²	54	23%	0.234	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-43	172.2	-76.8	169.6	178.6	-105.4	0.6	111.6	E218 E219 V220 V224 L225 C226 I247 D250 F253	E218-R222 WeakPolarHBondContact O-CB 3.49Å; E218-R222 VanDerWaalsContact O-CG 3.29Å; E218-R222 WeakPolarHBondContact O-CG 3.36Å; E218-R222 PolarHBondContact O-N 3.26Å; E218-R222 IonicContact OE1-CZ 2.73Å; E218-R222 VanDerWaalsContact OE1-CZ 3.28Å; E218-R222 IonicContact OE1-NE 2.95Å; E218-R222 PolarHBondContact OE1-NE 3.4Å; E218-R222 IonicContact OE1-NH2 3.97Å; E218-R222 PolarHBondContact OE1-NH2 3.41Å; E219-R222 WeakPolarHBondContact O-CB 3.44Å; E219-R222 PolarHBondContact O-N 3.39Å; V220-R222 VanDerWaalsContact C-N 3.29Å; V220-R222 PolarHBondContact O-N 3.14Å; R222-V224 VanDerWaalsContact C-N 3.32Å; R222-V224 PolarHBondContact O-N 3.14Å; R222-L225 PolarHBondContact O-N 3.37Å; R222-C226 WeakPolarHBondContact O-CB 3.09Å; R222-C226 PolarHBondContact O-N 3.35Å; R222-C226 PolarHBondContact O-SG 2.91Å; R222-I247 HydrophobicContact CG-CG2 3.6Å; R222-D250 IonicContact CZ-OD2 2.96Å; R222-D250 VanDerWaalsContact CZ-OD2 3.3Å; R222-D250 IonicContact NH1-OD2 3.13Å; R222-D250 PolarHBondContact NH1-OD2 3.22Å; R222-D250 IonicContact NH2-OD2 2.7Å; R222-D250 PolarHBondContact NH2-OD2 3.49Å; R222-F253 HydrophobicContact CB-CD2 4.25Å; R222-F253 HydrophobicContact CB-CE2 3.92Å; R222-F253 HydrophobicContact CG-CD2 4.07Å; R222-F253 HydrophobicContact CG-CE2 4.11Å; R222-F253 VanDerWaalsContact O-CE2 3.29Å; R222-F253 WeakPolarHBondContact O-CE2 3.37Å
223	E	83.6	Confident	82.1	Confident	116 Å²	116	51 Å²	51	54%	0.542	27%	0.273	S	S	.	.	H	α-helix	trans	-68.9	-26	176.6	-67.3	-53.8	140.3	0	0	113.9	E219 V220 C226	E219-E223 PolarHBondContact O-N 2.9Å; E219-E223 VanDerWaalsContact O-N 3.14Å; V220-E223 PolarHBondContact O-N 3.34Å; V220-E223 VanDerWaalsContact O-N 3.14Å; E223-C226 PolarHBondContact O-SG 3.36Å
224	V	84.8	Confident	83	Confident	65 Å²	65	50.7 Å²	50.7	39%	0.394	27%	0.265	S	S	.	.	H	α-helix	trans	-79.2	-47.7	172.8	174.5	0	0	0	0	110.4	V220 L221 R222 C226 L227	V220-V224 WeakPolarHBondContact O-CG2 3.09Å; V220-V224 PolarHBondContact O-N 3.13Å; L221-V224 PolarHBondContact O-N 2.93Å; R222-V224 VanDerWaalsContact C-N 3.32Å; R222-V224 PolarHBondContact O-N 3.14Å; V224-C226 VanDerWaalsContact C-N 3.3Å; V224-C226 PolarHBondContact O-N 3.24Å; V224-L227 PolarHBondContact O-N 3.46Å
225	L	86.9	Confident	83.7	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.026	27%	0.271	C	S	.	.	H	α-helix	trans	-68.3	-27.2	-175.5	-68.5	-178.6	0	0	0	112.6	L221 R222 L227 V228 L233 V237 W244 I247 F253	L221-L225 HydrophobicContact CD1-CD1 4.15Å; L221-L225 HydrophobicContact CD1-CG 4.07Å; L221-L225 HydrophobicContact CG-CD1 3.91Å; L221-L225 HydrophobicContact CG-CG 4.22Å; L221-L225 VanDerWaalsContact O-CB 3.31Å; L221-L225 WeakPolarHBondContact O-CB 3.48Å; L221-L225 WeakPolarHBondContact O-CG 3.26Å; L221-L225 PolarHBondContact O-N 3.01Å; R222-L225 PolarHBondContact O-N 3.37Å; L225-L227 PolarHBondContact O-N 3.42Å; L225-V228 HydrophobicContact CD2-CG2 4.49Å; L225-V228 WeakPolarHBondContact O-CB 3.06Å; L225-V228 PolarHBondContact O-N 3.13Å; L225-L233 HydrophobicContact CB-CD2 4.31Å; L225-L233 WeakPolarHBondContact O-CD2 3.49Å; L225-V237 HydrophobicContact CD1-CG1 4Å; L225-V237 HydrophobicContact CD2-CG1 3.55Å; L225-V237 HydrophobicContact CD2-CG2 4.31Å; L225-V237 HydrophobicContact CG-CG1 4.37Å; L225-W244 HydrophobicContact CD2-CE3 4.35Å; L225-W244 HydrophobicContact CD2-CZ3 4.48Å; L225-I247 HydrophobicContact CD1-CD1 4.5Å; L225-I247 HydrophobicContact CD1-CG2 4.27Å; L225-F253 HydrophobicContact CB-CE1 4.32Å; L225-F253 HydrophobicContact CB-CZ 3.75Å
226	C	85.9	Confident	84.1	Confident	6 Å²	6	51.8 Å²	51.8	4%	0.041	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-25.7	179.4	64.5	0	0	0	0	112.9	R222 E223 V224 V228 F253 V254 K257 T382	R222-C226 WeakPolarHBondContact O-CB 3.09Å; R222-C226 PolarHBondContact O-N 3.35Å; R222-C226 PolarHBondContact O-SG 2.91Å; E223-C226 PolarHBondContact O-SG 3.36Å; V224-C226 VanDerWaalsContact C-N 3.3Å; V224-C226 PolarHBondContact O-N 3.24Å; C226-V228 VanDerWaalsContact C-N 3.28Å; C226-F253 HydrophobicContact CB-CE2 4.08Å; C226-F253 HydrophobicContact CB-CZ 4.13Å; C226-V254 HydrophobicContact CB-CG1 3.77Å; C226-K257 PolarHBondContact O-NZ 3.35Å; C226-T382 HydrophobicContact CB-CG2 3.9Å; C226-T382 WeakPolarHBondContact SG-CG2 2.89Å
227	L	83.5	Confident	84.3	Confident	96 Å²	96	51.3 Å²	51.3	50%	0.503	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-23.4	174.9	-57.7	178.4	0	0	0	111.8	V224 L225 L381	V224-L227 PolarHBondContact O-N 3.46Å; L225-L227 PolarHBondContact O-N 3.42Å; L227-L381 HydrophobicContact CD2-CD2 4.14Å
228	V	84.1	Confident	84.2	Confident	35 Å²	35	48.9 Å²	48.9	21%	0.212	24%	0.243	C	C	.	.	S	Bend	trans	-71.6	134.7	178.4	-177.5	0	0	0	0	109.9	L225 C226 D232 L233 V237 K257	L225-V228 HydrophobicContact CD2-CG2 4.49Å; L225-V228 WeakPolarHBondContact O-CB 3.06Å; L225-V228 PolarHBondContact O-N 3.13Å; C226-V228 VanDerWaalsContact C-N 3.28Å; V228-D232 HydrophobicContact CG1-CB 3.69Å; V228-L233 HydrophobicContact CB-CD2 3.83Å; V228-L233 HydrophobicContact CB-CG 4.21Å; V228-L233 HydrophobicContact CG1-CD2 4.07Å; V228-L233 HydrophobicContact CG1-CG 4.22Å; V228-V237 HydrophobicContact CG1-CG2 4.15Å; V228-K257 WeakPolarHBondContact O-CE 3.41Å; V228-K257 PolarHBondContact O-NZ 2.78Å
229	P	84.4	Confident	84.2	Confident	8 Å²	8	51.4 Å²	51.4	5%	0.052	26%	0.258	C	S	.	.			trans	-67.4	151.8	-179.1	-27.5	42.1	0	0	0	112.4	A231 D232 L233 E421 R441	P229-A231 PolarHBondContact O-N 2.62Å; P229-A231 VanDerWaalsContact O-N 3.07Å; P229-D232 PolarHBondContact O-N 2.83Å; P229-D232 VanDerWaalsContact O-N 3.08Å; P229-L233 PolarHBondContact O-N 3.3Å; P229-L233 VanDerWaalsContact O-N 3.16Å; P229-E421 HydrophobicContact CB-CB 4.25Å; P229-E421 HydrophobicContact CB-CG 4.28Å; P229-E421 HydrophobicContact CG-CB 3.69Å; P229-E421 HydrophobicContact CG-CG 4.07Å; P229-R441 VanDerWaalsContact CB-NH1 3.31Å; P229-R441 VanDerWaalsContact CG-CZ 3.42Å
230	A	85.8	Confident	84.1	Confident	5 Å²	5	47.9 Å²	47.9	4%	0.041	25%	0.246	C	C	.	.	H	α-helix	trans	-57.1	-32.9	-170	0	0	0	0	0	113.7	L233 Y234 K257 F261	A230-L233 PolarHBondContact O-N 2.67Å; A230-Y234 WeakPolarHBondContact O-CD2 3.24Å; A230-Y234 PolarHBondContact O-N 2.96Å; A230-K257 HydrophobicContact CB-CG 4.11Å; A230-F261 HydrophobicContact CB-CB 3.52Å; A230-F261 HydrophobicContact CB-CD1 4.32Å; A230-F261 HydrophobicContact CB-CD2 4.17Å; A230-F261 HydrophobicContact CB-CG 3.75Å
231	A	83.8	Confident	84	Confident	25 Å²	25	47.1 Å²	47.1	21%	0.207	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-46.3	178.1	0	0	0	0	0	112.4	P229 Y234 R235 F261	P229-A231 PolarHBondContact O-N 2.62Å; P229-A231 VanDerWaalsContact O-N 3.07Å; A231-Y234 PolarHBondContact O-N 2.89Å; A231-R235 WeakPolarHBondContact O-CB 3.27Å; A231-R235 VanDerWaalsContact O-CG 3.31Å; A231-R235 WeakPolarHBondContact O-CG 3.21Å; A231-R235 PolarHBondContact O-N 2.99Å; A231-F261 HydrophobicContact CB-CD2 4.48Å; A231-F261 HydrophobicContact CB-CE2 3.69Å; A231-F261 HydrophobicContact CB-CZ 3.95Å
232	D	82.9	Confident	83.9	Confident	27 Å²	27	54.3 Å²	54.3	14%	0.144	28%	0.276	C	S	.	.	H	α-helix	trans	-77.2	-28.2	-179.6	-74.9	11.9	0	0	0	112.3	V228 P229 Y234 R235 N236 V237 R441	V228-D232 HydrophobicContact CG1-CB 3.69Å; P229-D232 PolarHBondContact O-N 2.83Å; P229-D232 VanDerWaalsContact O-N 3.08Å; D232-Y234 PolarHBondContact O-N 3.08Å; D232-R235 PolarHBondContact O-N 3.18Å; D232-N236 HydrophobicContact CB-CB 4.48Å; D232-N236 PolarHBondContact O-N 2.87Å; D232-V237 PolarHBondContact O-N 2.84Å; D232-R441 VanDerWaalsContact CB-NH2 3.35Å; D232-R441 IonicContact OD1-CZ 3.45Å; D232-R441 IonicContact OD1-NH2 2.91Å; D232-R441 PolarHBondContact OD1-NH2 2.54Å; D232-R441 IonicContact OD2-CZ 3.83Å; D232-R441 IonicContact OD2-NE 2.77Å; D232-R441 PolarHBondContact OD2-NE 2.89Å; D232-R441 IonicContact OD2-NH2 3.52Å; D232-R441 PolarHBondContact OD2-NH2 3.12Å
233	L	86.3	Confident	83.7	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.279	C	S	.	.	I	π-helix	trans	-53.6	-46.9	172.3	-73.2	-178.5	0	0	0	110.5	L225 V228 P229 A230 V237 C238 V248 F253 V254	L225-L233 HydrophobicContact CB-CD2 4.31Å; L225-L233 WeakPolarHBondContact O-CD2 3.49Å; V228-L233 HydrophobicContact CB-CD2 3.83Å; V228-L233 HydrophobicContact CB-CG 4.21Å; V228-L233 HydrophobicContact CG1-CD2 4.07Å; V228-L233 HydrophobicContact CG1-CG 4.22Å; P229-L233 PolarHBondContact O-N 3.3Å; P229-L233 VanDerWaalsContact O-N 3.16Å; A230-L233 PolarHBondContact O-N 2.67Å; L233-V237 HydrophobicContact CD2-CB 4.31Å; L233-V237 HydrophobicContact CD2-CG1 4.23Å; L233-V237 HydrophobicContact CD2-CG2 4.17Å; L233-C238 PolarHBondContact O-N 3.19Å; L233-C238 VanDerWaalsContact O-N 3.12Å; L233-C238 PolarHBondContact O-SG 3.08Å; L233-V248 HydrophobicContact CB-CG1 4.01Å; L233-V248 HydrophobicContact CB-CG2 4.49Å; L233-V248 HydrophobicContact CD2-CG2 4.11Å; L233-F253 HydrophobicContact CD1-CE1 4.38Å; L233-V254 HydrophobicContact CD1-CG2 4.21Å
234	Y	85.7	Confident	83.9	Confident	67 Å²	67	51.3 Å²	51.3	26%	0.263	26%	0.259	S	S	.	.	I	π-helix	trans	-79.6	-36.6	179.2	-70.6	-64.3	0	0	0	114.1	A230 A231 D232 V248 K258 F261	A230-Y234 WeakPolarHBondContact O-CD2 3.24Å; A230-Y234 PolarHBondContact O-N 2.96Å; A231-Y234 PolarHBondContact O-N 2.89Å; D232-Y234 PolarHBondContact O-N 3.08Å; Y234-V248 HydrophobicContact CD1-CG1 4.37Å; Y234-V248 HydrophobicContact CE1-CG1 4.4Å; Y234-K258 HydrophobicContact CE2-CB 4.43Å; Y234-K258 HydrophobicContact CE2-CG 4.15Å; Y234-K258 WeakPolarHBondContact OH-CB 3.47Å; Y234-K258 WeakPolarHBondContact OH-CD 3.41Å; Y234-K258 WeakPolarHBondContact OH-CG 3.31Å; Y234-F261 AromaticContact CD2-CD1 3.87Å; Y234-F261 HydrophobicContact CD2-CD1 3.87Å; Y234-F261 AromaticContact CD2-CE1 3.93Å; Y234-F261 HydrophobicContact CD2-CE1 3.93Å; Y234-F261 AromaticContact CE2-CD1 3.99Å; Y234-F261 HydrophobicContact CE2-CD1 3.99Å; Y234-F261 HydrophobicContact CE2-CE1 4.48Å
235	R	81.1	Confident	83.9	Confident	135 Å²	135	54.2 Å²	54.2	51%	0.509	26%	0.263	S	S	.	.	I	π-helix	trans	-85.3	-43.8	-173	-71.5	176.7	172.5	-167.3	-6	113.9	A231 D232 L239	A231-R235 WeakPolarHBondContact O-CB 3.27Å; A231-R235 VanDerWaalsContact O-CG 3.31Å; A231-R235 WeakPolarHBondContact O-CG 3.21Å; A231-R235 PolarHBondContact O-N 2.99Å; D232-R235 PolarHBondContact O-N 3.18Å; R235-L239 WeakPolarHBondContact O-CD1 3.38Å; R235-L239 WeakPolarHBondContact O-CG 3.31Å
236	N	81.6	Confident	83.9	Confident	79 Å²	79	59.2 Å²	59.2	42%	0.422	29%	0.29	S	S	.	.	I	π-helix	trans	-110.5	-54.2	-168.9	-60.4	-24.6	0	0	0	110.7	D232 C238 L239	D232-N236 HydrophobicContact CB-CB 4.48Å; D232-N236 PolarHBondContact O-N 2.87Å; N236-C238 PolarHBondContact O-N 3.07Å; N236-L239 PolarHBondContact O-N 3.15Å
237	V	82.7	Confident	84	Confident	13 Å²	13	59 Å²	59	8%	0.079	29%	0.289	C	S	.	.	I	π-helix	trans	-63.9	-39.3	-174.2	176.4	0	0	0	0	111.9	L225 V228 D232 L233 L239 V240 W244 V248	L225-V237 HydrophobicContact CD1-CG1 4Å; L225-V237 HydrophobicContact CD2-CG1 3.55Å; L225-V237 HydrophobicContact CD2-CG2 4.31Å; L225-V237 HydrophobicContact CG-CG1 4.37Å; V228-V237 HydrophobicContact CG1-CG2 4.15Å; D232-V237 PolarHBondContact O-N 2.84Å; L233-V237 HydrophobicContact CD2-CB 4.31Å; L233-V237 HydrophobicContact CD2-CG1 4.23Å; L233-V237 HydrophobicContact CD2-CG2 4.17Å; V237-L239 PolarHBondContact O-N 2.92Å; V237-V240 PolarHBondContact O-N 3.46Å; V237-W244 HydrophobicContact CB-CE3 4.49Å; V237-W244 HydrophobicContact CG1-CB 4.28Å; V237-W244 HydrophobicContact CG1-CD2 4.5Å; V237-W244 HydrophobicContact CG1-CE3 3.7Å; V237-W244 HydrophobicContact CG1-CZ3 4.43Å; V237-V248 HydrophobicContact CB-CG2 4.5Å; V237-V248 HydrophobicContact CG1-CG2 3.79Å
238	C	83.4	Confident	84.2	Confident	16 Å²	16	54.5 Å²	54.5	11%	0.108	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-20.8	176	-80.9	0	0	0	0	114.2	L233 N236 V248	L233-C238 PolarHBondContact O-N 3.19Å; L233-C238 VanDerWaalsContact O-N 3.12Å; L233-C238 PolarHBondContact O-SG 3.08Å; N236-C238 PolarHBondContact O-N 3.07Å; C238-V248 WeakPolarHBondContact SG-CG1 3.42Å
239	L	81.9	Confident	84.3	Confident	130 Å²	130	57.3 Å²	57.3	68%	0.681	28%	0.278	S	S	*	.	H	α-helix	trans	-93.4	-12.8	-177.1	-58.8	-176.9	0	0	0	112.9	R235 N236 V237	R235-L239 WeakPolarHBondContact O-CD1 3.38Å; R235-L239 WeakPolarHBondContact O-CG 3.31Å; N236-L239 PolarHBondContact O-N 3.15Å; V237-L239 PolarHBondContact O-N 2.92Å
240	V	81.7	Confident	84.5	Confident	60 Å²	60	58.7 Å²	58.7	36%	0.364	29%	0.285	S	S	.	.	H	α-helix	trans	-66	-56.8	-176.5	179.4	0	0	0	0	111.4	V237 W244	V237-V240 PolarHBondContact O-N 3.46Å; V240-W244 HydrophobicContact CB-CD2 4.11Å; V240-W244 HydrophobicContact CB-CE3 3.6Å; V240-W244 HydrophobicContact CB-CZ3 3.99Å; V240-W244 HydrophobicContact CG1-CD2 4.03Å; V240-W244 HydrophobicContact CG1-CE3 3.77Å; V240-W244 HydrophobicContact CG1-CH2 4.15Å; V240-W244 HydrophobicContact CG1-CZ2 4.33Å; V240-W244 HydrophobicContact CG1-CZ3 3.86Å; V240-W244 HydrophobicContact CG2-CE3 3.72Å; V240-W244 HydrophobicContact CG2-CZ3 3.75Å
241	C	82.1	Confident	84.5	Confident	39 Å²	39	63.4 Å²	63.4	26%	0.264	32%	0.315	S	S	.	.			trans	-157.4	165	176.7	77.2	0	0	0	0	112.4	R243 W244 R245	C241-R243 PolarHBondContact O-N 2.89Å; C241-W244 PolarHBondContact O-N 2.66Å; C241-W244 PolarHBondContact SG-N 3.42Å; C241-R245 WeakPolarHBondContact O-CB 3.44Å; C241-R245 PolarHBondContact O-N 3.42Å
242	H	83.2	Confident	84.7	Confident	152 Å²	152	70.8 Å²	70.8	70%	0.704	34%	0.343	S	S	*	.	H	α-helix	trans	-58.3	-34.6	178.8	-71.2	-67	0	0	0	113.2	N246	H242-N246 WeakPolarHBondContact O-CB 2.86Å; H242-N246 PolarHBondContact O-N 2.99Å; H242-N246 PolarHBondContact O-ND2 2.9Å; H242-N246 PolarHBondContact O-OD1 3.3Å
243	R	83.4	Confident	84.9	Confident	79 Å²	79	70 Å²	70	30%	0.298	34%	0.338	S	S	.	.	H	α-helix	trans	-65.4	-49.5	179.7	-176.1	-178.6	176.9	-156.4	-5.2	111.4	D214 L216 P217 C241 R245 N246 I247	D214-R243 PolarHBondContact O-NH1 2.86Å; L216-R243 VanDerWaalsContact O-CZ 3.32Å; L216-R243 PolarHBondContact O-NH1 3.5Å; L216-R243 PolarHBondContact O-NH2 3.23Å; P217-R243 VanDerWaalsContact C-NH2 3.31Å; C241-R243 PolarHBondContact O-N 2.89Å; R243-R245 VanDerWaalsContact C-N 3.33Å; R243-R245 PolarHBondContact O-N 2.87Å; R243-N246 PolarHBondContact O-N 3.17Å; R243-I247 WeakPolarHBondContact O-CG1 3.11Å; R243-I247 PolarHBondContact O-N 2.74Å; R243-I247 VanDerWaalsContact O-N 3.16Å
244	W	86.1	Confident	85.1	Confident	36 Å²	36	70.6 Å²	70.6	14%	0.136	34%	0.342	C	S	.	.	H	α-helix	trans	-64.4	-41.7	178.5	-66.6	27.2	0	0	0	110.6	V213 D214 L221 L225 V237 V240 C241 N246 I247 V248	V213-W244 HydrophobicContact CB-CZ2 4.39Å; V213-W244 HydrophobicContact CG1-CH2 4.29Å; V213-W244 HydrophobicContact CG1-CZ2 3.7Å; D214-W244 PolarHBondContact OD1-NE1 3.39Å; D214-W244 VanDerWaalsContact OD1-NE1 3.12Å; L221-W244 HydrophobicContact CD1-CZ2 4.26Å; L221-W244 VanDerWaalsContact CD2-CD1 3.5Å; L221-W244 HydrophobicContact CD2-CG 4.27Å; L225-W244 HydrophobicContact CD2-CE3 4.35Å; L225-W244 HydrophobicContact CD2-CZ3 4.48Å; V237-W244 HydrophobicContact CB-CE3 4.49Å; V237-W244 HydrophobicContact CG1-CB 4.28Å; V237-W244 HydrophobicContact CG1-CD2 4.5Å; V237-W244 HydrophobicContact CG1-CE3 3.7Å; V237-W244 HydrophobicContact CG1-CZ3 4.43Å; V240-W244 HydrophobicContact CB-CD2 4.11Å; V240-W244 HydrophobicContact CB-CE3 3.6Å; V240-W244 HydrophobicContact CB-CZ3 3.99Å; V240-W244 HydrophobicContact CG1-CD2 4.03Å; V240-W244 HydrophobicContact CG1-CE3 3.77Å; V240-W244 HydrophobicContact CG1-CH2 4.15Å; V240-W244 HydrophobicContact CG1-CZ2 4.33Å; V240-W244 HydrophobicContact CG1-CZ3 3.86Å; V240-W244 HydrophobicContact CG2-CE3 3.72Å; V240-W244 HydrophobicContact CG2-CZ3 3.75Å; C241-W244 PolarHBondContact O-N 2.66Å; C241-W244 PolarHBondContact SG-N 3.42Å; W244-N246 VanDerWaalsContact C-N 3.33Å; W244-N246 PolarHBondContact O-N 2.96Å; W244-I247 PolarHBondContact O-N 3.25Å; W244-V248 WeakPolarHBondContact O-CG2 2.88Å; W244-V248 PolarHBondContact O-N 2.86Å
245	R	85.1	Confident	85.3	Confident	125 Å²	125	69.6 Å²	69.6	47%	0.472	34%	0.343	S	S	.	.	H	α-helix	trans	-56.8	-44.2	173.1	-175.2	175.7	174.1	179.9	-0.2	112.5	C241 R243 I247 V248 L249	C241-R245 WeakPolarHBondContact O-CB 3.44Å; C241-R245 PolarHBondContact O-N 3.42Å; R243-R245 VanDerWaalsContact C-N 3.33Å; R243-R245 PolarHBondContact O-N 2.87Å; R245-I247 VanDerWaalsContact C-N 3.32Å; R245-I247 PolarHBondContact O-N 3Å; R245-V248 PolarHBondContact O-N 3.47Å; R245-L249 HydrophobicContact CG-CD1 3.71Å; R245-L249 HydrophobicContact CG-CG 4.21Å; R245-L249 WeakPolarHBondContact O-CB 3.3Å; R245-L249 VanDerWaalsContact O-CG 3.25Å; R245-L249 WeakPolarHBondContact O-CG 3.23Å; R245-L249 PolarHBondContact O-N 3.29Å
246	N	87.4	Confident	85.8	Confident	111 Å²	111	65.2 Å²	65.2	59%	0.594	33%	0.328	S	S	*	.	H	α-helix	trans	-63.6	-37.9	178.6	-70.3	-16.9	0	0	0	112.1	H242 R243 W244 D250	H242-N246 WeakPolarHBondContact O-CB 2.86Å; H242-N246 PolarHBondContact O-N 2.99Å; H242-N246 PolarHBondContact O-ND2 2.9Å; H242-N246 PolarHBondContact O-OD1 3.3Å; R243-N246 PolarHBondContact O-N 3.17Å; W244-N246 VanDerWaalsContact C-N 3.33Å; W244-N246 PolarHBondContact O-N 2.96Å; N246-D250 PolarHBondContact O-N 3.47Å; N246-D250 VanDerWaalsContact O-N 3.11Å
247	I	87.8	Confident	86.3	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-65.9	-48.2	175	-63.8	166.3	0	0	0	110.6	E218 L221 R222 L225 R243 W244 R245 L249 D250 F253	E218-I247 HydrophobicContact CG-CD1 3.75Å; E218-I247 HydrophobicContact CG-CG1 3.95Å; L221-I247 HydrophobicContact CB-CD1 4.31Å; L221-I247 HydrophobicContact CD2-CD1 3.44Å; L221-I247 VanDerWaalsContact CD2-CD1 3.44Å; L221-I247 HydrophobicContact CG-CD1 3.89Å; R222-I247 HydrophobicContact CG-CG2 3.6Å; L225-I247 HydrophobicContact CD1-CD1 4.5Å; L225-I247 HydrophobicContact CD1-CG2 4.27Å; R243-I247 WeakPolarHBondContact O-CG1 3.11Å; R243-I247 PolarHBondContact O-N 2.74Å; R243-I247 VanDerWaalsContact O-N 3.16Å; W244-I247 PolarHBondContact O-N 3.25Å; R245-I247 VanDerWaalsContact C-N 3.32Å; R245-I247 PolarHBondContact O-N 3Å; I247-L249 VanDerWaalsContact C-N 3.32Å; I247-L249 PolarHBondContact O-N 3.43Å; I247-D250 VanDerWaalsContact O-CB 3.29Å; I247-D250 WeakPolarHBondContact O-CB 3.17Å; I247-D250 PolarHBondContact O-N 3.31Å; I247-F253 HydrophobicContact CG2-CD1 4.01Å; I247-F253 HydrophobicContact CG2-CD2 4.17Å; I247-F253 HydrophobicContact CG2-CE1 4.1Å; I247-F253 HydrophobicContact CG2-CE2 4.26Å; I247-F253 HydrophobicContact CG2-CG 4.05Å; I247-F253 HydrophobicContact CG2-CZ 4.23Å; I247-F253 WeakPolarHBondContact O-CB 3.17Å; I247-F253 WeakPolarHBondContact O-CD1 3.48Å
248	V	87.4	Confident	86.7	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-37.8	-178.4	177.4	0	0	0	0	111.7	L233 Y234 V237 C238 W244 R245 D250 K258	L233-V248 HydrophobicContact CB-CG1 4.01Å; L233-V248 HydrophobicContact CB-CG2 4.49Å; L233-V248 HydrophobicContact CD2-CG2 4.11Å; Y234-V248 HydrophobicContact CD1-CG1 4.37Å; Y234-V248 HydrophobicContact CE1-CG1 4.4Å; V237-V248 HydrophobicContact CB-CG2 4.5Å; V237-V248 HydrophobicContact CG1-CG2 3.79Å; C238-V248 WeakPolarHBondContact SG-CG1 3.42Å; W244-V248 WeakPolarHBondContact O-CG2 2.88Å; W244-V248 PolarHBondContact O-N 2.86Å; R245-V248 PolarHBondContact O-N 3.47Å; V248-D250 VanDerWaalsContact C-N 3.31Å; V248-D250 PolarHBondContact O-N 2.74Å; V248-K258 PolarHBondContact O-NZ 2.87Å
249	L	87	Confident	87.1	Confident	95 Å²	95	61.6 Å²	61.6	50%	0.497	31%	0.306	S	S	.	.	H	α-helix	trans	-77.4	-12.6	178.1	-66.2	179.8	0	0	0	113.8	R245 I247 P251	R245-L249 HydrophobicContact CG-CD1 3.71Å; R245-L249 HydrophobicContact CG-CG 4.21Å; R245-L249 WeakPolarHBondContact O-CB 3.3Å; R245-L249 VanDerWaalsContact O-CG 3.25Å; R245-L249 WeakPolarHBondContact O-CG 3.23Å; R245-L249 PolarHBondContact O-N 3.29Å; I247-L249 VanDerWaalsContact C-N 3.32Å; I247-L249 PolarHBondContact O-N 3.43Å; L249-P251 WeakPolarHBondContact O-CD 3.5Å
250	D	89.3	Confident	87.6	Confident	36 Å²	36	56 Å²	56	19%	0.193	28%	0.276	C	S	.	.			trans	-60.7	119	175.2	179.9	-4.5	0	0	0	110	R222 N246 I247 V248 K252 F253 K258	R222-D250 IonicContact CZ-OD2 2.96Å; R222-D250 VanDerWaalsContact CZ-OD2 3.3Å; R222-D250 IonicContact NH1-OD2 3.13Å; R222-D250 PolarHBondContact NH1-OD2 3.22Å; R222-D250 IonicContact NH2-OD2 2.7Å; R222-D250 PolarHBondContact NH2-OD2 3.49Å; N246-D250 PolarHBondContact O-N 3.47Å; N246-D250 VanDerWaalsContact O-N 3.11Å; I247-D250 VanDerWaalsContact O-CB 3.29Å; I247-D250 WeakPolarHBondContact O-CB 3.17Å; I247-D250 PolarHBondContact O-N 3.31Å; V248-D250 VanDerWaalsContact C-N 3.31Å; V248-D250 PolarHBondContact O-N 2.74Å; D250-K252 PolarHBondContact O-N 2.82Å; D250-K252 VanDerWaalsContact O-N 3.09Å; D250-K252 WeakPolarHBondContact OD1-CB 3.33Å; D250-K252 PolarHBondContact OD1-N 2.94Å; D250-F253 HydrophobicContact CB-CB 4.09Å; D250-F253 PolarHBondContact O-N 3.26Å; D250-F253 VanDerWaalsContact O-N 3.09Å; D250-K258 PolarHBondContact O-NZ 2.99Å
251	P	85.6	Confident	88.1	Confident	104 Å²	104	55 Å²	55	68%	0.675	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-21	-179.2	25.4	-35.2	0	0	0	113.5	L249	L249-P251 WeakPolarHBondContact O-CD 3.5Å
252	K	87	Confident	88.5	Confident	180 Å²	180	56.6 Å²	56.6	78%	0.783	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-16.5	178.9	-62.6	-179.5	-179.9	177.6	0	113.7	D250	D250-K252 PolarHBondContact O-N 2.82Å; D250-K252 VanDerWaalsContact O-N 3.09Å; D250-K252 WeakPolarHBondContact OD1-CB 3.33Å; D250-K252 PolarHBondContact OD1-N 2.94Å
253	F	88.1	Confident	88.9	Confident	11 Å²	11	49.5 Å²	49.5	5%	0.048	23%	0.234	C	C	.	.	S	Bend	trans	-83	114.9	-179.7	178.6	-113.8	0	0	0	110.3	R222 L225 C226 L233 I247 D250 K258	R222-F253 HydrophobicContact CB-CD2 4.25Å; R222-F253 HydrophobicContact CB-CE2 3.92Å; R222-F253 HydrophobicContact CG-CD2 4.07Å; R222-F253 HydrophobicContact CG-CE2 4.11Å; R222-F253 VanDerWaalsContact O-CE2 3.29Å; R222-F253 WeakPolarHBondContact O-CE2 3.37Å; L225-F253 HydrophobicContact CB-CE1 4.32Å; L225-F253 HydrophobicContact CB-CZ 3.75Å; C226-F253 HydrophobicContact CB-CE2 4.08Å; C226-F253 HydrophobicContact CB-CZ 4.13Å; L233-F253 HydrophobicContact CD1-CE1 4.38Å; I247-F253 HydrophobicContact CG2-CD1 4.01Å; I247-F253 HydrophobicContact CG2-CD2 4.17Å; I247-F253 HydrophobicContact CG2-CE1 4.1Å; I247-F253 HydrophobicContact CG2-CE2 4.26Å; I247-F253 HydrophobicContact CG2-CG 4.05Å; I247-F253 HydrophobicContact CG2-CZ 4.23Å; I247-F253 WeakPolarHBondContact O-CB 3.17Å; I247-F253 WeakPolarHBondContact O-CD1 3.48Å; D250-F253 HydrophobicContact CB-CB 4.09Å; D250-F253 PolarHBondContact O-N 3.26Å; D250-F253 VanDerWaalsContact O-N 3.09Å; F253-K258 WeakPolarHBondContact O-CE 3.36Å; F253-K258 PolarHBondContact O-NZ 2.99Å
254	V	88.4	Confident	89.2	Confident	13 Å²	13	48.7 Å²	48.7	8%	0.079	24%	0.235	C	C	.	.	S	Bend	trans	41.9	56.8	-178.2	-67	0	0	0	0	114.1	C226 L233 F256 K257 K258 E386	C226-V254 HydrophobicContact CB-CG1 3.77Å; L233-V254 HydrophobicContact CD1-CG2 4.21Å; V254-F256 PolarHBondContact O-N 3.45Å; V254-K257 HydrophobicContact CB-CB 4.26Å; V254-K258 HydrophobicContact CG2-CD 4.21Å; V254-K258 HydrophobicContact CG2-CG 4.12Å; V254-K258 WeakPolarHBondContact O-CB 3.3Å; V254-K258 WeakPolarHBondContact O-CG 3.5Å; V254-K258 PolarHBondContact O-N 3.38Å; V254-K258 VanDerWaalsContact O-N 3.14Å; V254-E386 VanDerWaalsContact C-OE1 3.29Å; V254-E386 WeakPolarHBondContact CA-OE1 3.34Å; V254-E386 WeakPolarHBondContact CB-OE1 3.41Å
255	P	90.3	Very high	89.3	Confident	45 Å²	45	52.5 Å²	52.5	29%	0.292	26%	0.255	S	S	.	.	H	α-helix	trans	-57.8	-46.9	-171.5	22.2	-33.8	0	0	0	113.1	K258 Q259 E386	P255-K258 PolarHBondContact O-N 3.18Å; P255-Q259 VanDerWaalsContact O-CB 3.28Å; P255-Q259 WeakPolarHBondContact O-CB 3.42Å; P255-Q259 PolarHBondContact O-N 3.13Å; P255-E386 WeakPolarHBondContact CD-OE2 3.42Å; P255-E386 WeakPolarHBondContact CG-OE2 3.4Å; P255-E386 VanDerWaalsContact N-OE2 3.14Å
256	F	91.9	Very high	89.4	Confident	43 Å²	43	52 Å²	52	19%	0.189	26%	0.257	C	S	.	.	H	α-helix	trans	-77.4	-37.3	-172.4	-66.3	-71.1	0	0	0	112.2	V254 K258 Q259 Y260 H303 E386 H390 M393	V254-F256 PolarHBondContact O-N 3.45Å; F256-K258 VanDerWaalsContact C-N 3.34Å; F256-K258 PolarHBondContact O-N 3Å; F256-Q259 PolarHBondContact O-N 2.72Å; F256-Y260 WeakPolarHBondContact O-CB 3.45Å; F256-Y260 PolarHBondContact O-N 3.04Å; F256-H303 AromaticContact CD2-CE1 3.58Å; F256-H303 AromaticContact CE2-CE1 3.31Å; F256-H303 WeakPolarHBondContact CE2-CE1 3.39Å; F256-H303 AromaticContact CE2-ND1 3.6Å; F256-H303 AromaticContact CZ-ND1 3.9Å; F256-E386 WeakPolarHBondContact CB-OE2 3.47Å; F256-E386 WeakPolarHBondContact CD2-OE2 3.41Å; F256-E386 PolarHBondContact N-OE2 3.49Å; F256-H390 HydrophobicContact CB-CB 4.04Å; F256-H390 HydrophobicContact CD1-CB 3.7Å; F256-H390 AromaticContact CD1-CD2 3.48Å; F256-H390 VanDerWaalsContact CD1-CD2 3.48Å; F256-H390 WeakPolarHBondContact CD1-CD2 3.31Å; F256-H390 AromaticContact CD1-CG 3.56Å; F256-H390 HydrophobicContact CD2-CB 4.35Å; F256-H390 HydrophobicContact CE1-CB 4.21Å; F256-H390 AromaticContact CE1-CD2 3.41Å; F256-H390 VanDerWaalsContact CE1-CD2 3.41Å; F256-H390 WeakPolarHBondContact CE1-CD2 3.41Å; F256-H390 AromaticContact CE1-CE1 3.88Å; F256-H390 AromaticContact CE1-CG 3.59Å; F256-H390 AromaticContact CE1-ND1 3.88Å; F256-H390 AromaticContact CE1-NE2 3.61Å; F256-H390 HydrophobicContact CG-CB 3.77Å; F256-M393 HydrophobicContact CD1-CE 4.26Å
257	K	91.5	Very high	89.6	Confident	5 Å²	5	49.5 Å²	49.5	2%	0.022	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-44.9	171.6	176	169.4	171.3	170.8	0	111.3	C226 V228 A230 V254 F261 E386 E421	C226-K257 PolarHBondContact O-NZ 3.35Å; V228-K257 WeakPolarHBondContact O-CE 3.41Å; V228-K257 PolarHBondContact O-NZ 2.78Å; A230-K257 HydrophobicContact CB-CG 4.11Å; V254-K257 HydrophobicContact CB-CB 4.26Å; K257-F261 PolarHBondContact O-N 2.76Å; K257-F261 VanDerWaalsContact O-N 3.12Å; K257-E386 WeakPolarHBondContact CB-OE1 3.46Å; K257-E386 PolarHBondContact N-OE1 3.25Å; K257-E421 WeakPolarHBondContact CE-OE1 3.35Å; K257-E421 IonicContact NZ-OE1 3.15Å; K257-E421 PolarHBondContact NZ-OE1 2.92Å
258	K	91.9	Very high	89.7	Confident	6 Å²	6	57.8 Å²	57.8	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-66.5	-41.3	175.3	-74.9	-172.7	-38.7	-162	0	112.9	Y234 V248 D250 F253 V254 P255 F256 R262	Y234-K258 HydrophobicContact CE2-CB 4.43Å; Y234-K258 HydrophobicContact CE2-CG 4.15Å; Y234-K258 WeakPolarHBondContact OH-CB 3.47Å; Y234-K258 WeakPolarHBondContact OH-CD 3.41Å; Y234-K258 WeakPolarHBondContact OH-CG 3.31Å; V248-K258 PolarHBondContact O-NZ 2.87Å; D250-K258 PolarHBondContact O-NZ 2.99Å; F253-K258 WeakPolarHBondContact O-CE 3.36Å; F253-K258 PolarHBondContact O-NZ 2.99Å; V254-K258 HydrophobicContact CG2-CD 4.21Å; V254-K258 HydrophobicContact CG2-CG 4.12Å; V254-K258 WeakPolarHBondContact O-CB 3.3Å; V254-K258 WeakPolarHBondContact O-CG 3.5Å; V254-K258 PolarHBondContact O-N 3.38Å; V254-K258 VanDerWaalsContact O-N 3.14Å; P255-K258 PolarHBondContact O-N 3.18Å; F256-K258 VanDerWaalsContact C-N 3.34Å; F256-K258 PolarHBondContact O-N 3Å; K258-R262 WeakPolarHBondContact O-CB 3.43Å; K258-R262 VanDerWaalsContact O-CG 3.3Å; K258-R262 WeakPolarHBondContact O-CG 3.34Å; K258-R262 PolarHBondContact O-N 3.41Å; K258-R262 VanDerWaalsContact O-N 3.14Å; K258-R262 PolarHBondContact O-NE 2.95Å
259	Q	91.8	Very high	89.8	Confident	21 Å²	21	63.5 Å²	63.5	10%	0.098	30%	0.304	C	S	.	.	H	α-helix	trans	-68.8	-41.1	179.1	-160.3	179.6	19.3	0	0	111.3	P255 F256 R262 Y263 T270 E273 M393	P255-Q259 VanDerWaalsContact O-CB 3.28Å; P255-Q259 WeakPolarHBondContact O-CB 3.42Å; P255-Q259 PolarHBondContact O-N 3.13Å; F256-Q259 PolarHBondContact O-N 2.72Å; Q259-R262 PolarHBondContact O-N 3.48Å; Q259-Y263 VanDerWaalsContact O-CB 3.31Å; Q259-Y263 WeakPolarHBondContact O-CB 3.32Å; Q259-Y263 PolarHBondContact O-N 2.93Å; Q259-T270 HydrophobicContact CG-CG2 3.64Å; Q259-E273 VanDerWaalsContact NE2-CD 3.31Å; Q259-E273 PolarHBondContact NE2-OE2 3.08Å; Q259-M393 HydrophobicContact CB-CE 4.49Å; Q259-M393 HydrophobicContact CB-SD 3.9Å; Q259-M393 HydrophobicContact CG-CE 4.21Å; Q259-M393 HydrophobicContact CG-SD 3.61Å; Q259-M393 VanDerWaalsContact OE1-CE 3.29Å
260	Y	93.5	Very high	89.9	Confident	13 Å²	13	59.1 Å²	59.1	5%	0.051	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-48.5	175.5	177	-126.5	0	0	0	111.7	F256 R262 Y263 M264 A392 M393 L396 H410 Y414 L417	F256-Y260 WeakPolarHBondContact O-CB 3.45Å; F256-Y260 PolarHBondContact O-N 3.04Å; Y260-R262 PolarHBondContact O-N 3.28Å; Y260-Y263 WeakPolarHBondContact O-CB 3.47Å; Y260-Y263 PolarHBondContact O-N 2.84Å; Y260-M264 HydrophobicContact CD2-CG 4.21Å; Y260-M264 HydrophobicContact CE1-CE 4.31Å; Y260-M264 HydrophobicContact CE1-CG 4.41Å; Y260-M264 HydrophobicContact CE1-SD 3.94Å; Y260-M264 HydrophobicContact CE2-CG 3.85Å; Y260-M264 HydrophobicContact CE2-SD 4.19Å; Y260-M264 WeakPolarHBondContact O-CG 3.33Å; Y260-M264 PolarHBondContact O-N 3.07Å; Y260-A392 HydrophobicContact CD2-CB 4.34Å; Y260-A392 HydrophobicContact CE1-CB 4.29Å; Y260-A392 HydrophobicContact CE2-CB 3.79Å; Y260-M393 HydrophobicContact CD2-CB 3.73Å; Y260-M393 HydrophobicContact CD2-CG 4.45Å; Y260-M393 HydrophobicContact CG-CB 4.38Å; Y260-L396 HydrophobicContact CE2-CD2 4.23Å; Y260-H410 AromaticContact CE2-NE2 3.71Å; Y260-H410 AromaticContact CZ-NE2 3.67Å; Y260-H410 PolarHBondContact OH-CE1 3.49Å; Y260-H410 PolarHBondContact OH-NE2 3Å; Y260-Y414 WeakPolarHBondContact OH-CD2 3.43Å; Y260-L417 HydrophobicContact CE1-CD1 4.28Å
261	F	91	Very high	89.9	Confident	38 Å²	38	59.3 Å²	59.3	17%	0.167	28%	0.283	C	S	.	.	H	α-helix	trans	-58.3	-48.4	175.8	176.9	-102.2	0	0	0	112.4	A230 A231 Y234 K257 Y263 M264 M265	A230-F261 HydrophobicContact CB-CB 3.52Å; A230-F261 HydrophobicContact CB-CD1 4.32Å; A230-F261 HydrophobicContact CB-CD2 4.17Å; A230-F261 HydrophobicContact CB-CG 3.75Å; A231-F261 HydrophobicContact CB-CD2 4.48Å; A231-F261 HydrophobicContact CB-CE2 3.69Å; A231-F261 HydrophobicContact CB-CZ 3.95Å; Y234-F261 AromaticContact CD2-CD1 3.87Å; Y234-F261 HydrophobicContact CD2-CD1 3.87Å; Y234-F261 AromaticContact CD2-CE1 3.93Å; Y234-F261 HydrophobicContact CD2-CE1 3.93Å; Y234-F261 AromaticContact CE2-CD1 3.99Å; Y234-F261 HydrophobicContact CE2-CD1 3.99Å; Y234-F261 HydrophobicContact CE2-CE1 4.48Å; K257-F261 PolarHBondContact O-N 2.76Å; K257-F261 VanDerWaalsContact O-N 3.12Å; F261-Y263 VanDerWaalsContact C-N 3.29Å; F261-Y263 PolarHBondContact O-N 2.81Å; F261-M264 HydrophobicContact CD2-CE 4.37Å; F261-M264 WeakPolarHBondContact O-CB 3.46Å; F261-M264 PolarHBondContact O-N 2.77Å; F261-M265 HydrophobicContact CD1-CG 4.49Å; F261-M265 HydrophobicContact CE1-CG 4.11Å; F261-M265 HydrophobicContact CE2-CG 4.24Å; F261-M265 HydrophobicContact CZ-CG 3.97Å; F261-M265 HydrophobicContact CZ-SD 4.41Å; F261-M265 WeakPolarHBondContact O-CG 3.4Å; F261-M265 PolarHBondContact O-N 3.27Å
262	R	91.1	Very high	90	Very high	74 Å²	74	60.3 Å²	60.3	28%	0.279	28%	0.282	S	S	.	.	H	α-helix	trans	-61	-38.3	176.9	-74.3	178.8	-64.4	159.7	-3.3	112.4	K258 Q259 Y260 M265 K266 E267 T270	K258-R262 WeakPolarHBondContact O-CB 3.43Å; K258-R262 VanDerWaalsContact O-CG 3.3Å; K258-R262 WeakPolarHBondContact O-CG 3.34Å; K258-R262 PolarHBondContact O-N 3.41Å; K258-R262 VanDerWaalsContact O-N 3.14Å; K258-R262 PolarHBondContact O-NE 2.95Å; Q259-R262 PolarHBondContact O-N 3.48Å; Y260-R262 PolarHBondContact O-N 3.28Å; R262-M265 CarbonylContact O-C 3.5Å; R262-M265 PolarHBondContact O-N 2.93Å; R262-K266 PolarHBondContact O-N 3.31Å; R262-E267 HydrophobicContact CB-CB 4.39Å; R262-E267 WeakPolarHBondContact CB-OE2 3.47Å; R262-E267 VanDerWaalsContact CD-OE2 3.24Å; R262-E267 WeakPolarHBondContact CD-OE2 3.22Å; R262-E267 WeakPolarHBondContact CG-OE2 3.41Å; R262-E267 PolarHBondContact O-N 3.27Å; R262-E267 VanDerWaalsContact O-N 3.12Å; R262-T270 HydrophobicContact CB-CG2 4.13Å
263	Y	91.8	Very high	90.1	Very high	3 Å²	3	56.3 Å²	56.3	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-66.6	-42.2	174.4	-168.8	-99.1	0	0	0	112	Q259 Y260 F261 M265 K266 T270 V271 V274 M393 L396 A397 R400	Q259-Y263 VanDerWaalsContact O-CB 3.31Å; Q259-Y263 WeakPolarHBondContact O-CB 3.32Å; Q259-Y263 PolarHBondContact O-N 2.93Å; Y260-Y263 WeakPolarHBondContact O-CB 3.47Å; Y260-Y263 PolarHBondContact O-N 2.84Å; F261-Y263 VanDerWaalsContact C-N 3.29Å; F261-Y263 PolarHBondContact O-N 2.81Å; Y263-M265 VanDerWaalsContact C-N 3.28Å; Y263-M265 PolarHBondContact O-N 2.97Å; Y263-K266 PolarHBondContact O-N 3.02Å; Y263-T270 HydrophobicContact CD2-CG2 4.41Å; Y263-V271 HydrophobicContact CD2-CG2 3.94Å; Y263-V271 HydrophobicContact CE2-CB 4.35Å; Y263-V271 HydrophobicContact CE2-CG2 3.9Å; Y263-V274 HydrophobicContact CD2-CB 4.04Å; Y263-V274 HydrophobicContact CD2-CG1 4.27Å; Y263-V274 HydrophobicContact CD2-CG2 3.89Å; Y263-V274 HydrophobicContact CE2-CB 3.86Å; Y263-V274 HydrophobicContact CE2-CG1 3.84Å; Y263-V274 HydrophobicContact CE2-CG2 4.24Å; Y263-M393 HydrophobicContact CD1-CG 4.35Å; Y263-M393 HydrophobicContact CG-CG 4.27Å; Y263-L396 HydrophobicContact CD1-CD2 3.97Å; Y263-L396 HydrophobicContact CD1-CG 4.31Å; Y263-L396 HydrophobicContact CE1-CB 4.28Å; Y263-L396 HydrophobicContact CE1-CD2 4.14Å; Y263-L396 HydrophobicContact CE1-CG 3.99Å; Y263-A397 HydrophobicContact CE1-CB 4.01Å; Y263-A397 HydrophobicContact CE2-CB 4.47Å; Y263-A397 VanDerWaalsContact OH-CA 3.28Å; Y263-A397 WeakPolarHBondContact OH-CA 3.44Å; Y263-A397 WeakPolarHBondContact OH-CB 3.37Å; Y263-R400 VanDerWaalsContact CE1-NH1 3.32Å; Y263-R400 PolarHBondContact O-NH1 2.88Å; Y263-R400 PolarHBondContact O-NH2 3.48Å; Y263-R400 WeakPolarHBondContact OH-CD 3.33Å
264	M	89.8	Confident	90.1	Very high	62 Å²	62	55.8 Å²	55.8	31%	0.305	26%	0.264	S	S	.	.	H	α-helix	trans	-58	-42.3	173.3	-71.5	-155.4	-55.5	0	0	111.4	Y260 F261 K266 L396 R400 Y414	Y260-M264 HydrophobicContact CD2-CG 4.21Å; Y260-M264 HydrophobicContact CE1-CE 4.31Å; Y260-M264 HydrophobicContact CE1-CG 4.41Å; Y260-M264 HydrophobicContact CE1-SD 3.94Å; Y260-M264 HydrophobicContact CE2-CG 3.85Å; Y260-M264 HydrophobicContact CE2-SD 4.19Å; Y260-M264 WeakPolarHBondContact O-CG 3.33Å; Y260-M264 PolarHBondContact O-N 3.07Å; F261-M264 HydrophobicContact CD2-CE 4.37Å; F261-M264 WeakPolarHBondContact O-CB 3.46Å; F261-M264 PolarHBondContact O-N 2.77Å; M264-K266 PolarHBondContact O-N 3.3Å; M264-L396 HydrophobicContact CG-CD2 4.08Å; M264-R400 PolarHBondContact O-NH2 3.36Å; M264-Y414 HydrophobicContact CE-CE2 4.49Å; M264-Y414 HydrophobicContact SD-CD2 4.43Å; M264-Y414 HydrophobicContact SD-CE2 4.17Å
265	M	87.4	Confident	90	Very high	116 Å²	116	56.6 Å²	56.6	57%	0.571	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-4.3	176.6	-63.1	-60.9	-79.8	0	0	114.2	F261 R262 Y263 E267	F261-M265 HydrophobicContact CD1-CG 4.49Å; F261-M265 HydrophobicContact CE1-CG 4.11Å; F261-M265 HydrophobicContact CE2-CG 4.24Å; F261-M265 HydrophobicContact CZ-CG 3.97Å; F261-M265 HydrophobicContact CZ-SD 4.41Å; F261-M265 WeakPolarHBondContact O-CG 3.4Å; F261-M265 PolarHBondContact O-N 3.27Å; R262-M265 CarbonylContact O-C 3.5Å; R262-M265 PolarHBondContact O-N 2.93Å; Y263-M265 VanDerWaalsContact C-N 3.28Å; Y263-M265 PolarHBondContact O-N 2.97Å; M265-E267 VanDerWaalsContact C-N 3.33Å; M265-E267 PolarHBondContact O-N 3.44Å
266	K	88	Confident	89.8	Confident	114 Å²	114	56.8 Å²	56.8	50%	0.496	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	37.9	-179.2	-56.6	-171.9	175.7	-165.6	0	113.7	R262 Y263 M264 K268	R262-K266 PolarHBondContact O-N 3.31Å; Y263-K266 PolarHBondContact O-N 3.02Å; M264-K266 PolarHBondContact O-N 3.3Å; K266-K268 PolarHBondContact O-N 3.41Å
267	E	91.3	Very high	89.4	Confident	58 Å²	58	56.8 Å²	56.8	27%	0.271	28%	0.276	S	S	.	.			trans	-59.9	128.9	171.1	-175.3	-176.8	-136.2	0	0	110.6	R262 M265 E269 T270 V271	R262-E267 HydrophobicContact CB-CB 4.39Å; R262-E267 WeakPolarHBondContact CB-OE2 3.47Å; R262-E267 VanDerWaalsContact CD-OE2 3.24Å; R262-E267 WeakPolarHBondContact CD-OE2 3.22Å; R262-E267 WeakPolarHBondContact CG-OE2 3.41Å; R262-E267 PolarHBondContact O-N 3.27Å; R262-E267 VanDerWaalsContact O-N 3.12Å; M265-E267 VanDerWaalsContact C-N 3.33Å; M265-E267 PolarHBondContact O-N 3.44Å; E267-E269 PolarHBondContact O-N 3.2Å; E267-T270 PolarHBondContact O-N 3.13Å; E267-T270 PolarHBondContact OE2-OG1 2.85Å; E267-V271 WeakPolarHBondContact O-CB 3.32Å; E267-V271 VanDerWaalsContact O-CG2 3.23Å; E267-V271 WeakPolarHBondContact O-CG2 3.26Å; E267-V271 PolarHBondContact O-N 2.94Å
268	K	89.2	Confident	89.1	Confident	176 Å²	176	56.7 Å²	56.7	77%	0.765	28%	0.276	S	S	*	.	H	α-helix	trans	-58.6	-45.8	-171	-67.5	-178.8	-179.5	176.6	0	112.5	K266 V271 L272	K266-K268 PolarHBondContact O-N 3.41Å; K268-V271 PolarHBondContact O-N 2.97Å; K268-L272 WeakPolarHBondContact O-CG 3.28Å; K268-L272 PolarHBondContact O-N 3.17Å
269	E	90	Very high	88.6	Confident	121 Å²	121	63.1 Å²	63.1	57%	0.565	30%	0.304	S	S	*	.	H	α-helix	trans	-63.8	-52.2	-177.7	-64.8	-179.7	-176	0	0	111.4	H89 E267 V271 L272 E273	H89-E269 IonicContact CE1-OE1 3.88Å; E267-E269 PolarHBondContact O-N 3.2Å; E269-V271 VanDerWaalsContact C-N 3.3Å; E269-V271 PolarHBondContact O-N 2.99Å; E269-L272 PolarHBondContact O-N 3.2Å; E269-L272 VanDerWaalsContact O-N 3.13Å; E269-E273 PolarHBondContact O-N 2.88Å
270	T	88.9	Confident	88.1	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.018	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-38.5	177.5	-60.7	0	0	0	0	111.9	Q259 R262 Y263 E267 E273 V274	Q259-T270 HydrophobicContact CG-CG2 3.64Å; R262-T270 HydrophobicContact CB-CG2 4.13Å; Y263-T270 HydrophobicContact CD2-CG2 4.41Å; E267-T270 PolarHBondContact O-N 3.13Å; E267-T270 PolarHBondContact OE2-OG1 2.85Å; T270-E273 PolarHBondContact O-N 3.23Å; T270-V274 HydrophobicContact CG2-CG2 4.37Å; T270-V274 WeakPolarHBondContact O-CB 3.29Å; T270-V274 VanDerWaalsContact O-CG2 3.3Å; T270-V274 WeakPolarHBondContact O-CG2 3.38Å; T270-V274 PolarHBondContact O-N 3.04Å
271	V	89.4	Confident	87.3	Confident	39 Å²	39	69.2 Å²	69.2	24%	0.236	34%	0.34	C	S	.	.	H	α-helix	trans	-64	-42.2	175.8	170.4	0	0	0	0	111.4	Y263 E267 K268 E269 C275	Y263-V271 HydrophobicContact CD2-CG2 3.94Å; Y263-V271 HydrophobicContact CE2-CB 4.35Å; Y263-V271 HydrophobicContact CE2-CG2 3.9Å; E267-V271 WeakPolarHBondContact O-CB 3.32Å; E267-V271 VanDerWaalsContact O-CG2 3.23Å; E267-V271 WeakPolarHBondContact O-CG2 3.26Å; E267-V271 PolarHBondContact O-N 2.94Å; K268-V271 PolarHBondContact O-N 2.97Å; E269-V271 VanDerWaalsContact C-N 3.3Å; E269-V271 PolarHBondContact O-N 2.99Å; V271-C275 VanDerWaalsContact O-CB 3.27Å; V271-C275 WeakPolarHBondContact O-CB 3.41Å; V271-C275 PolarHBondContact O-N 2.94Å; V271-C275 PolarHBondContact O-SG 3.35Å
272	L	88.6	Confident	86.5	Confident	125 Å²	125	72.7 Å²	72.7	65%	0.654	36%	0.361	S	S	*	.	H	α-helix	trans	-65.8	-42.8	176.7	-71.2	171.1	0	0	0	111.9	K268 E269 C275 S276	K268-L272 WeakPolarHBondContact O-CG 3.28Å; K268-L272 PolarHBondContact O-N 3.17Å; E269-L272 PolarHBondContact O-N 3.2Å; E269-L272 VanDerWaalsContact O-N 3.13Å; L272-C275 PolarHBondContact O-N 3.31Å; L272-S276 WeakPolarHBondContact O-CB 3.31Å; L272-S276 PolarHBondContact O-N 3.32Å
273	E	89	Confident	85.6	Confident	96 Å²	96	69.3 Å²	69.3	45%	0.449	35%	0.348	S	S	.	.	H	α-helix	trans	-60.3	-49.7	177.1	-173.6	-172.5	-166.4	0	0	111.4	Q259 E269 T270 C275 S276 T277	Q259-E273 VanDerWaalsContact NE2-CD 3.31Å; Q259-E273 PolarHBondContact NE2-OE2 3.08Å; E269-E273 PolarHBondContact O-N 2.88Å; T270-E273 PolarHBondContact O-N 3.23Å; E273-C275 PolarHBondContact O-N 2.94Å; E273-S276 PolarHBondContact O-N 3.48Å; E273-S276 VanDerWaalsContact O-N 3.15Å; E273-S276 PolarHBondContact O-OG 3.32Å; E273-T277 PolarHBondContact O-N 3.04Å; E273-T277 PolarHBondContact O-OG1 2.8Å
274	V	87.6	Confident	84.1	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-63.6	-42.3	177.7	172.4	0	0	0	0	110.8	Y263 T270 S276 T277 L278 M393 M394 A397	Y263-V274 HydrophobicContact CD2-CB 4.04Å; Y263-V274 HydrophobicContact CD2-CG1 4.27Å; Y263-V274 HydrophobicContact CD2-CG2 3.89Å; Y263-V274 HydrophobicContact CE2-CB 3.86Å; Y263-V274 HydrophobicContact CE2-CG1 3.84Å; Y263-V274 HydrophobicContact CE2-CG2 4.24Å; T270-V274 HydrophobicContact CG2-CG2 4.37Å; T270-V274 WeakPolarHBondContact O-CB 3.29Å; T270-V274 VanDerWaalsContact O-CG2 3.3Å; T270-V274 WeakPolarHBondContact O-CG2 3.38Å; T270-V274 PolarHBondContact O-N 3.04Å; V274-S276 VanDerWaalsContact C-N 3.3Å; V274-S276 PolarHBondContact O-N 3.22Å; V274-T277 WeakPolarHBondContact O-CB 3.39Å; V274-T277 PolarHBondContact O-N 3.18Å; V274-L278 WeakPolarHBondContact O-CG 3.45Å; V274-L278 PolarHBondContact O-N 2.86Å; V274-M393 HydrophobicContact CG2-CE 4.3Å; V274-M393 HydrophobicContact CG2-CG 4.38Å; V274-M393 HydrophobicContact CG2-SD 3.87Å; V274-M394 HydrophobicContact CG1-CE 3.96Å; V274-A397 HydrophobicContact CG1-CB 3.62Å
275	C	85.3	Confident	82.2	Confident	30 Å²	30	71.9 Å²	71.9	20%	0.203	37%	0.37	C	S	.	.	H	α-helix	trans	-62.2	-36.2	174.6	-75.6	0	0	0	0	112.6	V271 L272 E273 K279	V271-C275 VanDerWaalsContact O-CB 3.27Å; V271-C275 WeakPolarHBondContact O-CB 3.41Å; V271-C275 PolarHBondContact O-N 2.94Å; V271-C275 PolarHBondContact O-SG 3.35Å; L272-C275 PolarHBondContact O-N 3.31Å; E273-C275 PolarHBondContact O-N 2.94Å; C275-K279 WeakPolarHBondContact O-CG 2.92Å; C275-K279 PolarHBondContact O-N 3.13Å
276	S	85.9	Confident	80.5	Confident	50 Å²	50	71.9 Å²	71.9	35%	0.35	38%	0.378	S	S	.	.	H	α-helix	trans	-67.8	-38.7	174.3	77.7	0	0	0	0	111.8	L272 E273 V274 K279 N280	L272-S276 WeakPolarHBondContact O-CB 3.31Å; L272-S276 PolarHBondContact O-N 3.32Å; E273-S276 PolarHBondContact O-N 3.48Å; E273-S276 VanDerWaalsContact O-N 3.15Å; E273-S276 PolarHBondContact O-OG 3.32Å; V274-S276 VanDerWaalsContact C-N 3.3Å; V274-S276 PolarHBondContact O-N 3.22Å; S276-K279 PolarHBondContact O-N 3.23Å; S276-N280 WeakPolarHBondContact O-CB 3.5Å; S276-N280 PolarHBondContact O-N 3.02Å; S276-N280 PolarHBondContact O-ND2 3.37Å; S276-N280 PolarHBondContact O-OD1 3.09Å
277	T	85	Confident	78.8	Confident	43 Å²	43	69.9 Å²	69.9	26%	0.264	38%	0.384	S	S	.	.	H	α-helix	trans	-61.5	-46.8	175	-54.7	0	0	0	0	110.5	E273 V274 K279 N280 S281 L299	E273-T277 PolarHBondContact O-N 3.04Å; E273-T277 PolarHBondContact O-OG1 2.8Å; V274-T277 WeakPolarHBondContact O-CB 3.39Å; V274-T277 PolarHBondContact O-N 3.18Å; T277-K279 VanDerWaalsContact C-N 3.34Å; T277-K279 PolarHBondContact O-N 2.73Å; T277-N280 PolarHBondContact O-N 3.37Å; T277-S281 WeakPolarHBondContact O-CB 3.26Å; T277-S281 PolarHBondContact O-N 3.07Å; T277-S281 PolarHBondContact O-OG 2.94Å; T277-S281 VanDerWaalsContact O-OG 3.12Å; T277-L299 HydrophobicContact CG2-CD1 4.5Å; T277-L299 HydrophobicContact CG2-CD2 4.35Å
278	L	84	Confident	77.2	Confident	3 Å²	3	70.4 Å²	70.4	2%	0.016	39%	0.392	C	S	.	.	H	α-helix	trans	-59.2	-42.7	175.4	-69.9	178.6	0	0	0	112.2	V274 S281 N282 I283 M394 A397 L398 N401	V274-L278 WeakPolarHBondContact O-CG 3.45Å; V274-L278 PolarHBondContact O-N 2.86Å; L278-S281 PolarHBondContact O-N 3.07Å; L278-N282 PolarHBondContact O-N 3.21Å; L278-I283 HydrophobicContact CB-CB 4.33Å; L278-I283 HydrophobicContact CD2-CB 3.97Å; L278-I283 HydrophobicContact CD2-CD1 3.98Å; L278-I283 HydrophobicContact CD2-CG2 3.94Å; L278-I283 WeakPolarHBondContact O-CA 3.36Å; L278-I283 PolarHBondContact O-N 3.45Å; L278-M394 HydrophobicContact CD2-SD 4.21Å; L278-A397 HydrophobicContact CD1-CB 3.81Å; L278-L398 HydrophobicContact CD2-CD2 4.16Å; L278-N401 WeakPolarHBondContact CD1-ND2 3.44Å
279	K	82.3	Confident	75.8	Confident	140 Å²	140	63.7 Å²	63.7	61%	0.609	37%	0.367	S	S	*	.	H	α-helix	trans	-62	-47.2	175.2	-74.1	175.9	179.4	-175.3	0	112.3	C275 S276 T277 S281 N282 T284	C275-K279 WeakPolarHBondContact O-CG 2.92Å; C275-K279 PolarHBondContact O-N 3.13Å; S276-K279 PolarHBondContact O-N 3.23Å; T277-K279 VanDerWaalsContact C-N 3.34Å; T277-K279 PolarHBondContact O-N 2.73Å; K279-S281 PolarHBondContact O-N 3.37Å; K279-N282 PolarHBondContact O-N 2.99Å; K279-N282 VanDerWaalsContact O-N 3.08Å; K279-T284 HydrophobicContact CB-CG2 4.2Å; K279-T284 HydrophobicContact CG-CG2 3.67Å
280	N	81.9	Confident	74.9	Confident	132 Å²	132	60.6 Å²	60.6	71%	0.706	35%	0.352	S	S	*	.	H	α-helix	trans	-64.5	-30	-180	-66.4	-16.1	0	0	0	112.2	S276 T277 N282	S276-N280 WeakPolarHBondContact O-CB 3.5Å; S276-N280 PolarHBondContact O-N 3.02Å; S276-N280 PolarHBondContact O-ND2 3.37Å; S276-N280 PolarHBondContact O-OD1 3.09Å; T277-N280 PolarHBondContact O-N 3.37Å; N280-N282 VanDerWaalsContact C-N 3.31Å
281	S	76.8	Confident	74.3	Confident	30 Å²	30	63.5 Å²	63.5	21%	0.21	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	10.2	175.9	-57.2	0	0	0	0	114	T277 L278 K279 I283 N295	T277-S281 WeakPolarHBondContact O-CB 3.26Å; T277-S281 PolarHBondContact O-N 3.07Å; T277-S281 PolarHBondContact O-OG 2.94Å; T277-S281 VanDerWaalsContact O-OG 3.12Å; L278-S281 PolarHBondContact O-N 3.07Å; K279-S281 PolarHBondContact O-N 3.37Å; S281-I283 VanDerWaalsContact C-N 3.25Å; S281-I283 PolarHBondContact O-N 3.32Å; S281-N295 WeakPolarHBondContact O-CB 3.43Å; S281-N295 PolarHBondContact O-ND2 3.31Å
282	N	73.4	Confident	73.9	Confident	111 Å²	111	61.7 Å²	61.7	59%	0.594	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	35.8	-176	-60	-42.5	0	0	0	113.5	L278 K279 N280 N295	L278-N282 PolarHBondContact O-N 3.21Å; K279-N282 PolarHBondContact O-N 2.99Å; K279-N282 VanDerWaalsContact O-N 3.08Å; N280-N282 VanDerWaalsContact C-N 3.31Å; N282-N295 PolarHBondContact O-ND2 2.75Å
283	I	71.3	Confident	73.7	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.015	32%	0.323	C	S	.	.			trans	-107.5	75.5	175.3	-53.9	167.6	0	0	0	108.3	L278 S281 N295 L296 L398 I403	L278-I283 HydrophobicContact CB-CB 4.33Å; L278-I283 HydrophobicContact CD2-CB 3.97Å; L278-I283 HydrophobicContact CD2-CD1 3.98Å; L278-I283 HydrophobicContact CD2-CG2 3.94Å; L278-I283 WeakPolarHBondContact O-CA 3.36Å; L278-I283 PolarHBondContact O-N 3.45Å; S281-I283 VanDerWaalsContact C-N 3.25Å; S281-I283 PolarHBondContact O-N 3.32Å; I283-N295 HydrophobicContact CD1-CB 4.15Å; I283-N295 HydrophobicContact CG1-CB 3.64Å; I283-L296 HydrophobicContact CD1-CB 4.3Å; I283-L398 HydrophobicContact CG2-CD2 3.23Å; I283-I403 HydrophobicContact CG2-CD1 3.72Å
284	T	61	Low	73.6	Confident	48 Å²	48	52.2 Å²	52.2	29%	0.294	31%	0.306	S	S	.	.			trans	-129	144.2	-175.4	51.1	0	0	0	0	112.8	K279	K279-T284 HydrophobicContact CB-CG2 4.2Å; K279-T284 HydrophobicContact CG-CG2 3.67Å
285	C	50.4	Low	73.5	Confident	71 Å²	71	54.2 Å²	54.2	48%	0.48	32%	0.317	S	S	.	.	S	Bend	trans	-91.8	133.2	165.6	-171.2	0	0	0	0	108.4	N401	C285-N401 WeakPolarHBondContact CB-O 3.33Å
286	P	50.7	Low	73.6	Confident	116 Å²	116	52.8 Å²	52.8	75%	0.753	31%	0.307	S	S	*	.	S	Bend	cis	-111.1	1.7	17	20.3	0.6	0	0	0	116.7
287	A	52.2	Low	73.7	Confident	73 Å²	73	50.4 Å²	50.4	60%	0.603	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145	137.4	-179.6	0	0	0	0	0	113.9
288	P	57.5	Low	73.7	Confident	69 Å²	69	49.6 Å²	49.6	45%	0.448	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	cis	-90	114	-26.6	23	-7.5	0	0	0	109.6	E290	P288-E290 HydrophobicContact CB-CB 4.34Å; P288-E290 HydrophobicContact CB-CG 4.32Å; P288-E290 PolarHBondContact O-N 3.26Å
289	S	60.7	Low	73.9	Confident	34 Å²	34	50.5 Å²	50.5	24%	0.238	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-63.4	-9.9	173.5	63.8	0	0	0	0	113.4	H291 S292 P1024	S289-H291 PolarHBondContact O-N 3.5Å; S289-S292 VanDerWaalsContact C-OG 3.29Å; S289-S292 VanDerWaalsContact CA-OG 3.28Å; S289-S292 WeakPolarHBondContact CA-OG 3.46Å; S289-S292 VanDerWaalsContact O-CB 3.26Å; S289-S292 WeakPolarHBondContact O-CB 3.46Å; S289-S292 PolarHBondContact O-N 3.32Å; S289-S292 PolarHBondContact O-OG 2.89Å; S289-P1024 WeakPolarHBondContact O-CB 3.45Å; S289-P1024 WeakPolarHBondContact O-CG 2.96Å
290	E	71	Confident	74.2	Confident	56 Å²	56	43.9 Å²	43.9	26%	0.262	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-55.7	-44.9	-177.8	-62.3	168.3	-157	0	0	113.2	P288 W1019 F1027 L1034	P288-E290 HydrophobicContact CB-CB 4.34Å; P288-E290 HydrophobicContact CB-CG 4.32Å; P288-E290 PolarHBondContact O-N 3.26Å; E290-W1019 HydrophobicContact CG-CH2 3.98Å; E290-W1019 HydrophobicContact CG-CZ2 4.41Å; E290-F1027 HydrophobicContact CB-CD2 4.01Å; E290-F1027 HydrophobicContact CB-CE1 4.2Å; E290-F1027 HydrophobicContact CB-CE2 3.52Å; E290-F1027 HydrophobicContact CB-CZ 3.62Å; E290-F1027 HydrophobicContact CG-CE2 3.66Å; E290-F1027 HydrophobicContact CG-CZ 3.62Å; E290-F1027 VanDerWaalsContact O-CD2 3.23Å; E290-F1027 WeakPolarHBondContact O-CD2 3.18Å; E290-F1027 WeakPolarHBondContact O-CG 3.46Å; E290-L1034 WeakPolarHBondContact OE1-CD1 3.35Å
291	H	75.6	Confident	74.4	Confident	65 Å²	65	37.9 Å²	37.9	30%	0.301	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-95.1	5.7	-178.8	-57.9	-53	0	0	0	113.5	S289 I293 R294 N295	S289-H291 PolarHBondContact O-N 3.5Å; H291-I293 VanDerWaalsContact C-N 3.26Å; H291-I293 PolarHBondContact O-N 2.91Å; H291-I293 VanDerWaalsContact O-N 3.16Å; H291-R294 PolarHBondContact O-N 3.4Å; H291-N295 WeakPolarHBondContact O-CB 3.25Å; H291-N295 PolarHBondContact O-N 3.38Å
292	S	81.8	Confident	74.7	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-53.1	-42.5	-175.2	-58.4	0	0	0	0	113	S289 L296	S289-S292 VanDerWaalsContact C-OG 3.29Å; S289-S292 VanDerWaalsContact CA-OG 3.28Å; S289-S292 WeakPolarHBondContact CA-OG 3.46Å; S289-S292 VanDerWaalsContact O-CB 3.26Å; S289-S292 WeakPolarHBondContact O-CB 3.46Å; S289-S292 PolarHBondContact O-N 3.32Å; S289-S292 PolarHBondContact O-OG 2.89Å; S292-L296 WeakPolarHBondContact O-CB 3.45Å; S292-L296 PolarHBondContact O-N 3.25Å
293	I	85.3	Confident	75.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-75.5	-34.3	-179.6	-64.6	-68.2	0	0	0	111.5	H291 L296 V297 V360 L398 I405 P1024 L1028	H291-I293 VanDerWaalsContact C-N 3.26Å; H291-I293 PolarHBondContact O-N 2.91Å; H291-I293 VanDerWaalsContact O-N 3.16Å; I293-L296 HydrophobicContact CD1-CD2 4.4Å; I293-L296 WeakPolarHBondContact O-CB 3.45Å; I293-L296 PolarHBondContact O-N 2.73Å; I293-V297 WeakPolarHBondContact O-CG2 3.27Å; I293-V297 PolarHBondContact O-N 3.11Å; I293-V360 HydrophobicContact CG2-CG1 3.89Å; I293-V360 HydrophobicContact CG2-CG2 4.36Å; I293-L398 HydrophobicContact CD1-CD1 3.73Å; I293-I405 HydrophobicContact CD1-CG2 4.02Å; I293-P1024 HydrophobicContact CB-CB 4.48Å; I293-P1024 HydrophobicContact CG1-CB 3.9Å; I293-L1028 HydrophobicContact CG2-CD1 3.78Å; I293-L1028 HydrophobicContact CG2-CD2 4.11Å; I293-L1028 HydrophobicContact CG2-CG 4.07Å
294	R	85.8	Confident	75.3	Confident	23 Å²	23	45.3 Å²	45.3	9%	0.087	26%	0.255	C	S	.	.	H	α-helix	trans	-65.7	-45.6	173.2	-65.3	-175.2	-174.8	174.5	-0.2	110.9	H291 L296 V297 V298 I335 F1027 L1028 D1031	H291-R294 PolarHBondContact O-N 3.4Å; R294-L296 VanDerWaalsContact C-N 3.28Å; R294-L296 PolarHBondContact O-N 3.23Å; R294-V297 WeakPolarHBondContact O-CB 3.37Å; R294-V297 PolarHBondContact O-N 3.12Å; R294-V298 WeakPolarHBondContact O-CG2 3.47Å; R294-V298 PolarHBondContact O-N 2.84Å; R294-I335 HydrophobicContact CB-CD1 4.44Å; R294-I335 HydrophobicContact CB-CG1 4.47Å; R294-I335 HydrophobicContact CG-CD1 4.41Å; R294-I335 HydrophobicContact CG-CG1 4.27Å; R294-F1027 PolarHBondContact NE-O 3.23Å; R294-F1027 PolarHBondContact NH2-O 2.77Å; R294-L1028 HydrophobicContact CG-CD2 3.88Å; R294-D1031 IonicContact CZ-OD1 2.75Å; R294-D1031 IonicContact NH1-OD1 2.68Å; R294-D1031 PolarHBondContact NH1-OD1 3.38Å; R294-D1031 IonicContact NH2-OD1 3.72Å; R294-D1031 PolarHBondContact NH2-OD1 2.84Å; R294-D1031 IonicContact NH2-OD2 2.82Å
295	N	85.6	Confident	75.7	Confident	42 Å²	42	44.5 Å²	44.5	23%	0.225	25%	0.25	C	C	.	.	H	α-helix	trans	-62.6	-36.7	176.2	-69.1	-12.9	0	0	0	111.4	S281 N282 I283 H291 V298 L299	S281-N295 WeakPolarHBondContact O-CB 3.43Å; S281-N295 PolarHBondContact O-ND2 3.31Å; N282-N295 PolarHBondContact O-ND2 2.75Å; I283-N295 HydrophobicContact CD1-CB 4.15Å; I283-N295 HydrophobicContact CG1-CB 3.64Å; H291-N295 WeakPolarHBondContact O-CB 3.25Å; H291-N295 PolarHBondContact O-N 3.38Å; N295-V298 PolarHBondContact O-N 2.69Å; N295-L299 WeakPolarHBondContact O-CB 3.14Å; N295-L299 PolarHBondContact O-N 2.69Å
296	L	88.1	Confident	76.2	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60	-46.9	170	174.7	62	0	0	0	111.4	I283 S292 I293 R294 V298 L299 M300 M391 M394 L395 L398	I283-L296 HydrophobicContact CD1-CB 4.3Å; S292-L296 WeakPolarHBondContact O-CB 3.45Å; S292-L296 PolarHBondContact O-N 3.25Å; I293-L296 HydrophobicContact CD1-CD2 4.4Å; I293-L296 WeakPolarHBondContact O-CB 3.45Å; I293-L296 PolarHBondContact O-N 2.73Å; R294-L296 VanDerWaalsContact C-N 3.28Å; R294-L296 PolarHBondContact O-N 3.23Å; L296-V298 VanDerWaalsContact C-N 3.32Å; L296-V298 PolarHBondContact O-N 3.13Å; L296-L299 WeakPolarHBondContact O-CB 3.03Å; L296-L299 PolarHBondContact O-N 3.4Å; L296-M300 HydrophobicContact CD1-CG 4.06Å; L296-M300 HydrophobicContact CG-CG 4.43Å; L296-M300 VanDerWaalsContact O-CG 3.3Å; L296-M300 WeakPolarHBondContact O-CG 3.39Å; L296-M300 PolarHBondContact O-N 3.45Å; L296-M391 HydrophobicContact CD2-CE 3.88Å; L296-M391 HydrophobicContact CD2-SD 4.25Å; L296-M391 HydrophobicContact CG-SD 4.5Å; L296-M394 HydrophobicContact CD1-CB 3.45Å; L296-M394 VanDerWaalsContact CD1-CB 3.45Å; L296-M394 HydrophobicContact CD1-CG 3.79Å; L296-L395 HydrophobicContact CD2-CD2 4.03Å; L296-L398 HydrophobicContact CD2-CD1 3.93Å
297	V	87.1	Confident	77.2	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-40.9	177.7	173.8	0	0	0	0	111.2	I293 R294 M300 A301 I335 I338 A353 A356 V357	I293-V297 WeakPolarHBondContact O-CG2 3.27Å; I293-V297 PolarHBondContact O-N 3.11Å; R294-V297 WeakPolarHBondContact O-CB 3.37Å; R294-V297 PolarHBondContact O-N 3.12Å; V297-M300 PolarHBondContact O-N 3.37Å; V297-A301 WeakPolarHBondContact O-CB 3.35Å; V297-A301 PolarHBondContact O-N 3.38Å; V297-I335 HydrophobicContact CB-CD1 3.94Å; V297-I335 HydrophobicContact CG1-CD1 3.75Å; V297-I335 HydrophobicContact CG2-CD1 4.42Å; V297-I338 HydrophobicContact CG1-CD1 4.16Å; V297-A353 HydrophobicContact CG1-CB 3.91Å; V297-A356 HydrophobicContact CG1-CB 4.49Å; V297-A356 HydrophobicContact CG2-CB 4.27Å; V297-V357 HydrophobicContact CB-CG2 4.5Å; V297-V357 HydrophobicContact CG1-CG2 3.87Å; V297-V357 HydrophobicContact CG2-CG2 3.75Å
298	V	86.3	Confident	77.8	Confident	26 Å²	26	53.1 Å²	53.1	16%	0.158	28%	0.275	C	S	.	.	H	α-helix	trans	-62.9	-42.6	175	175	0	0	0	0	111.4	R294 N295 L296 A301 Q302 I335 I338 F341	R294-V298 WeakPolarHBondContact O-CG2 3.47Å; R294-V298 PolarHBondContact O-N 2.84Å; N295-V298 PolarHBondContact O-N 2.69Å; L296-V298 VanDerWaalsContact C-N 3.32Å; L296-V298 PolarHBondContact O-N 3.13Å; V298-A301 WeakPolarHBondContact O-CB 3.3Å; V298-A301 PolarHBondContact O-N 2.92Å; V298-Q302 PolarHBondContact O-N 3.13Å; V298-I335 HydrophobicContact CG2-CG2 3.65Å; V298-I338 HydrophobicContact CG2-CG1 4.33Å; V298-F341 HydrophobicContact CG1-CE2 4.2Å
299	L	86.9	Confident	78.6	Confident	22 Å²	22	51 Å²	51	12%	0.115	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-44.6	175.3	179.6	66.6	0	0	0	111.5	T277 N295 L296 A301 Q302 M394	T277-L299 HydrophobicContact CG2-CD1 4.5Å; T277-L299 HydrophobicContact CG2-CD2 4.35Å; N295-L299 WeakPolarHBondContact O-CB 3.14Å; N295-L299 PolarHBondContact O-N 2.69Å; L296-L299 WeakPolarHBondContact O-CB 3.03Å; L296-L299 PolarHBondContact O-N 3.4Å; L299-A301 VanDerWaalsContact C-N 3.29Å; L299-A301 PolarHBondContact O-N 3.15Å; L299-Q302 PolarHBondContact O-N 3.42Å; L299-M394 HydrophobicContact CD2-CG 4.33Å; L299-M394 HydrophobicContact CD2-SD 3.78Å
300	M	88.9	Confident	79.5	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-68.2	-28.1	178	-65.9	-56.6	-63.1	0	0	112.6	L296 V297 Q302 H303 A356 Y387 H390 M391 M394	L296-M300 HydrophobicContact CD1-CG 4.06Å; L296-M300 HydrophobicContact CG-CG 4.43Å; L296-M300 VanDerWaalsContact O-CG 3.3Å; L296-M300 WeakPolarHBondContact O-CG 3.39Å; L296-M300 PolarHBondContact O-N 3.45Å; V297-M300 PolarHBondContact O-N 3.37Å; M300-Q302 PolarHBondContact O-N 2.88Å; M300-H303 WeakPolarHBondContact O-CB 3.47Å; M300-H303 PolarHBondContact O-N 3.29Å; M300-A356 HydrophobicContact CB-CB 3.75Å; M300-A356 HydrophobicContact CG-CB 4.13Å; M300-Y387 HydrophobicContact CE-CD2 4.08Å; M300-Y387 HydrophobicContact CE-CE1 4.09Å; M300-Y387 HydrophobicContact CE-CE2 3.61Å; M300-H390 HydrophobicContact CE-CB 4.22Å; M300-H390 PolarHBondContact SD-ND1 2.96Å; M300-M391 HydrophobicContact CE-CB 3.88Å; M300-M391 HydrophobicContact CE-SD 4.21Å; M300-M391 HydrophobicContact CG-SD 3.92Å; M300-M391 HydrophobicContact SD-SD 4.18Å; M300-M394 HydrophobicContact SD-CG 4.5Å
301	A	85.7	Confident	79.9	Confident	7 Å²	7	55.1 Å²	55.1	6%	0.058	28%	0.276	C	S	.	.	H	α-helix	trans	-65.6	-24.4	174	0	0	0	0	0	113.2	V297 V298 L299 H303 N350 A353	V297-A301 WeakPolarHBondContact O-CB 3.35Å; V297-A301 PolarHBondContact O-N 3.38Å; V298-A301 WeakPolarHBondContact O-CB 3.3Å; V298-A301 PolarHBondContact O-N 2.92Å; L299-A301 VanDerWaalsContact C-N 3.29Å; L299-A301 PolarHBondContact O-N 3.15Å; A301-H303 VanDerWaalsContact C-N 3.31Å; A301-N350 PolarHBondContact O-ND2 2.84Å; A301-A353 HydrophobicContact CB-CB 3.96Å
302	Q	84.3	Confident	80.2	Confident	92 Å²	92	56 Å²	56	43%	0.43	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	3.6	177.9	-62.2	172.5	9.6	0	0	113	V298 L299 M300 K304 F341	V298-Q302 PolarHBondContact O-N 3.13Å; L299-Q302 PolarHBondContact O-N 3.42Å; M300-Q302 PolarHBondContact O-N 2.88Å; Q302-K304 PolarHBondContact O-N 3.07Å; Q302-F341 HydrophobicContact CG-CD1 4Å; Q302-F341 HydrophobicContact CG-CE1 4.08Å; Q302-F341 HydrophobicContact CG-CG 4.42Å; Q302-F341 VanDerWaalsContact NE2-CE1 3.34Å
303	H	83.4	Confident	80.3	Confident	16 Å²	16	59.7 Å²	59.7	7%	0.074	30%	0.303	C	S	.	.			trans	-60.3	120.6	-179.3	-177.5	81.6	0	0	0	110.8	F256 M300 A301 V305 Y387 H390	F256-H303 AromaticContact CD2-CE1 3.58Å; F256-H303 AromaticContact CE2-CE1 3.31Å; F256-H303 WeakPolarHBondContact CE2-CE1 3.39Å; F256-H303 AromaticContact CE2-ND1 3.6Å; F256-H303 AromaticContact CZ-ND1 3.9Å; M300-H303 WeakPolarHBondContact O-CB 3.47Å; M300-H303 PolarHBondContact O-N 3.29Å; A301-H303 VanDerWaalsContact C-N 3.31Å; H303-V305 PolarHBondContact O-N 3.11Å; H303-Y387 HydrophobicContact CB-CD2 4.43Å; H303-Y387 HydrophobicContact CB-CE2 4.45Å; H303-Y387 AromaticContact CD2-CD2 3.72Å; H303-H390 AromaticContact ND1-ND1 3.23Å; H303-H390 PolarHBondContact ND1-ND1 2.99Å
304	K	74.3	Confident	80.3	Confident	192 Å²	192	59.7 Å²	59.7	84%	0.835	30%	0.303	S	S	*	.			trans	-85.1	110	179.6	-66.1	-177.4	-178.6	178.1	0	109.3	Q302	Q302-K304 PolarHBondContact O-N 3.07Å
305	V	68.9	Low	80.3	Confident	30 Å²	30	58.8 Å²	58.8	18%	0.182	30%	0.3	C	S	.	.			trans	-74.2	125.4	170.9	174.8	0	0	0	0	109	H303 E307 V309 Y352 M379 T383	H303-V305 PolarHBondContact O-N 3.11Å; V305-E307 HydrophobicContact CG1-CB 4.09Å; V305-E307 WeakPolarHBondContact CG1-O 3.33Å; V305-E307 PolarHBondContact O-N 2.73Å; V305-V309 HydrophobicContact CG1-CB 4.42Å; V305-V309 HydrophobicContact CG1-CG2 3.86Å; V305-Y352 HydrophobicContact CG2-CE1 3.52Å; V305-Y352 HydrophobicContact CG2-CE2 4.4Å; V305-Y352 VanDerWaalsContact CG2-CZ 3.45Å; V305-Y352 WeakPolarHBondContact CG2-OH 3.42Å; V305-M379 HydrophobicContact CG2-CE 4.4Å; V305-T383 HydrophobicContact CB-CG2 4.34Å; V305-T383 HydrophobicContact CG1-CG2 3.48Å; V305-T383 VanDerWaalsContact CG1-CG2 3.48Å; V305-T383 HydrophobicContact CG2-CG2 4.05Å
306	G	61.1	Low	80.4	Confident	92 Å²	92	59.4 Å²	59.4	95%	0.948	31%	0.307	S	S	*	.	S	Bend	trans	-70.5	-14.2	-179.9	0	0	0	0	0	113.9
307	E	70.6	Confident	80.4	Confident	96 Å²	96	60 Å²	60	45%	0.449	31%	0.311	S	S	.	.	S	Bend	trans	-101.8	151.6	179.4	-174	173.2	-170.3	0	0	111.5	V305 V309 S380 T383	V305-E307 HydrophobicContact CG1-CB 4.09Å; V305-E307 WeakPolarHBondContact CG1-O 3.33Å; V305-E307 PolarHBondContact O-N 2.73Å; E307-V309 HydrophobicContact CB-CG2 4.02Å; E307-V309 HydrophobicContact CG-CG2 4.01Å; E307-V309 PolarHBondContact O-N 3.47Å; E307-S380 WeakPolarHBondContact OE2-CB 3.29Å; E307-S380 PolarHBondContact OE2-OG 3.37Å; E307-T383 PolarHBondContact OE2-OG1 2.97Å
308	R	65.8	Low	80.5	Confident	254 Å²	254	60 Å²	60	96%	0.958	31%	0.311	S	S	*	.			trans	-76.9	71.7	174.3	-69.4	-173.2	-177.2	-173.7	1.5	110.6
309	V	73.4	Confident	80.7	Confident	23 Å²	23	63.5 Å²	63.5	14%	0.139	32%	0.324	C	S	.	.			trans	-89.5	129	175.1	-174	0	0	0	0	109.4	V305 E307 P311 V314 M379	V305-V309 HydrophobicContact CG1-CB 4.42Å; V305-V309 HydrophobicContact CG1-CG2 3.86Å; E307-V309 HydrophobicContact CB-CG2 4.02Å; E307-V309 HydrophobicContact CG-CG2 4.01Å; E307-V309 PolarHBondContact O-N 3.47Å; V309-P311 VanDerWaalsContact O-CD 3.32Å; V309-P311 WeakPolarHBondContact O-CD 3.31Å; V309-V314 HydrophobicContact CG1-CG2 3.36Å; V309-M379 HydrophobicContact CG1-CG 3.95Å; V309-M379 HydrophobicContact CG2-CG 4.38Å
310	K	79	Confident	80.9	Confident	145 Å²	145	69.2 Å²	69.2	63%	0.63	35%	0.348	S	S	*	.			trans	-71.1	119.8	172.3	-70.5	-177.6	-177.8	176.6	0	109.2	D312 D313 V314	K310-D312 PolarHBondContact O-N 3.36Å; K310-D313 HydrophobicContact CB-CB 4.4Å; K310-D313 WeakPolarHBondContact CB-OD2 3.31Å; K310-D313 PolarHBondContact O-N 2.87Å; K310-V314 PolarHBondContact O-N 3.15Å
311	P	80.5	Confident	81.1	Confident	33 Å²	33	69.6 Å²	69.6	21%	0.214	35%	0.35	C	S	.	.	H	α-helix	trans	-63.4	-27	-177.1	-22.8	34.1	0	0	0	113.7	V309 V314 L315 P343 I346 P351	V309-P311 VanDerWaalsContact O-CD 3.32Å; V309-P311 WeakPolarHBondContact O-CD 3.31Å; P311-V314 PolarHBondContact O-N 3.39Å; P311-L315 WeakPolarHBondContact O-CB 3.46Å; P311-L315 PolarHBondContact O-N 3.27Å; P311-P343 HydrophobicContact CG-CG 4.36Å; P311-I346 HydrophobicContact CB-CD1 3.62Å; P311-I346 HydrophobicContact CG-CD1 4.23Å; P311-P351 HydrophobicContact CB-CG 3.94Å
312	D	81.9	Confident	81.4	Confident	82 Å²	82	74.8 Å²	74.8	44%	0.439	37%	0.368	S	S	.	.	H	α-helix	trans	-63.6	-40	176.4	-64.2	-44.7	0	0	0	112.5	K310 L315 S316 I346	K310-D312 PolarHBondContact O-N 3.36Å; D312-L315 PolarHBondContact O-N 3.38Å; D312-S316 WeakPolarHBondContact O-CB 2.96Å; D312-S316 PolarHBondContact O-N 3.48Å; D312-I346 WeakPolarHBondContact OD1-CG1 3.35Å; D312-I346 WeakPolarHBondContact OD1-CG2 3.27Å
313	D	84.3	Confident	81.8	Confident	78 Å²	78	70.4 Å²	70.4	42%	0.417	35%	0.348	S	S	.	.	H	α-helix	trans	-66.7	-42.3	178.7	-64.7	-24	0	0	0	110.2	K310 S316 C317 C378	K310-D313 HydrophobicContact CB-CB 4.4Å; K310-D313 WeakPolarHBondContact CB-OD2 3.31Å; K310-D313 PolarHBondContact O-N 2.87Å; D313-S316 PolarHBondContact O-N 3.2Å; D313-S316 PolarHBondContact O-OG 3.46Å; D313-C317 PolarHBondContact O-N 2.91Å; D313-C317 VanDerWaalsContact O-N 3.1Å; D313-C378 HydrophobicContact CB-CB 4.47Å
314	V	85.1	Confident	82.2	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-60.4	-47.7	173.8	-174.9	0	0	0	0	110.4	V309 K310 P311 S316 C317 V318 P351 M355 L375 M379	V309-V314 HydrophobicContact CG1-CG2 3.36Å; K310-V314 PolarHBondContact O-N 3.15Å; P311-V314 PolarHBondContact O-N 3.39Å; V314-S316 VanDerWaalsContact C-N 3.31Å; V314-S316 PolarHBondContact O-N 2.93Å; V314-C317 PolarHBondContact O-N 3.22Å; V314-V318 HydrophobicContact CG1-CG2 4.11Å; V314-V318 WeakPolarHBondContact O-CB 3.35Å; V314-V318 VanDerWaalsContact O-CG2 3.22Å; V314-V318 WeakPolarHBondContact O-CG2 3.32Å; V314-V318 PolarHBondContact O-N 3.35Å; V314-P351 HydrophobicContact CB-CB 4.09Å; V314-P351 HydrophobicContact CG1-CB 3.86Å; V314-M355 HydrophobicContact CG1-SD 3.96Å; V314-L375 HydrophobicContact CG1-CD2 3.94Å; V314-M379 HydrophobicContact CG1-SD 4.07Å; V314-M379 HydrophobicContact CG2-CG 4.12Å; V314-M379 HydrophobicContact CG2-SD 3.89Å
315	L	86	Confident	83	Confident	4 Å²	4	63.8 Å²	63.8	2%	0.021	33%	0.325	C	S	.	.	H	α-helix	trans	-61.3	-40.4	179	-176	60	0	0	0	111.5	P311 D312 C317 V318 K319 F324 I346 P349 P351	P311-L315 WeakPolarHBondContact O-CB 3.46Å; P311-L315 PolarHBondContact O-N 3.27Å; D312-L315 PolarHBondContact O-N 3.38Å; L315-C317 VanDerWaalsContact C-N 3.33Å; L315-C317 PolarHBondContact O-N 2.85Å; L315-V318 PolarHBondContact O-N 3.49Å; L315-K319 HydrophobicContact CG-CD 4.4Å; L315-K319 WeakPolarHBondContact O-CB 3.38Å; L315-K319 VanDerWaalsContact O-CG 3.24Å; L315-K319 WeakPolarHBondContact O-CG 3.48Å; L315-K319 PolarHBondContact O-N 2.94Å; L315-F324 HydrophobicContact CD1-CE2 3.96Å; L315-F324 HydrophobicContact CD1-CZ 4.14Å; L315-I346 HydrophobicContact CD2-CG2 4.15Å; L315-P349 HydrophobicContact CD1-CG 4.21Å; L315-P351 HydrophobicContact CB-CB 4.13Å
316	S	86.6	Confident	84	Confident	55 Å²	55	63.1 Å²	63.1	39%	0.385	32%	0.319	S	S	.	.	H	α-helix	trans	-62.7	-36.6	177.3	83.7	0	0	0	0	113.1	D312 D313 V314	D312-S316 WeakPolarHBondContact O-CB 2.96Å; D312-S316 PolarHBondContact O-N 3.48Å; D313-S316 PolarHBondContact O-N 3.2Å; D313-S316 PolarHBondContact O-OG 3.46Å; V314-S316 VanDerWaalsContact C-N 3.31Å; V314-S316 PolarHBondContact O-N 2.93Å
317	C	88.3	Confident	85.3	Confident	12 Å²	12	58.7 Å²	58.7	8%	0.081	27%	0.274	C	S	.	.	H	α-helix	trans	-72.9	-46.6	175.3	-73.6	0	0	0	0	111.3	D313 V314 L315 K319 K320	D313-C317 PolarHBondContact O-N 2.91Å; D313-C317 VanDerWaalsContact O-N 3.1Å; V314-C317 PolarHBondContact O-N 3.22Å; L315-C317 VanDerWaalsContact C-N 3.33Å; L315-C317 PolarHBondContact O-N 2.85Å; C317-K319 VanDerWaalsContact C-N 3.27Å; C317-K319 PolarHBondContact O-N 3.11Å; C317-K320 WeakPolarHBondContact O-CB 3.28Å; C317-K320 PolarHBondContact O-N 3.05Å; C317-K320 VanDerWaalsContact O-N 3.12Å
318	V	88.6	Confident	86.2	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.8	-32.2	-178.8	175.4	0	0	0	0	111.6	V314 L315 K320 H321 F324 A354 M355 I358 L371 L375	V314-V318 HydrophobicContact CG1-CG2 4.11Å; V314-V318 WeakPolarHBondContact O-CB 3.35Å; V314-V318 VanDerWaalsContact O-CG2 3.22Å; V314-V318 WeakPolarHBondContact O-CG2 3.32Å; V314-V318 PolarHBondContact O-N 3.35Å; L315-V318 PolarHBondContact O-N 3.49Å; V318-K320 PolarHBondContact O-N 3.4Å; V318-K320 VanDerWaalsContact O-N 3.11Å; V318-H321 VanDerWaalsContact O-CB 3.29Å; V318-H321 WeakPolarHBondContact O-CB 3.37Å; V318-H321 PolarHBondContact O-N 3.1Å; V318-F324 HydrophobicContact CG1-CD2 3.9Å; V318-F324 HydrophobicContact CG1-CE2 4.32Å; V318-A354 HydrophobicContact CG1-CB 4.19Å; V318-M355 HydrophobicContact CG1-CG 4.35Å; V318-M355 HydrophobicContact CG2-CG 3.74Å; V318-M355 HydrophobicContact CG2-SD 4.19Å; V318-I358 HydrophobicContact CG1-CD1 3.55Å; V318-L371 HydrophobicContact CG2-CD1 4.3Å; V318-L375 HydrophobicContact CG2-CD2 3.79Å
319	K	90.8	Very high	87.2	Confident	100 Å²	100	45.1 Å²	45.1	44%	0.435	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-27.3	172.5	-86.6	171.6	176.9	178	0	114.1	L315 C317 H321 F324	L315-K319 HydrophobicContact CG-CD 4.4Å; L315-K319 WeakPolarHBondContact O-CB 3.38Å; L315-K319 VanDerWaalsContact O-CG 3.24Å; L315-K319 WeakPolarHBondContact O-CG 3.48Å; L315-K319 PolarHBondContact O-N 2.94Å; C317-K319 VanDerWaalsContact C-N 3.27Å; C317-K319 PolarHBondContact O-N 3.11Å; K319-H321 VanDerWaalsContact C-N 3.28Å; K319-H321 PolarHBondContact O-N 2.9Å; K319-F324 HydrophobicContact CB-CD1 4.33Å; K319-F324 HydrophobicContact CB-CE1 4.28Å; K319-F324 HydrophobicContact CB-CZ 4.43Å; K319-F324 HydrophobicContact CD-CZ 4.43Å; K319-F324 HydrophobicContact CG-CD1 4.01Å; K319-F324 HydrophobicContact CG-CD2 4.45Å; K319-F324 HydrophobicContact CG-CE1 3.47Å; K319-F324 VanDerWaalsContact CG-CE1 3.47Å; K319-F324 HydrophobicContact CG-CE2 3.92Å; K319-F324 HydrophobicContact CG-CG 4.47Å; K319-F324 HydrophobicContact CG-CZ 3.4Å
320	K	91.5	Very high	87.8	Confident	143 Å²	143	44 Å²	44	62%	0.622	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-9	-179.5	-60.3	176.8	-177	175.2	0	113.3	C317 V318 L374	C317-K320 WeakPolarHBondContact O-CB 3.28Å; C317-K320 PolarHBondContact O-N 3.05Å; C317-K320 VanDerWaalsContact O-N 3.12Å; V318-K320 PolarHBondContact O-N 3.4Å; V318-K320 VanDerWaalsContact O-N 3.11Å; K320-L374 HydrophobicContact CB-CD1 4.21Å; K320-L374 HydrophobicContact CB-CD2 4Å; K320-L374 HydrophobicContact CD-CD2 4.34Å
321	H	93.2	Very high	88.1	Confident	8 Å²	8	37.6 Å²	37.6	4%	0.037	19%	0.191	C	C	.	.	S	Bend	trans	-77.2	141.6	-178.2	-168.2	-89.9	0	0	0	111.9	V318 K319 L323 F324 I358 D367 L374	V318-H321 VanDerWaalsContact O-CB 3.29Å; V318-H321 WeakPolarHBondContact O-CB 3.37Å; V318-H321 PolarHBondContact O-N 3.1Å; K319-H321 VanDerWaalsContact C-N 3.28Å; K319-H321 PolarHBondContact O-N 2.9Å; H321-L323 PolarHBondContact ND1-N 2.92Å; H321-L323 VanDerWaalsContact ND1-N 3.2Å; H321-L323 PolarHBondContact O-N 3.33Å; H321-L323 VanDerWaalsContact O-N 3.11Å; H321-F324 VanDerWaalsContact O-CB 3.23Å; H321-F324 WeakPolarHBondContact O-CB 3.37Å; H321-F324 PolarHBondContact O-N 3.18Å; H321-I358 HydrophobicContact CB-CD1 4.16Å; H321-I358 VanDerWaalsContact CE1-CG2 3.49Å; H321-I358 WeakPolarHBondContact CE1-CG2 3.28Å; H321-D367 PolarHBondContact NE2-O 2.9Å; H321-D367 VanDerWaalsContact NE2-O 3.12Å; H321-L374 HydrophobicContact CB-CD1 3.95Å
322	R	92.4	Very high	88.3	Confident	115 Å²	115	43.3 Å²	43.3	43%	0.434	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-30.4	-176	81	179.6	176.3	99.9	-12.8	114.5	Q326 E363 D367	R322-Q326 PolarHBondContact O-OE1 3.22Å; R322-E363 IonicContact CZ-OE2 3.08Å; R322-E363 IonicContact NH1-OE1 2.85Å; R322-E363 PolarHBondContact NH1-OE1 3.38Å; R322-E363 IonicContact NH1-OE2 2.95Å; R322-E363 PolarHBondContact NH1-OE2 2.79Å; R322-E363 VanDerWaalsContact NH1-OE2 3.17Å; R322-E363 IonicContact NH2-OE1 3.88Å; R322-E363 IonicContact NH2-OE2 2.76Å; R322-E363 PolarHBondContact NH2-OE2 3.11Å; R322-D367 IonicContact CZ-OD1 3.32Å; R322-D367 IonicContact CZ-OD2 3.91Å; R322-D367 IonicContact NE-OD1 3.17Å; R322-D367 PolarHBondContact NE-OD1 3.43Å; R322-D367 IonicContact NH2-OD1 3.14Å; R322-D367 PolarHBondContact NH2-OD1 3.44Å; R322-D367 IonicContact NH2-OD2 2.67Å; R322-D367 PolarHBondContact NH2-OD2 2.94Å
323	L	92.2	Very high	88.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-0.4	-178.5	-63.2	178	0	0	0	113.3	H321 Q326 A327 I358 L361 S964	H321-L323 PolarHBondContact ND1-N 2.92Å; H321-L323 VanDerWaalsContact ND1-N 3.2Å; H321-L323 PolarHBondContact O-N 3.33Å; H321-L323 VanDerWaalsContact O-N 3.11Å; L323-Q326 VanDerWaalsContact C-OE1 3.27Å; L323-Q326 VanDerWaalsContact CA-OE1 3.28Å; L323-Q326 PolarHBondContact O-N 2.87Å; L323-Q326 PolarHBondContact O-OE1 3.12Å; L323-A327 PolarHBondContact O-N 3.34Å; L323-I358 HydrophobicContact CB-CG1 4.2Å; L323-I358 HydrophobicContact CB-CG2 4.37Å; L323-I358 HydrophobicContact CD1-CG2 4.49Å; L323-L361 HydrophobicContact CD1-CB 4.25Å; L323-L361 WeakPolarHBondContact CD1-O 3.38Å; L323-S964 WeakPolarHBondContact CD2-OG 3.35Å
324	F	92.1	Very high	88	Confident	11 Å²	11	42.3 Å²	42.3	5%	0.048	20%	0.2	C	C	.	.	H	α-helix	trans	-60	-42.9	-179.6	179.6	-97.6	0	0	0	113.5	L315 V318 K319 H321 Q326 A327 E328 P349 A354	L315-F324 HydrophobicContact CD1-CE2 3.96Å; L315-F324 HydrophobicContact CD1-CZ 4.14Å; V318-F324 HydrophobicContact CG1-CD2 3.9Å; V318-F324 HydrophobicContact CG1-CE2 4.32Å; K319-F324 HydrophobicContact CB-CD1 4.33Å; K319-F324 HydrophobicContact CB-CE1 4.28Å; K319-F324 HydrophobicContact CB-CZ 4.43Å; K319-F324 HydrophobicContact CD-CZ 4.43Å; K319-F324 HydrophobicContact CG-CD1 4.01Å; K319-F324 HydrophobicContact CG-CD2 4.45Å; K319-F324 HydrophobicContact CG-CE1 3.47Å; K319-F324 VanDerWaalsContact CG-CE1 3.47Å; K319-F324 HydrophobicContact CG-CE2 3.92Å; K319-F324 HydrophobicContact CG-CG 4.47Å; K319-F324 HydrophobicContact CG-CZ 3.4Å; H321-F324 VanDerWaalsContact O-CB 3.23Å; H321-F324 WeakPolarHBondContact O-CB 3.37Å; H321-F324 PolarHBondContact O-N 3.18Å; F324-Q326 PolarHBondContact O-N 3.02Å; F324-A327 WeakPolarHBondContact O-CB 3.49Å; F324-A327 PolarHBondContact O-N 3.47Å; F324-A327 VanDerWaalsContact O-N 3.09Å; F324-E328 HydrophobicContact CE1-CB 4.06Å; F324-E328 HydrophobicContact CE1-CG 4.48Å; F324-E328 HydrophobicContact CZ-CB 4.2Å; F324-E328 PolarHBondContact O-N 3.02Å; F324-P349 HydrophobicContact CE2-CG 4.48Å; F324-P349 HydrophobicContact CZ-CG 4.19Å; F324-A354 HydrophobicContact CD2-CB 4.49Å; F324-A354 HydrophobicContact CE2-CB 4.16Å
325	P	90.1	Very high	87.6	Confident	58 Å²	58	42.6 Å²	42.6	38%	0.377	20%	0.201	S	C	.	.	H	α-helix	trans	-55.2	-42.7	178.3	-27	36.5	0	0	0	112	A327 E328 A329 M966	P325-A327 VanDerWaalsContact C-N 3.35Å; P325-E328 PolarHBondContact O-N 3.12Å; P325-A329 WeakPolarHBondContact O-CB 3.32Å; P325-A329 PolarHBondContact O-N 3.45Å; P325-M966 HydrophobicContact CB-CE 3.42Å; P325-M966 VanDerWaalsContact CB-CE 3.42Å; P325-M966 HydrophobicContact CB-CG 4.42Å; P325-M966 WeakPolarHBondContact O-CE 3.33Å
326	Q	90.6	Very high	86.5	Confident	16 Å²	16	46.1 Å²	46.1	8%	0.075	22%	0.224	C	C	.	.	H	α-helix	trans	-64.9	-42.9	-179.6	-64.4	84.9	-27.2	0	0	110.1	R322 L323 F324 A329 T330 L361 S964 M966 F994	R322-Q326 PolarHBondContact O-OE1 3.22Å; L323-Q326 VanDerWaalsContact C-OE1 3.27Å; L323-Q326 VanDerWaalsContact CA-OE1 3.28Å; L323-Q326 PolarHBondContact O-N 2.87Å; L323-Q326 PolarHBondContact O-OE1 3.12Å; F324-Q326 PolarHBondContact O-N 3.02Å; Q326-A329 PolarHBondContact O-N 3.39Å; Q326-T330 WeakPolarHBondContact O-CB 3.48Å; Q326-T330 PolarHBondContact O-N 3.43Å; Q326-T330 PolarHBondContact O-OG1 3.15Å; Q326-L361 HydrophobicContact CB-CD1 3.81Å; Q326-S964 PolarHBondContact NE2-O 2.79Å; Q326-S964 VanDerWaalsContact NE2-O 3.13Å; Q326-M966 VanDerWaalsContact CA-CE 3.45Å; Q326-M966 HydrophobicContact CB-CE 4.35Å; Q326-M966 HydrophobicContact CG-CE 4.13Å; Q326-F994 HydrophobicContact CB-CB 4.33Å; Q326-F994 HydrophobicContact CB-CD1 4.3Å; Q326-F994 HydrophobicContact CB-CG 4.42Å; Q326-F994 HydrophobicContact CG-CB 3.98Å; Q326-F994 HydrophobicContact CG-CG 4.41Å
327	A	89.3	Confident	85.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.9	-44.6	177	0	0	0	0	0	112.7	L323 F324 P325 T330 I331 V357 I358	L323-A327 PolarHBondContact O-N 3.34Å; F324-A327 WeakPolarHBondContact O-CB 3.49Å; F324-A327 PolarHBondContact O-N 3.47Å; F324-A327 VanDerWaalsContact O-N 3.09Å; P325-A327 VanDerWaalsContact C-N 3.35Å; A327-T330 PolarHBondContact O-N 3.17Å; A327-I331 VanDerWaalsContact O-CG1 3.29Å; A327-I331 WeakPolarHBondContact O-CG1 3.23Å; A327-I331 PolarHBondContact O-N 3.11Å; A327-V357 HydrophobicContact CB-CB 3.83Å; A327-V357 HydrophobicContact CB-CG1 3.82Å; A327-I358 HydrophobicContact CB-CG1 4.02Å
328	E	88.9	Confident	84.3	Confident	44 Å²	44	47 Å²	47	21%	0.206	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-45.3	178.4	-177.1	176.2	-148.8	0	0	111.7	F324 P325 I331 R332 P349	F324-E328 HydrophobicContact CE1-CB 4.06Å; F324-E328 HydrophobicContact CE1-CG 4.48Å; F324-E328 HydrophobicContact CZ-CB 4.2Å; F324-E328 PolarHBondContact O-N 3.02Å; P325-E328 PolarHBondContact O-N 3.12Å; E328-I331 PolarHBondContact O-N 3.26Å; E328-R332 WeakPolarHBondContact O-CB 3.48Å; E328-R332 WeakPolarHBondContact O-CG 3.37Å; E328-R332 PolarHBondContact O-N 3.37Å; E328-R332 IonicContact OE1-CZ 2.65Å; E328-R332 IonicContact OE1-NE 2.84Å; E328-R332 IonicContact OE1-NH1 3.76Å; E328-R332 PolarHBondContact OE1-NH1 3.4Å; E328-R332 IonicContact OE1-NH2 2.65Å; E328-R332 PolarHBondContact OE1-NH2 2.89Å; E328-R332 IonicContact OE2-NH1 3.12Å; E328-P349 HydrophobicContact CG-CG 4.25Å
329	A	85.9	Confident	82.8	Confident	21 Å²	21	54.3 Å²	54.3	17%	0.174	26%	0.258	C	S	.	.	H	α-helix	trans	-61.3	-45.4	177	0	0	0	0	0	111.8	P325 Q326 L333 M966 A993	P325-A329 WeakPolarHBondContact O-CB 3.32Å; P325-A329 PolarHBondContact O-N 3.45Å; Q326-A329 PolarHBondContact O-N 3.39Å; A329-L333 VanDerWaalsContact O-CB 3.27Å; A329-L333 WeakPolarHBondContact O-CB 3.2Å; A329-L333 WeakPolarHBondContact O-CG 3.29Å; A329-L333 PolarHBondContact O-N 3.06Å; A329-M966 HydrophobicContact CB-CE 4.13Å; A329-A993 HydrophobicContact CB-CB 4.06Å; A329-A993 WeakPolarHBondContact CB-O 3.29Å
330	T	86.8	Confident	81.2	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62	-45.3	177.5	-69.2	0	0	0	0	112.2	Q326 A327 R334 I335 V357 F994 L1028	Q326-T330 WeakPolarHBondContact O-CB 3.48Å; Q326-T330 PolarHBondContact O-N 3.43Å; Q326-T330 PolarHBondContact O-OG1 3.15Å; A327-T330 PolarHBondContact O-N 3.17Å; T330-R334 WeakPolarHBondContact O-CA 3.42Å; T330-R334 WeakPolarHBondContact O-CB 3.41Å; T330-R334 PolarHBondContact O-N 3.29Å; T330-I335 HydrophobicContact CG2-CD1 4.37Å; T330-I335 PolarHBondContact O-N 3.47Å; T330-V357 HydrophobicContact CG2-CG1 4.4Å; T330-V357 HydrophobicContact CG2-CG2 4.47Å; T330-F994 WeakPolarHBondContact OG1-CD1 3.45Å; T330-F994 VanDerWaalsContact OG1-CE1 3.26Å; T330-F994 WeakPolarHBondContact OG1-CE1 3.48Å; T330-L1028 HydrophobicContact CG2-CB 3.83Å; T330-L1028 HydrophobicContact CG2-CD2 3.76Å; T330-L1028 HydrophobicContact CG2-CG 4.25Å; T330-L1028 PolarHBondContact OG1-O 3Å
331	I	85.9	Confident	79.6	Confident	10 Å²	10	54.4 Å²	54.4	5%	0.051	26%	0.259	C	S	.	.	H	α-helix	trans	-64.9	-47	-179.2	-70.1	165.3	0	0	0	110.6	A327 E328 I335 I338 P349 A353 A354 V357	A327-I331 VanDerWaalsContact O-CG1 3.29Å; A327-I331 WeakPolarHBondContact O-CG1 3.23Å; A327-I331 PolarHBondContact O-N 3.11Å; E328-I331 PolarHBondContact O-N 3.26Å; I331-I335 CarbonylContact O-C 3.52Å; I331-I335 PolarHBondContact O-N 2.59Å; I331-I338 HydrophobicContact CG1-CD1 4.29Å; I331-I338 HydrophobicContact CG2-CD1 3.95Å; I331-I338 HydrophobicContact CG2-CG2 4.46Å; I331-P349 HydrophobicContact CB-CB 4.22Å; I331-P349 HydrophobicContact CD1-CB 4Å; I331-P349 HydrophobicContact CG2-CB 3.76Å; I331-A353 HydrophobicContact CD1-CB 3.88Å; I331-A353 HydrophobicContact CG1-CB 4.48Å; I331-A354 HydrophobicContact CD1-CB 4.04Å; I331-V357 HydrophobicContact CD1-CG2 4.42Å; I331-V357 HydrophobicContact CG1-CG2 4.26Å
332	R	83.1	Confident	77.9	Confident	152 Å²	152	56.5 Å²	56.5	57%	0.574	27%	0.27	S	S	*	.	H	α-helix	trans	-65.8	-42.4	-178.6	-76	-174.2	172.9	142.5	8.8	113.2	E328	E328-R332 WeakPolarHBondContact O-CB 3.48Å; E328-R332 WeakPolarHBondContact O-CG 3.37Å; E328-R332 PolarHBondContact O-N 3.37Å; E328-R332 IonicContact OE1-CZ 2.65Å; E328-R332 IonicContact OE1-NE 2.84Å; E328-R332 IonicContact OE1-NH1 3.76Å; E328-R332 PolarHBondContact OE1-NH1 3.4Å; E328-R332 IonicContact OE1-NH2 2.65Å; E328-R332 PolarHBondContact OE1-NH2 2.89Å; E328-R332 IonicContact OE2-NH1 3.12Å
333	L	80.6	Confident	76	Confident	102 Å²	102	53.7 Å²	53.7	53%	0.534	27%	0.267	S	S	.	.	H	α-helix	trans	-91.6	-29.7	-171.3	-62.9	173	0	0	0	113.4	A329 A993	A329-L333 VanDerWaalsContact O-CB 3.27Å; A329-L333 WeakPolarHBondContact O-CB 3.2Å; A329-L333 WeakPolarHBondContact O-CG 3.29Å; A329-L333 PolarHBondContact O-N 3.06Å; L333-A993 HydrophobicContact CD1-CB 4.3Å
334	R	79.6	Confident	73.7	Confident	37 Å²	37	62.7 Å²	62.7	14%	0.14	31%	0.314	C	S	.	.	H	α-helix	trans	-123.2	-11	-165.3	-53.3	-60.4	174.4	-173.1	-5.3	115.1	T330 P336 G991 M1029 D1031	T330-R334 WeakPolarHBondContact O-CA 3.42Å; T330-R334 WeakPolarHBondContact O-CB 3.41Å; T330-R334 PolarHBondContact O-N 3.29Å; R334-P336 VanDerWaalsContact C-CD 3.49Å; R334-G991 PolarHBondContact NH2-O 2.86Å; R334-M1029 PolarHBondContact NE-O 3.47Å; R334-D1031 WeakPolarHBondContact CD-OD2 3.37Å; R334-D1031 IonicContact CZ-OD2 3.82Å; R334-D1031 IonicContact NH1-OD2 2.81Å; R334-D1031 PolarHBondContact NH1-OD2 2.76Å
335	I	77.1	Confident	71.7	Confident	7 Å²	7	65.9 Å²	65.9	4%	0.036	35%	0.35	C	S	.	.			trans	-131.6	66.2	179.1	-41.8	178.2	0	0	0	110.7	R294 V297 V298 T330 I331 D337 I338	R294-I335 HydrophobicContact CB-CD1 4.44Å; R294-I335 HydrophobicContact CB-CG1 4.47Å; R294-I335 HydrophobicContact CG-CD1 4.41Å; R294-I335 HydrophobicContact CG-CG1 4.27Å; V297-I335 HydrophobicContact CB-CD1 3.94Å; V297-I335 HydrophobicContact CG1-CD1 3.75Å; V297-I335 HydrophobicContact CG2-CD1 4.42Å; V298-I335 HydrophobicContact CG2-CG2 3.65Å; T330-I335 HydrophobicContact CG2-CD1 4.37Å; T330-I335 PolarHBondContact O-N 3.47Å; I331-I335 CarbonylContact O-C 3.52Å; I331-I335 PolarHBondContact O-N 2.59Å; I335-D337 PolarHBondContact O-N 2.99Å; I335-I338 HydrophobicContact CB-CD1 3.79Å; I335-I338 HydrophobicContact CB-CG1 4.38Å; I335-I338 HydrophobicContact CD1-CD1 4.31Å; I335-I338 HydrophobicContact CG2-CD1 3.48Å; I335-I338 VanDerWaalsContact CG2-CD1 3.48Å; I335-I338 HydrophobicContact CG2-CG1 3.69Å; I335-I338 PolarHBondContact O-N 2.69Å
336	P	62	Low	70	Confident	78 Å²	78	64.3 Å²	64.3	51%	0.506	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-65.5	-25	-176.9	26.8	-34.2	0	0	0	113.2	R334 I338 Q339	R334-P336 VanDerWaalsContact C-CD 3.49Å; P336-I338 PolarHBondContact O-N 3.31Å; P336-I338 VanDerWaalsContact O-N 3.09Å; P336-Q339 WeakPolarHBondContact O-CB 3.5Å; P336-Q339 PolarHBondContact O-N 2.84Å; P336-Q339 VanDerWaalsContact O-N 3.09Å
337	D	63.9	Low	68.4	Low	83 Å²	83	72.4 Å²	72.4	44%	0.444	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-61.7	-17.5	179.3	-76.2	-51	0	0	0	114.5	I335 Q339 K340	I335-D337 PolarHBondContact O-N 2.99Å; D337-Q339 PolarHBondContact O-N 2.65Å; D337-K340 PolarHBondContact O-N 3.01Å; D337-K340 IonicContact OD1-NZ 2.72Å; D337-K340 PolarHBondContact OD1-NZ 3.08Å
338	I	65.2	Low	67.2	Low	3 Å²	3	73.5 Å²	73.5	2%	0.015	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-64.7	-23.8	175.1	-70.6	168	0	0	0	111.8	V297 V298 I331 I335 P336 K340 F341 L342 N350 A353	V297-I338 HydrophobicContact CG1-CD1 4.16Å; V298-I338 HydrophobicContact CG2-CG1 4.33Å; I331-I338 HydrophobicContact CG1-CD1 4.29Å; I331-I338 HydrophobicContact CG2-CD1 3.95Å; I331-I338 HydrophobicContact CG2-CG2 4.46Å; I335-I338 HydrophobicContact CB-CD1 3.79Å; I335-I338 HydrophobicContact CB-CG1 4.38Å; I335-I338 HydrophobicContact CD1-CD1 4.31Å; I335-I338 HydrophobicContact CG2-CD1 3.48Å; I335-I338 VanDerWaalsContact CG2-CD1 3.48Å; I335-I338 HydrophobicContact CG2-CG1 3.69Å; I335-I338 PolarHBondContact O-N 2.69Å; P336-I338 PolarHBondContact O-N 3.31Å; P336-I338 VanDerWaalsContact O-N 3.09Å; I338-K340 PolarHBondContact O-N 3.36Å; I338-K340 VanDerWaalsContact O-N 3.12Å; I338-F341 CarbonylContact O-C 3.59Å; I338-F341 PolarHBondContact O-N 2.97Å; I338-L342 PolarHBondContact O-N 3.4Å; I338-N350 HydrophobicContact CG2-CB 3.66Å; I338-A353 HydrophobicContact CD1-CB 3.78Å
339	Q	57.5	Low	66.7	Low	153 Å²	153	71.7 Å²	71.7	72%	0.715	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-57.2	-26.8	175.8	-70.8	-177.5	-5	0	0	113.2	P336 D337 F341 L342	P336-Q339 WeakPolarHBondContact O-CB 3.5Å; P336-Q339 PolarHBondContact O-N 2.84Å; P336-Q339 VanDerWaalsContact O-N 3.09Å; D337-Q339 PolarHBondContact O-N 2.65Å; Q339-F341 VanDerWaalsContact C-N 3.3Å; Q339-F341 PolarHBondContact O-N 3.37Å; Q339-L342 HydrophobicContact CG-CD1 4.4Å
340	K	58	Low	66.6	Low	158 Å²	158	71 Å²	71	69%	0.687	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-74.1	-19.1	176.2	-63.5	167.8	-176.7	155.8	0	113.5	D337 I338	D337-K340 PolarHBondContact O-N 3.01Å; D337-K340 IonicContact OD1-NZ 2.72Å; D337-K340 PolarHBondContact OD1-NZ 3.08Å; I338-K340 PolarHBondContact O-N 3.36Å; I338-K340 VanDerWaalsContact O-N 3.12Å
341	F	57.6	Low	66.6	Low	87 Å²	87	71.1 Å²	71.1	38%	0.382	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-112.8	13.4	-175.7	-57.2	-76.3	0	0	0	112.5	V298 Q302 I338 Q339 N350	V298-F341 HydrophobicContact CG1-CE2 4.2Å; Q302-F341 HydrophobicContact CG-CD1 4Å; Q302-F341 HydrophobicContact CG-CE1 4.08Å; Q302-F341 HydrophobicContact CG-CG 4.42Å; Q302-F341 VanDerWaalsContact NE2-CE1 3.34Å; I338-F341 CarbonylContact O-C 3.59Å; I338-F341 PolarHBondContact O-N 2.97Å; Q339-F341 VanDerWaalsContact C-N 3.3Å; Q339-F341 PolarHBondContact O-N 3.37Å; F341-N350 PolarHBondContact O-ND2 3.2Å
342	L	57	Low	66.7	Low	51 Å²	51	71.7 Å²	71.7	27%	0.267	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-76.9	127	172.9	-101.7	142.4	0	0	0	109.6	I338 Q339 L344 I346 G348	I338-L342 PolarHBondContact O-N 3.4Å; Q339-L342 HydrophobicContact CG-CD1 4.4Å; L342-L344 PolarHBondContact O-N 3.07Å; L342-I346 HydrophobicContact CD2-CB 4.19Å; L342-I346 HydrophobicContact CD2-CG2 4.49Å; L342-G348 WeakPolarHBondContact CD2-O 3.46Å
343	P	52.9	Low	67	Low	57 Å²	57	64.4 Å²	64.4	37%	0.37	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-57.6	134.2	166.8	-19.5	30.5	0	0	0	109.8	P311 G345 I346	P311-P343 HydrophobicContact CG-CG 4.36Å; P343-G345 PolarHBondContact O-N 3.49Å; P343-G345 VanDerWaalsContact O-N 3.13Å; P343-I346 HydrophobicContact CB-CD1 3.84Å; P343-I346 HydrophobicContact CB-CG1 4.34Å; P343-I346 HydrophobicContact CG-CD1 3.72Å
344	L	44	Very low	67.5	Low	188 Å²	188	59.6 Å²	59.6	98%	0.984	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	117.2	176.3	-80.1	151.3	0	0	0	110.1	L342	L342-L344 PolarHBondContact O-N 3.07Å
345	G	48.7	Very low	68.1	Low	79 Å²	79	57.9 Å²	57.9	81%	0.814	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.5	0.9	171.8	0	0	0	0	0	117.5	P343	P343-G345 PolarHBondContact O-N 3.49Å; P343-G345 VanDerWaalsContact O-N 3.13Å
346	I	56.1	Low	68.8	Low	24 Å²	24	57.6 Å²	57.6	12%	0.123	31%	0.314	C	S	.	.			trans	-93.9	121.8	-179.6	-55.9	-176.9	0	0	0	111.5	P311 D312 L315 L342 P343 G348	P311-I346 HydrophobicContact CB-CD1 3.62Å; P311-I346 HydrophobicContact CG-CD1 4.23Å; D312-I346 WeakPolarHBondContact OD1-CG1 3.35Å; D312-I346 WeakPolarHBondContact OD1-CG2 3.27Å; L315-I346 HydrophobicContact CD2-CG2 4.15Å; L342-I346 HydrophobicContact CD2-CB 4.19Å; L342-I346 HydrophobicContact CD2-CG2 4.49Å; P343-I346 HydrophobicContact CB-CD1 3.84Å; P343-I346 HydrophobicContact CB-CG1 4.34Å; P343-I346 HydrophobicContact CG-CD1 3.72Å; I346-G348 PolarHBondContact O-N 2.99Å
347	E	56.8	Low	70.3	Confident	187 Å²	187	53.9 Å²	53.9	87%	0.874	29%	0.29	S	S	*	.			trans	-81.6	90.4	166.7	-71.8	-173.5	172.3	0	0	110.5
348	G	64.5	Low	71.7	Confident	23 Å²	23	50 Å²	50	24%	0.237	27%	0.269	C	S	.	.	S	Bend	trans	155.5	-177.5	174.7	0	0	0	0	0	116	L342 I346	L342-G348 WeakPolarHBondContact CD2-O 3.46Å; I346-G348 PolarHBondContact O-N 2.99Å
349	P	76.8	Confident	73.1	Confident	6 Å²	6	49.9 Å²	49.9	4%	0.039	27%	0.269	C	S	.	.	S	Bend	trans	-70.4	152.3	172	30.9	-34.5	0	0	0	111.3	L315 F324 E328 I331	L315-P349 HydrophobicContact CD1-CG 4.21Å; F324-P349 HydrophobicContact CE2-CG 4.48Å; F324-P349 HydrophobicContact CZ-CG 4.19Å; E328-P349 HydrophobicContact CG-CG 4.25Å; I331-P349 HydrophobicContact CB-CB 4.22Å; I331-P349 HydrophobicContact CD1-CB 4Å; I331-P349 HydrophobicContact CG2-CB 3.76Å
350	N	84.4	Confident	74.8	Confident	6 Å²	6	42.8 Å²	42.8	3%	0.032	24%	0.236	C	C	.	.			trans	-56.9	127.2	173.6	177.2	-53.2	0	0	0	110.1	A301 I338 F341 Y352 A353 A354	A301-N350 PolarHBondContact O-ND2 2.84Å; I338-N350 HydrophobicContact CG2-CB 3.66Å; F341-N350 PolarHBondContact O-ND2 3.2Å; N350-Y352 PolarHBondContact O-N 3.41Å; N350-Y352 WeakPolarHBondContact OD1-CB 3.5Å; N350-Y352 PolarHBondContact OD1-N 3.03Å; N350-A353 HydrophobicContact CB-CB 4.01Å; N350-A353 WeakPolarHBondContact O-CB 3.3Å; N350-A353 PolarHBondContact O-N 3.49Å; N350-A353 PolarHBondContact OD1-N 3.26Å; N350-A353 VanDerWaalsContact OD1-N 3.15Å; N350-A354 PolarHBondContact O-N 3.32Å
351	P	86.7	Confident	76.4	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.013	21%	0.205	C	C	.	.	H	α-helix	trans	-64	-38.6	-173.6	22.5	-32.3	0	0	0	113.1	P311 V314 L315 A353 A354 M355	P311-P351 HydrophobicContact CB-CG 3.94Å; V314-P351 HydrophobicContact CB-CB 4.09Å; V314-P351 HydrophobicContact CG1-CB 3.86Å; L315-P351 HydrophobicContact CB-CB 4.13Å; P351-A353 VanDerWaalsContact C-N 3.35Å; P351-A354 WeakPolarHBondContact O-CB 3.48Å; P351-A354 PolarHBondContact O-N 3.24Å; P351-M355 VanDerWaalsContact O-CG 3.3Å; P351-M355 WeakPolarHBondContact O-CG 3.35Å; P351-M355 PolarHBondContact O-N 2.77Å
352	Y	89	Confident	78	Confident	22 Å²	22	31.9 Å²	31.9	9%	0.086	19%	0.19	C	C	.	.	H	α-helix	trans	-71	-31.8	178.5	-55.3	-66.7	0	0	0	112	V305 N350 M355 A356 M379 Y387	V305-Y352 HydrophobicContact CG2-CE1 3.52Å; V305-Y352 HydrophobicContact CG2-CE2 4.4Å; V305-Y352 VanDerWaalsContact CG2-CZ 3.45Å; V305-Y352 WeakPolarHBondContact CG2-OH 3.42Å; N350-Y352 PolarHBondContact O-N 3.41Å; N350-Y352 WeakPolarHBondContact OD1-CB 3.5Å; N350-Y352 PolarHBondContact OD1-N 3.03Å; Y352-M355 HydrophobicContact CD1-SD 4.18Å; Y352-A356 PolarHBondContact O-N 2.84Å; Y352-A356 VanDerWaalsContact O-N 3.08Å; Y352-M379 HydrophobicContact CE1-CE 4.38Å; Y352-Y387 HydrophobicContact CD1-CD2 4.27Å; Y352-Y387 HydrophobicContact CD1-CE2 4.09Å; Y352-Y387 PolarHBondContact O-OH 3.03Å
353	A	89.1	Confident	79.5	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.3	-42.2	170.3	0	0	0	0	0	111.2	V297 A301 I331 I338 N350 P351 M355 A356 V357	V297-A353 HydrophobicContact CG1-CB 3.91Å; A301-A353 HydrophobicContact CB-CB 3.96Å; I331-A353 HydrophobicContact CD1-CB 3.88Å; I331-A353 HydrophobicContact CG1-CB 4.48Å; I338-A353 HydrophobicContact CD1-CB 3.78Å; N350-A353 HydrophobicContact CB-CB 4.01Å; N350-A353 WeakPolarHBondContact O-CB 3.3Å; N350-A353 PolarHBondContact O-N 3.49Å; N350-A353 PolarHBondContact OD1-N 3.26Å; N350-A353 VanDerWaalsContact OD1-N 3.15Å; P351-A353 VanDerWaalsContact C-N 3.35Å; A353-M355 PolarHBondContact O-N 3.08Å; A353-A356 WeakPolarHBondContact O-CB 3.42Å; A353-A356 PolarHBondContact O-N 2.79Å; A353-V357 WeakPolarHBondContact O-CG2 3.47Å; A353-V357 PolarHBondContact O-N 2.78Å
354	A	89.8	Confident	81.2	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.8	-43.5	177	0	0	0	0	0	111.6	V318 F324 I331 N350 P351 A356 V357 I358	V318-A354 HydrophobicContact CG1-CB 4.19Å; F324-A354 HydrophobicContact CD2-CB 4.49Å; F324-A354 HydrophobicContact CE2-CB 4.16Å; I331-A354 HydrophobicContact CD1-CB 4.04Å; N350-A354 PolarHBondContact O-N 3.32Å; P351-A354 WeakPolarHBondContact O-CB 3.48Å; P351-A354 PolarHBondContact O-N 3.24Å; A354-A356 PolarHBondContact O-N 3.04Å; A354-V357 PolarHBondContact O-N 2.75Å; A354-I358 VanDerWaalsContact O-CG1 3.28Å; A354-I358 WeakPolarHBondContact O-CG1 3.45Å; A354-I358 PolarHBondContact O-N 2.84Å
355	M	92.4	Very high	83.4	Confident	2 Å²	2	21 Å²	21	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-57.7	-45.4	172.2	-70.5	167	57.5	0	0	111.9	V314 V318 P351 Y352 A353 V357 I358 L359 L371 L375 Y387	V314-M355 HydrophobicContact CG1-SD 3.96Å; V318-M355 HydrophobicContact CG1-CG 4.35Å; V318-M355 HydrophobicContact CG2-CG 3.74Å; V318-M355 HydrophobicContact CG2-SD 4.19Å; P351-M355 VanDerWaalsContact O-CG 3.3Å; P351-M355 WeakPolarHBondContact O-CG 3.35Å; P351-M355 PolarHBondContact O-N 2.77Å; Y352-M355 HydrophobicContact CD1-SD 4.18Å; A353-M355 PolarHBondContact O-N 3.08Å; M355-V357 PolarHBondContact O-N 3.4Å; M355-I358 PolarHBondContact O-N 2.83Å; M355-L359 VanDerWaalsContact O-CG 3.32Å; M355-L359 WeakPolarHBondContact O-CG 3.46Å; M355-L359 PolarHBondContact O-N 3.17Å; M355-L371 HydrophobicContact CG-CD1 4.47Å; M355-L375 HydrophobicContact CE-CD1 3.49Å; M355-L375 VanDerWaalsContact CE-CD1 3.49Å; M355-L375 HydrophobicContact CE-CD2 4.22Å; M355-L375 HydrophobicContact SD-CD1 4.25Å; M355-L375 HydrophobicContact SD-CD2 3.96Å; M355-Y387 HydrophobicContact CB-CE1 3.96Å; M355-Y387 HydrophobicContact CE-CD1 3.57Å; M355-Y387 HydrophobicContact CE-CD2 4.27Å; M355-Y387 HydrophobicContact CE-CE1 3.62Å; M355-Y387 HydrophobicContact CE-CE2 4.3Å; M355-Y387 HydrophobicContact CE-CG 3.92Å
356	A	92.8	Very high	85.3	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.5	-43.9	179.1	0	0	0	0	0	111.9	V297 M300 Y352 A353 A354 L359 V360 Y387	V297-A356 HydrophobicContact CG1-CB 4.49Å; V297-A356 HydrophobicContact CG2-CB 4.27Å; M300-A356 HydrophobicContact CB-CB 3.75Å; M300-A356 HydrophobicContact CG-CB 4.13Å; Y352-A356 PolarHBondContact O-N 2.84Å; Y352-A356 VanDerWaalsContact O-N 3.08Å; A353-A356 WeakPolarHBondContact O-CB 3.42Å; A353-A356 PolarHBondContact O-N 2.79Å; A354-A356 PolarHBondContact O-N 3.04Å; A356-L359 PolarHBondContact O-N 2.9Å; A356-V360 WeakPolarHBondContact O-CG2 3.33Å; A356-V360 PolarHBondContact O-N 2.91Å; A356-Y387 WeakPolarHBondContact CA-OH 3.23Å; A356-Y387 WeakPolarHBondContact CB-OH 3.37Å; A356-Y387 PolarHBondContact N-OH 2.87Å; A356-Y387 VanDerWaalsContact N-OH 3.1Å
357	V	92.6	Very high	87	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.6	-41	177.5	-179.7	0	0	0	0	111.2	V297 A327 T330 I331 A353 A354 M355 L359 V360 L361	V297-V357 HydrophobicContact CB-CG2 4.5Å; V297-V357 HydrophobicContact CG1-CG2 3.87Å; V297-V357 HydrophobicContact CG2-CG2 3.75Å; A327-V357 HydrophobicContact CB-CB 3.83Å; A327-V357 HydrophobicContact CB-CG1 3.82Å; T330-V357 HydrophobicContact CG2-CG1 4.4Å; T330-V357 HydrophobicContact CG2-CG2 4.47Å; I331-V357 HydrophobicContact CD1-CG2 4.42Å; I331-V357 HydrophobicContact CG1-CG2 4.26Å; A353-V357 WeakPolarHBondContact O-CG2 3.47Å; A353-V357 PolarHBondContact O-N 2.78Å; A354-V357 PolarHBondContact O-N 2.75Å; M355-V357 PolarHBondContact O-N 3.4Å; V357-L359 VanDerWaalsContact C-N 3.29Å; V357-L359 PolarHBondContact O-N 3.16Å; V357-V360 PolarHBondContact O-N 3.45Å; V357-L361 HydrophobicContact CG1-CD1 3.74Å; V357-L361 HydrophobicContact CG1-CG 4.13Å; V357-L361 WeakPolarHBondContact O-CB 3.24Å; V357-L361 WeakPolarHBondContact O-CG 3.26Å; V357-L361 PolarHBondContact O-N 3.15Å
358	I	93.8	Very high	88.7	Confident	1 Å²	1	9.4 Å²	9.4	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-57.9	-43.6	174.2	-71.5	166.7	0	0	0	110.9	V318 H321 L323 A327 A354 M355 L361 S362 L371	V318-I358 HydrophobicContact CG1-CD1 3.55Å; H321-I358 HydrophobicContact CB-CD1 4.16Å; H321-I358 VanDerWaalsContact CE1-CG2 3.49Å; H321-I358 WeakPolarHBondContact CE1-CG2 3.28Å; L323-I358 HydrophobicContact CB-CG1 4.2Å; L323-I358 HydrophobicContact CB-CG2 4.37Å; L323-I358 HydrophobicContact CD1-CG2 4.49Å; A327-I358 HydrophobicContact CB-CG1 4.02Å; A354-I358 VanDerWaalsContact O-CG1 3.28Å; A354-I358 WeakPolarHBondContact O-CG1 3.45Å; A354-I358 PolarHBondContact O-N 2.84Å; M355-I358 PolarHBondContact O-N 2.83Å; I358-L361 CarbonylContact O-C 3.55Å; I358-L361 PolarHBondContact O-N 3.36Å; I358-S362 PolarHBondContact O-N 3.39Å; I358-L371 HydrophobicContact CG2-CD2 4.18Å
359	L	94.3	Very high	90	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.005	7%	0.069	C	C	.	.	H	α-helix	trans	-66.8	-38.3	178.3	-69.2	174	0	0	0	112.4	M355 A356 V357 L361 S362 V368 L371 Y387 L388 M391 I413	M355-L359 VanDerWaalsContact O-CG 3.32Å; M355-L359 WeakPolarHBondContact O-CG 3.46Å; M355-L359 PolarHBondContact O-N 3.17Å; A356-L359 PolarHBondContact O-N 2.9Å; V357-L359 VanDerWaalsContact C-N 3.29Å; V357-L359 PolarHBondContact O-N 3.16Å; L359-L361 VanDerWaalsContact C-N 3.32Å; L359-S362 WeakPolarHBondContact O-CB 3.43Å; L359-S362 PolarHBondContact O-N 3.2Å; L359-S362 PolarHBondContact O-OG 3.12Å; L359-V368 HydrophobicContact CD2-CB 4.46Å; L359-V368 HydrophobicContact CD2-CG1 3.98Å; L359-V368 HydrophobicContact CD2-CG2 3.94Å; L359-L371 HydrophobicContact CD2-CD2 3.86Å; L359-L371 HydrophobicContact CG-CD2 4.04Å; L359-Y387 HydrophobicContact CD1-CD1 4.47Å; L359-Y387 HydrophobicContact CD1-CE1 3.83Å; L359-L388 HydrophobicContact CD1-CD2 3.84Å; L359-L388 HydrophobicContact CD2-CD2 4.1Å; L359-M391 HydrophobicContact CB-CE 4.29Å; L359-M391 HydrophobicContact CB-CG 4.42Å; L359-M391 HydrophobicContact CD1-CB 4.2Å; L359-M391 HydrophobicContact CD1-CG 3.83Å; L359-I413 HydrophobicContact CB-CD1 4.22Å; L359-I413 HydrophobicContact CD1-CD1 4.16Å; L359-I413 HydrophobicContact CD2-CD1 4.26Å; L359-I413 HydrophobicContact CD2-CG1 4.19Å; L359-I413 HydrophobicContact CG-CD1 4.45Å
360	V	92.6	Very high	90.8	Very high	5 Å²	5	13.4 Å²	13.4	3%	0.03	8%	0.084	C	C	.	.	H	α-helix	trans	-68.4	-30.5	175.2	171.5	0	0	0	0	112.5	I293 A356 V357 M391 L409 T1025 L1028	I293-V360 HydrophobicContact CG2-CG1 3.89Å; I293-V360 HydrophobicContact CG2-CG2 4.36Å; A356-V360 WeakPolarHBondContact O-CG2 3.33Å; A356-V360 PolarHBondContact O-N 2.91Å; V357-V360 PolarHBondContact O-N 3.45Å; V360-M391 HydrophobicContact CG2-CE 3.47Å; V360-M391 VanDerWaalsContact CG2-CE 3.47Å; V360-L409 WeakPolarHBondContact O-CD2 3.31Å; V360-T1025 HydrophobicContact CG1-CG2 4.17Å; V360-L1028 HydrophobicContact CG1-CD1 3.95Å
361	L	91.7	Very high	91.2	Very high	7 Å²	7	13.2 Å²	13.2	4%	0.037	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	2.7	177.5	-61.3	-179.6	0	0	0	113.2	L323 Q326 V357 I358 L359 E363 F994 M996 T1025	L323-L361 HydrophobicContact CD1-CB 4.25Å; L323-L361 WeakPolarHBondContact CD1-O 3.38Å; Q326-L361 HydrophobicContact CB-CD1 3.81Å; V357-L361 HydrophobicContact CG1-CD1 3.74Å; V357-L361 HydrophobicContact CG1-CG 4.13Å; V357-L361 WeakPolarHBondContact O-CB 3.24Å; V357-L361 WeakPolarHBondContact O-CG 3.26Å; V357-L361 PolarHBondContact O-N 3.15Å; I358-L361 CarbonylContact O-C 3.55Å; I358-L361 PolarHBondContact O-N 3.36Å; L359-L361 VanDerWaalsContact C-N 3.32Å; L361-E363 PolarHBondContact O-N 3.04Å; L361-F994 HydrophobicContact CD1-CD1 4.45Å; L361-F994 HydrophobicContact CD1-CE1 4.07Å; L361-F994 HydrophobicContact CD1-CZ 4.27Å; L361-F994 HydrophobicContact CD2-CE1 4.26Å; L361-F994 HydrophobicContact CD2-CE2 4.1Å; L361-F994 HydrophobicContact CD2-CZ 3.67Å; L361-M996 HydrophobicContact CD2-CE 3.78Å; L361-T1025 HydrophobicContact CD2-CG2 4.23Å
362	S	91.6	Very high	91.4	Very high	9 Å²	9	13.6 Å²	13.6	6%	0.063	9%	0.085	C	C	.	.			trans	-62.7	129.1	-178.2	65.4	0	0	0	0	111.1	I358 L359	I358-S362 PolarHBondContact O-N 3.39Å; L359-S362 WeakPolarHBondContact O-CB 3.43Å; L359-S362 PolarHBondContact O-N 3.2Å; L359-S362 PolarHBondContact O-OG 3.12Å
363	E	88.8	Confident	91.5	Very high	35 Å²	35	16.1 Å²	16.1	16%	0.164	11%	0.106	C	C	.	.			trans	-93.3	-29.3	-177	-61.7	168.9	-175.2	0	0	110.6	R322 L361 D367 R408 K963 S964	R322-E363 IonicContact CZ-OE2 3.08Å; R322-E363 IonicContact NH1-OE1 2.85Å; R322-E363 PolarHBondContact NH1-OE1 3.38Å; R322-E363 IonicContact NH1-OE2 2.95Å; R322-E363 PolarHBondContact NH1-OE2 2.79Å; R322-E363 VanDerWaalsContact NH1-OE2 3.17Å; R322-E363 IonicContact NH2-OE1 3.88Å; R322-E363 IonicContact NH2-OE2 2.76Å; R322-E363 PolarHBondContact NH2-OE2 3.11Å; L361-E363 PolarHBondContact O-N 3.04Å; E363-D367 PolarHBondContact N-OD2 3.19Å; E363-R408 PolarHBondContact O-NE 3.23Å; E363-R408 PolarHBondContact O-NH2 3.48Å; E363-K963 HydrophobicContact CG-CG 4.45Å; E363-K963 WeakPolarHBondContact OE1-CA 3.47Å; E363-K963 WeakPolarHBondContact OE1-CB 3.41Å; E363-K963 WeakPolarHBondContact OE2-CE 3.45Å; E363-S964 PolarHBondContact OE1-N 2.72Å
364	S	88.5	Confident	91.6	Very high	27 Å²	27	17.4 Å²	17.4	19%	0.189	11%	0.113	C	C	.	.	S	Bend	trans	-144.1	168.4	-177.2	67.1	0	0	0	0	112.2	G366 D367 E707	S364-G366 PolarHBondContact O-N 3.02Å; S364-G366 PolarHBondContact OG-N 3.35Å; S364-D367 PolarHBondContact N-OD2 3.48Å; S364-D367 PolarHBondContact O-N 2.82Å; S364-D367 PolarHBondContact OG-OD2 3.06Å; S364-E707 WeakPolarHBondContact CB-OE1 3.39Å
365	V	89.8	Confident	91.6	Very high	4 Å²	4	17.5 Å²	17.5	2%	0.024	11%	0.114	C	C	.	.	H	α-helix	trans	-56.4	-34.7	168.6	174.8	0	0	0	0	111.2	D367 V368 Q369 Y411 N412 Y415 V416 A706	V365-D367 VanDerWaalsContact C-N 3.25Å; V365-D367 PolarHBondContact O-N 3.2Å; V365-V368 PolarHBondContact O-N 2.92Å; V365-V368 VanDerWaalsContact O-N 3.13Å; V365-Q369 HydrophobicContact CG1-CG 4.19Å; V365-Q369 WeakPolarHBondContact O-CG 3.45Å; V365-Q369 PolarHBondContact O-N 3.41Å; V365-Y411 HydrophobicContact CG2-CE1 4.31Å; V365-N412 HydrophobicContact CG2-CB 4.49Å; V365-Y415 HydrophobicContact CB-CD1 4.41Å; V365-Y415 HydrophobicContact CG1-CD1 3.41Å; V365-Y415 VanDerWaalsContact CG1-CD1 3.41Å; V365-Y415 HydrophobicContact CG1-CE1 3.89Å; V365-Y415 HydrophobicContact CG1-CG 3.94Å; V365-Y415 HydrophobicContact CG2-CD1 4.12Å; V365-Y415 HydrophobicContact CG2-CD2 4.11Å; V365-Y415 HydrophobicContact CG2-CG 3.8Å; V365-V416 HydrophobicContact CG1-CG2 3.81Å; V365-A706 HydrophobicContact CB-CB 3.97Å; V365-A706 HydrophobicContact CG1-CB 4.48Å; V365-A706 HydrophobicContact CG2-CB 3.7Å
366	G	88.8	Confident	91.4	Very high	34 Å²	34	20.6 Å²	20.6	35%	0.351	14%	0.135	S	C	.	.	H	α-helix	trans	-59.9	-32.6	179.7	0	0	0	0	0	113.5	S364 Q369 A370	S364-G366 PolarHBondContact O-N 3.02Å; S364-G366 PolarHBondContact OG-N 3.35Å; G366-Q369 PolarHBondContact O-N 2.79Å; G366-A370 WeakPolarHBondContact O-CB 3.29Å; G366-A370 PolarHBondContact O-N 3.25Å
367	D	91.8	Very high	91	Very high	12 Å²	12	29.9 Å²	29.9	6%	0.064	17%	0.17	C	C	.	.	H	α-helix	trans	-68.3	-41.3	176.7	-59.7	-45	0	0	0	111.8	H321 R322 E363 S364 V365 A370 L371	H321-D367 PolarHBondContact NE2-O 2.9Å; H321-D367 VanDerWaalsContact NE2-O 3.12Å; R322-D367 IonicContact CZ-OD1 3.32Å; R322-D367 IonicContact CZ-OD2 3.91Å; R322-D367 IonicContact NE-OD1 3.17Å; R322-D367 PolarHBondContact NE-OD1 3.43Å; R322-D367 IonicContact NH2-OD1 3.14Å; R322-D367 PolarHBondContact NH2-OD1 3.44Å; R322-D367 IonicContact NH2-OD2 2.67Å; R322-D367 PolarHBondContact NH2-OD2 2.94Å; E363-D367 PolarHBondContact N-OD2 3.19Å; S364-D367 PolarHBondContact N-OD2 3.48Å; S364-D367 PolarHBondContact O-N 2.82Å; S364-D367 PolarHBondContact OG-OD2 3.06Å; V365-D367 VanDerWaalsContact C-N 3.25Å; V365-D367 PolarHBondContact O-N 3.2Å; D367-A370 PolarHBondContact O-N 2.94Å; D367-L371 PolarHBondContact O-N 3.47Å
368	V	93.6	Very high	90.6	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-68.3	-39.7	177.4	-175.1	0	0	0	0	110	L359 V365 L371 V372 L388 N412 V416	L359-V368 HydrophobicContact CD2-CB 4.46Å; L359-V368 HydrophobicContact CD2-CG1 3.98Å; L359-V368 HydrophobicContact CD2-CG2 3.94Å; V365-V368 PolarHBondContact O-N 2.92Å; V365-V368 VanDerWaalsContact O-N 3.13Å; V368-L371 PolarHBondContact O-N 3.26Å; V368-V372 WeakPolarHBondContact O-CG2 3.46Å; V368-V372 PolarHBondContact O-N 3.28Å; V368-L388 HydrophobicContact CG1-CD2 4.37Å; V368-N412 HydrophobicContact CG2-CB 3.95Å; V368-V416 HydrophobicContact CB-CB 4.49Å; V368-V416 HydrophobicContact CB-CG2 3.71Å; V368-V416 HydrophobicContact CG1-CB 3.86Å; V368-V416 HydrophobicContact CG1-CG1 4.15Å; V368-V416 HydrophobicContact CG1-CG2 3.64Å
369	Q	91.8	Very high	90.2	Very high	71 Å²	71	32 Å²	32	33%	0.332	18%	0.184	S	C	.	.	H	α-helix	trans	-63.7	-40.7	174.1	-70.3	177.9	-43.2	0	0	112.5	V365 G366 L371 V372 S373 V416 L419	V365-Q369 HydrophobicContact CG1-CG 4.19Å; V365-Q369 WeakPolarHBondContact O-CG 3.45Å; V365-Q369 PolarHBondContact O-N 3.41Å; G366-Q369 PolarHBondContact O-N 2.79Å; Q369-L371 VanDerWaalsContact C-N 3.34Å; Q369-V372 PolarHBondContact O-N 3.16Å; Q369-S373 WeakPolarHBondContact O-CB 3.4Å; Q369-S373 PolarHBondContact O-N 2.9Å; Q369-S373 PolarHBondContact O-OG 3.23Å; Q369-V416 HydrophobicContact CG-CG2 3.65Å; Q369-L419 VanDerWaalsContact NE2-CD1 3.29Å
370	A	92.2	Very high	89.9	Confident	43 Å²	43	33.6 Å²	33.6	36%	0.355	20%	0.195	S	C	.	.	H	α-helix	trans	-62.1	-43.2	175.1	0	0	0	0	0	111	G366 D367 S373 L374	G366-A370 WeakPolarHBondContact O-CB 3.29Å; G366-A370 PolarHBondContact O-N 3.25Å; D367-A370 PolarHBondContact O-N 2.94Å; A370-S373 PolarHBondContact O-N 3.26Å; A370-L374 WeakPolarHBondContact O-CG 3.47Å; A370-L374 PolarHBondContact O-N 3.01Å
371	L	93.2	Very high	89.5	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-60.3	-47.9	174	-178	63.3	0	0	0	111.7	V318 M355 I358 L359 D367 V368 Q369 S373 L374 L375	V318-L371 HydrophobicContact CG2-CD1 4.3Å; M355-L371 HydrophobicContact CG-CD1 4.47Å; I358-L371 HydrophobicContact CG2-CD2 4.18Å; L359-L371 HydrophobicContact CD2-CD2 3.86Å; L359-L371 HydrophobicContact CG-CD2 4.04Å; D367-L371 PolarHBondContact O-N 3.47Å; V368-L371 PolarHBondContact O-N 3.26Å; Q369-L371 VanDerWaalsContact C-N 3.34Å; L371-S373 VanDerWaalsContact C-N 3.33Å; L371-S373 PolarHBondContact O-N 2.83Å; L371-L374 PolarHBondContact O-N 3.03Å; L371-L375 HydrophobicContact CD1-CD1 4.08Å; L371-L375 HydrophobicContact CD1-CG 4.25Å; L371-L375 HydrophobicContact CD2-CD1 4.48Å; L371-L375 HydrophobicContact CG-CD1 3.84Å; L371-L375 HydrophobicContact CG-CG 4.41Å; L371-L375 VanDerWaalsContact O-CG 3.27Å; L371-L375 WeakPolarHBondContact O-CG 3.27Å; L371-L375 PolarHBondContact O-N 3.36Å
372	V	92.3	Very high	89.3	Confident	10 Å²	10	37.4 Å²	37.4	6%	0.061	22%	0.216	C	C	.	.	H	α-helix	trans	-60.5	-41.9	177.5	170.2	0	0	0	0	111.7	V368 Q369 L374 L375 S376 I384 L388 V416 L420	V368-V372 WeakPolarHBondContact O-CG2 3.46Å; V368-V372 PolarHBondContact O-N 3.28Å; Q369-V372 PolarHBondContact O-N 3.16Å; V372-L374 VanDerWaalsContact C-N 3.29Å; V372-L374 PolarHBondContact O-N 2.84Å; V372-L375 PolarHBondContact O-N 3.49Å; V372-S376 WeakPolarHBondContact O-CB 3.46Å; V372-S376 PolarHBondContact O-N 3.2Å; V372-S376 PolarHBondContact O-OG 3.3Å; V372-I384 HydrophobicContact CG1-CG2 4.23Å; V372-I384 HydrophobicContact CG2-CG2 3.88Å; V372-L388 HydrophobicContact CG2-CD1 3.73Å; V372-V416 HydrophobicContact CG2-CG1 3.87Å; V372-L420 HydrophobicContact CG1-CD1 4.19Å; V372-L420 HydrophobicContact CG1-CD2 4.16Å; V372-L420 HydrophobicContact CG2-CD1 4.46Å
373	S	91.1	Very high	89.1	Confident	76 Å²	76	37.7 Å²	37.7	53%	0.531	22%	0.217	S	C	.	.	H	α-helix	trans	-63	-36.6	178.5	-57.6	0	0	0	0	112.1	Q369 A370 L371	Q369-S373 WeakPolarHBondContact O-CB 3.4Å; Q369-S373 PolarHBondContact O-N 2.9Å; Q369-S373 PolarHBondContact O-OG 3.23Å; A370-S373 PolarHBondContact O-N 3.26Å; L371-S373 VanDerWaalsContact C-N 3.33Å; L371-S373 PolarHBondContact O-N 2.83Å
374	L	91.3	Very high	89.2	Confident	26 Å²	26	36 Å²	36	14%	0.136	21%	0.209	C	C	.	.	H	α-helix	trans	-70.9	-41.6	174.5	-69.5	171.2	0	0	0	112	K320 H321 A370 L371 V372 R377	K320-L374 HydrophobicContact CB-CD1 4.21Å; K320-L374 HydrophobicContact CB-CD2 4Å; K320-L374 HydrophobicContact CD-CD2 4.34Å; H321-L374 HydrophobicContact CB-CD1 3.95Å; A370-L374 WeakPolarHBondContact O-CG 3.47Å; A370-L374 PolarHBondContact O-N 3.01Å; L371-L374 PolarHBondContact O-N 3.03Å; V372-L374 VanDerWaalsContact C-N 3.29Å; V372-L374 PolarHBondContact O-N 2.84Å; L374-R377 PolarHBondContact O-N 3.03Å
375	L	88.8	Confident	89.3	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-72.1	-30.4	-179.1	-68.2	171.5	0	0	0	113	V314 V318 M355 L371 V372 R377 C378 M379 I384	V314-L375 HydrophobicContact CG1-CD2 3.94Å; V318-L375 HydrophobicContact CG2-CD2 3.79Å; M355-L375 HydrophobicContact CE-CD1 3.49Å; M355-L375 VanDerWaalsContact CE-CD1 3.49Å; M355-L375 HydrophobicContact CE-CD2 4.22Å; M355-L375 HydrophobicContact SD-CD1 4.25Å; M355-L375 HydrophobicContact SD-CD2 3.96Å; L371-L375 HydrophobicContact CD1-CD1 4.08Å; L371-L375 HydrophobicContact CD1-CG 4.25Å; L371-L375 HydrophobicContact CD2-CD1 4.48Å; L371-L375 HydrophobicContact CG-CD1 3.84Å; L371-L375 HydrophobicContact CG-CG 4.41Å; L371-L375 VanDerWaalsContact O-CG 3.27Å; L371-L375 WeakPolarHBondContact O-CG 3.27Å; L371-L375 PolarHBondContact O-N 3.36Å; V372-L375 PolarHBondContact O-N 3.49Å; L375-R377 PolarHBondContact O-N 3.44Å; L375-C378 PolarHBondContact O-N 3.5Å; L375-C378 PolarHBondContact O-SG 2.86Å; L375-C378 VanDerWaalsContact O-SG 3.41Å; L375-M379 HydrophobicContact CD2-SD 4Å; L375-M379 PolarHBondContact O-N 3.41Å; L375-I384 HydrophobicContact CB-CD1 3.69Å; L375-I384 HydrophobicContact CB-CG1 3.98Å
376	S	87.5	Confident	89.4	Confident	67 Å²	67	35.9 Å²	35.9	47%	0.469	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-13.6	178.7	-59	0	0	0	0	113.1	V372	V372-S376 WeakPolarHBondContact O-CB 3.46Å; V372-S376 PolarHBondContact O-N 3.2Å; V372-S376 PolarHBondContact O-OG 3.3Å
377	R	85.9	Confident	89.6	Confident	195 Å²	195	34.3 Å²	34.3	74%	0.736	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-20.5	173.9	-68.4	178.2	155.1	156.9	-6	114	L374 L375	L374-R377 PolarHBondContact O-N 3.03Å; L375-R377 PolarHBondContact O-N 3.44Å
378	C	83.9	Confident	89.7	Confident	33 Å²	33	33.9 Å²	33.9	22%	0.223	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.9	-11.1	-174.6	60	0	0	0	0	114.4	D313 L375	D313-C378 HydrophobicContact CB-CB 4.47Å; L375-C378 PolarHBondContact O-N 3.5Å; L375-C378 PolarHBondContact O-SG 2.86Å; L375-C378 VanDerWaalsContact O-SG 3.41Å
379	M	85.6	Confident	89.8	Confident	12 Å²	12	34 Å²	34	6%	0.059	19%	0.188	C	C	.	.	S	Bend	trans	-135.6	147.8	-178.1	-62.7	178.1	69.5	0	0	110.7	V305 V309 V314 Y352 L375 T383 I384	V305-M379 HydrophobicContact CG2-CE 4.4Å; V309-M379 HydrophobicContact CG1-CG 3.95Å; V309-M379 HydrophobicContact CG2-CG 4.38Å; V314-M379 HydrophobicContact CG1-SD 4.07Å; V314-M379 HydrophobicContact CG2-CG 4.12Å; V314-M379 HydrophobicContact CG2-SD 3.89Å; Y352-M379 HydrophobicContact CE1-CE 4.38Å; L375-M379 HydrophobicContact CD2-SD 4Å; L375-M379 PolarHBondContact O-N 3.41Å; M379-T383 HydrophobicContact CE-CG2 3.17Å; M379-I384 HydrophobicContact CB-CD1 4.37Å; M379-I384 HydrophobicContact CB-CG1 4.06Å
380	S	86.4	Confident	89.9	Confident	34 Å²	34	31.2 Å²	31.2	24%	0.238	18%	0.175	C	C	.	.			trans	-62.9	148.8	169.9	53.9	0	0	0	0	111.8	E307 T382 T383 I384	E307-S380 WeakPolarHBondContact OE2-CB 3.29Å; E307-S380 PolarHBondContact OE2-OG 3.37Å; S380-T382 PolarHBondContact O-N 3.2Å; S380-T382 PolarHBondContact OG-OG1 3.23Å; S380-T382 VanDerWaalsContact OG-OG1 3.08Å; S380-T383 PolarHBondContact O-N 2.92Å; S380-T383 VanDerWaalsContact O-N 3.1Å; S380-T383 PolarHBondContact OG-OG1 3.02Å; S380-I384 WeakPolarHBondContact O-CG1 3.38Å; S380-I384 PolarHBondContact O-N 2.94Å; S380-I384 VanDerWaalsContact O-N 3.1Å
381	L	85.5	Confident	90	Very high	66 Å²	66	29.1 Å²	29.1	35%	0.346	16%	0.158	S	C	.	.	H	α-helix	trans	-58.2	-32.5	177.1	-179.5	62.1	0	0	0	112.1	L227 I384 T385 L420	L227-L381 HydrophobicContact CD2-CD2 4.14Å; L381-I384 PolarHBondContact O-N 2.89Å; L381-T385 HydrophobicContact CD1-CG2 4.24Å; L381-T385 HydrophobicContact CG-CG2 4.4Å; L381-T385 WeakPolarHBondContact O-CB 3.14Å; L381-T385 VanDerWaalsContact O-CG2 3.29Å; L381-T385 WeakPolarHBondContact O-CG2 3.4Å; L381-T385 PolarHBondContact O-N 3.34Å; L381-T385 PolarHBondContact O-OG1 2.68Å; L381-L420 HydrophobicContact CD1-CD1 4.01Å; L381-L420 HydrophobicContact CD1-CD2 3.86Å; L381-L420 HydrophobicContact CD1-CG 4.32Å
382	T	86.4	Confident	90.1	Very high	26 Å²	26	29.1 Å²	29.1	16%	0.16	16%	0.158	C	C	.	.	H	α-helix	trans	-63	-45.3	175.8	55.6	0	0	0	0	111.6	C226 S380 T385 E386	C226-T382 HydrophobicContact CB-CG2 3.9Å; C226-T382 WeakPolarHBondContact SG-CG2 2.89Å; S380-T382 PolarHBondContact O-N 3.2Å; S380-T382 PolarHBondContact OG-OG1 3.23Å; S380-T382 VanDerWaalsContact OG-OG1 3.08Å; T382-T385 WeakPolarHBondContact CA-OG1 3.42Å; T382-T385 PolarHBondContact O-N 2.88Å; T382-T385 PolarHBondContact O-OG1 3.49Å; T382-E386 WeakPolarHBondContact O-CB 3.21Å; T382-E386 WeakPolarHBondContact O-CG 3.48Å; T382-E386 PolarHBondContact O-N 3.45Å
383	T	88.4	Confident	90.2	Very high	15 Å²	15	28.7 Å²	28.7	9%	0.092	16%	0.155	C	C	.	.	H	α-helix	trans	-67.7	-38.9	177.9	-55.1	0	0	0	0	111.6	V305 E307 M379 S380 E386 Y387	V305-T383 HydrophobicContact CB-CG2 4.34Å; V305-T383 HydrophobicContact CG1-CG2 3.48Å; V305-T383 VanDerWaalsContact CG1-CG2 3.48Å; V305-T383 HydrophobicContact CG2-CG2 4.05Å; E307-T383 PolarHBondContact OE2-OG1 2.97Å; M379-T383 HydrophobicContact CE-CG2 3.17Å; S380-T383 PolarHBondContact O-N 2.92Å; S380-T383 VanDerWaalsContact O-N 3.1Å; S380-T383 PolarHBondContact OG-OG1 3.02Å; T383-E386 PolarHBondContact O-N 3.46Å; T383-Y387 PolarHBondContact O-N 2.98Å
384	I	90.3	Very high	90.3	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-62.7	-48.2	175.7	-63.2	168.8	0	0	0	110.5	V372 L375 M379 S380 L381 E386 Y387 L388	V372-I384 HydrophobicContact CG1-CG2 4.23Å; V372-I384 HydrophobicContact CG2-CG2 3.88Å; L375-I384 HydrophobicContact CB-CD1 3.69Å; L375-I384 HydrophobicContact CB-CG1 3.98Å; M379-I384 HydrophobicContact CB-CD1 4.37Å; M379-I384 HydrophobicContact CB-CG1 4.06Å; S380-I384 WeakPolarHBondContact O-CG1 3.38Å; S380-I384 PolarHBondContact O-N 2.94Å; S380-I384 VanDerWaalsContact O-N 3.1Å; L381-I384 PolarHBondContact O-N 2.89Å; I384-E386 PolarHBondContact O-N 3.09Å; I384-Y387 PolarHBondContact O-N 3.43Å; I384-L388 HydrophobicContact CG2-CD1 4.03Å; I384-L388 HydrophobicContact CG2-CG 4.36Å; I384-L388 WeakPolarHBondContact O-CB 3.43Å; I384-L388 WeakPolarHBondContact O-CG 3.47Å; I384-L388 PolarHBondContact O-N 2.89Å
385	T	90.5	Very high	90.3	Very high	10 Å²	10	24 Å²	24	6%	0.061	12%	0.124	C	C	.	.	H	α-helix	trans	-64.8	-37.3	179.8	50.3	0	0	0	0	112.4	L381 T382 S389 L417 L420	L381-T385 HydrophobicContact CD1-CG2 4.24Å; L381-T385 HydrophobicContact CG-CG2 4.4Å; L381-T385 WeakPolarHBondContact O-CB 3.14Å; L381-T385 VanDerWaalsContact O-CG2 3.29Å; L381-T385 WeakPolarHBondContact O-CG2 3.4Å; L381-T385 PolarHBondContact O-N 3.34Å; L381-T385 PolarHBondContact O-OG1 2.68Å; T382-T385 WeakPolarHBondContact CA-OG1 3.42Å; T382-T385 PolarHBondContact O-N 2.88Å; T382-T385 PolarHBondContact O-OG1 3.49Å; T385-S389 WeakPolarHBondContact O-CB 3.43Å; T385-S389 PolarHBondContact O-N 3.26Å; T385-S389 PolarHBondContact O-OG 3.26Å; T385-L417 HydrophobicContact CG2-CD2 4.34Å; T385-L420 HydrophobicContact CG2-CB 4.28Å; T385-L420 HydrophobicContact CG2-CD1 3.9Å
386	E	91.8	Very high	90.5	Very high	18 Å²	18	24.5 Å²	24.5	8%	0.084	13%	0.127	C	C	.	.	H	α-helix	trans	-64	-45.7	173.6	-78.3	-70.4	109.4	0	0	112.1	V254 P255 F256 K257 T382 T383 I384 S389 H390	V254-E386 VanDerWaalsContact C-OE1 3.29Å; V254-E386 WeakPolarHBondContact CA-OE1 3.34Å; V254-E386 WeakPolarHBondContact CB-OE1 3.41Å; P255-E386 WeakPolarHBondContact CD-OE2 3.42Å; P255-E386 WeakPolarHBondContact CG-OE2 3.4Å; P255-E386 VanDerWaalsContact N-OE2 3.14Å; F256-E386 WeakPolarHBondContact CB-OE2 3.47Å; F256-E386 WeakPolarHBondContact CD2-OE2 3.41Å; F256-E386 PolarHBondContact N-OE2 3.49Å; K257-E386 WeakPolarHBondContact CB-OE1 3.46Å; K257-E386 PolarHBondContact N-OE1 3.25Å; T382-E386 WeakPolarHBondContact O-CB 3.21Å; T382-E386 WeakPolarHBondContact O-CG 3.48Å; T382-E386 PolarHBondContact O-N 3.45Å; T383-E386 PolarHBondContact O-N 3.46Å; I384-E386 PolarHBondContact O-N 3.09Å; E386-S389 PolarHBondContact O-N 2.74Å; E386-H390 WeakPolarHBondContact O-CB 3.23Å; E386-H390 PolarHBondContact O-N 3.29Å
387	Y	93.1	Very high	90.6	Very high	1 Å²	1	21.3 Å²	21.3	0%	0.004	11%	0.105	C	C	.	.	H	α-helix	trans	-63.3	-46.3	177.5	-177.8	-86.3	0	0	0	111.8	M300 H303 Y352 M355 A356 L359 T383 I384 S389 H390 M391	M300-Y387 HydrophobicContact CE-CD2 4.08Å; M300-Y387 HydrophobicContact CE-CE1 4.09Å; M300-Y387 HydrophobicContact CE-CE2 3.61Å; H303-Y387 HydrophobicContact CB-CD2 4.43Å; H303-Y387 HydrophobicContact CB-CE2 4.45Å; H303-Y387 AromaticContact CD2-CD2 3.72Å; Y352-Y387 HydrophobicContact CD1-CD2 4.27Å; Y352-Y387 HydrophobicContact CD1-CE2 4.09Å; Y352-Y387 PolarHBondContact O-OH 3.03Å; M355-Y387 HydrophobicContact CB-CE1 3.96Å; M355-Y387 HydrophobicContact CE-CD1 3.57Å; M355-Y387 HydrophobicContact CE-CD2 4.27Å; M355-Y387 HydrophobicContact CE-CE1 3.62Å; M355-Y387 HydrophobicContact CE-CE2 4.3Å; M355-Y387 HydrophobicContact CE-CG 3.92Å; A356-Y387 WeakPolarHBondContact CA-OH 3.23Å; A356-Y387 WeakPolarHBondContact CB-OH 3.37Å; A356-Y387 PolarHBondContact N-OH 2.87Å; A356-Y387 VanDerWaalsContact N-OH 3.1Å; L359-Y387 HydrophobicContact CD1-CD1 4.47Å; L359-Y387 HydrophobicContact CD1-CE1 3.83Å; T383-Y387 PolarHBondContact O-N 2.98Å; I384-Y387 PolarHBondContact O-N 3.43Å; Y387-S389 VanDerWaalsContact C-N 3.35Å; Y387-S389 PolarHBondContact O-N 2.79Å; Y387-H390 WeakPolarHBondContact O-CB 3.23Å; Y387-H390 PolarHBondContact O-N 2.98Å; Y387-M391 PolarHBondContact O-N 2.66Å
388	L	94.6	Very high	90.7	Very high	3 Å²	3	12 Å²	12	2%	0.016	7%	0.069	C	C	.	.	H	α-helix	trans	-64	-39.4	176.8	-70.8	-178.2	0	0	0	111.8	L359 V368 V372 I384 H390 M391 A392 I413 V416 L417 L420	L359-L388 HydrophobicContact CD1-CD2 3.84Å; L359-L388 HydrophobicContact CD2-CD2 4.1Å; V368-L388 HydrophobicContact CG1-CD2 4.37Å; V372-L388 HydrophobicContact CG2-CD1 3.73Å; I384-L388 HydrophobicContact CG2-CD1 4.03Å; I384-L388 HydrophobicContact CG2-CG 4.36Å; I384-L388 WeakPolarHBondContact O-CB 3.43Å; I384-L388 WeakPolarHBondContact O-CG 3.47Å; I384-L388 PolarHBondContact O-N 2.89Å; L388-H390 VanDerWaalsContact C-N 3.34Å; L388-H390 PolarHBondContact O-N 3.32Å; L388-M391 PolarHBondContact O-N 3.29Å; L388-A392 VanDerWaalsContact O-CB 3.31Å; L388-A392 WeakPolarHBondContact O-CB 3.47Å; L388-A392 PolarHBondContact O-N 3.21Å; L388-I413 HydrophobicContact CB-CG2 3.91Å; L388-I413 HydrophobicContact CD2-CG2 4.12Å; L388-I413 HydrophobicContact CG-CG2 4.49Å; L388-I413 WeakPolarHBondContact O-CG2 3.48Å; L388-V416 HydrophobicContact CD1-CG1 4.4Å; L388-L417 HydrophobicContact CB-CD1 4.28Å; L388-L417 HydrophobicContact CB-CD2 3.66Å; L388-L417 HydrophobicContact CB-CG 4.01Å; L388-L417 HydrophobicContact CD1-CD2 4.27Å; L388-L420 HydrophobicContact CD1-CD1 4.37Å
389	S	94.4	Very high	90.9	Very high	2 Å²	2	13 Å²	13	1%	0.014	7%	0.071	C	C	.	.	H	α-helix	trans	-63.6	-40.1	175.5	-63.3	0	0	0	0	111.7	T385 E386 Y387 M393	T385-S389 WeakPolarHBondContact O-CB 3.43Å; T385-S389 PolarHBondContact O-N 3.26Å; T385-S389 PolarHBondContact O-OG 3.26Å; E386-S389 PolarHBondContact O-N 2.74Å; Y387-S389 VanDerWaalsContact C-N 3.35Å; Y387-S389 PolarHBondContact O-N 2.79Å; S389-M393 VanDerWaalsContact O-CB 3.29Å; S389-M393 WeakPolarHBondContact O-CB 3.4Å; S389-M393 PolarHBondContact O-N 3.06Å
390	H	94.1	Very high	90.9	Very high	13 Å²	13	16.5 Å²	16.5	6%	0.06	8%	0.083	C	C	.	.	H	α-helix	trans	-62.6	-47	174.9	-172.8	-154.9	0	0	0	111.3	F256 M300 H303 E386 Y387 L388 M393 M394	F256-H390 HydrophobicContact CB-CB 4.04Å; F256-H390 HydrophobicContact CD1-CB 3.7Å; F256-H390 AromaticContact CD1-CD2 3.48Å; F256-H390 VanDerWaalsContact CD1-CD2 3.48Å; F256-H390 WeakPolarHBondContact CD1-CD2 3.31Å; F256-H390 AromaticContact CD1-CG 3.56Å; F256-H390 HydrophobicContact CD2-CB 4.35Å; F256-H390 HydrophobicContact CE1-CB 4.21Å; F256-H390 AromaticContact CE1-CD2 3.41Å; F256-H390 VanDerWaalsContact CE1-CD2 3.41Å; F256-H390 WeakPolarHBondContact CE1-CD2 3.41Å; F256-H390 AromaticContact CE1-CE1 3.88Å; F256-H390 AromaticContact CE1-CG 3.59Å; F256-H390 AromaticContact CE1-ND1 3.88Å; F256-H390 AromaticContact CE1-NE2 3.61Å; F256-H390 HydrophobicContact CG-CB 3.77Å; M300-H390 HydrophobicContact CE-CB 4.22Å; M300-H390 PolarHBondContact SD-ND1 2.96Å; H303-H390 AromaticContact ND1-ND1 3.23Å; H303-H390 PolarHBondContact ND1-ND1 2.99Å; E386-H390 WeakPolarHBondContact O-CB 3.23Å; E386-H390 PolarHBondContact O-N 3.29Å; Y387-H390 WeakPolarHBondContact O-CB 3.23Å; Y387-H390 PolarHBondContact O-N 2.98Å; L388-H390 VanDerWaalsContact C-N 3.34Å; L388-H390 PolarHBondContact O-N 3.32Å; H390-M393 PolarHBondContact O-N 3.32Å; H390-M394 WeakPolarHBondContact O-CG 3.11Å; H390-M394 PolarHBondContact O-N 2.73Å
391	M	94.9	Very high	90.8	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.8	-45.4	177.7	-172.1	61.7	178.5	0	0	112.2	L296 M300 L359 V360 Y387 L388 M393 M394 L395 I413	L296-M391 HydrophobicContact CD2-CE 3.88Å; L296-M391 HydrophobicContact CD2-SD 4.25Å; L296-M391 HydrophobicContact CG-SD 4.5Å; M300-M391 HydrophobicContact CE-CB 3.88Å; M300-M391 HydrophobicContact CE-SD 4.21Å; M300-M391 HydrophobicContact CG-SD 3.92Å; M300-M391 HydrophobicContact SD-SD 4.18Å; L359-M391 HydrophobicContact CB-CE 4.29Å; L359-M391 HydrophobicContact CB-CG 4.42Å; L359-M391 HydrophobicContact CD1-CB 4.2Å; L359-M391 HydrophobicContact CD1-CG 3.83Å; V360-M391 HydrophobicContact CG2-CE 3.47Å; V360-M391 VanDerWaalsContact CG2-CE 3.47Å; Y387-M391 PolarHBondContact O-N 2.66Å; L388-M391 PolarHBondContact O-N 3.29Å; M391-M393 VanDerWaalsContact C-N 3.34Å; M391-M393 PolarHBondContact O-N 3.24Å; M391-M394 PolarHBondContact O-N 3.28Å; M391-L395 HydrophobicContact CE-CD1 4.06Å; M391-L395 HydrophobicContact CE-CD2 4.03Å; M391-L395 HydrophobicContact CE-CG 4.02Å; M391-L395 HydrophobicContact CG-CD1 4.18Å; M391-L395 HydrophobicContact CG-CG 4.47Å; M391-L395 WeakPolarHBondContact O-CG 3.43Å; M391-L395 PolarHBondContact O-N 3.32Å; M391-I413 HydrophobicContact CB-CD1 4.08Å; M391-I413 HydrophobicContact CG-CD1 3.55Å
392	A	95.3	Very high	90.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.2	-44	177.1	0	0	0	0	0	111.4	Y260 L388 M394 L395 L396 H410 I413 L417	Y260-A392 HydrophobicContact CD2-CB 4.34Å; Y260-A392 HydrophobicContact CE1-CB 4.29Å; Y260-A392 HydrophobicContact CE2-CB 3.79Å; L388-A392 VanDerWaalsContact O-CB 3.31Å; L388-A392 WeakPolarHBondContact O-CB 3.47Å; L388-A392 PolarHBondContact O-N 3.21Å; A392-M394 PolarHBondContact O-N 2.67Å; A392-L395 PolarHBondContact O-N 3.39Å; A392-L396 WeakPolarHBondContact O-CB 3.41Å; A392-L396 PolarHBondContact O-N 3.23Å; A392-H410 PolarHBondContact O-CD2 2.84Å; A392-H410 VanDerWaalsContact O-CD2 3.29Å; A392-I413 HydrophobicContact CB-CB 4.39Å; A392-I413 HydrophobicContact CB-CG2 3.86Å; A392-L417 HydrophobicContact CB-CD1 4.17Å
393	M	94.5	Very high	90.5	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-59	-46.7	175.8	-177.2	175.1	68.3	0	0	111.8	F256 Q259 Y260 Y263 V274 S389 H390 M391 L396 A397	F256-M393 HydrophobicContact CD1-CE 4.26Å; Q259-M393 HydrophobicContact CB-CE 4.49Å; Q259-M393 HydrophobicContact CB-SD 3.9Å; Q259-M393 HydrophobicContact CG-CE 4.21Å; Q259-M393 HydrophobicContact CG-SD 3.61Å; Q259-M393 VanDerWaalsContact OE1-CE 3.29Å; Y260-M393 HydrophobicContact CD2-CB 3.73Å; Y260-M393 HydrophobicContact CD2-CG 4.45Å; Y260-M393 HydrophobicContact CG-CB 4.38Å; Y263-M393 HydrophobicContact CD1-CG 4.35Å; Y263-M393 HydrophobicContact CG-CG 4.27Å; V274-M393 HydrophobicContact CG2-CE 4.3Å; V274-M393 HydrophobicContact CG2-CG 4.38Å; V274-M393 HydrophobicContact CG2-SD 3.87Å; S389-M393 VanDerWaalsContact O-CB 3.29Å; S389-M393 WeakPolarHBondContact O-CB 3.4Å; S389-M393 PolarHBondContact O-N 3.06Å; H390-M393 PolarHBondContact O-N 3.32Å; M391-M393 VanDerWaalsContact C-N 3.34Å; M391-M393 PolarHBondContact O-N 3.24Å; M393-L396 PolarHBondContact O-N 3.35Å; M393-A397 VanDerWaalsContact O-CB 3.31Å; M393-A397 WeakPolarHBondContact O-CB 3.43Å; M393-A397 PolarHBondContact O-N 3.13Å
394	M	92.8	Very high	90.2	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.015	12%	0.118	C	C	.	.	H	α-helix	trans	-64	-47.9	178.9	-70.3	-57.1	105.2	0	0	111.9	V274 L278 L296 L299 M300 H390 M391 A392 L396 A397 L398	V274-M394 HydrophobicContact CG1-CE 3.96Å; L278-M394 HydrophobicContact CD2-SD 4.21Å; L296-M394 HydrophobicContact CD1-CB 3.45Å; L296-M394 VanDerWaalsContact CD1-CB 3.45Å; L296-M394 HydrophobicContact CD1-CG 3.79Å; L299-M394 HydrophobicContact CD2-CG 4.33Å; L299-M394 HydrophobicContact CD2-SD 3.78Å; M300-M394 HydrophobicContact SD-CG 4.5Å; H390-M394 WeakPolarHBondContact O-CG 3.11Å; H390-M394 PolarHBondContact O-N 2.73Å; M391-M394 PolarHBondContact O-N 3.28Å; A392-M394 PolarHBondContact O-N 2.67Å; M394-L396 VanDerWaalsContact C-N 3.34Å; M394-L396 PolarHBondContact O-N 3.41Å; M394-A397 CarbonylContact O-C 3.56Å; M394-A397 WeakPolarHBondContact O-CA 3.33Å; M394-A397 WeakPolarHBondContact O-CB 3.32Å; M394-A397 PolarHBondContact O-N 3.37Å; M394-L398 WeakPolarHBondContact O-CG 3.49Å; M394-L398 PolarHBondContact O-N 3.09Å
395	L	92.5	Very high	90	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59	-44.4	177.2	-70.6	174.1	0	0	0	111.8	L296 M391 A392 A397 L398 E399 I405 L409 H410 I413	L296-L395 HydrophobicContact CD2-CD2 4.03Å; M391-L395 HydrophobicContact CE-CD1 4.06Å; M391-L395 HydrophobicContact CE-CD2 4.03Å; M391-L395 HydrophobicContact CE-CG 4.02Å; M391-L395 HydrophobicContact CG-CD1 4.18Å; M391-L395 HydrophobicContact CG-CG 4.47Å; M391-L395 WeakPolarHBondContact O-CG 3.43Å; M391-L395 PolarHBondContact O-N 3.32Å; A392-L395 PolarHBondContact O-N 3.39Å; L395-A397 PolarHBondContact O-N 3.29Å; L395-L398 HydrophobicContact CD2-CD1 4.47Å; L395-L398 WeakPolarHBondContact O-CB 3.14Å; L395-L398 PolarHBondContact O-N 2.79Å; L395-E399 PolarHBondContact O-N 3.12Å; L395-E399 VanDerWaalsContact O-N 3.11Å; L395-I405 HydrophobicContact CB-CD1 4.45Å; L395-I405 HydrophobicContact CD2-CD1 4.32Å; L395-I405 VanDerWaalsContact O-CD1 3.23Å; L395-I405 WeakPolarHBondContact O-CD1 3.39Å; L395-L409 HydrophobicContact CD1-CB 3.93Å; L395-L409 HydrophobicContact CD2-CB 4.47Å; L395-L409 HydrophobicContact CD2-CD1 4.47Å; L395-H410 HydrophobicContact CB-CB 4.34Å; L395-I413 HydrophobicContact CD1-CD1 3.66Å
396	L	91.4	Very high	89.9	Confident	14 Å²	14	26.9 Å²	26.9	7%	0.073	12%	0.122	C	C	.	.	H	α-helix	trans	-62.4	-35.4	175.6	-172.8	58.2	0	0	0	111.9	Y260 Y263 M264 A392 M393 M394 E399 R400	Y260-L396 HydrophobicContact CE2-CD2 4.23Å; Y263-L396 HydrophobicContact CD1-CD2 3.97Å; Y263-L396 HydrophobicContact CD1-CG 4.31Å; Y263-L396 HydrophobicContact CE1-CB 4.28Å; Y263-L396 HydrophobicContact CE1-CD2 4.14Å; Y263-L396 HydrophobicContact CE1-CG 3.99Å; M264-L396 HydrophobicContact CG-CD2 4.08Å; A392-L396 WeakPolarHBondContact O-CB 3.41Å; A392-L396 PolarHBondContact O-N 3.23Å; M393-L396 PolarHBondContact O-N 3.35Å; M394-L396 VanDerWaalsContact C-N 3.34Å; M394-L396 PolarHBondContact O-N 3.41Å; L396-E399 PolarHBondContact O-N 3.15Å; L396-R400 WeakPolarHBondContact O-CG 3.47Å; L396-R400 PolarHBondContact O-N 3.26Å
397	A	89.9	Confident	89.8	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-71.2	-35.9	177.6	0	0	0	0	0	112.7	Y263 V274 L278 M393 M394 L395 R400 N401	Y263-A397 HydrophobicContact CE1-CB 4.01Å; Y263-A397 HydrophobicContact CE2-CB 4.47Å; Y263-A397 VanDerWaalsContact OH-CA 3.28Å; Y263-A397 WeakPolarHBondContact OH-CA 3.44Å; Y263-A397 WeakPolarHBondContact OH-CB 3.37Å; V274-A397 HydrophobicContact CG1-CB 3.62Å; L278-A397 HydrophobicContact CD1-CB 3.81Å; M393-A397 VanDerWaalsContact O-CB 3.31Å; M393-A397 WeakPolarHBondContact O-CB 3.43Å; M393-A397 PolarHBondContact O-N 3.13Å; M394-A397 CarbonylContact O-C 3.56Å; M394-A397 WeakPolarHBondContact O-CA 3.33Å; M394-A397 WeakPolarHBondContact O-CB 3.32Å; M394-A397 PolarHBondContact O-N 3.37Å; L395-A397 PolarHBondContact O-N 3.29Å; A397-R400 PolarHBondContact O-N 3.19Å; A397-N401 WeakPolarHBondContact O-CB 3.29Å; A397-N401 PolarHBondContact O-N 2.77Å; A397-N401 PolarHBondContact O-ND2 2.92Å
398	L	88.9	Confident	89.7	Confident	0 Å²	0	27 Å²	27	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.8	-47.5	171	-62.2	-173	0	0	0	111	L278 I283 I293 L296 M394 L395 R400 N401 K402 I403 I405	L278-L398 HydrophobicContact CD2-CD2 4.16Å; I283-L398 HydrophobicContact CG2-CD2 3.23Å; I293-L398 HydrophobicContact CD1-CD1 3.73Å; L296-L398 HydrophobicContact CD2-CD1 3.93Å; M394-L398 WeakPolarHBondContact O-CG 3.49Å; M394-L398 PolarHBondContact O-N 3.09Å; L395-L398 HydrophobicContact CD2-CD1 4.47Å; L395-L398 WeakPolarHBondContact O-CB 3.14Å; L395-L398 PolarHBondContact O-N 2.79Å; L398-R400 PolarHBondContact O-N 2.94Å; L398-N401 CarbonylContact O-C 3.57Å; L398-N401 PolarHBondContact O-N 3.01Å; L398-K402 PolarHBondContact O-N 3.14Å; L398-I403 HydrophobicContact CB-CB 4.23Å; L398-I403 HydrophobicContact CB-CD1 4.44Å; L398-I403 HydrophobicContact CD2-CD1 3.67Å; L398-I403 WeakPolarHBondContact O-CB 3.02Å; L398-I403 PolarHBondContact O-N 3.01Å; L398-I405 HydrophobicContact CB-CD1 3.88Å; L398-I405 HydrophobicContact CB-CG1 4.47Å; L398-I405 HydrophobicContact CD1-CD1 4.5Å; L398-I405 HydrophobicContact CD1-CG2 4.28Å
399	E	86.6	Confident	89.6	Confident	54 Å²	54	27.4 Å²	27.4	25%	0.252	12%	0.123	S	C	.	.	H	α-helix	trans	-60.4	-47.5	179.4	-171.2	-174.8	-175	0	0	111.5	L395 L396 N401 K402 I405 K717	L395-E399 PolarHBondContact O-N 3.12Å; L395-E399 VanDerWaalsContact O-N 3.11Å; L396-E399 PolarHBondContact O-N 3.15Å; E399-N401 VanDerWaalsContact C-N 3.27Å; E399-N401 PolarHBondContact O-N 3.38Å; E399-K402 PolarHBondContact O-N 3Å; E399-I405 HydrophobicContact CB-CD1 4.23Å; E399-I405 HydrophobicContact CB-CG1 4.35Å; E399-K717 WeakPolarHBondContact OE1-CE 3.34Å; E399-K717 IonicContact OE1-NZ 3.57Å; E399-K717 PolarHBondContact OE1-NZ 3.47Å; E399-K717 IonicContact OE2-NZ 3.47Å; E399-K717 PolarHBondContact OE2-NZ 3.37Å
400	R	87.2	Confident	89.6	Confident	85 Å²	85	27.5 Å²	27.5	32%	0.321	12%	0.124	S	C	.	.	H	α-helix	trans	-65.1	-28.6	179.3	-73.7	176	177.2	-172.1	0.9	113.3	Y263 M264 L396 A397 L398 K402	Y263-R400 VanDerWaalsContact CE1-NH1 3.32Å; Y263-R400 PolarHBondContact O-NH1 2.88Å; Y263-R400 PolarHBondContact O-NH2 3.48Å; Y263-R400 WeakPolarHBondContact OH-CD 3.33Å; M264-R400 PolarHBondContact O-NH2 3.36Å; L396-R400 WeakPolarHBondContact O-CG 3.47Å; L396-R400 PolarHBondContact O-N 3.26Å; A397-R400 PolarHBondContact O-N 3.19Å; L398-R400 PolarHBondContact O-N 2.94Å; R400-K402 PolarHBondContact O-N 3.21Å
401	N	84.2	Confident	89.6	Confident	56 Å²	56	27 Å²	27	30%	0.299	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	15.2	173.5	-74.5	-67.6	0	0	0	113.4	L278 C285 A397 L398 E399 I403	L278-N401 WeakPolarHBondContact CD1-ND2 3.44Å; C285-N401 WeakPolarHBondContact CB-O 3.33Å; A397-N401 WeakPolarHBondContact O-CB 3.29Å; A397-N401 PolarHBondContact O-N 2.77Å; A397-N401 PolarHBondContact O-ND2 2.92Å; L398-N401 CarbonylContact O-C 3.57Å; L398-N401 PolarHBondContact O-N 3.01Å; E399-N401 VanDerWaalsContact C-N 3.27Å; E399-N401 PolarHBondContact O-N 3.38Å; N401-I403 PolarHBondContact O-N 2.92Å
402	K	81.7	Confident	89.5	Confident	186 Å²	186	27 Å²	27	81%	0.809	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.8	24.5	177.8	-54.4	-177.7	178.2	-179.6	0	113.9	L398 E399 R400	L398-K402 PolarHBondContact O-N 3.14Å; E399-K402 PolarHBondContact O-N 3Å; R400-K402 PolarHBondContact O-N 3.21Å
403	I	83	Confident	89.5	Confident	7 Å²	7	27 Å²	27	4%	0.036	12%	0.121	C	C	.	.			trans	-78	129.3	169.2	-60.8	171.2	0	0	0	107.3	I283 L398 N401 I405 P1024	I283-I403 HydrophobicContact CG2-CD1 3.72Å; L398-I403 HydrophobicContact CB-CB 4.23Å; L398-I403 HydrophobicContact CB-CD1 4.44Å; L398-I403 HydrophobicContact CD2-CD1 3.67Å; L398-I403 WeakPolarHBondContact O-CB 3.02Å; L398-I403 PolarHBondContact O-N 3.01Å; N401-I403 PolarHBondContact O-N 2.92Å; I403-I405 HydrophobicContact CG2-CG2 4.28Å; I403-I405 PolarHBondContact O-N 3.08Å; I403-P1024 HydrophobicContact CG2-CG 4.08Å
404	K	82.5	Confident	89.5	Confident	95 Å²	95	28.6 Å²	28.6	41%	0.413	13%	0.128	S	C	.	.			trans	-73	99.4	-174.8	-174.2	172.6	178.7	173.4	0	110.6	T1020 R1021 P1024	K404-T1020 PolarHBondContact NZ-O 3.07Å; K404-R1021 WeakPolarHBondContact CE-O 3.31Å; K404-P1024 WeakPolarHBondContact O-CD 3.46Å
405	I	86.3	Confident	89.5	Confident	15 Å²	15	28.6 Å²	28.6	8%	0.077	13%	0.128	C	C	.	.			trans	-131.7	156.4	174.4	60.1	160.5	0	0	0	110.2	I293 L395 L398 E399 I403 Y407	I293-I405 HydrophobicContact CD1-CG2 4.02Å; L395-I405 HydrophobicContact CB-CD1 4.45Å; L395-I405 HydrophobicContact CD2-CD1 4.32Å; L395-I405 VanDerWaalsContact O-CD1 3.23Å; L395-I405 WeakPolarHBondContact O-CD1 3.39Å; L398-I405 HydrophobicContact CB-CD1 3.88Å; L398-I405 HydrophobicContact CB-CG1 4.47Å; L398-I405 HydrophobicContact CD1-CD1 4.5Å; L398-I405 HydrophobicContact CD1-CG2 4.28Å; E399-I405 HydrophobicContact CB-CD1 4.23Å; E399-I405 HydrophobicContact CB-CG1 4.35Å; I403-I405 HydrophobicContact CG2-CG2 4.28Å; I403-I405 PolarHBondContact O-N 3.08Å; I405-Y407 PolarHBondContact O-N 3.28Å
406	S	88	Confident	89.4	Confident	10 Å²	10	28.8 Å²	28.8	7%	0.07	13%	0.128	C	C	.	.			trans	-68.8	129.6	172.3	178.3	0	0	0	0	110	R408 L409 G958 E959	S406-R408 PolarHBondContact O-N 3.33Å; S406-R408 VanDerWaalsContact OG-CB 3.28Å; S406-R408 WeakPolarHBondContact OG-CB 3.26Å; S406-R408 PolarHBondContact OG-N 3.39Å; S406-R408 VanDerWaalsContact OG-N 3.14Å; S406-L409 PolarHBondContact O-N 3.09Å; S406-G958 WeakPolarHBondContact CB-O 3.36Å; S406-E959 PolarHBondContact OG-OE2 3.48Å
407	Y	89.1	Confident	89.4	Confident	8 Å²	8	28.3 Å²	28.3	3%	0.031	13%	0.126	C	C	.	.	H	α-helix	trans	-56.8	-29.1	170.8	169.5	-129.9	0	0	0	112.2	I405 L409 H410 Y411 F710 K717 A957	I405-Y407 PolarHBondContact O-N 3.28Å; Y407-L409 PolarHBondContact O-N 3.08Å; Y407-H410 PolarHBondContact O-N 3.38Å; Y407-Y411 PolarHBondContact O-N 3.28Å; Y407-Y411 VanDerWaalsContact O-N 3.07Å; Y407-F710 AromaticContact CD1-CE2 3.94Å; Y407-F710 HydrophobicContact CD1-CE2 3.94Å; Y407-F710 HydrophobicContact CE1-CE2 4.31Å; Y407-K717 HydrophobicContact CD1-CD 3.84Å; Y407-K717 HydrophobicContact CD2-CD 3.76Å; Y407-K717 HydrophobicContact CE1-CB 4.45Å; Y407-K717 HydrophobicContact CE1-CD 3.65Å; Y407-K717 HydrophobicContact CE2-CD 3.55Å; Y407-K717 HydrophobicContact CG-CD 3.88Å; Y407-K717 VanDerWaalsContact CZ-CD 3.48Å; Y407-A957 WeakPolarHBondContact CB-O 3.41Å; Y407-A957 PolarHBondContact N-O 3.43Å
408	R	91.8	Very high	89.3	Confident	13 Å²	13	29 Å²	29	5%	0.049	13%	0.129	C	C	.	.	H	α-helix	trans	-57.7	-32.7	-179	-165.4	169.9	171.8	109.9	-4.2	113.1	E363 S406 Y411 N412 E707 F710 E959	E363-R408 PolarHBondContact O-NE 3.23Å; E363-R408 PolarHBondContact O-NH2 3.48Å; S406-R408 PolarHBondContact O-N 3.33Å; S406-R408 VanDerWaalsContact OG-CB 3.28Å; S406-R408 WeakPolarHBondContact OG-CB 3.26Å; S406-R408 PolarHBondContact OG-N 3.39Å; S406-R408 VanDerWaalsContact OG-N 3.14Å; R408-Y411 PolarHBondContact O-N 3.47Å; R408-N412 WeakPolarHBondContact O-CB 3.48Å; R408-N412 PolarHBondContact O-N 2.77Å; R408-N412 PolarHBondContact O-OD1 2.85Å; R408-E707 IonicContact CZ-OE1 3.77Å; R408-E707 IonicContact CZ-OE2 2.64Å; R408-E707 VanDerWaalsContact CZ-OE2 3.27Å; R408-E707 IonicContact NH1-OE2 3.73Å; R408-E707 PolarHBondContact NH1-OE2 2.91Å; R408-E707 IonicContact NH2-OE1 2.74Å; R408-E707 PolarHBondContact NH2-OE1 3.48Å; R408-E707 IonicContact NH2-OE2 2.77Å; R408-E707 PolarHBondContact NH2-OE2 3.42Å; R408-F710 HydrophobicContact CB-CD2 4.48Å; R408-F710 HydrophobicContact CB-CE1 4.47Å; R408-F710 HydrophobicContact CB-CE2 3.62Å; R408-F710 HydrophobicContact CB-CZ 3.61Å; R408-F710 HydrophobicContact CG-CD2 4.19Å; R408-F710 HydrophobicContact CG-CE1 4.33Å; R408-F710 HydrophobicContact CG-CE2 3.78Å; R408-F710 HydrophobicContact CG-CZ 3.86Å; R408-F710 VanDerWaalsContact NH1-CD1 3.31Å; R408-E959 VanDerWaalsContact CB-OE2 3.24Å; R408-E959 WeakPolarHBondContact CB-OE2 3.49Å; R408-E959 VanDerWaalsContact CD-CD 3.45Å; R408-E959 WeakPolarHBondContact CD-OE2 3.39Å
409	L	92.6	Very high	89.2	Confident	12 Å²	12	29.4 Å²	29.4	6%	0.063	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-48.3	179.6	-58.4	-179.9	0	0	0	111.8	V360 L395 S406 Y407 I413	V360-L409 WeakPolarHBondContact O-CD2 3.31Å; L395-L409 HydrophobicContact CD1-CB 3.93Å; L395-L409 HydrophobicContact CD2-CB 4.47Å; L395-L409 HydrophobicContact CD2-CD1 4.47Å; S406-L409 PolarHBondContact O-N 3.09Å; Y407-L409 PolarHBondContact O-N 3.08Å; L409-I413 PolarHBondContact O-N 3.12Å
410	H	93.8	Very high	89.1	Confident	5 Å²	5	29.1 Å²	29.1	2%	0.023	13%	0.131	C	C	.	.	H	α-helix	trans	-66.4	-42.7	175.1	173.7	-92.2	0	0	0	111.2	Y260 A392 L395 Y407 N412 I413 Y414	Y260-H410 AromaticContact CE2-NE2 3.71Å; Y260-H410 AromaticContact CZ-NE2 3.67Å; Y260-H410 PolarHBondContact OH-CE1 3.49Å; Y260-H410 PolarHBondContact OH-NE2 3Å; A392-H410 PolarHBondContact O-CD2 2.84Å; A392-H410 VanDerWaalsContact O-CD2 3.29Å; L395-H410 HydrophobicContact CB-CB 4.34Å; Y407-H410 PolarHBondContact O-N 3.38Å; H410-N412 PolarHBondContact O-N 3.1Å; H410-I413 PolarHBondContact O-N 3.34Å; H410-Y414 VanDerWaalsContact O-CB 3.32Å; H410-Y414 WeakPolarHBondContact O-CB 3.49Å; H410-Y414 PolarHBondContact O-N 2.6Å
411	Y	94.2	Very high	88.7	Confident	1 Å²	1	27.4 Å²	27.4	0%	0.004	13%	0.126	C	C	.	.	H	α-helix	trans	-58.4	-45.7	179.4	177.2	-89.8	0	0	0	112.2	V365 Y407 R408 I413 Y414 Y415 A706 A709 F710 A713 I725 L726	V365-Y411 HydrophobicContact CG2-CE1 4.31Å; Y407-Y411 PolarHBondContact O-N 3.28Å; Y407-Y411 VanDerWaalsContact O-N 3.07Å; R408-Y411 PolarHBondContact O-N 3.47Å; Y411-I413 PolarHBondContact O-N 3.28Å; Y411-Y414 PolarHBondContact O-N 2.99Å; Y411-Y415 AromaticContact CE1-CD2 3.93Å; Y411-Y415 HydrophobicContact CE1-CD2 3.93Å; Y411-Y415 AromaticContact CZ-CD2 3.83Å; Y411-Y415 WeakPolarHBondContact O-CB 3.23Å; Y411-Y415 PolarHBondContact O-N 3.18Å; Y411-A706 PolarHBondContact OH-O 3.17Å; Y411-A709 VanDerWaalsContact OH-CB 3.22Å; Y411-A709 WeakPolarHBondContact OH-CB 3.4Å; Y411-F710 HydrophobicContact CD1-CB 4.16Å; Y411-F710 AromaticContact CD1-CD2 3.58Å; Y411-F710 HydrophobicContact CD1-CD2 3.58Å; Y411-F710 HydrophobicContact CD1-CE2 4.48Å; Y411-F710 HydrophobicContact CD1-CG 4.28Å; Y411-F710 HydrophobicContact CD2-CD2 4.2Å; Y411-F710 HydrophobicContact CE1-CB 3.65Å; Y411-F710 AromaticContact CE1-CD2 3.96Å; Y411-F710 HydrophobicContact CE1-CD2 3.96Å; Y411-F710 HydrophobicContact CE1-CG 4.26Å; Y411-F710 AromaticContact CG-CD2 3.71Å; Y411-F710 HydrophobicContact CG-CD2 3.71Å; Y411-F710 HydrophobicContact CG-CE2 4.36Å; Y411-F710 PolarHBondContact OH-N 3.32Å; Y411-A713 HydrophobicContact CD2-CB 4.32Å; Y411-A713 HydrophobicContact CE2-CB 3.87Å; Y411-I725 HydrophobicContact CD2-CG2 3.56Å; Y411-I725 HydrophobicContact CE2-CG2 3.53Å; Y411-L726 WeakPolarHBondContact CE2-O 3.37Å; Y411-L726 PolarHBondContact OH-O 2.89Å
412	N	93.9	Very high	88.2	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-60.1	-45.5	-178.9	-70.6	-11.3	0	0	0	111.8	V365 V368 R408 H410 Y415 V416	V365-N412 HydrophobicContact CG2-CB 4.49Å; V368-N412 HydrophobicContact CG2-CB 3.95Å; R408-N412 WeakPolarHBondContact O-CB 3.48Å; R408-N412 PolarHBondContact O-N 2.77Å; R408-N412 PolarHBondContact O-OD1 2.85Å; H410-N412 PolarHBondContact O-N 3.1Å; N412-Y415 PolarHBondContact O-N 3.19Å; N412-V416 PolarHBondContact O-N 3.27Å
413	I	94.9	Very high	87.2	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-69.1	-44.7	179	-58	177.8	0	0	0	110.8	L359 L388 M391 A392 L395 L409 H410 Y411 Y415 V416 L417	L359-I413 HydrophobicContact CB-CD1 4.22Å; L359-I413 HydrophobicContact CD1-CD1 4.16Å; L359-I413 HydrophobicContact CD2-CD1 4.26Å; L359-I413 HydrophobicContact CD2-CG1 4.19Å; L359-I413 HydrophobicContact CG-CD1 4.45Å; L388-I413 HydrophobicContact CB-CG2 3.91Å; L388-I413 HydrophobicContact CD2-CG2 4.12Å; L388-I413 HydrophobicContact CG-CG2 4.49Å; L388-I413 WeakPolarHBondContact O-CG2 3.48Å; M391-I413 HydrophobicContact CB-CD1 4.08Å; M391-I413 HydrophobicContact CG-CD1 3.55Å; A392-I413 HydrophobicContact CB-CB 4.39Å; A392-I413 HydrophobicContact CB-CG2 3.86Å; L395-I413 HydrophobicContact CD1-CD1 3.66Å; L409-I413 PolarHBondContact O-N 3.12Å; H410-I413 PolarHBondContact O-N 3.34Å; Y411-I413 PolarHBondContact O-N 3.28Å; I413-Y415 VanDerWaalsContact C-N 3.28Å; I413-Y415 PolarHBondContact O-N 3.36Å; I413-V416 PolarHBondContact O-N 2.88Å; I413-L417 HydrophobicContact CG2-CD1 3.97Å; I413-L417 HydrophobicContact CG2-CG 4.28Å; I413-L417 WeakPolarHBondContact O-CB 3.34Å; I413-L417 WeakPolarHBondContact O-CG 3.46Å; I413-L417 PolarHBondContact O-N 3.42Å
414	Y	93.6	Very high	85.5	Confident	35 Å²	35	22.6 Å²	22.6	14%	0.137	12%	0.121	C	C	.	.	H	α-helix	trans	-56.9	-43.5	176.1	174.4	-90.5	0	0	0	111.5	Y260 M264 H410 Y411 V416 L417 Y418 I725 V727	Y260-Y414 WeakPolarHBondContact OH-CD2 3.43Å; M264-Y414 HydrophobicContact CE-CE2 4.49Å; M264-Y414 HydrophobicContact SD-CD2 4.43Å; M264-Y414 HydrophobicContact SD-CE2 4.17Å; H410-Y414 VanDerWaalsContact O-CB 3.32Å; H410-Y414 WeakPolarHBondContact O-CB 3.49Å; H410-Y414 PolarHBondContact O-N 2.6Å; Y411-Y414 PolarHBondContact O-N 2.99Å; Y414-V416 PolarHBondContact O-N 3.19Å; Y414-L417 PolarHBondContact O-N 3.23Å; Y414-Y418 VanDerWaalsContact O-CB 3.29Å; Y414-Y418 WeakPolarHBondContact O-CB 3.42Å; Y414-Y418 PolarHBondContact O-N 3.48Å; Y414-I725 HydrophobicContact CD1-CB 4.07Å; Y414-I725 HydrophobicContact CD1-CD1 3.77Å; Y414-I725 HydrophobicContact CD1-CG2 3.89Å; Y414-I725 HydrophobicContact CD2-CD1 4.14Å; Y414-I725 HydrophobicContact CE1-CB 3.67Å; Y414-I725 HydrophobicContact CE1-CD1 4.01Å; Y414-I725 HydrophobicContact CE1-CG1 4.35Å; Y414-I725 HydrophobicContact CE1-CG2 3.87Å; Y414-I725 HydrophobicContact CE2-CD1 4.33Å; Y414-I725 HydrophobicContact CG-CD1 3.84Å; Y414-V727 HydrophobicContact CD1-CG2 4.49Å; Y414-V727 HydrophobicContact CE1-CG2 3.83Å
415	Y	92.4	Very high	83.7	Confident	4 Å²	4	21 Å²	21	2%	0.016	11%	0.114	C	C	.	.	H	α-helix	trans	-59.6	-47.9	178.8	-165.1	-71.1	0	0	0	111.4	V365 Y411 N412 I413 Y418 L419 A706 V727 G728 G729	V365-Y415 HydrophobicContact CB-CD1 4.41Å; V365-Y415 HydrophobicContact CG1-CD1 3.41Å; V365-Y415 VanDerWaalsContact CG1-CD1 3.41Å; V365-Y415 HydrophobicContact CG1-CE1 3.89Å; V365-Y415 HydrophobicContact CG1-CG 3.94Å; V365-Y415 HydrophobicContact CG2-CD1 4.12Å; V365-Y415 HydrophobicContact CG2-CD2 4.11Å; V365-Y415 HydrophobicContact CG2-CG 3.8Å; Y411-Y415 AromaticContact CE1-CD2 3.93Å; Y411-Y415 HydrophobicContact CE1-CD2 3.93Å; Y411-Y415 AromaticContact CZ-CD2 3.83Å; Y411-Y415 WeakPolarHBondContact O-CB 3.23Å; Y411-Y415 PolarHBondContact O-N 3.18Å; N412-Y415 PolarHBondContact O-N 3.19Å; I413-Y415 VanDerWaalsContact C-N 3.28Å; I413-Y415 PolarHBondContact O-N 3.36Å; Y415-Y418 WeakPolarHBondContact O-CB 3.49Å; Y415-Y418 PolarHBondContact O-N 3.46Å; Y415-L419 HydrophobicContact CD1-CD1 3.81Å; Y415-L419 HydrophobicContact CD1-CG 3.96Å; Y415-L419 HydrophobicContact CE1-CD1 3.57Å; Y415-L419 HydrophobicContact CE1-CD2 4.32Å; Y415-L419 HydrophobicContact CE1-CG 3.91Å; Y415-L419 WeakPolarHBondContact O-CG 3.07Å; Y415-L419 PolarHBondContact O-N 3.05Å; Y415-A706 HydrophobicContact CD2-CB 4.32Å; Y415-A706 HydrophobicContact CE1-CB 4.27Å; Y415-A706 HydrophobicContact CE2-CB 3.67Å; Y415-A706 PolarHBondContact OH-N 3.07Å; Y415-V727 HydrophobicContact CD1-CG1 4.38Å; Y415-V727 HydrophobicContact CD2-CG1 3.69Å; Y415-V727 HydrophobicContact CE1-CG1 4.25Å; Y415-V727 HydrophobicContact CE2-CB 4.42Å; Y415-V727 HydrophobicContact CE2-CG1 3.55Å; Y415-V727 HydrophobicContact CG-CG1 4.12Å; Y415-G728 VanDerWaalsContact OH-CA 3.27Å; Y415-G728 WeakPolarHBondContact OH-CA 3.33Å; Y415-G728 PolarHBondContact OH-N 3.1Å; Y415-G728 PolarHBondContact OH-O 2.89Å; Y415-G729 PolarHBondContact OH-O 3.38Å
416	V	91.4	Very high	81.3	Confident	3 Å²	3	24.2 Å²	24.2	2%	0.018	14%	0.137	C	C	.	.	H	α-helix	trans	-67.1	-43.1	178.6	177.2	0	0	0	0	111.4	V365 V368 Q369 V372 L388 N412 I413 Y414 Y418 L419 L420	V365-V416 HydrophobicContact CG1-CG2 3.81Å; V368-V416 HydrophobicContact CB-CB 4.49Å; V368-V416 HydrophobicContact CB-CG2 3.71Å; V368-V416 HydrophobicContact CG1-CB 3.86Å; V368-V416 HydrophobicContact CG1-CG1 4.15Å; V368-V416 HydrophobicContact CG1-CG2 3.64Å; Q369-V416 HydrophobicContact CG-CG2 3.65Å; V372-V416 HydrophobicContact CG2-CG1 3.87Å; L388-V416 HydrophobicContact CD1-CG1 4.4Å; N412-V416 PolarHBondContact O-N 3.27Å; I413-V416 PolarHBondContact O-N 2.88Å; Y414-V416 PolarHBondContact O-N 3.19Å; V416-Y418 VanDerWaalsContact C-N 3.28Å; V416-Y418 PolarHBondContact O-N 3.3Å; V416-L419 PolarHBondContact O-N 3.41Å; V416-L419 VanDerWaalsContact O-N 3.14Å; V416-L420 HydrophobicContact CG1-CD1 4.08Å; V416-L420 HydrophobicContact CG1-CG 4.21Å; V416-L420 VanDerWaalsContact O-CG 3.3Å; V416-L420 WeakPolarHBondContact O-CG 3.27Å; V416-L420 PolarHBondContact O-N 2.86Å
417	L	90.9	Very high	78.6	Confident	5 Å²	5	30 Å²	30	3%	0.026	17%	0.173	C	C	.	.	H	α-helix	trans	-55.8	-45.5	173.4	-77.1	173	0	0	0	111.3	Y260 T385 L388 A392 I413 Y414 L419 L420 E421	Y260-L417 HydrophobicContact CE1-CD1 4.28Å; T385-L417 HydrophobicContact CG2-CD2 4.34Å; L388-L417 HydrophobicContact CB-CD1 4.28Å; L388-L417 HydrophobicContact CB-CD2 3.66Å; L388-L417 HydrophobicContact CB-CG 4.01Å; L388-L417 HydrophobicContact CD1-CD2 4.27Å; A392-L417 HydrophobicContact CB-CD1 4.17Å; I413-L417 HydrophobicContact CG2-CD1 3.97Å; I413-L417 HydrophobicContact CG2-CG 4.28Å; I413-L417 WeakPolarHBondContact O-CB 3.34Å; I413-L417 WeakPolarHBondContact O-CG 3.46Å; I413-L417 PolarHBondContact O-N 3.42Å; Y414-L417 PolarHBondContact O-N 3.23Å; L417-L419 VanDerWaalsContact C-N 3.34Å; L417-L419 PolarHBondContact O-N 3.13Å; L417-L420 PolarHBondContact O-N 3.08Å; L417-E421 VanDerWaalsContact O-CB 3.29Å; L417-E421 WeakPolarHBondContact O-CB 3.23Å; L417-E421 WeakPolarHBondContact O-CG 3.41Å; L417-E421 PolarHBondContact O-N 2.79Å
418	Y	88.9	Confident	75.7	Confident	13 Å²	13	35.6 Å²	35.6	5%	0.051	20%	0.203	C	C	.	.	H	α-helix	trans	-60.4	-42.2	176.8	-178.6	-84	0	0	0	111.9	Y414 Y415 V416 E421 N422 E442 Q700 V727	Y414-Y418 VanDerWaalsContact O-CB 3.29Å; Y414-Y418 WeakPolarHBondContact O-CB 3.42Å; Y414-Y418 PolarHBondContact O-N 3.48Å; Y415-Y418 WeakPolarHBondContact O-CB 3.49Å; Y415-Y418 PolarHBondContact O-N 3.46Å; V416-Y418 VanDerWaalsContact C-N 3.28Å; V416-Y418 PolarHBondContact O-N 3.3Å; Y418-E421 PolarHBondContact O-N 2.76Å; Y418-N422 VanDerWaalsContact CD2-ND2 3.33Å; Y418-N422 WeakPolarHBondContact CD2-ND2 3.18Å; Y418-N422 HydrophobicContact CE1-CB 4.41Å; Y418-N422 WeakPolarHBondContact CE2-ND2 3.32Å; Y418-N422 VanDerWaalsContact CZ-ND2 3.33Å; Y418-N422 WeakPolarHBondContact O-CB 3.45Å; Y418-N422 PolarHBondContact O-N 3.04Å; Y418-N422 PolarHBondContact O-ND2 3.32Å; Y418-E442 PolarHBondContact OH-OE2 3.45Å; Y418-Q700 HydrophobicContact CE1-CB 4.01Å; Y418-Q700 HydrophobicContact CE1-CG 4.31Å; Y418-V727 HydrophobicContact CD1-CB 4.34Å; Y418-V727 HydrophobicContact CD1-CG1 3.76Å; Y418-V727 HydrophobicContact CD1-CG2 4.24Å; Y418-V727 HydrophobicContact CD2-CG2 4.4Å; Y418-V727 HydrophobicContact CE1-CB 4.41Å; Y418-V727 HydrophobicContact CE1-CG1 4.11Å; Y418-V727 HydrophobicContact CG-CG1 4.4Å; Y418-V727 HydrophobicContact CG-CG2 4.18Å
419	L	85.7	Confident	72.7	Confident	10 Å²	10	40.2 Å²	40.2	5%	0.052	24%	0.237	C	C	.	.	H	α-helix	trans	-67.8	-38	176	-70.3	-174	0	0	0	113.1	Q369 Y415 V416 L417 E421 G423 M730	Q369-L419 VanDerWaalsContact NE2-CD1 3.29Å; Y415-L419 HydrophobicContact CD1-CD1 3.81Å; Y415-L419 HydrophobicContact CD1-CG 3.96Å; Y415-L419 HydrophobicContact CE1-CD1 3.57Å; Y415-L419 HydrophobicContact CE1-CD2 4.32Å; Y415-L419 HydrophobicContact CE1-CG 3.91Å; Y415-L419 WeakPolarHBondContact O-CG 3.07Å; Y415-L419 PolarHBondContact O-N 3.05Å; V416-L419 PolarHBondContact O-N 3.41Å; V416-L419 VanDerWaalsContact O-N 3.14Å; L417-L419 VanDerWaalsContact C-N 3.34Å; L417-L419 PolarHBondContact O-N 3.13Å; L419-E421 VanDerWaalsContact C-N 3.34Å; L419-G423 CarbonylContact O-C 3.45Å; L419-G423 WeakPolarHBondContact O-CA 3.42Å; L419-G423 PolarHBondContact O-N 2.97Å; L419-M730 HydrophobicContact CD1-CE 3.81Å; L419-M730 HydrophobicContact CD1-SD 3.94Å; L419-M730 HydrophobicContact CD2-CE 3.57Å; L419-M730 HydrophobicContact CD2-SD 4.26Å; L419-M730 HydrophobicContact CG-CE 4.16Å
420	L	84	Confident	69.8	Low	47 Å²	47	44.6 Å²	44.6	25%	0.246	26%	0.26	C	S	.	.	H	α-helix	trans	-67.4	-37.8	176.9	-67.6	177.5	0	0	0	111.6	V372 L381 T385 L388 V416 L417	V372-L420 HydrophobicContact CG1-CD1 4.19Å; V372-L420 HydrophobicContact CG1-CD2 4.16Å; V372-L420 HydrophobicContact CG2-CD1 4.46Å; L381-L420 HydrophobicContact CD1-CD1 4.01Å; L381-L420 HydrophobicContact CD1-CD2 3.86Å; L381-L420 HydrophobicContact CD1-CG 4.32Å; T385-L420 HydrophobicContact CG2-CB 4.28Å; T385-L420 HydrophobicContact CG2-CD1 3.9Å; L388-L420 HydrophobicContact CD1-CD1 4.37Å; V416-L420 HydrophobicContact CG1-CD1 4.08Å; V416-L420 HydrophobicContact CG1-CG 4.21Å; V416-L420 VanDerWaalsContact O-CG 3.3Å; V416-L420 WeakPolarHBondContact O-CG 3.27Å; V416-L420 PolarHBondContact O-N 2.86Å; L417-L420 PolarHBondContact O-N 3.08Å
421	E	79.8	Confident	67.2	Low	49 Å²	49	53.8 Å²	53.8	23%	0.229	30%	0.303	C	S	.	.	H	α-helix	trans	-76.1	-31	-179.9	-80.7	-171.7	164	0	0	113.7	P229 K257 L417 Y418 L419	P229-E421 HydrophobicContact CB-CB 4.25Å; P229-E421 HydrophobicContact CB-CG 4.28Å; P229-E421 HydrophobicContact CG-CB 3.69Å; P229-E421 HydrophobicContact CG-CG 4.07Å; K257-E421 WeakPolarHBondContact CE-OE1 3.35Å; K257-E421 IonicContact NZ-OE1 3.15Å; K257-E421 PolarHBondContact NZ-OE1 2.92Å; L417-E421 VanDerWaalsContact O-CB 3.29Å; L417-E421 WeakPolarHBondContact O-CB 3.23Å; L417-E421 WeakPolarHBondContact O-CG 3.41Å; L417-E421 PolarHBondContact O-N 2.79Å; Y418-E421 PolarHBondContact O-N 2.76Å; L419-E421 VanDerWaalsContact C-N 3.34Å
422	N	73.3	Confident	64.3	Low	24 Å²	24	60.4 Å²	60.4	13%	0.128	34%	0.339	C	S	.	.	H	α-helix	trans	-105.6	6	-178.8	-59.4	-66.2	0	0	0	113.3	Y418 R441	Y418-N422 VanDerWaalsContact CD2-ND2 3.33Å; Y418-N422 WeakPolarHBondContact CD2-ND2 3.18Å; Y418-N422 HydrophobicContact CE1-CB 4.41Å; Y418-N422 WeakPolarHBondContact CE2-ND2 3.32Å; Y418-N422 VanDerWaalsContact CZ-ND2 3.33Å; Y418-N422 WeakPolarHBondContact O-CB 3.45Å; Y418-N422 PolarHBondContact O-N 3.04Å; Y418-N422 PolarHBondContact O-ND2 3.32Å; N422-R441 PolarHBondContact OD1-NH1 2.95Å
423	G	61.3	Low	61.5	Low	24 Å²	24	63.8 Å²	63.8	25%	0.247	37%	0.374	C	S	.	.			trans	77.3	149	174.2	0	0	0	0	0	114.9	L419 F425	L419-G423 CarbonylContact O-C 3.45Å; L419-G423 WeakPolarHBondContact O-CA 3.42Å; L419-G423 PolarHBondContact O-N 2.97Å; G423-F425 PolarHBondContact O-N 2.96Å
424	P	46.6	Very low	58.5	Low	101 Å²	101	70.4 Å²	70.4	66%	0.656	41%	0.408	S	S	*	.			trans	-71.4	119.8	162.6	29	-28.9	0	0	0	109	C426	P424-C426 VanDerWaalsContact C-N 3.31Å; P424-C426 PolarHBondContact O-N 3.22Å
425	F	45.3	Very low	55.9	Low	60 Å²	60	74.2 Å²	74.2	26%	0.263	44%	0.437	S	S	.	.			trans	-69.9	87.4	170.5	-53.8	-85.8	0	0	0	108.8	G423 T427 H438 T440	G423-F425 PolarHBondContact O-N 2.96Å; F425-T427 PolarHBondContact O-N 3.36Å; F425-H438 HydrophobicContact CD1-CB 3.95Å; F425-T440 HydrophobicContact CE1-CG2 4.36Å; F425-T440 HydrophobicContact CZ-CG2 3.82Å
426	C	34.6	Very low	53.6	Low	83 Å²	83	79.7 Å²	79.7	56%	0.561	46%	0.463	S	S	*	.			trans	-72.6	122	166.2	-76.5	0	0	0	0	108.7	P424 N428	P424-C426 VanDerWaalsContact C-N 3.31Å; P424-C426 PolarHBondContact O-N 3.22Å; C426-N428 PolarHBondContact O-N 3.23Å
427	T	31.4	Very low	52.1	Low	133 Å²	133	83.7 Å²	83.7	82%	0.816	48%	0.483	S	S	*	.			trans	-71.7	78.7	166.5	50	0	0	0	0	108.8	F425 S429	F425-T427 PolarHBondContact O-N 3.36Å; T427-S429 PolarHBondContact O-N 2.77Å
428	N	29	Very low	50.9	Low	125 Å²	125	87.2 Å²	87.2	67%	0.668	50%	0.5	S	S	*	.			trans	-80.7	111.1	163.9	-74.7	0.2	0	0	0	106.9	C426 N430	C426-N428 PolarHBondContact O-N 3.23Å; N428-N430 PolarHBondContact O-N 2.93Å
429	S	28.8	Very low	50.3	Low	109 Å²	109	88.9 Å²	88.9	76%	0.762	51%	0.509	S	S	*	.			trans	-62.6	118.6	162.6	46.2	0	0	0	0	107.5	T427	T427-S429 PolarHBondContact O-N 2.77Å
430	N	32.5	Very low	50.2	Low	104 Å²	104	88.5 Å²	88.5	56%	0.556	51%	0.507	S	S	*	.			trans	-64.8	155.7	159.5	-86.4	-16.8	0	0	0	108.4	N428 N432 G433	N428-N430 PolarHBondContact O-N 2.93Å; N430-N432 PolarHBondContact O-N 3.18Å; N430-G433 PolarHBondContact O-N 3.06Å
431	Q	38.2	Very low	50.1	Low	199 Å²	199	89.5 Å²	89.5	93%	0.93	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	1.5	178.5	-66.3	174.8	-11.5	0	0	115.4
432	N	33	Very low	50.5	Low	140 Å²	140	88.5 Å²	88.5	75%	0.749	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	6.7	-178.5	-72	-1.3	0	0	0	115.1	N430 L434	N430-N432 PolarHBondContact O-N 3.18Å; N432-L434 PolarHBondContact O-N 3.3Å
433	G	35.2	Very low	51.3	Low	71 Å²	71	87.6 Å²	87.6	73%	0.732	50%	0.498	S	S	*	.			trans	65.6	-0.6	171.3	0	0	0	0	0	116.9	N430	N430-G433 PolarHBondContact O-N 3.06Å
434	L	33.4	Very low	52.6	Low	139 Å²	139	91 Å²	91	73%	0.728	51%	0.508	S	S	*	.			trans	-85.4	122	174	-83.2	152.1	0	0	0	110	N432 Q436	N432-L434 PolarHBondContact O-N 3.3Å; L434-Q436 PolarHBondContact O-N 2.93Å; L434-Q436 VanDerWaalsContact O-N 3.11Å
435	P	37.3	Very low	54.5	Low	115 Å²	115	89.2 Å²	89.2	75%	0.747	49%	0.49	S	S	*	.			trans	-65.1	114.3	177.4	24	-30.7	0	0	0	110	I437	P435-I437 PolarHBondContact O-N 2.88Å; P435-I437 VanDerWaalsContact O-N 3.17Å
436	Q	45.3	Very low	56.7	Low	120 Å²	120	86.5 Å²	86.5	56%	0.561	48%	0.479	S	S	*	.			trans	-73	109.3	172.8	-160.2	173.9	10.3	0	0	108.1	L434 H438	L434-Q436 PolarHBondContact O-N 2.93Å; L434-Q436 VanDerWaalsContact O-N 3.11Å; Q436-H438 PolarHBondContact O-CD2 3.33Å; Q436-H438 VanDerWaalsContact O-CD2 3.26Å; Q436-H438 PolarHBondContact O-N 2.88Å
437	I	59.1	Low	59.4	Low	86 Å²	86	82.7 Å²	82.7	44%	0.441	45%	0.453	S	S	.	.			trans	-67.4	102.1	172.6	-58.3	180	0	0	0	107.2	P435 L439 T469	P435-I437 PolarHBondContact O-N 2.88Å; P435-I437 VanDerWaalsContact O-N 3.17Å; I437-L439 PolarHBondContact O-N 3.43Å; I437-T469 HydrophobicContact CG2-CG2 4.34Å
438	H	66.1	Low	62.1	Low	80 Å²	80	78.5 Å²	78.5	37%	0.37	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-76.3	118.7	175.4	-70.6	-75.1	0	0	0	109.9	F425 Q436	F425-H438 HydrophobicContact CD1-CB 3.95Å; Q436-H438 PolarHBondContact O-CD2 3.33Å; Q436-H438 VanDerWaalsContact O-CD2 3.26Å; Q436-H438 PolarHBondContact O-N 2.88Å
439	L	77.2	Confident	65	Low	47 Å²	47	73.7 Å²	73.7	25%	0.246	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-80	140.7	-179.4	-65.3	159	0	0	0	110	I437 Q443 L447 R473	I437-L439 PolarHBondContact O-N 3.43Å; L439-Q443 HydrophobicContact CB-CB 4.21Å; L439-Q443 HydrophobicContact CD2-CB 4.12Å; L439-L447 HydrophobicContact CD1-CD1 3.28Å; L439-L447 HydrophobicContact CD2-CD1 3.97Å; L439-L447 HydrophobicContact CG-CD1 4.15Å; L439-R473 HydrophobicContact CD2-CG 4.37Å
440	T	83.6	Confident	68	Low	3 Å²	3	72.8 Å²	72.8	2%	0.018	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-69	160	170	63.1	0	0	0	0	110	F425 E442 Q443 Q444 F702	F425-T440 HydrophobicContact CE1-CG2 4.36Å; F425-T440 HydrophobicContact CZ-CG2 3.82Å; T440-E442 PolarHBondContact O-N 3.3Å; T440-Q443 CarbonylContact O-C 3.55Å; T440-Q443 WeakPolarHBondContact O-CB 3.3Å; T440-Q443 PolarHBondContact O-N 3.11Å; T440-Q443 VanDerWaalsContact OG1-CG 3.28Å; T440-Q443 WeakPolarHBondContact OG1-CG 3.42Å; T440-Q443 PolarHBondContact OG1-N 3.18Å; T440-Q443 PolarHBondContact OG1-OE1 2.71Å; T440-Q444 PolarHBondContact O-N 2.98Å; T440-F702 HydrophobicContact CG2-CE1 4.14Å; T440-F702 HydrophobicContact CG2-CE2 4.38Å; T440-F702 HydrophobicContact CG2-CZ 3.5Å; T440-F702 VanDerWaalsContact CG2-CZ 3.5Å
441	R	81.3	Confident	70.9	Confident	68 Å²	68	68.7 Å²	68.7	26%	0.257	37%	0.367	S	S	.	.	H	α-helix	trans	-57.5	-37.9	173.9	178.2	158.7	154.7	-95.8	2.9	112.8	P229 D232 N422 Q444 E445	P229-R441 VanDerWaalsContact CB-NH1 3.31Å; P229-R441 VanDerWaalsContact CG-CZ 3.42Å; D232-R441 VanDerWaalsContact CB-NH2 3.35Å; D232-R441 IonicContact OD1-CZ 3.45Å; D232-R441 IonicContact OD1-NH2 2.91Å; D232-R441 PolarHBondContact OD1-NH2 2.54Å; D232-R441 IonicContact OD2-CZ 3.83Å; D232-R441 IonicContact OD2-NE 2.77Å; D232-R441 PolarHBondContact OD2-NE 2.89Å; D232-R441 IonicContact OD2-NH2 3.52Å; D232-R441 PolarHBondContact OD2-NH2 3.12Å; N422-R441 PolarHBondContact OD1-NH1 2.95Å; R441-Q444 PolarHBondContact O-N 2.96Å; R441-E445 PolarHBondContact O-N 2.89Å
442	E	88.6	Confident	73.4	Confident	28 Å²	28	64.2 Å²	64.2	13%	0.131	35%	0.346	C	S	.	.	H	α-helix	trans	-62.8	-41.3	174.5	-63.4	177.7	151.1	0	0	111.8	Y418 T440 I446 Y697 L698 T699	Y418-E442 PolarHBondContact OH-OE2 3.45Å; T440-E442 PolarHBondContact O-N 3.3Å; E442-I446 WeakPolarHBondContact O-CD1 3.4Å; E442-I446 WeakPolarHBondContact O-CG1 3.41Å; E442-I446 PolarHBondContact O-N 2.6Å; E442-Y697 WeakPolarHBondContact CB-O 3.41Å; E442-Y697 VanDerWaalsContact CD-O 3.3Å; E442-L698 HydrophobicContact CB-CD2 3.82Å; E442-L698 WeakPolarHBondContact OE2-CA 3.45Å; E442-T699 WeakPolarHBondContact OE1-CG2 3.28Å; E442-T699 PolarHBondContact OE1-OG1 2.9Å; E442-T699 PolarHBondContact OE2-N 3.46Å; E442-T699 PolarHBondContact OE2-OG1 3.06Å
443	Q	89.8	Confident	76.1	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.019	34%	0.338	C	S	.	.	H	α-helix	trans	-66.2	-40.3	173.2	-70.9	173.9	-40.8	0	0	111.7	L439 T440 E445 I446 L447 T470 L698	L439-Q443 HydrophobicContact CB-CB 4.21Å; L439-Q443 HydrophobicContact CD2-CB 4.12Å; T440-Q443 CarbonylContact O-C 3.55Å; T440-Q443 WeakPolarHBondContact O-CB 3.3Å; T440-Q443 PolarHBondContact O-N 3.11Å; T440-Q443 VanDerWaalsContact OG1-CG 3.28Å; T440-Q443 WeakPolarHBondContact OG1-CG 3.42Å; T440-Q443 PolarHBondContact OG1-N 3.18Å; T440-Q443 PolarHBondContact OG1-OE1 2.71Å; Q443-E445 VanDerWaalsContact C-N 3.34Å; Q443-E445 PolarHBondContact O-N 3.24Å; Q443-I446 WeakPolarHBondContact O-CB 3.12Å; Q443-I446 PolarHBondContact O-N 3.28Å; Q443-L447 VanDerWaalsContact O-CG 3.27Å; Q443-L447 WeakPolarHBondContact O-CG 3.24Å; Q443-L447 PolarHBondContact O-N 2.89Å; Q443-T470 HydrophobicContact CB-CG2 4.38Å; Q443-T470 HydrophobicContact CG-CG2 4.22Å; Q443-T470 PolarHBondContact NE2-OG1 3.39Å; Q443-T470 VanDerWaalsContact NE2-OG1 3.09Å; Q443-L698 HydrophobicContact CG-CD2 3.67Å
444	Q	87.6	Confident	78.7	Confident	97 Å²	97	64.8 Å²	64.8	45%	0.453	33%	0.332	S	S	.	.	H	α-helix	trans	-64.1	-39.2	178	-168.3	63.8	39.7	0	0	111.9	T440 R441 I446 L447 S448	T440-Q444 PolarHBondContact O-N 2.98Å; R441-Q444 PolarHBondContact O-N 2.96Å; Q444-I446 VanDerWaalsContact C-N 3.32Å; Q444-I446 PolarHBondContact O-N 3.18Å; Q444-L447 PolarHBondContact O-N 3.11Å; Q444-S448 WeakPolarHBondContact O-CB 3.01Å; Q444-S448 PolarHBondContact O-N 3.03Å; Q444-S448 PolarHBondContact O-OG 2.91Å
445	E	86.4	Confident	81.6	Confident	62 Å²	62	59.6 Å²	59.6	29%	0.29	30%	0.304	S	S	.	.	H	α-helix	trans	-59.1	-44.8	174.5	-169.2	-178.9	-178.9	0	0	110.5	R441 Q443 S448 H449 F696	R441-E445 PolarHBondContact O-N 2.89Å; Q443-E445 VanDerWaalsContact C-N 3.34Å; Q443-E445 PolarHBondContact O-N 3.24Å; E445-S448 PolarHBondContact O-N 3.29Å; E445-S448 PolarHBondContact O-OG 3.43Å; E445-H449 PolarHBondContact O-N 2.93Å; E445-F696 HydrophobicContact CG-CD1 4.09Å; E445-F696 HydrophobicContact CG-CE1 3.89Å
446	I	92.3	Very high	84.3	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-46.1	175.3	-66.1	161.4	0	0	0	111.2	E442 Q443 Q444 S448 H449 I459 T470 Y474 F696 L698	E442-I446 WeakPolarHBondContact O-CD1 3.4Å; E442-I446 WeakPolarHBondContact O-CG1 3.41Å; E442-I446 PolarHBondContact O-N 2.6Å; Q443-I446 WeakPolarHBondContact O-CB 3.12Å; Q443-I446 PolarHBondContact O-N 3.28Å; Q444-I446 VanDerWaalsContact C-N 3.32Å; Q444-I446 PolarHBondContact O-N 3.18Å; I446-S448 VanDerWaalsContact C-N 3.27Å; I446-S448 PolarHBondContact O-N 3.33Å; I446-H449 WeakPolarHBondContact O-CB 3.34Å; I446-H449 PolarHBondContact O-N 3.13Å; I446-H449 VanDerWaalsContact O-N 3.15Å; I446-I459 HydrophobicContact CD1-CD1 4.13Å; I446-I459 HydrophobicContact CD1-CG1 4.24Å; I446-I459 HydrophobicContact CD1-CG2 3.71Å; I446-I459 HydrophobicContact CG1-CD1 4.38Å; I446-I459 HydrophobicContact CG1-CG1 4.49Å; I446-I459 HydrophobicContact CG2-CD1 3.61Å; I446-I459 HydrophobicContact CG2-CG1 4.48Å; I446-T470 HydrophobicContact CB-CG2 4.3Å; I446-T470 HydrophobicContact CD1-CG2 4.16Å; I446-T470 HydrophobicContact CG2-CG2 3.96Å; I446-Y474 HydrophobicContact CG2-CD2 4.32Å; I446-Y474 WeakPolarHBondContact O-CE2 3.35Å; I446-F696 HydrophobicContact CD1-CB 3.93Å; I446-F696 HydrophobicContact CG1-CB 3.53Å; I446-F696 HydrophobicContact CG1-CD1 4.15Å; I446-F696 HydrophobicContact CG1-CD2 4Å; I446-F696 HydrophobicContact CG1-CG 3.63Å; I446-L698 HydrophobicContact CD1-CD1 4.31Å; I446-L698 HydrophobicContact CD1-CD2 3.66Å; I446-L698 HydrophobicContact CD1-CG 3.95Å
447	L	90.9	Very high	86.7	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-64.8	-32.2	-178.9	-68.9	170.2	0	0	0	112.9	L439 Q443 Q444 H449 R473 Y474 R478	L439-L447 HydrophobicContact CD1-CD1 3.28Å; L439-L447 HydrophobicContact CD2-CD1 3.97Å; L439-L447 HydrophobicContact CG-CD1 4.15Å; Q443-L447 VanDerWaalsContact O-CG 3.27Å; Q443-L447 WeakPolarHBondContact O-CG 3.24Å; Q443-L447 PolarHBondContact O-N 2.89Å; Q444-L447 PolarHBondContact O-N 3.11Å; L447-H449 PolarHBondContact O-N 3.33Å; L447-R473 HydrophobicContact CD1-CB 4.31Å; L447-R473 HydrophobicContact CD2-CB 3.89Å; L447-Y474 HydrophobicContact CD2-CD2 4.17Å; L447-Y474 HydrophobicContact CD2-CG 4.43Å; L447-R478 PolarHBondContact O-NH1 3.24Å; L447-R478 PolarHBondContact O-NH2 3.33Å
448	S	88.3	Confident	88.5	Confident	44 Å²	44	45.6 Å²	45.6	31%	0.308	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-11.9	176.3	71.5	0	0	0	0	114.3	Q444 E445 I446	Q444-S448 WeakPolarHBondContact O-CB 3.01Å; Q444-S448 PolarHBondContact O-N 3.03Å; Q444-S448 PolarHBondContact O-OG 2.91Å; E445-S448 PolarHBondContact O-N 3.29Å; E445-S448 PolarHBondContact O-OG 3.43Å; I446-S448 VanDerWaalsContact C-N 3.27Å; I446-S448 PolarHBondContact O-N 3.33Å
449	H	91.1	Very high	89.9	Confident	25 Å²	25	41.9 Å²	41.9	12%	0.116	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-82.1	118	179.6	179.8	70.1	0	0	0	111.6	E445 I446 L447 H455 V457 Y474 R478 H694 F696	E445-H449 PolarHBondContact O-N 2.93Å; I446-H449 WeakPolarHBondContact O-CB 3.34Å; I446-H449 PolarHBondContact O-N 3.13Å; I446-H449 VanDerWaalsContact O-N 3.15Å; L447-H449 PolarHBondContact O-N 3.33Å; H449-H455 AromaticContact CE1-CE1 3.66Å; H449-H455 AromaticContact CE1-ND1 3.5Å; H449-H455 PolarHBondContact CE1-ND1 3.46Å; H449-H455 AromaticContact NE2-CE1 3.89Å; H449-H455 AromaticContact NE2-ND1 3.26Å; H449-H455 PolarHBondContact NE2-ND1 2.71Å; H449-V457 WeakPolarHBondContact NE2-CG2 3.44Å; H449-Y474 VanDerWaalsContact O-CE2 3.26Å; H449-Y474 WeakPolarHBondContact O-CE2 3.48Å; H449-Y474 PolarHBondContact O-OH 3.4Å; H449-R478 PolarHBondContact O-NH2 3.24Å; H449-R478 VanDerWaalsContact O-NH2 3.12Å; H449-H694 AromaticContact CE1-CD2 3.93Å; H449-H694 AromaticContact CE1-CE1 3.78Å; H449-H694 AromaticContact CE1-CG 3.88Å; H449-H694 AromaticContact CE1-ND1 3.77Å; H449-H694 AromaticContact CE1-NE2 3.88Å; H449-F696 HydrophobicContact CB-CE2 4.24Å; H449-F696 HydrophobicContact CB-CZ 3.95Å
450	D	91	Very high	90.8	Very high	90 Å²	90	40.4 Å²	40.4	48%	0.481	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-84.9	118.7	172.9	-66.8	-38.3	0	0	0	111.3	R478	D450-R478 IonicContact OD1-CZ 3.89Å; D450-R478 IonicContact OD1-NE 3.17Å; D450-R478 PolarHBondContact OD1-NE 3.13Å; D450-R478 IonicContact OD1-NH2 3.81Å; D450-R478 PolarHBondContact OD1-NH2 2.93Å
451	I	92.8	Very high	91.2	Very high	18 Å²	18	40.2 Å²	40.2	9%	0.092	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-73.4	139.4	-178.1	-166.9	72.2	0	0	0	111	H455 V457 Y474 L481 A643 I668	I451-H455 HydrophobicContact CD1-CB 3.52Å; I451-H455 HydrophobicContact CG1-CB 4.36Å; I451-V457 HydrophobicContact CD1-CG2 3.6Å; I451-Y474 WeakPolarHBondContact CB-OH 3.5Å; I451-Y474 PolarHBondContact N-OH 2.81Å; I451-L481 HydrophobicContact CG2-CD1 4.16Å; I451-A643 HydrophobicContact CG1-CB 4.41Å; I451-A643 HydrophobicContact CG2-CB 4.3Å; I451-I668 HydrophobicContact CD1-CD1 4.38Å; I451-I668 HydrophobicContact CD1-CG1 4.09Å
452	Q	91.8	Very high	91.9	Very high	104 Å²	104	37.2 Å²	37.2	49%	0.486	19%	0.192	S	C	.	.			trans	-119.3	166	172.7	-54.2	-63.1	-55.4	0	0	109.8	D454 H455 G666	Q452-D454 VanDerWaalsContact C-N 3.31Å; Q452-D454 PolarHBondContact O-N 3.41Å; Q452-H455 VanDerWaalsContact CG-CE1 3.46Å; Q452-H455 WeakPolarHBondContact CG-CE1 3.16Å; Q452-H455 PolarHBondContact N-ND1 3.26Å; Q452-H455 WeakPolarHBondContact O-CB 3.4Å; Q452-H455 PolarHBondContact O-N 3.4Å; Q452-G666 VanDerWaalsContact O-CA 3.31Å; Q452-G666 WeakPolarHBondContact O-CA 3.3Å
453	D	88.4	Confident	92	Very high	109 Å²	109	36 Å²	36	58%	0.583	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-30	-172.2	-61.6	-26.4	0	0	0	114.2	C665	D453-C665 CarbonylContact O-C 3.4Å; D453-C665 VanDerWaalsContact O-O 3.09Å
454	D	89.8	Confident	91.9	Very high	115 Å²	115	36.5 Å²	36.5	62%	0.615	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-8.9	177	70.6	-40.5	0	0	0	112.9	Q452 V456	Q452-D454 VanDerWaalsContact C-N 3.31Å; Q452-D454 PolarHBondContact O-N 3.41Å; D454-V456 PolarHBondContact O-N 3.34Å
455	H	94.2	Very high	92.1	Very high	29 Å²	29	32 Å²	32	13%	0.134	17%	0.172	C	C	.	.			trans	-71.8	126.3	-176.7	-73.6	-172.7	0	0	0	112.2	H449 I451 Q452 V457 K667 H694	H449-H455 AromaticContact CE1-CE1 3.66Å; H449-H455 AromaticContact CE1-ND1 3.5Å; H449-H455 PolarHBondContact CE1-ND1 3.46Å; H449-H455 AromaticContact NE2-CE1 3.89Å; H449-H455 AromaticContact NE2-ND1 3.26Å; H449-H455 PolarHBondContact NE2-ND1 2.71Å; I451-H455 HydrophobicContact CD1-CB 3.52Å; I451-H455 HydrophobicContact CG1-CB 4.36Å; Q452-H455 VanDerWaalsContact CG-CE1 3.46Å; Q452-H455 WeakPolarHBondContact CG-CE1 3.16Å; Q452-H455 PolarHBondContact N-ND1 3.26Å; Q452-H455 WeakPolarHBondContact O-CB 3.4Å; Q452-H455 PolarHBondContact O-N 3.4Å; H455-V457 HydrophobicContact CB-CG2 4.28Å; H455-K667 PolarHBondContact O-N 3.09Å; H455-H694 AromaticContact CE1-CE1 3.9Å; H455-H694 AromaticContact NE2-CE1 3.89Å
456	V	95.2	Very high	92.1	Very high	23 Å²	23	29.9 Å²	29.9	14%	0.139	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	105.1	162.4	-174.5	0	0	0	0	108.1	D454 K667 L669 V690 H691 T693 H694	D454-V456 PolarHBondContact O-N 3.34Å; V456-K667 HydrophobicContact CG2-CD 4.07Å; V456-L669 HydrophobicContact CG1-CD1 3.99Å; V456-V690 HydrophobicContact CG1-CG1 4.2Å; V456-H691 WeakPolarHBondContact CG1-O 3.22Å; V456-T693 PolarHBondContact N-OG1 3.11Å; V456-T693 VanDerWaalsContact N-OG1 3.17Å; V456-T693 PolarHBondContact O-N 3.11Å; V456-T693 PolarHBondContact O-OG1 3.48Å; V456-H694 PolarHBondContact O-N 3.28Å
457	V	96.2	Very high	92.1	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.012	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	133.6	-177.2	-178	0	0	0	0	109.5	H449 I451 H455 I459 K667 I668 L669 H694 F696	H449-V457 WeakPolarHBondContact NE2-CG2 3.44Å; I451-V457 HydrophobicContact CD1-CG2 3.6Å; H455-V457 HydrophobicContact CB-CG2 4.28Å; V457-I459 HydrophobicContact CG1-CG1 4.41Å; V457-K667 PolarHBondContact N-O 3.48Å; V457-I668 HydrophobicContact CB-CG1 4.27Å; V457-I668 HydrophobicContact CB-CG2 4.36Å; V457-I668 HydrophobicContact CG1-CG2 4.36Å; V457-I668 WeakPolarHBondContact O-CA 3.22Å; V457-L669 PolarHBondContact O-N 3.12Å; V457-H694 HydrophobicContact CG1-CB 4.42Å; V457-H694 HydrophobicContact CG2-CB 4.34Å; V457-F696 HydrophobicContact CG1-CD2 3.6Å; V457-F696 HydrophobicContact CG1-CE2 3.59Å
458	K	95.9	Very high	91.9	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.009	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.1	173.3	-71.4	-174	174	-163.9	0	110.8	L669 A686 L687 V690 H692 H694 I695 F696	K458-L669 CarbonylContact C-O 3.33Å; K458-L669 WeakPolarHBondContact CA-O 3.28Å; K458-L669 HydrophobicContact CG-CB 4.47Å; K458-A686 PolarHBondContact NZ-O 3.27Å; K458-L687 VanDerWaalsContact NZ-C 3.28Å; K458-L687 PolarHBondContact NZ-O 3.38Å; K458-V690 WeakPolarHBondContact CE-O 3.25Å; K458-V690 PolarHBondContact NZ-O 2.95Å; K458-H692 HydrophobicContact CB-CB 4.44Å; K458-H692 HydrophobicContact CD-CB 3.68Å; K458-H692 HydrophobicContact CG-CB 3.74Å; K458-H694 PolarHBondContact N-O 3.37Å; K458-I695 HydrophobicContact CB-CG1 4.23Å; K458-I695 CarbonylContact O-C 3.52Å; K458-I695 WeakPolarHBondContact O-CA 3.48Å; K458-F696 PolarHBondContact O-N 2.92Å
459	I	95.9	Very high	92	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	99.5	171.6	-55.6	174.1	0	0	0	107.4	I446 V457 A461 I668 L669 V670 G671 F696 L698	I446-I459 HydrophobicContact CD1-CD1 4.13Å; I446-I459 HydrophobicContact CD1-CG1 4.24Å; I446-I459 HydrophobicContact CD1-CG2 3.71Å; I446-I459 HydrophobicContact CG1-CD1 4.38Å; I446-I459 HydrophobicContact CG1-CG1 4.49Å; I446-I459 HydrophobicContact CG2-CD1 3.61Å; I446-I459 HydrophobicContact CG2-CG1 4.48Å; V457-I459 HydrophobicContact CG1-CG1 4.41Å; I459-A461 HydrophobicContact CG2-CB 4.43Å; I459-A461 PolarHBondContact O-N 2.69Å; I459-I668 HydrophobicContact CD1-CG2 3.56Å; I459-I668 HydrophobicContact CG1-CG2 4.08Å; I459-L669 PolarHBondContact N-O 2.74Å; I459-V670 HydrophobicContact CB-CB 4.42Å; I459-V670 HydrophobicContact CB-CG1 4.19Å; I459-V670 HydrophobicContact CB-CG2 3.98Å; I459-V670 HydrophobicContact CD1-CG2 3.82Å; I459-V670 HydrophobicContact CG1-CG2 4.23Å; I459-V670 HydrophobicContact CG2-CG1 4.28Å; I459-G671 PolarHBondContact O-N 2.9Å; I459-F696 HydrophobicContact CG1-CB 4.42Å; I459-F696 HydrophobicContact CG1-CD2 4.47Å; I459-L698 HydrophobicContact CG2-CD1 3.91Å; I459-L698 HydrophobicContact CG2-CG 4.01Å
460	V	95	Very high	92.1	Very high	16 Å²	16	30.6 Å²	30.6	10%	0.097	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	106.9	176.9	177.4	0	0	0	0	108.5	P673 I695 F696 Y697 L698	V460-P673 HydrophobicContact CG1-CG 3.92Å; V460-I695 HydrophobicContact CG2-CD1 4Å; V460-I695 HydrophobicContact CG2-CG1 4.29Å; V460-F696 PolarHBondContact N-O 3.2Å; V460-Y697 HydrophobicContact CB-CD1 3.74Å; V460-Y697 HydrophobicContact CB-CE1 3.83Å; V460-Y697 HydrophobicContact CG1-CD1 3.94Å; V460-Y697 HydrophobicContact CG1-CE1 3.94Å; V460-Y697 HydrophobicContact CG2-CE1 4.26Å; V460-Y697 CarbonylContact O-C 3.57Å; V460-Y697 VanDerWaalsContact O-CA 3.26Å; V460-Y697 WeakPolarHBondContact O-CA 3.44Å; V460-L698 PolarHBondContact O-N 3.5Å
461	A	93.8	Very high	92.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125.2	-168.6	0	0	0	0	0	110.9	I459 T465 K467 G671 D672 L698	I459-A461 HydrophobicContact CG2-CB 4.43Å; I459-A461 PolarHBondContact O-N 2.69Å; A461-T465 WeakPolarHBondContact CB-OG1 3.49Å; A461-K467 HydrophobicContact CB-CD 3.5Å; A461-K467 VanDerWaalsContact CB-CD 3.5Å; A461-K467 HydrophobicContact CB-CG 3.52Å; A461-G671 PolarHBondContact N-O 2.76Å; A461-D672 VanDerWaalsContact O-CA 3.27Å; A461-D672 WeakPolarHBondContact O-CA 3.48Å; A461-D672 WeakPolarHBondContact O-CB 3.49Å; A461-L698 HydrophobicContact CB-CB 3.8Å; A461-L698 HydrophobicContact CB-CD1 3.92Å; A461-L698 HydrophobicContact CB-CG 4.22Å
462	F	94.8	Very high	92.3	Very high	5 Å²	5	26.6 Å²	26.6	2%	0.022	15%	0.149	C	C	.	.			trans	-72.1	172.8	175.8	-64.3	-38.3	0	0	0	112.7	G464 T465 D672 H674 L698 T699 L716 V722 K724 L726	F462-G464 PolarHBondContact O-N 3.11Å; F462-T465 HydrophobicContact CB-CG2 3.9Å; F462-T465 WeakPolarHBondContact O-CB 3.27Å; F462-T465 WeakPolarHBondContact O-CG2 3.48Å; F462-T465 PolarHBondContact O-N 3.43Å; F462-T465 PolarHBondContact O-OG1 3.41Å; F462-D672 WeakPolarHBondContact CA-OD2 3.41Å; F462-H674 AromaticContact CE1-CD2 3.77Å; F462-L698 PolarHBondContact N-O 2.84Å; F462-T699 HydrophobicContact CD2-CG2 4.35Å; F462-T699 HydrophobicContact CE2-CG2 4.07Å; F462-L716 HydrophobicContact CE1-CD1 4.25Å; F462-V722 HydrophobicContact CZ-CG1 4.39Å; F462-K724 HydrophobicContact CE2-CB 4.21Å; F462-K724 HydrophobicContact CZ-CB 3.82Å; F462-L726 HydrophobicContact CB-CD1 3.74Å; F462-L726 HydrophobicContact CD2-CB 3.89Å; F462-L726 HydrophobicContact CD2-CD1 3.96Å; F462-L726 HydrophobicContact CE2-CB 4.19Å; F462-L726 HydrophobicContact CG-CD1 4.21Å
463	A	90.9	Very high	92.3	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.008	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	132.3	176.4	0	0	0	0	0	113.1	T465 D672 S701 F704 Y934 T938	A463-T465 VanDerWaalsContact C-N 3.28Å; A463-T465 PolarHBondContact O-N 3.05Å; A463-D672 PolarHBondContact N-OD2 3.19Å; A463-S701 VanDerWaalsContact O-CB 3.31Å; A463-S701 WeakPolarHBondContact O-CB 3.49Å; A463-S701 PolarHBondContact O-OG 2.81Å; A463-F704 HydrophobicContact CB-CE1 4.4Å; A463-F704 HydrophobicContact CB-CZ 4.44Å; A463-Y934 HydrophobicContact CB-CE1 4.41Å; A463-Y934 PolarHBondContact N-OH 3Å; A463-T938 HydrophobicContact CB-CG2 3.86Å
464	G	88.8	Confident	92.5	Very high	15 Å²	15	21.6 Å²	21.6	16%	0.155	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	11.4	172.7	0	0	0	0	0	115.5	F462 G466 F702	F462-G464 PolarHBondContact O-N 3.11Å; G464-G466 VanDerWaalsContact C-N 3.3Å; G464-G466 PolarHBondContact O-N 3.04Å; G464-F702 PolarHBondContact O-N 3.46Å
465	T	90	Very high	92.8	Very high	2 Å²	2	16.1 Å²	16.1	1%	0.012	9%	0.088	C	C	.	.	S	Bend	trans	-82.6	4.7	-173.1	55.4	0	0	0	0	115.6	A461 F462 A463 L698 Q700	A461-T465 WeakPolarHBondContact CB-OG1 3.49Å; F462-T465 HydrophobicContact CB-CG2 3.9Å; F462-T465 WeakPolarHBondContact O-CB 3.27Å; F462-T465 WeakPolarHBondContact O-CG2 3.48Å; F462-T465 PolarHBondContact O-N 3.43Å; F462-T465 PolarHBondContact O-OG1 3.41Å; A463-T465 VanDerWaalsContact C-N 3.28Å; A463-T465 PolarHBondContact O-N 3.05Å; T465-L698 HydrophobicContact CG2-CB 4.23Å; T465-L698 WeakPolarHBondContact CG2-O 3.36Å; T465-Q700 VanDerWaalsContact CA-O 3.3Å; T465-Q700 WeakPolarHBondContact CA-O 3.31Å; T465-Q700 WeakPolarHBondContact CB-O 3.34Å; T465-Q700 VanDerWaalsContact CG2-O 3.28Å; T465-Q700 WeakPolarHBondContact CG2-O 3.36Å
466	G	88	Confident	92.7	Very high	18 Å²	18	17.2 Å²	17.2	19%	0.186	10%	0.102	C	C	.	.			trans	77.7	37	178	0	0	0	0	0	114.9	G464 T468 T469 T470	G464-G466 VanDerWaalsContact C-N 3.3Å; G464-G466 PolarHBondContact O-N 3.04Å; G466-T468 PolarHBondContact O-N 3.18Å; G466-T469 PolarHBondContact O-N 3.3Å; G466-T470 PolarHBondContact O-N 3.31Å; G466-T470 PolarHBondContact O-OG1 3.08Å
467	K	90.7	Very high	92.6	Very high	26 Å²	26	21.2 Å²	21.2	11%	0.113	12%	0.119	C	C	.	.	H	α-helix	trans	-48.3	-59.9	177.9	-53.4	-164.8	-49.2	-84.4	0	112.9	A461 T469 T470 L471 E648 V670	A461-K467 HydrophobicContact CB-CD 3.5Å; A461-K467 VanDerWaalsContact CB-CD 3.5Å; A461-K467 HydrophobicContact CB-CG 3.52Å; K467-T469 PolarHBondContact O-N 3.15Å; K467-T470 WeakPolarHBondContact O-CB 3.25Å; K467-T470 PolarHBondContact O-N 3.02Å; K467-T470 VanDerWaalsContact O-N 3.12Å; K467-L471 PolarHBondContact O-N 2.93Å; K467-L471 VanDerWaalsContact O-N 3.11Å; K467-E648 VanDerWaalsContact CE-OE1 3.24Å; K467-E648 WeakPolarHBondContact CE-OE1 3.19Å; K467-E648 IonicContact NZ-OE1 3.95Å; K467-E648 PolarHBondContact NZ-OE1 3.03Å; K467-V670 HydrophobicContact CB-CG1 3.8Å; K467-V670 HydrophobicContact CD-CG1 3.98Å; K467-V670 HydrophobicContact CG-CG1 4.18Å
468	T	88.3	Confident	92.5	Very high	31 Å²	31	21.6 Å²	21.6	19%	0.19	12%	0.121	C	C	.	.	H	α-helix	trans	-62.3	-41.7	-178.9	-42	0	0	0	0	111.4	G466 T470 L471 V472 F500	G466-T468 PolarHBondContact O-N 3.18Å; T468-T470 VanDerWaalsContact C-N 3.27Å; T468-T470 PolarHBondContact O-N 2.87Å; T468-L471 PolarHBondContact O-N 2.64Å; T468-V472 VanDerWaalsContact O-CG2 3.3Å; T468-V472 WeakPolarHBondContact O-CG2 3.33Å; T468-V472 PolarHBondContact O-N 3.29Å; T468-F500 HydrophobicContact CG2-CE2 3.88Å; T468-F500 HydrophobicContact CG2-CZ 4.36Å
469	T	89.5	Confident	92.4	Very high	32 Å²	32	26 Å²	26	20%	0.196	15%	0.15	C	C	.	.	H	α-helix	trans	-59.9	-38.4	175.6	-50.3	0	0	0	0	112	I437 G466 K467 R473 R499	I437-T469 HydrophobicContact CG2-CG2 4.34Å; G466-T469 PolarHBondContact O-N 3.3Å; K467-T469 PolarHBondContact O-N 3.15Å; T469-R473 WeakPolarHBondContact O-CG 3.14Å; T469-R473 PolarHBondContact O-N 3.5Å; T469-R473 VanDerWaalsContact O-N 3.1Å; T469-R499 PolarHBondContact OG1-NH2 3.32Å
470	T	92.3	Very high	92.3	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.012	18%	0.181	C	C	.	.	H	α-helix	trans	-64.5	-45.1	176.8	-49.3	0	0	0	0	110.6	Q443 I446 G466 K467 T468 R473 Y474	Q443-T470 HydrophobicContact CB-CG2 4.38Å; Q443-T470 HydrophobicContact CG-CG2 4.22Å; Q443-T470 PolarHBondContact NE2-OG1 3.39Å; Q443-T470 VanDerWaalsContact NE2-OG1 3.09Å; I446-T470 HydrophobicContact CB-CG2 4.3Å; I446-T470 HydrophobicContact CD1-CG2 4.16Å; I446-T470 HydrophobicContact CG2-CG2 3.96Å; G466-T470 PolarHBondContact O-N 3.31Å; G466-T470 PolarHBondContact O-OG1 3.08Å; K467-T470 WeakPolarHBondContact O-CB 3.25Å; K467-T470 PolarHBondContact O-N 3.02Å; K467-T470 VanDerWaalsContact O-N 3.12Å; T468-T470 VanDerWaalsContact C-N 3.27Å; T468-T470 PolarHBondContact O-N 2.87Å; T470-R473 PolarHBondContact O-N 3.48Å; T470-Y474 WeakPolarHBondContact O-CB 3.29Å; T470-Y474 PolarHBondContact O-N 2.74Å
471	L	94.4	Very high	92.3	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-65.4	-42.1	177.6	-69.6	178.1	0	0	0	112.9	K467 T468 R473 Y474 A475 Y485 F500 F645 I668 V670	K467-L471 PolarHBondContact O-N 2.93Å; K467-L471 VanDerWaalsContact O-N 3.11Å; T468-L471 PolarHBondContact O-N 2.64Å; L471-R473 VanDerWaalsContact C-N 3.32Å; L471-R473 PolarHBondContact O-N 3.05Å; L471-Y474 WeakPolarHBondContact O-CB 3.49Å; L471-Y474 PolarHBondContact O-N 3.14Å; L471-A475 PolarHBondContact O-N 2.82Å; L471-Y485 HydrophobicContact CD1-CD2 4.36Å; L471-Y485 HydrophobicContact CD1-CE2 4.04Å; L471-F500 HydrophobicContact CB-CE1 3.85Å; L471-F500 HydrophobicContact CB-CZ 3.72Å; L471-F645 HydrophobicContact CB-CD2 4.18Å; L471-F645 HydrophobicContact CB-CE2 4.3Å; L471-F645 HydrophobicContact CD1-CB 4.22Å; L471-F645 HydrophobicContact CD1-CD2 4.42Å; L471-F645 HydrophobicContact CD1-CG 4.42Å; L471-F645 HydrophobicContact CD2-CB 4.43Å; L471-F645 HydrophobicContact CD2-CD1 4.04Å; L471-F645 HydrophobicContact CD2-CD2 4.09Å; L471-F645 HydrophobicContact CD2-CE1 4.32Å; L471-F645 HydrophobicContact CD2-CE2 4.35Å; L471-F645 HydrophobicContact CD2-CG 3.93Å; L471-F645 HydrophobicContact CD2-CZ 4.47Å; L471-F645 HydrophobicContact CG-CD2 4.47Å; L471-I668 HydrophobicContact CD2-CG2 4.32Å; L471-V670 HydrophobicContact CD1-CB 4.36Å; L471-V670 HydrophobicContact CD1-CG2 3.93Å; L471-V670 HydrophobicContact CD2-CG2 3.82Å; L471-V670 HydrophobicContact CG-CG2 4.15Å
472	V	93.9	Very high	92.4	Very high	23 Å²	23	39.3 Å²	39.3	14%	0.139	21%	0.206	C	C	.	.	H	α-helix	trans	-57.9	-47.3	175.7	168.9	0	0	0	0	110.3	T468 A475 A476 R499 F500	T468-V472 VanDerWaalsContact O-CG2 3.3Å; T468-V472 WeakPolarHBondContact O-CG2 3.33Å; T468-V472 PolarHBondContact O-N 3.29Å; V472-A475 PolarHBondContact O-N 3.03Å; V472-A476 VanDerWaalsContact O-CB 3.3Å; V472-A476 WeakPolarHBondContact O-CB 3.43Å; V472-A476 PolarHBondContact O-N 2.91Å; V472-R499 WeakPolarHBondContact CG1-O 3.38Å; V472-R499 HydrophobicContact CG2-CB 4.35Å; V472-F500 HydrophobicContact CB-CD1 4.46Å; V472-F500 HydrophobicContact CB-CE1 4.48Å; V472-F500 HydrophobicContact CG2-CD1 3.86Å; V472-F500 HydrophobicContact CG2-CD2 3.7Å; V472-F500 HydrophobicContact CG2-CE1 3.88Å; V472-F500 HydrophobicContact CG2-CE2 3.73Å; V472-F500 HydrophobicContact CG2-CG 3.8Å; V472-F500 HydrophobicContact CG2-CZ 3.83Å
473	R	91.8	Very high	92.5	Very high	105 Å²	105	39.1 Å²	39.1	40%	0.396	21%	0.205	S	C	.	.	H	α-helix	trans	-66.8	-37.2	178	-70.4	-70.1	-174.3	166.6	-1.7	112.3	L439 L447 T469 T470 L471 A476 Q477	L439-R473 HydrophobicContact CD2-CG 4.37Å; L447-R473 HydrophobicContact CD1-CB 4.31Å; L447-R473 HydrophobicContact CD2-CB 3.89Å; T469-R473 WeakPolarHBondContact O-CG 3.14Å; T469-R473 PolarHBondContact O-N 3.5Å; T469-R473 VanDerWaalsContact O-N 3.1Å; T470-R473 PolarHBondContact O-N 3.48Å; L471-R473 VanDerWaalsContact C-N 3.32Å; L471-R473 PolarHBondContact O-N 3.05Å; R473-A476 PolarHBondContact O-N 3.46Å; R473-Q477 PolarHBondContact O-N 3.3Å
474	Y	94.3	Very high	92.7	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-60.8	-46.6	177.6	-171.8	-84	0	0	0	111.8	I446 L447 H449 I451 T470 L471 R478 F483 F645 I668	I446-Y474 HydrophobicContact CG2-CD2 4.32Å; I446-Y474 WeakPolarHBondContact O-CE2 3.35Å; L447-Y474 HydrophobicContact CD2-CD2 4.17Å; L447-Y474 HydrophobicContact CD2-CG 4.43Å; H449-Y474 VanDerWaalsContact O-CE2 3.26Å; H449-Y474 WeakPolarHBondContact O-CE2 3.48Å; H449-Y474 PolarHBondContact O-OH 3.4Å; I451-Y474 WeakPolarHBondContact CB-OH 3.5Å; I451-Y474 PolarHBondContact N-OH 2.81Å; T470-Y474 WeakPolarHBondContact O-CB 3.29Å; T470-Y474 PolarHBondContact O-N 2.74Å; L471-Y474 WeakPolarHBondContact O-CB 3.49Å; L471-Y474 PolarHBondContact O-N 3.14Å; Y474-R478 VanDerWaalsContact CE2-NH1 3.32Å; Y474-R478 PolarHBondContact O-NH1 3.05Å; Y474-F483 HydrophobicContact CD1-CE1 4.26Å; Y474-F483 HydrophobicContact CD1-CZ 4.31Å; Y474-F483 HydrophobicContact CE1-CE1 4.05Å; Y474-F483 HydrophobicContact CE1-CZ 4.19Å; Y474-F645 HydrophobicContact CD1-CE1 4.03Å; Y474-F645 AromaticContact CD1-CZ 3.78Å; Y474-F645 HydrophobicContact CD1-CZ 3.78Å; Y474-F645 HydrophobicContact CE1-CE1 4.37Å; Y474-F645 HydrophobicContact CE1-CZ 4.47Å; Y474-I668 HydrophobicContact CD1-CD1 4.28Å; Y474-I668 HydrophobicContact CE1-CD1 3.84Å
475	A	94.8	Very high	93.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-69.2	-40	176.6	0	0	0	0	0	112.6	L471 V472 Q477 R478 F483 P501 N503 V504 F645	L471-A475 PolarHBondContact O-N 2.82Å; V472-A475 PolarHBondContact O-N 3.03Å; A475-Q477 VanDerWaalsContact C-N 3.28Å; A475-Q477 PolarHBondContact O-N 3.35Å; A475-R478 CarbonylContact O-C 3.52Å; A475-R478 VanDerWaalsContact O-C 3.3Å; A475-R478 PolarHBondContact O-N 3.2Å; A475-F483 HydrophobicContact CB-CD2 3.82Å; A475-F483 HydrophobicContact CB-CE2 3.93Å; A475-F483 HydrophobicContact CB-CG 4.41Å; A475-P501 HydrophobicContact CB-CG 3.85Å; A475-N503 PolarHBondContact O-ND2 3.34Å; A475-V504 HydrophobicContact CB-CG2 3.44Å; A475-V504 VanDerWaalsContact CB-CG2 3.44Å; A475-F645 HydrophobicContact CB-CE2 4.02Å; A475-F645 HydrophobicContact CB-CZ 4.23Å
476	A	93.3	Very high	93.3	Very high	52 Å²	52	38.5 Å²	38.5	43%	0.43	20%	0.198	S	C	.	.	H	α-helix	trans	-64.6	-31.3	-180	0	0	0	0	0	112.8	V472 R473 R478 P501	V472-A476 VanDerWaalsContact O-CB 3.3Å; V472-A476 WeakPolarHBondContact O-CB 3.43Å; V472-A476 PolarHBondContact O-N 2.91Å; R473-A476 PolarHBondContact O-N 3.46Å; A476-R478 PolarHBondContact O-N 3.46Å; A476-P501 HydrophobicContact CB-CG 4.25Å
477	Q	93.1	Very high	93.4	Very high	107 Å²	107	37.8 Å²	37.8	50%	0.5	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-16.5	174.5	-171.4	174	-7.2	0	0	112.8	R473 A475 P479	R473-Q477 PolarHBondContact O-N 3.3Å; A475-Q477 VanDerWaalsContact C-N 3.28Å; A475-Q477 PolarHBondContact O-N 3.35Å; Q477-P479 VanDerWaalsContact C-CD 3.43Å; Q477-P479 WeakPolarHBondContact O-CD 3.35Å
478	R	93.9	Very high	92.9	Very high	10 Å²	10	38.5 Å²	38.5	4%	0.038	19%	0.194	C	C	.	.			trans	-125.6	65	-175.5	-63.7	177.9	-179.8	75.7	2.6	111.1	L447 H449 D450 Y474 A475 A476 H480 L481 F483 N503	L447-R478 PolarHBondContact O-NH1 3.24Å; L447-R478 PolarHBondContact O-NH2 3.33Å; H449-R478 PolarHBondContact O-NH2 3.24Å; H449-R478 VanDerWaalsContact O-NH2 3.12Å; D450-R478 IonicContact OD1-CZ 3.89Å; D450-R478 IonicContact OD1-NE 3.17Å; D450-R478 PolarHBondContact OD1-NE 3.13Å; D450-R478 IonicContact OD1-NH2 3.81Å; D450-R478 PolarHBondContact OD1-NH2 2.93Å; Y474-R478 VanDerWaalsContact CE2-NH1 3.32Å; Y474-R478 PolarHBondContact O-NH1 3.05Å; A475-R478 CarbonylContact O-C 3.52Å; A475-R478 VanDerWaalsContact O-C 3.3Å; A475-R478 PolarHBondContact O-N 3.2Å; A476-R478 PolarHBondContact O-N 3.46Å; R478-H480 PolarHBondContact O-N 2.77Å; R478-H480 VanDerWaalsContact O-N 3.13Å; R478-L481 HydrophobicContact CB-CB 4.42Å; R478-L481 HydrophobicContact CB-CD1 4.09Å; R478-L481 HydrophobicContact CB-CG 4.28Å; R478-L481 HydrophobicContact CG-CD1 4.45Å; R478-L481 PolarHBondContact O-N 2.89Å; R478-L481 VanDerWaalsContact O-N 3.12Å; R478-F483 HydrophobicContact CB-CE2 4.26Å; R478-F483 HydrophobicContact CB-CZ 4.17Å; R478-N503 PolarHBondContact O-ND2 2.96Å; R478-N503 VanDerWaalsContact O-ND2 3.14Å
479	P	93.8	Very high	92.5	Very high	95 Å²	95	39.6 Å²	39.6	62%	0.617	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-15	-178	29	-36.5	0	0	0	113.7	Q477	Q477-P479 VanDerWaalsContact C-CD 3.43Å; Q477-P479 WeakPolarHBondContact O-CD 3.35Å
480	H	93.6	Very high	92.2	Very high	147 Å²	147	38.9 Å²	38.9	68%	0.681	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-12.5	177.2	60.3	-85.1	0	0	0	113.5	R478	R478-H480 PolarHBondContact O-N 2.77Å; R478-H480 VanDerWaalsContact O-N 3.13Å
481	L	94.5	Very high	91.7	Very high	34 Å²	34	41.4 Å²	41.4	18%	0.178	21%	0.211	C	C	.	.	S	Bend	trans	-102.2	145.8	177	-60.9	-179.1	0	0	0	110.7	I451 R478 F483 N503 D642	I451-L481 HydrophobicContact CG2-CD1 4.16Å; R478-L481 HydrophobicContact CB-CB 4.42Å; R478-L481 HydrophobicContact CB-CD1 4.09Å; R478-L481 HydrophobicContact CB-CG 4.28Å; R478-L481 HydrophobicContact CG-CD1 4.45Å; R478-L481 PolarHBondContact O-N 2.89Å; R478-L481 VanDerWaalsContact O-N 3.12Å; L481-F483 HydrophobicContact CB-CD2 4.42Å; L481-F483 HydrophobicContact CB-CE2 3.66Å; L481-F483 HydrophobicContact CB-CZ 3.73Å; L481-F483 HydrophobicContact CD1-CZ 3.95Å; L481-F483 HydrophobicContact CG-CZ 4.48Å; L481-N503 WeakPolarHBondContact O-CB 3.29Å; L481-N503 PolarHBondContact O-ND2 3.36Å; L481-D642 WeakPolarHBondContact CA-OD2 3.44Å; L481-D642 HydrophobicContact CD2-CB 4.16Å
482	R	95.3	Very high	91.2	Very high	117 Å²	117	43.6 Å²	43.6	44%	0.442	23%	0.225	S	C	.	.			trans	-100.4	125.9	174.7	-60.7	175.3	-63	160.7	8.7	109.7	E639 R640 D642 A643	R482-E639 PolarHBondContact NH1-O 3.12Å; R482-E639 PolarHBondContact NH2-O 2.94Å; R482-E639 VanDerWaalsContact NH2-O 3.08Å; R482-R640 PolarHBondContact NE-O 2.86Å; R482-R640 PolarHBondContact NH1-O 3.28Å; R482-D642 PolarHBondContact N-OD2 3.2Å; R482-D642 IonicContact NE-OD1 2.76Å; R482-D642 IonicContact NE-OD2 3.87Å; R482-D642 IonicContact NH2-OD1 3.46Å; R482-D642 PolarHBondContact NH2-OD1 3.35Å; R482-D642 PolarHBondContact O-N 3.33Å; R482-A643 PolarHBondContact O-N 2.94Å
483	F	96.6	Very high	90.9	Very high	1 Å²	1	42.5 Å²	42.5	0%	0.004	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	145.2	-177.2	-62.7	-85.4	0	0	0	111.8	Y474 A475 R478 L481 N503 V504 D505 A643 F645	Y474-F483 HydrophobicContact CD1-CE1 4.26Å; Y474-F483 HydrophobicContact CD1-CZ 4.31Å; Y474-F483 HydrophobicContact CE1-CE1 4.05Å; Y474-F483 HydrophobicContact CE1-CZ 4.19Å; A475-F483 HydrophobicContact CB-CD2 3.82Å; A475-F483 HydrophobicContact CB-CE2 3.93Å; A475-F483 HydrophobicContact CB-CG 4.41Å; R478-F483 HydrophobicContact CB-CE2 4.26Å; R478-F483 HydrophobicContact CB-CZ 4.17Å; L481-F483 HydrophobicContact CB-CD2 4.42Å; L481-F483 HydrophobicContact CB-CE2 3.66Å; L481-F483 HydrophobicContact CB-CZ 3.73Å; L481-F483 HydrophobicContact CD1-CZ 3.95Å; L481-F483 HydrophobicContact CG-CZ 4.48Å; F483-N503 PolarHBondContact N-O 3.32Å; F483-V504 HydrophobicContact CB-CB 4.3Å; F483-V504 HydrophobicContact CB-CG1 4.11Å; F483-V504 HydrophobicContact CB-CG2 3.89Å; F483-V504 HydrophobicContact CD2-CG2 4.12Å; F483-V504 HydrophobicContact CG-CG2 4.37Å; F483-V504 WeakPolarHBondContact O-CA 3.46Å; F483-D505 PolarHBondContact O-N 3.22Å; F483-A643 WeakPolarHBondContact CA-O 3.37Å; F483-A643 HydrophobicContact CD1-CB 3.74Å; F483-A643 HydrophobicContact CE1-CB 3.79Å; F483-F645 HydrophobicContact CB-CE2 4.23Å; F483-F645 HydrophobicContact CB-CZ 4.32Å; F483-F645 HydrophobicContact CD1-CD1 4.3Å; F483-F645 AromaticContact CD1-CE1 3.43Å; F483-F645 HydrophobicContact CD1-CE1 3.43Å; F483-F645 VanDerWaalsContact CD1-CE1 3.43Å; F483-F645 AromaticContact CD1-CE2 4Å; F483-F645 HydrophobicContact CD1-CE2 4Å; F483-F645 AromaticContact CD1-CZ 3.25Å; F483-F645 HydrophobicContact CD1-CZ 3.25Å; F483-F645 HydrophobicContact CD2-CZ 4.49Å; F483-F645 AromaticContact CE1-CE1 3.69Å; F483-F645 HydrophobicContact CE1-CE1 3.69Å; F483-F645 AromaticContact CE1-CZ 3.54Å; F483-F645 HydrophobicContact CE1-CZ 3.54Å; F483-F645 HydrophobicContact CG-CE1 4.34Å; F483-F645 HydrophobicContact CG-CE2 4.12Å; F483-F645 AromaticContact CG-CZ 3.78Å; F483-F645 HydrophobicContact CG-CZ 3.78Å; F483-F645 HydrophobicContact CZ-CZ 4.28Å
484	L	96	Very high	90.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	119.9	164	174.9	65.3	0	0	0	109.2	V486 D505 K507 L512 L637 Y641 A643 I644 F645	L484-V486 HydrophobicContact CD2-CG2 3.95Å; L484-V486 HydrophobicContact CG-CG2 3.86Å; L484-D505 HydrophobicContact CD1-CB 4.26Å; L484-K507 HydrophobicContact CD1-CB 4.44Å; L484-L512 HydrophobicContact CD2-CD1 4.16Å; L484-L637 HydrophobicContact CD2-CD1 3.97Å; L484-Y641 HydrophobicContact CB-CD1 3.82Å; L484-Y641 HydrophobicContact CB-CD2 3.73Å; L484-Y641 HydrophobicContact CB-CE1 4.04Å; L484-Y641 HydrophobicContact CB-CE2 3.94Å; L484-Y641 HydrophobicContact CB-CG 3.64Å; L484-Y641 HydrophobicContact CD1-CE1 4.38Å; L484-Y641 HydrophobicContact CD1-CE2 4.08Å; L484-Y641 HydrophobicContact CD2-CD2 4.03Å; L484-Y641 HydrophobicContact CD2-CE2 3.88Å; L484-Y641 HydrophobicContact CG-CD2 4.36Å; L484-Y641 HydrophobicContact CG-CE2 4.18Å; L484-A643 PolarHBondContact N-O 3.18Å; L484-I644 HydrophobicContact CB-CG1 4.31Å; L484-I644 HydrophobicContact CB-CG2 4.49Å; L484-I644 HydrophobicContact CD2-CG1 4.44Å; L484-I644 HydrophobicContact CD2-CG2 4.39Å; L484-I644 HydrophobicContact CG-CG2 4.5Å; L484-I644 CarbonylContact O-C 3.37Å; L484-I644 WeakPolarHBondContact O-CA 3.42Å; L484-F645 PolarHBondContact O-N 3.35Å
485	Y	96.3	Very high	90.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	115.7	171.1	175.2	-97.5	0	0	0	110.3	L471 A487 A496 F500 D505 C506 K507 F645 D647	L471-Y485 HydrophobicContact CD1-CD2 4.36Å; L471-Y485 HydrophobicContact CD1-CE2 4.04Å; Y485-A487 HydrophobicContact CD1-CB 4.41Å; Y485-A487 HydrophobicContact CE1-CB 3.71Å; Y485-A496 HydrophobicContact CD1-CB 3.73Å; Y485-A496 HydrophobicContact CE1-CB 3.3Å; Y485-F500 HydrophobicContact CD1-CE2 4.45Å; Y485-F500 HydrophobicContact CD2-CE1 4.35Å; Y485-F500 AromaticContact CD2-CE2 3.94Å; Y485-F500 HydrophobicContact CD2-CE2 3.94Å; Y485-F500 AromaticContact CD2-CZ 3.6Å; Y485-F500 HydrophobicContact CD2-CZ 3.6Å; Y485-F500 HydrophobicContact CE1-CE2 4.43Å; Y485-F500 AromaticContact CE2-CE2 3.94Å; Y485-F500 HydrophobicContact CE2-CE2 3.94Å; Y485-F500 AromaticContact CE2-CZ 3.79Å; Y485-F500 HydrophobicContact CE2-CZ 3.79Å; Y485-F500 HydrophobicContact CG-CE2 4.19Å; Y485-F500 HydrophobicContact CG-CZ 4.17Å; Y485-D505 PolarHBondContact N-O 3.17Å; Y485-C506 HydrophobicContact CD1-CB 3.82Å; Y485-C506 WeakPolarHBondContact O-CA 3.44Å; Y485-K507 PolarHBondContact O-N 3.02Å; Y485-K507 VanDerWaalsContact O-O 3.09Å; Y485-F645 HydrophobicContact CD2-CB 3.92Å; Y485-F645 HydrophobicContact CD2-CD2 4.3Å; Y485-D647 HydrophobicContact CE2-CB 3.73Å; Y485-D647 PolarHBondContact OH-OD2 3.3Å
486	V	94.3	Very high	89.9	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.024	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	111.5	177.6	-172.7	0	0	0	0	109.6	L484 K507 A509 L512 I644 F645 D647 L660	L484-V486 HydrophobicContact CD2-CG2 3.95Å; L484-V486 HydrophobicContact CG-CG2 3.86Å; V486-K507 VanDerWaalsContact CA-O 3.31Å; V486-K507 WeakPolarHBondContact CA-O 3.46Å; V486-A509 HydrophobicContact CG1-CB 4.14Å; V486-L512 HydrophobicContact CG2-CD1 4.45Å; V486-I644 HydrophobicContact CG2-CG2 3.98Å; V486-F645 PolarHBondContact N-O 3.05Å; V486-D647 PolarHBondContact O-N 2.82Å; V486-D647 VanDerWaalsContact O-N 3.11Å; V486-L660 HydrophobicContact CB-CD1 4.44Å; V486-L660 HydrophobicContact CG1-CD1 4.17Å; V486-L660 HydrophobicContact CG2-CD1 4.43Å; V486-L660 HydrophobicContact CG2-CD2 4.07Å
487	A	89.8	Confident	89.8	Confident	3 Å²	3	45.8 Å²	45.8	3%	0.025	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	155.9	173.2	0	0	0	0	0	112	Y485 V492 A493 K507 T508	Y485-A487 HydrophobicContact CD1-CB 4.41Å; Y485-A487 HydrophobicContact CE1-CB 3.71Å; A487-V492 HydrophobicContact CB-CB 4.25Å; A487-V492 HydrophobicContact CB-CG1 4.04Å; A487-A493 HydrophobicContact CB-CB 4.04Å; A487-K507 PolarHBondContact N-O 3.33Å; A487-T508 WeakPolarHBondContact O-CA 3.45Å
488	F	80.8	Confident	89.7	Confident	42 Å²	42	48.6 Å²	48.6	18%	0.184	24%	0.235	C	C	.	.	S	Bend	trans	-76.2	-38.7	174.6	-174.1	-101.1	0	0	0	112.9	D651 Y678	F488-D651 HydrophobicContact CD2-CB 4.34Å; F488-D651 HydrophobicContact CE2-CB 4.34Å; F488-D651 VanDerWaalsContact CE2-O 3.26Å; F488-D651 WeakPolarHBondContact CE2-O 3.35Å; F488-Y678 HydrophobicContact CE1-CD1 4.5Å; F488-Y678 HydrophobicContact CE1-CD2 4.08Å; F488-Y678 HydrophobicContact CE1-CE1 4.43Å; F488-Y678 AromaticContact CE1-CE2 3.99Å; F488-Y678 HydrophobicContact CE1-CE2 3.99Å; F488-Y678 HydrophobicContact CE1-CG 4.33Å; F488-Y678 HydrophobicContact CZ-CD2 4.32Å; F488-Y678 HydrophobicContact CZ-CG 4.26Å
489	N	81.1	Confident	89.4	Confident	54 Å²	54	53.1 Å²	53.1	29%	0.289	25%	0.252	S	S	.	.	S	Bend	trans	-115.3	148.5	-178.4	-69.2	-21.3	0	0	0	111.4	V492 A493	N489-V492 HydrophobicContact CB-CG2 4.21Å; N489-V492 PolarHBondContact O-N 2.96Å; N489-A493 PolarHBondContact O-N 3.37Å
490	N	81.9	Confident	89.5	Confident	17 Å²	17	49.4 Å²	49.4	9%	0.091	23%	0.226	C	C	.	.	H	α-helix	trans	-67.2	-37.1	177.7	-169	49.1	0	0	0	112.9	D139 V492 A493 S494 T508	D139-N490 HydrophobicContact CB-CB 3.56Å; N490-V492 VanDerWaalsContact C-N 3.27Å; N490-V492 PolarHBondContact O-N 3.19Å; N490-A493 WeakPolarHBondContact O-CB 3.34Å; N490-A493 PolarHBondContact O-N 2.95Å; N490-A493 VanDerWaalsContact O-N 3.08Å; N490-S494 WeakPolarHBondContact O-CB 3.39Å; N490-S494 PolarHBondContact O-N 3.34Å; N490-S494 PolarHBondContact O-OG 3.13Å; N490-S494 VanDerWaalsContact O-OG 3.13Å; N490-T508 HydrophobicContact CB-CG2 4.27Å
491	S	82	Confident	89.5	Confident	55 Å²	55	43.6 Å²	43.6	39%	0.385	20%	0.201	S	C	.	.	H	α-helix	trans	-55.1	-43.3	173.8	46.6	0	0	0	0	112.2	S494 E495	S491-S494 PolarHBondContact O-N 2.76Å; S491-E495 PolarHBondContact O-N 2.84Å
492	V	84.1	Confident	89.4	Confident	47 Å²	47	48.5 Å²	48.5	29%	0.285	24%	0.235	S	C	.	.	H	α-helix	trans	-68.5	-39.4	175.2	178.4	0	0	0	0	111.7	A487 N489 N490 A496	A487-V492 HydrophobicContact CB-CB 4.25Å; A487-V492 HydrophobicContact CB-CG1 4.04Å; N489-V492 HydrophobicContact CB-CG2 4.21Å; N489-V492 PolarHBondContact O-N 2.96Å; N490-V492 VanDerWaalsContact C-N 3.27Å; N490-V492 PolarHBondContact O-N 3.19Å; V492-A496 VanDerWaalsContact O-CB 3.22Å; V492-A496 WeakPolarHBondContact O-CB 3.19Å; V492-A496 PolarHBondContact O-N 3.42Å
493	A	87.3	Confident	89.5	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-44.4	175.5	0	0	0	0	0	111.7	A487 N489 N490 A496 R497 T508	A487-A493 HydrophobicContact CB-CB 4.04Å; N489-A493 PolarHBondContact O-N 3.37Å; N490-A493 WeakPolarHBondContact O-CB 3.34Å; N490-A493 PolarHBondContact O-N 2.95Å; N490-A493 VanDerWaalsContact O-N 3.08Å; A493-A496 WeakPolarHBondContact O-CB 3.47Å; A493-A496 PolarHBondContact O-N 2.93Å; A493-R497 WeakPolarHBondContact O-CG 3.21Å; A493-R497 PolarHBondContact O-N 3.18Å; A493-T508 HydrophobicContact CB-CG2 3.96Å
494	S	87	Confident	89.4	Confident	31 Å²	31	44.9 Å²	44.9	22%	0.217	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-41.2	178.9	-65.4	0	0	0	0	112.5	N490 S491 A496 R497	N490-S494 WeakPolarHBondContact O-CB 3.39Å; N490-S494 PolarHBondContact O-N 3.34Å; N490-S494 PolarHBondContact O-OG 3.13Å; N490-S494 VanDerWaalsContact O-OG 3.13Å; S491-S494 PolarHBondContact O-N 2.76Å; S494-A496 VanDerWaalsContact C-N 3.34Å; S494-R497 PolarHBondContact O-N 2.86Å
495	E	85.1	Confident	89.4	Confident	100 Å²	100	48.1 Å²	48.1	47%	0.467	24%	0.242	S	C	.	.	H	α-helix	trans	-62.9	-43.6	171.6	-167.7	-160.8	143.9	0	0	110.8	S491 R497 R498 R499	S491-E495 PolarHBondContact O-N 2.84Å; E495-R497 PolarHBondContact O-N 3.34Å; E495-R498 PolarHBondContact O-N 3.34Å; E495-R498 VanDerWaalsContact O-N 3.15Å; E495-R499 PolarHBondContact O-N 3.46Å; E495-R499 WeakPolarHBondContact OE1-CD 3.46Å; E495-R499 IonicContact OE1-CZ 3.91Å; E495-R499 IonicContact OE1-NH1 2.99Å; E495-R499 PolarHBondContact OE1-NH1 3.38Å
496	A	88	Confident	89.3	Confident	2 Å²	2	48.4 Å²	48.4	2%	0.017	24%	0.244	C	C	.	.	H	α-helix	trans	-59.8	-43.2	178.3	0	0	0	0	0	111.9	Y485 V492 A493 S494 R498 R499 F500 C506	Y485-A496 HydrophobicContact CD1-CB 3.73Å; Y485-A496 HydrophobicContact CE1-CB 3.3Å; V492-A496 VanDerWaalsContact O-CB 3.22Å; V492-A496 WeakPolarHBondContact O-CB 3.19Å; V492-A496 PolarHBondContact O-N 3.42Å; A493-A496 WeakPolarHBondContact O-CB 3.47Å; A493-A496 PolarHBondContact O-N 2.93Å; S494-A496 VanDerWaalsContact C-N 3.34Å; A496-R498 PolarHBondContact O-N 3.1Å; A496-R498 VanDerWaalsContact O-N 3.08Å; A496-R499 PolarHBondContact O-N 2.91Å; A496-F500 HydrophobicContact CB-CD2 3.68Å; A496-F500 HydrophobicContact CB-CE2 3.75Å; A496-F500 WeakPolarHBondContact O-CB 2.98Å; A496-F500 VanDerWaalsContact O-CD2 3.31Å; A496-F500 WeakPolarHBondContact O-CD2 3.22Å; A496-F500 PolarHBondContact O-N 3.3Å; A496-C506 HydrophobicContact CB-CB 4.1Å
497	R	91.1	Very high	89.3	Confident	96 Å²	96	51.3 Å²	51.3	36%	0.362	26%	0.257	S	S	.	.	H	α-helix	trans	-54.3	-32.1	176.6	-71.4	178.3	-160.2	167.1	-2	113.6	E136 A493 S494 E495 C506	E136-R497 IonicContact OE1-CZ 3.74Å; E136-R497 IonicContact OE1-NH1 3.9Å; E136-R497 PolarHBondContact OE1-NH1 3Å; E136-R497 IonicContact OE1-NH2 3.4Å; E136-R497 PolarHBondContact OE1-NH2 3.4Å; E136-R497 IonicContact OE2-NH1 2.71Å; E136-R497 PolarHBondContact OE2-NH1 2.94Å; A493-R497 WeakPolarHBondContact O-CG 3.21Å; A493-R497 PolarHBondContact O-N 3.18Å; S494-R497 PolarHBondContact O-N 2.86Å; E495-R497 PolarHBondContact O-N 3.34Å; R497-C506 HydrophobicContact CG-CB 3.57Å; R497-C506 PolarHBondContact NE-O 3.25Å; R497-C506 VanDerWaalsContact NE-O 3.12Å
498	R	90.4	Very high	89.4	Confident	166 Å²	166	51.2 Å²	51.2	63%	0.626	26%	0.256	S	S	*	.	H	α-helix	trans	-80.3	-24.8	179.2	-61.6	178.8	-172	178.7	2.9	113.1	L165 E495 A496	L165-R498 VanDerWaalsContact CD1-NH1 3.27Å; E495-R498 PolarHBondContact O-N 3.34Å; E495-R498 VanDerWaalsContact O-N 3.15Å; A496-R498 PolarHBondContact O-N 3.1Å; A496-R498 VanDerWaalsContact O-N 3.08Å
499	R	89.4	Confident	89.9	Confident	105 Å²	105	49.5 Å²	49.5	40%	0.396	25%	0.249	S	C	.	.	H	α-helix	trans	-102.1	-31.2	-172	-67	-178.8	64.4	179.2	-0.5	113.5	T469 V472 E495 A496	T469-R499 PolarHBondContact OG1-NH2 3.32Å; V472-R499 WeakPolarHBondContact CG1-O 3.38Å; V472-R499 HydrophobicContact CG2-CB 4.35Å; E495-R499 PolarHBondContact O-N 3.46Å; E495-R499 WeakPolarHBondContact OE1-CD 3.46Å; E495-R499 IonicContact OE1-CZ 3.91Å; E495-R499 IonicContact OE1-NH1 2.99Å; E495-R499 PolarHBondContact OE1-NH1 3.38Å; A496-R499 PolarHBondContact O-N 2.91Å
500	F	94.1	Very high	90.4	Very high	17 Å²	17	48 Å²	48	8%	0.075	24%	0.24	C	C	.	.	S	Bend	trans	-77.3	149.3	-178.7	-84.4	-93.2	0	0	0	111.4	T468 L471 V472 Y485 A496 V504 F645	T468-F500 HydrophobicContact CG2-CE2 3.88Å; T468-F500 HydrophobicContact CG2-CZ 4.36Å; L471-F500 HydrophobicContact CB-CE1 3.85Å; L471-F500 HydrophobicContact CB-CZ 3.72Å; V472-F500 HydrophobicContact CB-CD1 4.46Å; V472-F500 HydrophobicContact CB-CE1 4.48Å; V472-F500 HydrophobicContact CG2-CD1 3.86Å; V472-F500 HydrophobicContact CG2-CD2 3.7Å; V472-F500 HydrophobicContact CG2-CE1 3.88Å; V472-F500 HydrophobicContact CG2-CE2 3.73Å; V472-F500 HydrophobicContact CG2-CG 3.8Å; V472-F500 HydrophobicContact CG2-CZ 3.83Å; Y485-F500 HydrophobicContact CD1-CE2 4.45Å; Y485-F500 HydrophobicContact CD2-CE1 4.35Å; Y485-F500 AromaticContact CD2-CE2 3.94Å; Y485-F500 HydrophobicContact CD2-CE2 3.94Å; Y485-F500 AromaticContact CD2-CZ 3.6Å; Y485-F500 HydrophobicContact CD2-CZ 3.6Å; Y485-F500 HydrophobicContact CE1-CE2 4.43Å; Y485-F500 AromaticContact CE2-CE2 3.94Å; Y485-F500 HydrophobicContact CE2-CE2 3.94Å; Y485-F500 AromaticContact CE2-CZ 3.79Å; Y485-F500 HydrophobicContact CE2-CZ 3.79Å; Y485-F500 HydrophobicContact CG-CE2 4.19Å; Y485-F500 HydrophobicContact CG-CZ 4.17Å; A496-F500 HydrophobicContact CB-CD2 3.68Å; A496-F500 HydrophobicContact CB-CE2 3.75Å; A496-F500 WeakPolarHBondContact O-CB 2.98Å; A496-F500 VanDerWaalsContact O-CD2 3.31Å; A496-F500 WeakPolarHBondContact O-CD2 3.22Å; A496-F500 PolarHBondContact O-N 3.3Å; F500-V504 HydrophobicContact CB-CB 4Å; F500-V504 HydrophobicContact CB-CG1 4.16Å; F500-V504 HydrophobicContact CB-CG2 4.36Å; F500-V504 HydrophobicContact CD1-CB 4.06Å; F500-V504 HydrophobicContact CD1-CG1 3.7Å; F500-V504 HydrophobicContact CD1-CG2 3.86Å; F500-V504 HydrophobicContact CE1-CG1 4.3Å; F500-V504 HydrophobicContact CG-CB 4.35Å; F500-V504 HydrophobicContact CG-CG1 4.04Å; F500-F645 AromaticContact CE1-CD2 3.95Å; F500-F645 HydrophobicContact CE1-CD2 3.95Å; F500-F645 AromaticContact CE1-CE2 3.97Å; F500-F645 HydrophobicContact CE1-CE2 3.97Å; F500-F645 HydrophobicContact CZ-CD2 4.49Å
501	P	94.4	Very high	90.9	Very high	25 Å²	25	48.8 Å²	48.8	16%	0.162	25%	0.247	C	C	.	.			trans	-65.3	161	173.2	30.3	-37.6	0	0	0	111.7	A475 A476 N503 V504	A475-P501 HydrophobicContact CB-CG 3.85Å; A476-P501 HydrophobicContact CB-CG 4.25Å; P501-N503 VanDerWaalsContact CB-OD1 3.24Å; P501-N503 WeakPolarHBondContact CB-OD1 3.32Å; P501-N503 WeakPolarHBondContact CG-OD1 3.39Å; P501-N503 PolarHBondContact O-N 2.93Å; P501-V504 HydrophobicContact CG-CG2 3.91Å; P501-V504 PolarHBondContact O-N 3.46Å; P501-V504 VanDerWaalsContact O-N 3.13Å
502	P	93.5	Very high	91.4	Very high	136 Å²	136	46.7 Å²	46.7	88%	0.883	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-11.8	-172.9	26.5	-36.6	0	0	0	114.9	V504	P502-V504 PolarHBondContact O-N 3.16Å
503	N	95.6	Very high	91.8	Very high	29 Å²	29	44.5 Å²	44.5	16%	0.155	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	11.2	174.5	65	-50.8	0	0	0	113.6	A475 R478 L481 F483 P501	A475-N503 PolarHBondContact O-ND2 3.34Å; R478-N503 PolarHBondContact O-ND2 2.96Å; R478-N503 VanDerWaalsContact O-ND2 3.14Å; L481-N503 WeakPolarHBondContact O-CB 3.29Å; L481-N503 PolarHBondContact O-ND2 3.36Å; F483-N503 PolarHBondContact N-O 3.32Å; P501-N503 VanDerWaalsContact CB-OD1 3.24Å; P501-N503 WeakPolarHBondContact CB-OD1 3.32Å; P501-N503 WeakPolarHBondContact CG-OD1 3.39Å; P501-N503 PolarHBondContact O-N 2.93Å
504	V	96.1	Very high	92.1	Very high	13 Å²	13	46.7 Å²	46.7	8%	0.079	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	120.7	-176.8	-175.8	0	0	0	0	110.4	A475 F483 F500 P501 P502	A475-V504 HydrophobicContact CB-CG2 3.44Å; A475-V504 VanDerWaalsContact CB-CG2 3.44Å; F483-V504 HydrophobicContact CB-CB 4.3Å; F483-V504 HydrophobicContact CB-CG1 4.11Å; F483-V504 HydrophobicContact CB-CG2 3.89Å; F483-V504 HydrophobicContact CD2-CG2 4.12Å; F483-V504 HydrophobicContact CG-CG2 4.37Å; F483-V504 WeakPolarHBondContact O-CA 3.46Å; F500-V504 HydrophobicContact CB-CB 4Å; F500-V504 HydrophobicContact CB-CG1 4.16Å; F500-V504 HydrophobicContact CB-CG2 4.36Å; F500-V504 HydrophobicContact CD1-CB 4.06Å; F500-V504 HydrophobicContact CD1-CG1 3.7Å; F500-V504 HydrophobicContact CD1-CG2 3.86Å; F500-V504 HydrophobicContact CE1-CG1 4.3Å; F500-V504 HydrophobicContact CG-CB 4.35Å; F500-V504 HydrophobicContact CG-CG1 4.04Å; P501-V504 HydrophobicContact CG-CG2 3.91Å; P501-V504 PolarHBondContact O-N 3.46Å; P501-V504 VanDerWaalsContact O-N 3.13Å; P502-V504 PolarHBondContact O-N 3.16Å
505	D	95.3	Very high	92.2	Very high	68 Å²	68	47.7 Å²	47.7	36%	0.364	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	118.8	171.6	-81.2	6.5	0	0	0	110	F483 L484 Y485 K507 Y641	F483-D505 PolarHBondContact O-N 3.22Å; L484-D505 HydrophobicContact CD1-CB 4.26Å; Y485-D505 PolarHBondContact N-O 3.17Å; D505-K507 IonicContact OD2-NZ 3.51Å; D505-Y641 HydrophobicContact CB-CE1 3.78Å; D505-Y641 PolarHBondContact OD2-OH 3.49Å
506	C	95.3	Very high	92.4	Very high	6 Å²	6	46.9 Å²	46.9	4%	0.041	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	113.7	178.7	-57.1	0	0	0	0	111.7	Y485 A496 R497	Y485-C506 HydrophobicContact CD1-CB 3.82Å; Y485-C506 WeakPolarHBondContact O-CA 3.44Å; A496-C506 HydrophobicContact CB-CB 4.1Å; R497-C506 HydrophobicContact CG-CB 3.57Å; R497-C506 PolarHBondContact NE-O 3.25Å; R497-C506 VanDerWaalsContact NE-O 3.12Å
507	K	93.8	Very high	92.5	Very high	66 Å²	66	47.9 Å²	47.9	29%	0.287	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	158.2	-175	-68	-177	178.9	167.5	0	111.5	L484 Y485 V486 A487 D505 L512	L484-K507 HydrophobicContact CD1-CB 4.44Å; Y485-K507 PolarHBondContact O-N 3.02Å; Y485-K507 VanDerWaalsContact O-O 3.09Å; V486-K507 VanDerWaalsContact CA-O 3.31Å; V486-K507 WeakPolarHBondContact CA-O 3.46Å; A487-K507 PolarHBondContact N-O 3.33Å; D505-K507 IonicContact OD2-NZ 3.51Å; K507-L512 HydrophobicContact CB-CD2 4.25Å; K507-L512 HydrophobicContact CB-CG 4.21Å; K507-L512 HydrophobicContact CD-CD2 3.63Å; K507-L512 HydrophobicContact CD-CG 4.45Å
508	T	92.1	Very high	92.4	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	154.2	166.7	67.3	0	0	0	0	110.4	A487 N490 A493 H510 S511 L512	A487-T508 WeakPolarHBondContact O-CA 3.45Å; N490-T508 HydrophobicContact CB-CG2 4.27Å; A493-T508 HydrophobicContact CB-CG2 3.96Å; T508-H510 PolarHBondContact O-N 2.93Å; T508-S511 PolarHBondContact N-OG 2.71Å; T508-S511 PolarHBondContact O-N 3.18Å; T508-S511 VanDerWaalsContact O-N 3.07Å; T508-S511 PolarHBondContact O-OG 3.02Å; T508-S511 VanDerWaalsContact OG1-CB 3.26Å; T508-S511 WeakPolarHBondContact OG1-CB 3.35Å; T508-S511 PolarHBondContact OG1-N 3.04Å; T508-S511 PolarHBondContact OG1-OG 3.28Å; T508-L512 PolarHBondContact O-N 3.23Å; T508-L512 VanDerWaalsContact O-N 3.13Å
509	A	91.6	Very high	92.5	Very high	5 Å²	5	41.2 Å²	41.2	4%	0.041	21%	0.211	C	C	.	.	H	α-helix	trans	-57.4	-39.4	174.8	0	0	0	0	0	111.8	V486 L512 A513 I656	V486-A509 HydrophobicContact CG1-CB 4.14Å; A509-L512 PolarHBondContact O-N 3.04Å; A509-A513 PolarHBondContact O-N 2.92Å; A509-A513 VanDerWaalsContact O-N 3.14Å; A509-I656 HydrophobicContact CB-CD1 3.91Å; A509-I656 HydrophobicContact CB-CG1 3.97Å; A509-I656 HydrophobicContact CB-CG2 3.75Å
510	H	91.5	Very high	92.6	Very high	22 Å²	22	44.1 Å²	44.1	10%	0.102	22%	0.222	C	C	.	.	H	α-helix	trans	-65.6	-36.9	175	-66.7	76.7	0	0	0	112.7	T508 A513 Y514 D622	T508-H510 PolarHBondContact O-N 2.93Å; H510-A513 PolarHBondContact O-N 3.34Å; H510-Y514 WeakPolarHBondContact O-CB 3.32Å; H510-Y514 PolarHBondContact O-N 2.85Å; H510-D622 IonicContact CD2-OD1 2.8Å; H510-D622 IonicContact CE1-OD1 2.76Å; H510-D622 IonicContact NE2-OD1 2.64Å; H510-D622 PolarHBondContact NE2-OD1 3.06Å
511	S	92.3	Very high	92.3	Very high	35 Å²	35	43.9 Å²	43.9	25%	0.245	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-39.3	176.2	71.7	0	0	0	0	112.6	T508 Y514 S515	T508-S511 PolarHBondContact N-OG 2.71Å; T508-S511 PolarHBondContact O-N 3.18Å; T508-S511 VanDerWaalsContact O-N 3.07Å; T508-S511 PolarHBondContact O-OG 3.02Å; T508-S511 VanDerWaalsContact OG1-CB 3.26Å; T508-S511 WeakPolarHBondContact OG1-CB 3.35Å; T508-S511 PolarHBondContact OG1-N 3.04Å; T508-S511 PolarHBondContact OG1-OG 3.28Å; S511-Y514 PolarHBondContact O-N 3.39Å; S511-S515 PolarHBondContact O-N 3.16Å
512	L	91.9	Very high	92.1	Very high	11 Å²	11	47.1 Å²	47.1	6%	0.058	23%	0.232	C	C	.	.	H	α-helix	trans	-60.5	-52.9	174.4	-68.6	169.6	0	0	0	110.3	L484 V486 K507 T508 A509 Y514 S515 W628	L484-L512 HydrophobicContact CD2-CD1 4.16Å; V486-L512 HydrophobicContact CG2-CD1 4.45Å; K507-L512 HydrophobicContact CB-CD2 4.25Å; K507-L512 HydrophobicContact CB-CG 4.21Å; K507-L512 HydrophobicContact CD-CD2 3.63Å; K507-L512 HydrophobicContact CD-CG 4.45Å; T508-L512 PolarHBondContact O-N 3.23Å; T508-L512 VanDerWaalsContact O-N 3.13Å; A509-L512 PolarHBondContact O-N 3.04Å; L512-Y514 VanDerWaalsContact C-N 3.3Å; L512-Y514 PolarHBondContact O-N 3.12Å; L512-S515 PolarHBondContact O-N 3.02Å; L512-S515 PolarHBondContact O-OG 3.31Å; L512-W628 HydrophobicContact CB-CH2 4.17Å; L512-W628 HydrophobicContact CB-CZ2 4.1Å; L512-W628 HydrophobicContact CD1-CH2 4.49Å
513	A	92.6	Very high	91.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-33.4	178	0	0	0	0	0	113.3	A509 H510 E516 V517 G518 Y624 L625 W628	A509-A513 PolarHBondContact O-N 2.92Å; A509-A513 VanDerWaalsContact O-N 3.14Å; H510-A513 PolarHBondContact O-N 3.34Å; A513-E516 PolarHBondContact O-N 2.96Å; A513-V517 PolarHBondContact O-N 3.4Å; A513-G518 PolarHBondContact O-N 3.44Å; A513-Y624 HydrophobicContact CB-CD2 3.97Å; A513-Y624 HydrophobicContact CB-CE2 4.01Å; A513-L625 HydrophobicContact CB-CB 4.39Å; A513-L625 HydrophobicContact CB-CD1 3.63Å; A513-W628 HydrophobicContact CB-CB 3.71Å; A513-W628 HydrophobicContact CB-CD2 3.71Å; A513-W628 HydrophobicContact CB-CE3 3.81Å; A513-W628 HydrophobicContact CB-CG 3.7Å
514	Y	92.5	Very high	91.5	Very high	46 Å²	46	49 Å²	49	18%	0.18	24%	0.236	C	C	.	.	I	π-helix	trans	-66.2	-41.1	178.8	176.7	-94.4	0	0	0	111.4	H510 S511 L512 E516 G518 R519 K522 L527 Y624	H510-Y514 WeakPolarHBondContact O-CB 3.32Å; H510-Y514 PolarHBondContact O-N 2.85Å; S511-Y514 PolarHBondContact O-N 3.39Å; L512-Y514 VanDerWaalsContact C-N 3.3Å; L512-Y514 PolarHBondContact O-N 3.12Å; Y514-E516 VanDerWaalsContact C-N 3.28Å; Y514-E516 PolarHBondContact O-N 3.47Å; Y514-G518 CarbonylContact O-C 3.53Å; Y514-G518 WeakPolarHBondContact O-CA 3.31Å; Y514-G518 PolarHBondContact O-N 3.01Å; Y514-R519 HydrophobicContact CD1-CG 4.32Å; Y514-R519 HydrophobicContact CE1-CG 3.81Å; Y514-R519 PolarHBondContact O-N 3.46Å; Y514-K522 HydrophobicContact CE2-CB 4.28Å; Y514-K522 HydrophobicContact CE2-CD 4.48Å; Y514-K522 WeakPolarHBondContact OH-CD 3.42Å; Y514-L527 HydrophobicContact CE2-CD1 4.26Å; Y514-Y624 HydrophobicContact CD2-CE1 4.33Å
515	S	90.1	Very high	91.1	Very high	52 Å²	52	55.9 Å²	55.9	36%	0.364	27%	0.267	S	S	.	.	I	π-helix	trans	-59.4	-38.1	179.3	74.4	0	0	0	0	112.9	S511 L512	S511-S515 PolarHBondContact O-N 3.16Å; L512-S515 PolarHBondContact O-N 3.02Å; L512-S515 PolarHBondContact O-OG 3.31Å
516	E	89.4	Confident	90.8	Very high	84 Å²	84	52.6 Å²	52.6	39%	0.393	25%	0.25	S	C	.	.	I	π-helix	trans	-91.7	-41	-177.3	-67.9	-178.3	-158.5	0	0	113.9	A513 Y514 W628 R631	A513-E516 PolarHBondContact O-N 2.96Å; Y514-E516 VanDerWaalsContact C-N 3.28Å; Y514-E516 PolarHBondContact O-N 3.47Å; E516-W628 PolarHBondContact OE2-NE1 2.88Å; E516-R631 IonicContact OE2-CZ 3.84Å; E516-R631 IonicContact OE2-NH1 2.8Å; E516-R631 PolarHBondContact OE2-NH1 3.14Å
517	V	90.8	Very high	90.4	Very high	23 Å²	23	54.4 Å²	54.4	14%	0.139	26%	0.259	C	S	.	.	I	π-helix	trans	-116.8	-44.6	-171.5	-174.7	0	0	0	0	111.8	A513 R519 R520 Y521 L627 W628	A513-V517 PolarHBondContact O-N 3.4Å; V517-R519 PolarHBondContact O-N 3.47Å; V517-R520 PolarHBondContact O-N 2.65Å; V517-Y521 HydrophobicContact CG1-CE2 4.14Å; V517-L627 HydrophobicContact CG1-CB 4.04Å; V517-L627 HydrophobicContact CG1-CD1 4.4Å; V517-W628 HydrophobicContact CG2-CB 3.95Å
518	G	89.1	Confident	89.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.251	C	S	.	.	I	π-helix	trans	-63.8	-36.2	-173.5	0	0	0	0	0	114.6	A513 Y514 R520 Y521 K522	A513-G518 PolarHBondContact O-N 3.44Å; Y514-G518 CarbonylContact O-C 3.53Å; Y514-G518 WeakPolarHBondContact O-CA 3.31Å; Y514-G518 PolarHBondContact O-N 3.01Å; G518-R520 PolarHBondContact O-N 2.75Å; G518-R520 VanDerWaalsContact O-N 3.16Å; G518-Y521 PolarHBondContact O-N 2.82Å; G518-K522 PolarHBondContact O-N 2.72Å
519	R	90.7	Very high	89.1	Confident	121 Å²	121	58.8 Å²	58.8	46%	0.457	28%	0.279	S	S	.	.	H	α-helix	trans	-53	-37.5	178.1	-76.8	-176.8	-171.6	-174.3	3.6	112.5	E134 Y514 V517 Y521 K522 T523	E134-R519 IonicContact OE1-NH2 3.07Å; E134-R519 PolarHBondContact OE1-NH2 3.16Å; E134-R519 VanDerWaalsContact OE1-NH2 3.07Å; Y514-R519 HydrophobicContact CD1-CG 4.32Å; Y514-R519 HydrophobicContact CE1-CG 3.81Å; Y514-R519 PolarHBondContact O-N 3.46Å; V517-R519 PolarHBondContact O-N 3.47Å; R519-Y521 PolarHBondContact O-N 3.08Å; R519-K522 PolarHBondContact O-N 2.8Å; R519-T523 WeakPolarHBondContact O-CB 3.21Å; R519-T523 PolarHBondContact O-N 3.32Å; R519-T523 PolarHBondContact O-OG1 3.49Å
520	R	91.5	Very high	88.3	Confident	167 Å²	167	63.1 Å²	63.1	63%	0.63	30%	0.302	S	S	*	.	H	α-helix	trans	-61.8	-43.4	177.1	-173.1	178.7	-179.7	-177.3	-1.6	111.7	V517 G518 H524 V609	V517-R520 PolarHBondContact O-N 2.65Å; G518-R520 PolarHBondContact O-N 2.75Å; G518-R520 VanDerWaalsContact O-N 3.16Å; R520-H524 PolarHBondContact O-CD2 2.84Å; R520-H524 VanDerWaalsContact O-CD2 3.25Å; R520-H524 PolarHBondContact O-N 2.69Å; R520-V609 HydrophobicContact CG-CG2 4.4Å
521	Y	89.2	Confident	87.6	Confident	11 Å²	11	62.5 Å²	62.5	4%	0.043	30%	0.3	C	S	.	.	H	α-helix	trans	-74.6	-33.3	179.9	-69.4	-85.8	0	0	0	112.7	V517 G518 R519 H524 E525 K526 K607 V609 M619 L627	V517-Y521 HydrophobicContact CG1-CE2 4.14Å; G518-Y521 PolarHBondContact O-N 2.82Å; R519-Y521 PolarHBondContact O-N 3.08Å; Y521-H524 CarbonylContact O-C 3.48Å; Y521-H524 PolarHBondContact O-N 3.11Å; Y521-E525 PolarHBondContact O-N 3.38Å; Y521-K526 HydrophobicContact CD1-CB 4.39Å; Y521-K526 HydrophobicContact CD1-CD 4.22Å; Y521-K526 HydrophobicContact CE1-CD 4.48Å; Y521-K526 PolarHBondContact O-N 3.48Å; Y521-K607 PolarHBondContact OH-O 3.36Å; Y521-V609 HydrophobicContact CD1-CG2 4.38Å; Y521-V609 HydrophobicContact CE1-CG2 3.84Å; Y521-M619 HydrophobicContact CD1-CB 3.62Å; Y521-M619 HydrophobicContact CD1-CG 4.03Å; Y521-M619 HydrophobicContact CD2-CG 4.28Å; Y521-M619 HydrophobicContact CE1-CB 4.02Å; Y521-M619 HydrophobicContact CE1-CE 3.78Å; Y521-M619 HydrophobicContact CE1-CG 4.21Å; Y521-M619 HydrophobicContact CE2-CE 4.3Å; Y521-M619 HydrophobicContact CE2-CG 4.45Å; Y521-M619 HydrophobicContact CG-CB 4.02Å; Y521-M619 HydrophobicContact CG-CG 4.08Å; Y521-L627 HydrophobicContact CE2-CD1 4.01Å; Y521-L627 WeakPolarHBondContact OH-CD1 3.18Å
522	K	89	Confident	86.9	Confident	94 Å²	94	63.5 Å²	63.5	41%	0.409	30%	0.3	S	S	.	.	H	α-helix	trans	-64.5	-46.5	172.8	-170.4	-179.7	176.1	-171.6	0	111.5	I137 Y514 G518 R519 H524 E525 L527	I137-K522 HydrophobicContact CD1-CD 3.9Å; Y514-K522 HydrophobicContact CE2-CB 4.28Å; Y514-K522 HydrophobicContact CE2-CD 4.48Å; Y514-K522 WeakPolarHBondContact OH-CD 3.42Å; G518-K522 PolarHBondContact O-N 2.72Å; R519-K522 PolarHBondContact O-N 2.8Å; K522-H524 PolarHBondContact O-N 3.02Å; K522-E525 PolarHBondContact O-N 2.98Å; K522-L527 HydrophobicContact CB-CD1 3.61Å; K522-L527 HydrophobicContact CG-CD1 4.18Å
523	T	89.4	Confident	86.3	Confident	114 Å²	114	64.1 Å²	64.1	70%	0.699	30%	0.304	S	S	*	.	H	α-helix	trans	-58.4	-33.5	-179.8	-54.9	0	0	0	0	111.8	R519	R519-T523 WeakPolarHBondContact O-CB 3.21Å; R519-T523 PolarHBondContact O-N 3.32Å; R519-T523 PolarHBondContact O-OG1 3.49Å
524	H	87.1	Confident	85.7	Confident	90 Å²	90	65.9 Å²	65.9	42%	0.417	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	15.4	174.9	-73	-76.8	0	0	0	113.6	R520 Y521 K522 K526 V609 K612	R520-H524 PolarHBondContact O-CD2 2.84Å; R520-H524 VanDerWaalsContact O-CD2 3.25Å; R520-H524 PolarHBondContact O-N 2.69Å; Y521-H524 CarbonylContact O-C 3.48Å; Y521-H524 PolarHBondContact O-N 3.11Å; K522-H524 PolarHBondContact O-N 3.02Å; H524-K526 PolarHBondContact O-N 3.35Å; H524-K526 VanDerWaalsContact O-N 3.07Å; H524-V609 HydrophobicContact CB-CG1 3.48Å; H524-V609 VanDerWaalsContact CB-CG1 3.48Å; H524-V609 WeakPolarHBondContact CD2-CG1 3.5Å; H524-K612 WeakPolarHBondContact O-CE 3.31Å; H524-K612 PolarHBondContact O-NZ 2.94Å
525	E	87.3	Confident	85.1	Confident	157 Å²	157	64.2 Å²	64.2	73%	0.734	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	37	178.6	-59.8	-178.3	158.9	0	0	113.7	Y521 K522 Y618	Y521-E525 PolarHBondContact O-N 3.38Å; K522-E525 PolarHBondContact O-N 2.98Å; E525-Y618 WeakPolarHBondContact O-CE1 3.43Å
526	K	89	Confident	84.7	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	29%	0.29	C	S	.	.			trans	-111.5	17.1	-173.9	-153.8	-165.8	166.9	-175.3	0	112.9	Y521 H524 K605 M606 D608 E611 K612 Y617 Y618 M619	Y521-K526 HydrophobicContact CD1-CB 4.39Å; Y521-K526 HydrophobicContact CD1-CD 4.22Å; Y521-K526 HydrophobicContact CE1-CD 4.48Å; Y521-K526 PolarHBondContact O-N 3.48Å; H524-K526 PolarHBondContact O-N 3.35Å; H524-K526 VanDerWaalsContact O-N 3.07Å; K526-K605 PolarHBondContact NZ-O 2.64Å; K526-M606 PolarHBondContact NZ-O 3.29Å; K526-D608 PolarHBondContact NZ-O 3.11Å; K526-E611 WeakPolarHBondContact CE-O 3.3Å; K526-E611 PolarHBondContact NZ-O 2.93Å; K526-K612 HydrophobicContact CG-CG 4.44Å; K526-Y617 WeakPolarHBondContact CE-O 3.43Å; K526-Y617 PolarHBondContact NZ-O 2.99Å; K526-Y617 VanDerWaalsContact NZ-O 3.08Å; K526-Y618 HydrophobicContact CG-CD1 4.39Å; K526-Y618 HydrophobicContact CG-CG 4.38Å; K526-M619 PolarHBondContact O-N 2.75Å
527	L	87.2	Confident	84.4	Confident	44 Å²	44	59.3 Å²	59.3	23%	0.23	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	143.2	176.7	-69.7	176.3	0	0	0	110.7	Y514 K522 M619 Y624	Y514-L527 HydrophobicContact CE2-CD1 4.26Å; K522-L527 HydrophobicContact CB-CD1 3.61Å; K522-L527 HydrophobicContact CG-CD1 4.18Å; L527-M619 WeakPolarHBondContact CA-O 3.48Å; L527-M619 HydrophobicContact CD2-CB 4.41Å; L527-Y624 HydrophobicContact CD2-CD1 4Å; L527-Y624 HydrophobicContact CD2-CE1 4.27Å
528	T	84.8	Confident	83.9	Confident	20 Å²	20	63.5 Å²	63.5	12%	0.123	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	152.1	169.6	-175.3	0	0	0	0	109.3	N530 V531 M619 P620	T528-N530 PolarHBondContact OG1-O 2.87Å; T528-V531 HydrophobicContact CG2-CG2 4.44Å; T528-M619 PolarHBondContact N-O 3.35Å; T528-P620 HydrophobicContact CG2-CB 4.39Å; T528-P620 WeakPolarHBondContact O-CA 3.23Å
529	F	73.9	Confident	83.5	Confident	138 Å²	138	64 Å²	64	61%	0.605	31%	0.305	S	S	*	.	S	Bend	trans	-72.2	-40.2	176.3	-72.9	-79.2	0	0	0	112.1
530	N	74.4	Confident	83.1	Confident	97 Å²	97	59 Å²	59	52%	0.519	29%	0.287	S	S	.	.			trans	-155.8	154.2	-179.4	-163.6	-0.2	0	0	0	111	T528	T528-N530 PolarHBondContact OG1-O 2.87Å
531	V	77.2	Confident	82.4	Confident	8 Å²	8	54 Å²	54	5%	0.048	28%	0.275	C	S	.	.			trans	-96.4	102.4	177.3	-168	0	0	0	0	108.6	T528 I536 M606 P620	T528-V531 HydrophobicContact CG2-CG2 4.44Å; V531-I536 HydrophobicContact CB-CD1 4.43Å; V531-I536 HydrophobicContact CG1-CD1 3.55Å; V531-I536 HydrophobicContact CG1-CG1 3.58Å; V531-M606 HydrophobicContact CB-CE 4.46Å; V531-M606 HydrophobicContact CG1-CE 4.02Å; V531-M606 HydrophobicContact CG2-CE 3.69Å; V531-P620 HydrophobicContact CG2-CB 4.25Å; V531-P620 HydrophobicContact CG2-CG 3.98Å
532	K	78.3	Confident	81.1	Confident	57 Å²	57	60 Å²	60	25%	0.248	32%	0.315	C	S	.	.			trans	-73.2	142	-178.4	-65.6	-172.6	178.7	-170.2	0	111.3	E146 F534 S535 I536 L821	E146-K532 VanDerWaalsContact CD-NZ 3.31Å; E146-K532 IonicContact OE1-NZ 3.46Å; E146-K532 PolarHBondContact OE1-NZ 2.84Å; K532-F534 PolarHBondContact O-N 2.83Å; K532-F534 VanDerWaalsContact O-N 3.15Å; K532-S535 PolarHBondContact O-N 3.19Å; K532-I536 PolarHBondContact O-N 2.7Å; K532-I536 VanDerWaalsContact O-N 3.12Å; K532-L821 HydrophobicContact CD-CD1 4.29Å
533	P	79.9	Confident	79.8	Confident	24 Å²	24	59.4 Å²	59.4	16%	0.156	34%	0.336	C	S	.	.	H	α-helix	trans	-54.8	-34.1	173.5	-26.3	34.5	0	0	0	112.7	I536 N537 A550 K551 A554 T843	P533-I536 PolarHBondContact O-N 3.4Å; P533-N537 WeakPolarHBondContact O-CB 3.34Å; P533-N537 PolarHBondContact O-N 3.22Å; P533-A550 VanDerWaalsContact O-CB 3.29Å; P533-A550 WeakPolarHBondContact O-CB 3.46Å; P533-K551 HydrophobicContact CG-CD 4.24Å; P533-A554 HydrophobicContact CG-CB 4.48Å; P533-T843 HydrophobicContact CB-CG2 4.23Å
534	F	79.1	Confident	78.5	Confident	36 Å²	36	54.3 Å²	54.3	16%	0.158	31%	0.306	C	S	.	.	H	α-helix	trans	-58.3	-48.3	174.1	-176.2	-93.4	0	0	0	112.8	K532 I536 N537 L538 Y547 L821 T824	K532-F534 PolarHBondContact O-N 2.83Å; K532-F534 VanDerWaalsContact O-N 3.15Å; F534-I536 VanDerWaalsContact C-N 3.33Å; F534-I536 PolarHBondContact O-N 2.72Å; F534-N537 WeakPolarHBondContact O-CB 3.42Å; F534-N537 PolarHBondContact O-N 2.8Å; F534-L538 HydrophobicContact CD1-CD1 4.2Å; F534-L538 HydrophobicContact CE1-CD1 3.73Å; F534-L538 HydrophobicContact CZ-CD1 4.31Å; F534-L538 PolarHBondContact O-N 3.41Å; F534-Y547 AromaticContact CD2-CE1 3.93Å; F534-Y547 HydrophobicContact CD2-CE1 3.93Å; F534-Y547 HydrophobicContact CE2-CE1 4.38Å; F534-L821 HydrophobicContact CB-CD1 3.68Å; F534-L821 HydrophobicContact CD2-CD1 4.45Å; F534-L821 HydrophobicContact CG-CD1 3.99Å; F534-L821 HydrophobicContact CG-CG 4.45Å; F534-T824 HydrophobicContact CE1-CG2 4.3Å; F534-T824 WeakPolarHBondContact CE2-OG1 3.36Å; F534-T824 HydrophobicContact CZ-CG2 3.75Å
535	S	80	Confident	77.3	Confident	12 Å²	12	52.1 Å²	52.1	8%	0.084	31%	0.307	C	S	.	.	H	α-helix	trans	-66.1	-37.2	178.7	-52.1	0	0	0	0	111.5	K532 L538 A539 A616	K532-S535 PolarHBondContact O-N 3.19Å; S535-L538 PolarHBondContact O-N 2.97Å; S535-A539 PolarHBondContact O-N 3.17Å; S535-A616 WeakPolarHBondContact O-CB 3.35Å
536	I	82.1	Confident	76.9	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.1	-41.6	175.5	-69.1	163.8	0	0	0	110.7	V531 K532 P533 F534 L538 A539 L540 A550 V553 A554 I602 A616	V531-I536 HydrophobicContact CB-CD1 4.43Å; V531-I536 HydrophobicContact CG1-CD1 3.55Å; V531-I536 HydrophobicContact CG1-CG1 3.58Å; K532-I536 PolarHBondContact O-N 2.7Å; K532-I536 VanDerWaalsContact O-N 3.12Å; P533-I536 PolarHBondContact O-N 3.4Å; F534-I536 VanDerWaalsContact C-N 3.33Å; F534-I536 PolarHBondContact O-N 2.72Å; I536-L538 PolarHBondContact O-N 2.92Å; I536-A539 CarbonylContact O-C 3.3Å; I536-A539 VanDerWaalsContact O-CA 3.31Å; I536-A539 WeakPolarHBondContact O-CA 3.33Å; I536-A539 WeakPolarHBondContact O-CB 3.5Å; I536-A539 PolarHBondContact O-N 2.78Å; I536-L540 HydrophobicContact CG2-CD2 4.27Å; I536-L540 HydrophobicContact CG2-CG 4.28Å; I536-L540 WeakPolarHBondContact O-CG 3.42Å; I536-L540 PolarHBondContact O-N 3.41Å; I536-A550 HydrophobicContact CB-CB 4.21Å; I536-A550 HydrophobicContact CG2-CB 3.93Å; I536-V553 HydrophobicContact CG2-CB 4.16Å; I536-V553 HydrophobicContact CG2-CG1 4Å; I536-A554 HydrophobicContact CD1-CB 3.44Å; I536-A554 VanDerWaalsContact CD1-CB 3.44Å; I536-I602 HydrophobicContact CG2-CD1 4.03Å; I536-A616 HydrophobicContact CG1-CB 4.28Å
537	N	83.4	Confident	76.5	Confident	33 Å²	33	48.3 Å²	48.3	18%	0.176	30%	0.295	C	S	.	.	H	α-helix	trans	-57.8	-36.2	179.1	-170.8	41.8	0	0	0	112.4	P533 F534 A539 G546 Y547 A550	P533-N537 WeakPolarHBondContact O-CB 3.34Å; P533-N537 PolarHBondContact O-N 3.22Å; F534-N537 WeakPolarHBondContact O-CB 3.42Å; F534-N537 PolarHBondContact O-N 2.8Å; N537-A539 VanDerWaalsContact C-N 3.25Å; N537-A539 PolarHBondContact O-N 2.94Å; N537-G546 PolarHBondContact OD1-N 3.46Å; N537-Y547 HydrophobicContact CB-CD1 4.31Å; N537-Y547 WeakPolarHBondContact ND2-CE1 3.35Å; N537-A550 HydrophobicContact CB-CB 3.75Å
538	L	79.4	Confident	76.3	Confident	110 Å²	110	46.8 Å²	46.8	58%	0.576	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-18.1	173.7	-64.6	167.6	0	0	0	113.1	F534 S535 I536 K614	F534-L538 HydrophobicContact CD1-CD1 4.2Å; F534-L538 HydrophobicContact CE1-CD1 3.73Å; F534-L538 HydrophobicContact CZ-CD1 4.31Å; F534-L538 PolarHBondContact O-N 3.41Å; S535-L538 PolarHBondContact O-N 2.97Å; I536-L538 PolarHBondContact O-N 2.92Å; L538-K614 PolarHBondContact O-NZ 2.96Å
539	A	80.6	Confident	76.2	Confident	11 Å²	11	49.5 Å²	49.5	9%	0.091	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-22.2	-178.9	0	0	0	0	0	114.3	S535 I536 N537 K614 A616 Y617	S535-A539 PolarHBondContact O-N 3.17Å; I536-A539 CarbonylContact O-C 3.3Å; I536-A539 VanDerWaalsContact O-CA 3.31Å; I536-A539 WeakPolarHBondContact O-CA 3.33Å; I536-A539 WeakPolarHBondContact O-CB 3.5Å; I536-A539 PolarHBondContact O-N 2.78Å; N537-A539 VanDerWaalsContact C-N 3.25Å; N537-A539 PolarHBondContact O-N 2.94Å; A539-K614 HydrophobicContact CB-CD 3.88Å; A539-A616 HydrophobicContact CB-CB 3.65Å; A539-Y617 HydrophobicContact CB-CE1 3.99Å
540	L	82.3	Confident	76.8	Confident	15 Å²	15	43 Å²	43	8%	0.079	27%	0.267	C	S	.	.	S	Bend	trans	-62.7	157.5	178.9	-67.6	177	0	0	0	112.8	I536 R549 A550 V553 E598	I536-L540 HydrophobicContact CG2-CD2 4.27Å; I536-L540 HydrophobicContact CG2-CG 4.28Å; I536-L540 WeakPolarHBondContact O-CG 3.42Å; I536-L540 PolarHBondContact O-N 3.41Å; L540-R549 HydrophobicContact CD1-CB 4.48Å; L540-A550 HydrophobicContact CD1-CB 4.07Å; L540-V553 HydrophobicContact CD2-CG2 4.22Å; L540-E598 HydrophobicContact CD2-CB 4.21Å; L540-E598 HydrophobicContact CD2-CG 4.28Å
541	T	76.5	Confident	77.4	Confident	62 Å²	62	41.4 Å²	41.4	38%	0.38	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-60.1	142.2	177.3	42.1	0	0	0	0	112.7	G543 A544 E598	T541-G543 PolarHBondContact O-N 3.47Å; T541-A544 WeakPolarHBondContact O-CB 3.33Å; T541-A544 PolarHBondContact O-N 2.76Å; T541-A544 WeakPolarHBondContact OG1-CB 3.24Å; T541-E598 PolarHBondContact N-OE2 3.25Å; T541-E598 PolarHBondContact OG1-OE2 2.9Å
542	P	63.2	Low	78	Confident	137 Å²	137	41.1 Å²	41.1	89%	0.89	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	125.5	178.5	-22.5	32.6	0	0	0	111.4
543	G	60.3	Low	78.5	Confident	82 Å²	82	38.4 Å²	38.4	85%	0.845	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	93.6	-14.9	-175	0	0	0	0	0	115	T541	T541-G543 PolarHBondContact O-N 3.47Å
544	A	61.9	Low	79	Confident	7 Å²	7	37.5 Å²	37.5	6%	0.058	24%	0.237	C	C	.	.			trans	-95.4	-3.3	173.3	0	0	0	0	0	114.1	T541 R549 F594	T541-A544 WeakPolarHBondContact O-CB 3.33Å; T541-A544 PolarHBondContact O-N 2.76Å; T541-A544 WeakPolarHBondContact OG1-CB 3.24Å; A544-R549 VanDerWaalsContact O-CD 3.23Å; A544-R549 WeakPolarHBondContact O-CD 3.33Å; A544-F594 HydrophobicContact CB-CE1 4.08Å; A544-F594 HydrophobicContact CB-CE2 4.41Å; A544-F594 HydrophobicContact CB-CZ 3.45Å; A544-F594 VanDerWaalsContact CB-CZ 3.45Å
545	G	62.6	Low	79.5	Confident	44 Å²	44	37.9 Å²	37.9	45%	0.454	24%	0.242	S	C	.	.			trans	-59.2	151.7	-178	0	0	0	0	0	114.2
546	G	78.1	Confident	80	Confident	27 Å²	27	37.3 Å²	37.3	28%	0.278	24%	0.238	S	C	.	.			trans	156	134.8	179.4	0	0	0	0	0	110.5	N537 S548 R549 A550	N537-G546 PolarHBondContact OD1-N 3.46Å; G546-S548 VanDerWaalsContact C-N 3.29Å; G546-S548 PolarHBondContact O-N 3.11Å; G546-R549 PolarHBondContact O-N 3.48Å; G546-R549 VanDerWaalsContact O-N 3.13Å; G546-A550 PolarHBondContact O-N 3.39Å
547	Y	80.8	Confident	80.5	Confident	51 Å²	51	37.4 Å²	37.4	20%	0.2	24%	0.239	C	C	.	.	H	α-helix	trans	-62.2	-36.9	-176.3	-59.9	-64	0	0	0	112.6	F534 N537 A550 K551 F825 Y839	F534-Y547 AromaticContact CD2-CE1 3.93Å; F534-Y547 HydrophobicContact CD2-CE1 3.93Å; F534-Y547 HydrophobicContact CE2-CE1 4.38Å; N537-Y547 HydrophobicContact CB-CD1 4.31Å; N537-Y547 WeakPolarHBondContact ND2-CE1 3.35Å; Y547-A550 PolarHBondContact O-N 2.91Å; Y547-K551 WeakPolarHBondContact O-CB 3.4Å; Y547-K551 PolarHBondContact O-N 3.48Å; Y547-F825 HydrophobicContact CE2-CE1 4.47Å; Y547-Y839 AromaticContact CD1-CD2 3.54Å; Y547-Y839 HydrophobicContact CD1-CD2 3.54Å; Y547-Y839 AromaticContact CD1-CE2 3.62Å; Y547-Y839 HydrophobicContact CD1-CE2 3.62Å; Y547-Y839 AromaticContact CD2-CD2 3.87Å; Y547-Y839 HydrophobicContact CD2-CD2 3.87Å; Y547-Y839 AromaticContact CE1-CD2 3.84Å; Y547-Y839 HydrophobicContact CE1-CD2 3.84Å; Y547-Y839 HydrophobicContact CE1-CE2 4Å; Y547-Y839 HydrophobicContact CE2-CD2 4.14Å; Y547-Y839 AromaticContact CG-CD2 3.55Å; Y547-Y839 HydrophobicContact CG-CD2 3.55Å; Y547-Y839 HydrophobicContact CG-CE2 4.03Å
548	S	82.6	Confident	80.9	Confident	12 Å²	12	38.9 Å²	38.9	8%	0.084	25%	0.247	C	C	.	.	H	α-helix	trans	-59.1	-45.7	172.8	-57.3	0	0	0	0	112.8	G546 K551 V552 A578 Q842	G546-S548 VanDerWaalsContact C-N 3.29Å; G546-S548 PolarHBondContact O-N 3.11Å; S548-K551 WeakPolarHBondContact O-CB 3.48Å; S548-K551 PolarHBondContact O-N 3.27Å; S548-V552 WeakPolarHBondContact O-CG2 3.41Å; S548-V552 PolarHBondContact O-N 3.43Å; S548-V552 VanDerWaalsContact O-N 3.11Å; S548-A578 WeakPolarHBondContact CB-O 3.33Å; S548-A578 PolarHBondContact OG-O 2.91Å; S548-Q842 WeakPolarHBondContact OG-CB 3.38Å; S548-Q842 WeakPolarHBondContact OG-CG 3.44Å
549	R	84.3	Confident	81.4	Confident	77 Å²	77	36.4 Å²	36.4	29%	0.291	24%	0.236	S	C	.	.	H	α-helix	trans	-68.4	-42.2	179.2	-71.9	-175.6	168.7	165.2	-5.5	111.5	L540 A544 G546 K551 V552 V553 F595	L540-R549 HydrophobicContact CD1-CB 4.48Å; A544-R549 VanDerWaalsContact O-CD 3.23Å; A544-R549 WeakPolarHBondContact O-CD 3.33Å; G546-R549 PolarHBondContact O-N 3.48Å; G546-R549 VanDerWaalsContact O-N 3.13Å; R549-K551 VanDerWaalsContact C-N 3.26Å; R549-K551 PolarHBondContact O-N 2.96Å; R549-V552 WeakPolarHBondContact O-CB 3.44Å; R549-V552 PolarHBondContact O-N 3.38Å; R549-V553 PolarHBondContact O-N 2.94Å; R549-F595 HydrophobicContact CB-CE1 3.86Å; R549-F595 HydrophobicContact CB-CZ 4.46Å; R549-F595 HydrophobicContact CG-CE1 3.82Å; R549-F595 HydrophobicContact CG-CZ 3.98Å
550	A	86.4	Confident	82.1	Confident	0 Å²	0	36 Å²	36	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.2	-35.5	175.2	0	0	0	0	0	112.1	P533 I536 N537 L540 G546 Y547 V553 A554	P533-A550 VanDerWaalsContact O-CB 3.29Å; P533-A550 WeakPolarHBondContact O-CB 3.46Å; I536-A550 HydrophobicContact CB-CB 4.21Å; I536-A550 HydrophobicContact CG2-CB 3.93Å; N537-A550 HydrophobicContact CB-CB 3.75Å; L540-A550 HydrophobicContact CD1-CB 4.07Å; G546-A550 PolarHBondContact O-N 3.39Å; Y547-A550 PolarHBondContact O-N 2.91Å; A550-V553 PolarHBondContact O-N 2.82Å; A550-A554 WeakPolarHBondContact O-CB 3.41Å; A550-A554 PolarHBondContact O-N 3.29Å
551	K	86.6	Confident	82.6	Confident	64 Å²	64	35.5 Å²	35.5	28%	0.278	23%	0.23	S	C	.	.	H	α-helix	trans	-63.4	-44.8	172.4	175.5	64.4	178.3	-160.7	0	111.8	P533 Y547 S548 R549 V553 A554 T555 T843	P533-K551 HydrophobicContact CG-CD 4.24Å; Y547-K551 WeakPolarHBondContact O-CB 3.4Å; Y547-K551 PolarHBondContact O-N 3.48Å; S548-K551 WeakPolarHBondContact O-CB 3.48Å; S548-K551 PolarHBondContact O-N 3.27Å; R549-K551 VanDerWaalsContact C-N 3.26Å; R549-K551 PolarHBondContact O-N 2.96Å; K551-V553 VanDerWaalsContact C-N 3.34Å; K551-V553 PolarHBondContact O-N 2.82Å; K551-A554 WeakPolarHBondContact O-CB 3.35Å; K551-A554 PolarHBondContact O-N 3.29Å; K551-T555 PolarHBondContact O-N 2.78Å; K551-T555 PolarHBondContact O-OG1 3.49Å; K551-T843 WeakPolarHBondContact CD-O 3.22Å; K551-T843 WeakPolarHBondContact CE-O 3.4Å; K551-T843 PolarHBondContact NZ-O 2.9Å
552	V	88.9	Confident	83.3	Confident	2 Å²	2	33 Å²	33	1%	0.012	22%	0.216	C	C	.	.	H	α-helix	trans	-57.4	-47.9	175.5	174.3	0	0	0	0	110.8	S548 R549 A554 T555 I556 P574 Y577 I587 F595	S548-V552 WeakPolarHBondContact O-CG2 3.41Å; S548-V552 PolarHBondContact O-N 3.43Å; S548-V552 VanDerWaalsContact O-N 3.11Å; R549-V552 WeakPolarHBondContact O-CB 3.44Å; R549-V552 PolarHBondContact O-N 3.38Å; V552-A554 PolarHBondContact O-N 3.41Å; V552-T555 WeakPolarHBondContact O-CB 2.95Å; V552-T555 PolarHBondContact O-N 3.34Å; V552-I556 HydrophobicContact CG1-CD1 3.92Å; V552-I556 HydrophobicContact CG1-CG1 4.49Å; V552-I556 WeakPolarHBondContact O-CG1 3.2Å; V552-I556 PolarHBondContact O-N 3.45Å; V552-P574 HydrophobicContact CG1-CG 4.07Å; V552-P574 HydrophobicContact CG2-CG 4.48Å; V552-Y577 VanDerWaalsContact CG2-CB 3.47Å; V552-Y577 HydrophobicContact CG2-CD1 4.03Å; V552-Y577 HydrophobicContact CG2-CD2 4.39Å; V552-Y577 HydrophobicContact CG2-CG 3.72Å; V552-I587 HydrophobicContact CG1-CD1 3.99Å; V552-I587 HydrophobicContact CG2-CD1 4.36Å; V552-F595 HydrophobicContact CB-CD1 4.44Å; V552-F595 HydrophobicContact CB-CE1 4.39Å; V552-F595 HydrophobicContact CG1-CB 4.3Å; V552-F595 HydrophobicContact CG1-CD1 4.09Å; V552-F595 HydrophobicContact CG1-CD2 3.83Å; V552-F595 HydrophobicContact CG1-CE1 4.37Å; V552-F595 HydrophobicContact CG1-CE2 4.12Å; V552-F595 HydrophobicContact CG1-CG 3.82Å; V552-F595 HydrophobicContact CG1-CZ 4.39Å
553	V	90	Very high	84.7	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.006	18%	0.179	C	C	.	.	H	α-helix	trans	-62.9	-40.7	177.8	174.9	0	0	0	0	111.9	I536 L540 R549 A550 K551 I556 L557 F595 E598 A599 I602	I536-V553 HydrophobicContact CG2-CB 4.16Å; I536-V553 HydrophobicContact CG2-CG1 4Å; L540-V553 HydrophobicContact CD2-CG2 4.22Å; R549-V553 PolarHBondContact O-N 2.94Å; A550-V553 PolarHBondContact O-N 2.82Å; K551-V553 VanDerWaalsContact C-N 3.34Å; K551-V553 PolarHBondContact O-N 2.82Å; V553-I556 PolarHBondContact O-N 3.47Å; V553-L557 HydrophobicContact CG1-CD1 4.3Å; V553-L557 WeakPolarHBondContact O-CG 3.41Å; V553-L557 PolarHBondContact O-N 3.48Å; V553-F595 HydrophobicContact CG2-CD1 3.98Å; V553-E598 HydrophobicContact CG2-CB 4.36Å; V553-A599 HydrophobicContact CG1-CB 4.2Å; V553-I602 HydrophobicContact CG1-CD1 3.71Å
554	A	89.4	Confident	86.2	Confident	5 Å²	5	25 Å²	25	4%	0.041	15%	0.152	C	C	.	.	H	α-helix	trans	-60.5	-44.2	173.8	0	0	0	0	0	111.8	P533 I536 A550 K551 V552 L557 N558	P533-A554 HydrophobicContact CG-CB 4.48Å; I536-A554 HydrophobicContact CD1-CB 3.44Å; I536-A554 VanDerWaalsContact CD1-CB 3.44Å; A550-A554 WeakPolarHBondContact O-CB 3.41Å; A550-A554 PolarHBondContact O-N 3.29Å; K551-A554 WeakPolarHBondContact O-CB 3.35Å; K551-A554 PolarHBondContact O-N 3.29Å; V552-A554 PolarHBondContact O-N 3.41Å; A554-L557 PolarHBondContact O-N 2.98Å; A554-N558 WeakPolarHBondContact O-CB 3.38Å; A554-N558 VanDerWaalsContact O-CG 3.31Å; A554-N558 PolarHBondContact O-N 3.35Å; A554-N558 PolarHBondContact O-ND2 3.19Å
555	T	89.3	Confident	87.7	Confident	43 Å²	43	27.4 Å²	27.4	26%	0.264	16%	0.164	S	C	.	.	H	α-helix	trans	-63	-42.6	176.9	-59.6	0	0	0	0	111.4	K551 V552 N558 T559 P574	K551-T555 PolarHBondContact O-N 2.78Å; K551-T555 PolarHBondContact O-OG1 3.49Å; V552-T555 WeakPolarHBondContact O-CB 2.95Å; V552-T555 PolarHBondContact O-N 3.34Å; T555-N558 PolarHBondContact O-N 2.93Å; T555-T559 VanDerWaalsContact O-CB 3.29Å; T555-T559 WeakPolarHBondContact O-CB 3.4Å; T555-T559 PolarHBondContact O-N 3.24Å; T555-T559 PolarHBondContact O-OG1 3.03Å; T555-P574 HydrophobicContact CG2-CG 4.47Å
556	I	92.1	Very high	89.1	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.6	-48.5	175.9	-69.6	164.1	0	0	0	110.5	V552 V553 T559 F560 I568 H572 V573 F595 A599	V552-I556 HydrophobicContact CG1-CD1 3.92Å; V552-I556 HydrophobicContact CG1-CG1 4.49Å; V552-I556 WeakPolarHBondContact O-CG1 3.2Å; V552-I556 PolarHBondContact O-N 3.45Å; V553-I556 PolarHBondContact O-N 3.47Å; I556-T559 PolarHBondContact O-N 3.44Å; I556-F560 VanDerWaalsContact O-CB 3.27Å; I556-F560 WeakPolarHBondContact O-CB 3.4Å; I556-F560 PolarHBondContact O-N 3.38Å; I556-I568 HydrophobicContact CG2-CG2 3.55Å; I556-H572 HydrophobicContact CG2-CB 4.16Å; I556-V573 HydrophobicContact CD1-CB 4.44Å; I556-V573 HydrophobicContact CD1-CG1 4.28Å; I556-V573 HydrophobicContact CD1-CG2 3.87Å; I556-V573 HydrophobicContact CG1-CB 4.45Å; I556-V573 HydrophobicContact CG1-CG2 4.08Å; I556-F595 HydrophobicContact CD1-CB 3.63Å; I556-A599 HydrophobicContact CB-CB 4.33Å; I556-A599 HydrophobicContact CG2-CB 3.7Å
557	L	92.3	Very high	89.8	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-61.1	-48.1	179.1	-71	170.6	0	0	0	111.3	V553 A554 T559 F560 M561 I568 A599 I602 W603 M606	V553-L557 HydrophobicContact CG1-CD1 4.3Å; V553-L557 WeakPolarHBondContact O-CG 3.41Å; V553-L557 PolarHBondContact O-N 3.48Å; A554-L557 PolarHBondContact O-N 2.98Å; L557-T559 PolarHBondContact O-N 3.09Å; L557-F560 PolarHBondContact O-N 2.98Å; L557-M561 HydrophobicContact CB-CE 4.28Å; L557-M561 WeakPolarHBondContact O-CB 3.31Å; L557-M561 WeakPolarHBondContact O-CE 3.47Å; L557-M561 VanDerWaalsContact O-CG 3.25Å; L557-M561 WeakPolarHBondContact O-CG 3.23Å; L557-M561 PolarHBondContact O-N 2.91Å; L557-I568 HydrophobicContact CD2-CD1 4.2Å; L557-A599 HydrophobicContact CD2-CB 4.33Å; L557-A599 HydrophobicContact CG-CB 4.45Å; L557-I602 HydrophobicContact CD1-CB 4.43Å; L557-I602 HydrophobicContact CD1-CG2 3.85Å; L557-W603 HydrophobicContact CD2-CB 4.12Å; L557-M606 HydrophobicContact CD1-CE 4.07Å
558	N	90.9	Very high	90.4	Very high	65 Å²	65	31.6 Å²	31.6	35%	0.348	17%	0.173	S	C	.	.	H	α-helix	trans	-64.4	-41.5	179.7	-70.1	-15.7	0	0	0	112.2	A554 T555 M561 A562	A554-N558 WeakPolarHBondContact O-CB 3.38Å; A554-N558 VanDerWaalsContact O-CG 3.31Å; A554-N558 PolarHBondContact O-N 3.35Å; A554-N558 PolarHBondContact O-ND2 3.19Å; T555-N558 PolarHBondContact O-N 2.93Å; N558-M561 PolarHBondContact O-N 3.45Å; N558-M561 WeakPolarHBondContact OD1-CE 3.39Å; N558-A562 WeakPolarHBondContact O-CB 3.44Å; N558-A562 PolarHBondContact O-N 3.37Å
559	T	91.1	Very high	90.9	Very high	58 Å²	58	31.5 Å²	31.5	36%	0.356	17%	0.173	S	C	.	.	H	α-helix	trans	-66.1	-39.5	177.9	-50.9	0	0	0	0	111	T555 I556 L557 A562 S563 H572	T555-T559 VanDerWaalsContact O-CB 3.29Å; T555-T559 WeakPolarHBondContact O-CB 3.4Å; T555-T559 PolarHBondContact O-N 3.24Å; T555-T559 PolarHBondContact O-OG1 3.03Å; I556-T559 PolarHBondContact O-N 3.44Å; L557-T559 PolarHBondContact O-N 3.09Å; T559-A562 PolarHBondContact O-N 3.09Å; T559-S563 WeakPolarHBondContact O-CB 3.26Å; T559-S563 PolarHBondContact O-N 3.26Å; T559-H572 HydrophobicContact CG2-CB 4.44Å
560	F	94.1	Very high	91.2	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.009	18%	0.181	C	C	.	.	H	α-helix	trans	-66.7	-41.7	174.1	170.5	-109	0	0	0	112.9	I556 L557 A562 S563 D565 T567 I568 H572 W603 K626 L630	I556-F560 VanDerWaalsContact O-CB 3.27Å; I556-F560 WeakPolarHBondContact O-CB 3.4Å; I556-F560 PolarHBondContact O-N 3.38Å; L557-F560 PolarHBondContact O-N 2.98Å; F560-A562 PolarHBondContact O-N 3.5Å; F560-S563 PolarHBondContact O-N 3.2Å; F560-S563 PolarHBondContact O-OG 2.99Å; F560-D565 WeakPolarHBondContact CE2-O 3.42Å; F560-T567 VanDerWaalsContact CE2-C 3.43Å; F560-I568 HydrophobicContact CB-CG1 4.08Å; F560-I568 HydrophobicContact CD1-CD1 4.14Å; F560-I568 HydrophobicContact CD1-CG1 3.65Å; F560-I568 HydrophobicContact CD2-CG1 3.8Å; F560-I568 HydrophobicContact CE1-CD1 4.48Å; F560-I568 HydrophobicContact CE1-CG1 3.99Å; F560-I568 HydrophobicContact CE2-CG1 4.13Å; F560-I568 HydrophobicContact CG-CD1 4.42Å; F560-I568 HydrophobicContact CG-CG1 3.54Å; F560-I568 HydrophobicContact CZ-CG1 4.21Å; F560-H572 VanDerWaalsContact CA-CD2 3.46Å; F560-H572 WeakPolarHBondContact CA-CD2 3.27Å; F560-H572 AromaticContact CD2-CE1 3.81Å; F560-H572 AromaticContact CD2-NE2 3.8Å; F560-W603 HydrophobicContact CE1-CD2 4.16Å; F560-W603 AromaticContact CE1-CE2 3.73Å; F560-W603 AromaticContact CE1-CZ2 3.94Å; F560-W603 HydrophobicContact CE1-CZ2 3.94Å; F560-W603 AromaticContact CE1-NE1 3.83Å; F560-K626 HydrophobicContact CE1-CG 4.01Å; F560-K626 VanDerWaalsContact CZ-CE 3.47Å; F560-K626 HydrophobicContact CZ-CG 4.33Å; F560-K626 WeakPolarHBondContact O-CE 3.44Å; F560-K626 PolarHBondContact O-NZ 3Å; F560-L630 HydrophobicContact CZ-CD1 4.2Å
561	M	93	Very high	91.3	Very high	4 Å²	4	36.7 Å²	36.7	2%	0.02	21%	0.207	C	C	.	.	H	α-helix	trans	-64.7	-30.8	177	-71.7	-177.8	-64.6	0	0	112	L557 N558 W603 P620 D622 G623 K626 A655	L557-M561 HydrophobicContact CB-CE 4.28Å; L557-M561 WeakPolarHBondContact O-CB 3.31Å; L557-M561 WeakPolarHBondContact O-CE 3.47Å; L557-M561 VanDerWaalsContact O-CG 3.25Å; L557-M561 WeakPolarHBondContact O-CG 3.23Å; L557-M561 PolarHBondContact O-N 2.91Å; N558-M561 PolarHBondContact O-N 3.45Å; N558-M561 WeakPolarHBondContact OD1-CE 3.39Å; M561-W603 HydrophobicContact CG-CZ3 4.27Å; M561-W603 HydrophobicContact SD-CZ3 4.23Å; M561-P620 HydrophobicContact CE-CG 4Å; M561-P620 HydrophobicContact SD-CG 3.61Å; M561-D622 HydrophobicContact CB-CB 4.17Å; M561-D622 HydrophobicContact SD-CB 4.43Å; M561-G623 VanDerWaalsContact SD-CA 3.53Å; M561-K626 HydrophobicContact CB-CB 4.39Å; M561-K626 HydrophobicContact CG-CB 4.3Å; M561-A655 WeakPolarHBondContact O-CB 3.1Å
562	A	91.3	Very high	91.5	Very high	10 Å²	10	33.9 Å²	33.9	8%	0.083	20%	0.195	C	C	.	.	H	α-helix	trans	-83.6	-21	175.5	0	0	0	0	0	114.2	N558 T559 F560 T653 P654 A655	N558-A562 WeakPolarHBondContact O-CB 3.44Å; N558-A562 PolarHBondContact O-N 3.37Å; T559-A562 PolarHBondContact O-N 3.09Å; F560-A562 PolarHBondContact O-N 3.5Å; A562-T653 HydrophobicContact CB-CG2 4.15Å; A562-P654 WeakPolarHBondContact O-CB 3.44Å; A562-P654 WeakPolarHBondContact O-CD 3.22Å; A562-A655 PolarHBondContact O-N 3.48Å
563	S	93.5	Very high	91.5	Very high	17 Å²	17	34.6 Å²	34.6	12%	0.119	20%	0.2	C	C	.	.	S	Bend	trans	-82.5	164.6	-175.5	77.5	0	0	0	0	113.3	T559 F560 D565 H572 K626 A655	T559-S563 WeakPolarHBondContact O-CB 3.26Å; T559-S563 PolarHBondContact O-N 3.26Å; F560-S563 PolarHBondContact O-N 3.2Å; F560-S563 PolarHBondContact O-OG 2.99Å; S563-D565 VanDerWaalsContact C-N 3.28Å; S563-D565 PolarHBondContact OG-N 2.9Å; S563-H572 PolarHBondContact OG-NE2 3.41Å; S563-K626 PolarHBondContact O-NZ 2.85Å; S563-A655 WeakPolarHBondContact O-CB 3.35Å
564	A	91.6	Very high	91.4	Very high	35 Å²	35	36.2 Å²	36.2	29%	0.289	21%	0.21	S	C	.	.			trans	-83.1	-2.9	171.7	0	0	0	0	0	113.2	Q629 D658	A564-Q629 PolarHBondContact O-NE2 3.25Å; A564-D658 HydrophobicContact CB-CB 3.89Å
565	D	93.3	Very high	91.2	Very high	56 Å²	56	44 Å²	44	30%	0.299	24%	0.239	S	C	.	.			trans	-70.2	143.5	-170.3	-66.6	-24.7	0	0	0	112.8	F560 S563 Q571 H572 K626	F560-D565 WeakPolarHBondContact CE2-O 3.42Å; S563-D565 VanDerWaalsContact C-N 3.28Å; S563-D565 PolarHBondContact OG-N 2.9Å; D565-Q571 VanDerWaalsContact OD2-CG 3.29Å; D565-Q571 WeakPolarHBondContact OD2-CG 3.17Å; D565-Q571 PolarHBondContact OD2-NE2 2.93Å; D565-H572 IonicContact OD2-CE1 3.93Å; D565-H572 PolarHBondContact OD2-CE1 3.04Å; D565-H572 IonicContact OD2-NE2 3.87Å; D565-H572 PolarHBondContact OD2-NE2 3.14Å; D565-K626 WeakPolarHBondContact O-CE 3.34Å; D565-K626 PolarHBondContact O-NZ 3Å
566	Q	91.6	Very high	90.9	Very high	115 Å²	115	43.9 Å²	43.9	54%	0.537	24%	0.237	S	C	.	.	S	Bend	trans	-73.8	-28.2	-177.5	-64.3	-60.8	-33.3	0	0	113.5
567	T	93.1	Very high	90.4	Very high	92 Å²	92	45 Å²	45	56%	0.564	24%	0.241	S	C	*	.	S	Bend	trans	-142.3	158.9	-178.4	67	0	0	0	0	112	F560 G569 H572	F560-T567 VanDerWaalsContact CE2-C 3.43Å; T567-G569 PolarHBondContact O-N 2.79Å; T567-G569 VanDerWaalsContact O-N 3.12Å; T567-H572 PolarHBondContact O-CE1 3.15Å
568	I	94.1	Very high	89.7	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.021	25%	0.245	C	C	.	.			trans	-68.3	109.6	174.1	-58.5	171.3	0	0	0	108.9	I556 L557 F560 I596 A599 K600 W603	I556-I568 HydrophobicContact CG2-CG2 3.55Å; L557-I568 HydrophobicContact CD2-CD1 4.2Å; F560-I568 HydrophobicContact CB-CG1 4.08Å; F560-I568 HydrophobicContact CD1-CD1 4.14Å; F560-I568 HydrophobicContact CD1-CG1 3.65Å; F560-I568 HydrophobicContact CD2-CG1 3.8Å; F560-I568 HydrophobicContact CE1-CD1 4.48Å; F560-I568 HydrophobicContact CE1-CG1 3.99Å; F560-I568 HydrophobicContact CE2-CG1 4.13Å; F560-I568 HydrophobicContact CG-CD1 4.42Å; F560-I568 HydrophobicContact CG-CG1 3.54Å; F560-I568 HydrophobicContact CZ-CG1 4.21Å; I568-I596 HydrophobicContact CG2-CG2 4.25Å; I568-A599 HydrophobicContact CD1-CB 4.23Å; I568-A599 HydrophobicContact CG2-CB 4.45Å; I568-K600 HydrophobicContact CB-CG 4.05Å; I568-K600 HydrophobicContact CD1-CG 4.14Å; I568-K600 WeakPolarHBondContact O-CE 3.18Å; I568-K600 PolarHBondContact O-NZ 3.05Å; I568-W603 HydrophobicContact CD1-CB 4.02Å; I568-W603 HydrophobicContact CD1-CG 4.33Å
569	G	92.1	Very high	88.9	Confident	9 Å²	9	45.8 Å²	45.8	9%	0.093	25%	0.247	C	C	.	.			trans	-119.3	-179.8	174.6	0	0	0	0	0	115	T567 Q571 H572	T567-G569 PolarHBondContact O-N 2.79Å; T567-G569 VanDerWaalsContact O-N 3.12Å; G569-Q571 PolarHBondContact O-N 3.31Å; G569-H572 PolarHBondContact N-ND1 3.44Å; G569-H572 VanDerWaalsContact N-ND1 3.16Å; G569-H572 PolarHBondContact O-N 3.3Å; G569-H572 PolarHBondContact O-ND1 3.23Å
570	P	89.8	Confident	87.8	Confident	71 Å²	71	45.6 Å²	45.6	46%	0.461	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-52.9	-32.4	-179.8	-28.6	37.3	0	0	0	115.2	H572 V573 Q592 I596	P570-H572 PolarHBondContact O-N 2.84Å; P570-V573 WeakPolarHBondContact O-CB 3.25Å; P570-V573 PolarHBondContact O-N 3.07Å; P570-V573 VanDerWaalsContact O-N 3.07Å; P570-Q592 PolarHBondContact O-NE2 3.13Å; P570-I596 HydrophobicContact CG-CD1 4.24Å
571	Q	89.7	Confident	86.3	Confident	115 Å²	115	53.3 Å²	53.3	54%	0.537	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-64.2	-18.2	-179.1	67.6	-84	20.9	0	0	114.5	D565 G569	D565-Q571 VanDerWaalsContact OD2-CG 3.29Å; D565-Q571 WeakPolarHBondContact OD2-CG 3.17Å; D565-Q571 PolarHBondContact OD2-NE2 2.93Å; G569-Q571 PolarHBondContact O-N 3.31Å
572	H	90.3	Very high	84.8	Confident	5 Å²	5	55.6 Å²	55.6	2%	0.023	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-89.2	-9.4	176.7	-53.7	103.7	0	0	0	113	I556 T559 F560 S563 D565 T567 G569 P570	I556-H572 HydrophobicContact CG2-CB 4.16Å; T559-H572 HydrophobicContact CG2-CB 4.44Å; F560-H572 VanDerWaalsContact CA-CD2 3.46Å; F560-H572 WeakPolarHBondContact CA-CD2 3.27Å; F560-H572 AromaticContact CD2-CE1 3.81Å; F560-H572 AromaticContact CD2-NE2 3.8Å; S563-H572 PolarHBondContact OG-NE2 3.41Å; D565-H572 IonicContact OD2-CE1 3.93Å; D565-H572 PolarHBondContact OD2-CE1 3.04Å; D565-H572 IonicContact OD2-NE2 3.87Å; D565-H572 PolarHBondContact OD2-NE2 3.14Å; T567-H572 PolarHBondContact O-CE1 3.15Å; G569-H572 PolarHBondContact N-ND1 3.44Å; G569-H572 VanDerWaalsContact N-ND1 3.16Å; G569-H572 PolarHBondContact O-N 3.3Å; G569-H572 PolarHBondContact O-ND1 3.23Å; P570-H572 PolarHBondContact O-N 2.84Å
573	V	89.6	Confident	83.9	Confident	18 Å²	18	63.8 Å²	63.8	11%	0.109	33%	0.334	C	S	.	.	S	Bend	trans	-85	127.7	-177.2	-172.4	0	0	0	0	108.7	I556 P570 I587 Q592 I596	I556-V573 HydrophobicContact CD1-CB 4.44Å; I556-V573 HydrophobicContact CD1-CG1 4.28Å; I556-V573 HydrophobicContact CD1-CG2 3.87Å; I556-V573 HydrophobicContact CG1-CB 4.45Å; I556-V573 HydrophobicContact CG1-CG2 4.08Å; P570-V573 WeakPolarHBondContact O-CB 3.25Å; P570-V573 PolarHBondContact O-N 3.07Å; P570-V573 VanDerWaalsContact O-N 3.07Å; V573-I587 HydrophobicContact CG1-CD1 3.85Å; V573-I587 HydrophobicContact CG1-CG2 4.41Å; V573-Q592 HydrophobicContact CB-CG 4.08Å; V573-Q592 HydrophobicContact CG1-CG 4.05Å; V573-Q592 HydrophobicContact CG2-CG 3.86Å; V573-I596 HydrophobicContact CG2-CD1 3.95Å; V573-I596 HydrophobicContact CG2-CG1 3.69Å
574	P	86.8	Confident	83.2	Confident	35 Å²	35	68.6 Å²	68.6	23%	0.227	35%	0.349	C	S	.	.			trans	-62.4	153.7	174.6	27.6	-35	0	0	0	110.9	V552 T555 I587	V552-P574 HydrophobicContact CG1-CG 4.07Å; V552-P574 HydrophobicContact CG2-CG 4.48Å; T555-P574 HydrophobicContact CG2-CG 4.47Å; P574-I587 HydrophobicContact CG-CD1 4.22Å; P574-I587 WeakPolarHBondContact O-CD1 3.43Å
575	Y	84.9	Confident	82.8	Confident	167 Å²	167	69.9 Å²	69.9	66%	0.655	35%	0.348	S	S	*	.	S	Bend	trans	-66.9	-38.1	179.8	178.9	-100.9	0	0	0	112.6	I586 I587	Y575-I586 HydrophobicContact CE1-CD1 4.17Å; Y575-I586 HydrophobicContact CE1-CG1 3.9Å; Y575-I586 HydrophobicContact CE1-CG2 4.27Å; Y575-I586 HydrophobicContact CE2-CG2 4.26Å; Y575-I587 PolarHBondContact O-N 3.44Å; Y575-I587 VanDerWaalsContact O-N 3.09Å
576	D	84.6	Confident	82.5	Confident	42 Å²	42	71.5 Å²	71.5	23%	0.225	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	168	-178.1	65.7	-9.2	0	0	0	112	R584 K585	D576-R584 HydrophobicContact CB-CB 4.46Å; D576-R584 VanDerWaalsContact CG-NH1 3.25Å; D576-R584 IonicContact OD1-CZ 3.62Å; D576-R584 IonicContact OD1-NH1 2.73Å; D576-R584 PolarHBondContact OD1-NH1 3.44Å; D576-R584 VanDerWaalsContact OD2-CD 3.32Å; D576-R584 WeakPolarHBondContact OD2-CD 3.48Å; D576-R584 IonicContact OD2-CZ 3.07Å; D576-R584 IonicContact OD2-NE 2.85Å; D576-R584 IonicContact OD2-NH1 3.03Å; D576-R584 PolarHBondContact OD2-NH1 2.94Å; D576-K585 VanDerWaalsContact CA-O 3.28Å; D576-K585 WeakPolarHBondContact CA-O 3.4Å; D576-K585 WeakPolarHBondContact CB-O 3.49Å
577	Y	81.4	Confident	82.1	Confident	22 Å²	22	67 Å²	67	9%	0.086	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	153.1	171.8	70.3	-87.1	0	0	0	112.4	V552 I579 R584 K585 I587	V552-Y577 VanDerWaalsContact CG2-CB 3.47Å; V552-Y577 HydrophobicContact CG2-CD1 4.03Å; V552-Y577 HydrophobicContact CG2-CD2 4.39Å; V552-Y577 HydrophobicContact CG2-CG 3.72Å; Y577-I579 HydrophobicContact CD2-CG1 4.37Å; Y577-I579 HydrophobicContact CE2-CD1 4.47Å; Y577-I579 HydrophobicContact CE2-CG1 3.86Å; Y577-R584 WeakPolarHBondContact O-CA 3.43Å; Y577-K585 HydrophobicContact CE1-CB 4.3Å; Y577-K585 HydrophobicContact CE1-CD 4.31Å; Y577-K585 PolarHBondContact N-O 2.97Å; Y577-K585 PolarHBondContact O-N 3.32Å; Y577-I587 HydrophobicContact CD1-CD1 3.84Å; Y577-I587 HydrophobicContact CD1-CG1 3.59Å; Y577-I587 HydrophobicContact CE1-CD1 4.46Å; Y577-I587 HydrophobicContact CE1-CG1 3.96Å
578	A	76.9	Confident	81.8	Confident	9 Å²	9	66.5 Å²	66.5	7%	0.074	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	130.8	179.7	0	0	0	0	0	112.7	S548 E844	S548-A578 WeakPolarHBondContact CB-O 3.33Å; S548-A578 PolarHBondContact OG-O 2.91Å; A578-E844 HydrophobicContact CB-CG 3.84Å; A578-E844 WeakPolarHBondContact CB-OE1 3.47Å
579	I	74.7	Confident	81.5	Confident	76 Å²	76	70.9 Å²	70.9	39%	0.39	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	-47.4	170	-61.1	-177.4	0	0	0	110.1	Y577 R583 K585 Q842	Y577-I579 HydrophobicContact CD2-CG1 4.37Å; Y577-I579 HydrophobicContact CE2-CD1 4.47Å; Y577-I579 HydrophobicContact CE2-CG1 3.86Å; I579-R583 PolarHBondContact N-O 3.46Å; I579-R583 VanDerWaalsContact N-O 3.12Å; I579-K585 HydrophobicContact CD1-CB 3.49Å; I579-K585 VanDerWaalsContact CD1-CB 3.49Å; I579-K585 HydrophobicContact CD1-CD 3.97Å; I579-K585 HydrophobicContact CD1-CG 4.21Å; I579-K585 HydrophobicContact CG1-CB 4.07Å; I579-Q842 WeakPolarHBondContact O-CG 3.38Å
580	C	67.8	Low	81.2	Confident	54 Å²	54	77.2 Å²	77.2	37%	0.365	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	174.1	174.4	64.8	0	0	0	0	110.4	G582 R583	C580-G582 PolarHBondContact O-N 2.95Å; C580-G582 VanDerWaalsContact O-N 3.09Å; C580-R583 PolarHBondContact O-N 3.26Å
581	K	61.7	Low	80.9	Confident	163 Å²	163	75.4 Å²	75.4	71%	0.709	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	117.5	-171	-164.5	170.4	-177.5	171.2	0	110.2	R583 I841	K581-R583 VanDerWaalsContact C-N 3.31Å; K581-R583 PolarHBondContact O-N 3.28Å; K581-I841 HydrophobicContact CB-CD1 4.14Å; K581-I841 HydrophobicContact CB-CG1 4.49Å; K581-I841 HydrophobicContact CB-CG2 4.04Å; K581-I841 HydrophobicContact CD-CD1 4.44Å
582	G	62.3	Low	80.9	Confident	52 Å²	52	72.6 Å²	72.6	54%	0.536	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	7.8	-178.7	0	0	0	0	0	115.9	C580	C580-G582 PolarHBondContact O-N 2.95Å; C580-G582 VanDerWaalsContact O-N 3.09Å
583	R	72.3	Confident	80.8	Confident	183 Å²	183	78.1 Å²	78.1	69%	0.691	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	111.3	172.4	-64.6	-169.6	-175.3	170.9	0	111	I579 C580 K581	I579-R583 PolarHBondContact N-O 3.46Å; I579-R583 VanDerWaalsContact N-O 3.12Å; C580-R583 PolarHBondContact O-N 3.26Å; K581-R583 VanDerWaalsContact C-N 3.31Å; K581-R583 PolarHBondContact O-N 3.28Å
584	R	78.7	Confident	80.8	Confident	117 Å²	117	80.9 Å²	80.9	44%	0.442	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	142.5	175.1	-72.2	173.9	144	-134.4	-2.2	109.9	D576 Y577 E844	D576-R584 HydrophobicContact CB-CB 4.46Å; D576-R584 VanDerWaalsContact CG-NH1 3.25Å; D576-R584 IonicContact OD1-CZ 3.62Å; D576-R584 IonicContact OD1-NH1 2.73Å; D576-R584 PolarHBondContact OD1-NH1 3.44Å; D576-R584 VanDerWaalsContact OD2-CD 3.32Å; D576-R584 WeakPolarHBondContact OD2-CD 3.48Å; D576-R584 IonicContact OD2-CZ 3.07Å; D576-R584 IonicContact OD2-NE 2.85Å; D576-R584 IonicContact OD2-NH1 3.03Å; D576-R584 PolarHBondContact OD2-NH1 2.94Å; Y577-R584 WeakPolarHBondContact O-CA 3.43Å; R584-E844 IonicContact CZ-OE1 2.84Å; R584-E844 IonicContact NE-OE1 3.61Å; R584-E844 PolarHBondContact NE-OE1 3.49Å; R584-E844 IonicContact NH2-OE1 3.88Å; R584-E844 PolarHBondContact NH2-OE1 3.09Å; R584-E844 IonicContact NH2-OE2 3.94Å; R584-E844 PolarHBondContact NH2-OE2 3.1Å
585	K	83.8	Confident	81	Confident	63 Å²	63	79.3 Å²	79.3	27%	0.274	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.3	174.1	-174.2	-171.2	175.7	-161.7	0	108.6	D576 Y577 I579 D588 E591	D576-K585 VanDerWaalsContact CA-O 3.28Å; D576-K585 WeakPolarHBondContact CA-O 3.4Å; D576-K585 WeakPolarHBondContact CB-O 3.49Å; Y577-K585 HydrophobicContact CE1-CB 4.3Å; Y577-K585 HydrophobicContact CE1-CD 4.31Å; Y577-K585 PolarHBondContact N-O 2.97Å; Y577-K585 PolarHBondContact O-N 3.32Å; I579-K585 HydrophobicContact CD1-CB 3.49Å; I579-K585 VanDerWaalsContact CD1-CB 3.49Å; I579-K585 HydrophobicContact CD1-CD 3.97Å; I579-K585 HydrophobicContact CD1-CG 4.21Å; I579-K585 HydrophobicContact CG1-CB 4.07Å; K585-D588 IonicContact NZ-OD2 3.11Å; K585-E591 WeakPolarHBondContact CE-OE2 3.37Å; K585-E591 IonicContact NZ-OE1 3.27Å; K585-E591 PolarHBondContact NZ-OE1 2.95Å; K585-E591 IonicContact NZ-OE2 3.86Å; K585-E591 PolarHBondContact NZ-OE2 3.03Å
586	I	85.9	Confident	81.3	Confident	89 Å²	89	71.5 Å²	71.5	46%	0.456	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	136.7	171.2	-61.2	170.1	0	0	0	107.8	Y575 D588	Y575-I586 HydrophobicContact CE1-CD1 4.17Å; Y575-I586 HydrophobicContact CE1-CG1 3.9Å; Y575-I586 HydrophobicContact CE1-CG2 4.27Å; Y575-I586 HydrophobicContact CE2-CG2 4.26Å; I586-D588 PolarHBondContact O-N 3.28Å
587	I	84.8	Confident	81.6	Confident	20 Å²	20	72.1 Å²	72.1	10%	0.103	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-78.3	116.8	179.9	-59	-172.1	0	0	0	109	V552 V573 P574 Y575 Y577 E591 Q592 F595	V552-I587 HydrophobicContact CG1-CD1 3.99Å; V552-I587 HydrophobicContact CG2-CD1 4.36Å; V573-I587 HydrophobicContact CG1-CD1 3.85Å; V573-I587 HydrophobicContact CG1-CG2 4.41Å; P574-I587 HydrophobicContact CG-CD1 4.22Å; P574-I587 WeakPolarHBondContact O-CD1 3.43Å; Y575-I587 PolarHBondContact O-N 3.44Å; Y575-I587 VanDerWaalsContact O-N 3.09Å; Y577-I587 HydrophobicContact CD1-CD1 3.84Å; Y577-I587 HydrophobicContact CD1-CG1 3.59Å; Y577-I587 HydrophobicContact CE1-CD1 4.46Å; Y577-I587 HydrophobicContact CE1-CG1 3.96Å; I587-E591 HydrophobicContact CG2-CB 4Å; I587-Q592 HydrophobicContact CG2-CB 3.94Å; I587-F595 HydrophobicContact CD1-CD2 4.25Å; I587-F595 HydrophobicContact CD1-CE2 4.09Å; I587-F595 HydrophobicContact CG2-CD2 4.13Å; I587-F595 HydrophobicContact CG2-CE2 4.13Å
588	D	86.8	Confident	82.1	Confident	82 Å²	82	72.6 Å²	72.6	44%	0.439	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-71.4	153.8	174.6	-61.5	-52.8	0	0	0	110.6	K585 I586 D590 E591 Q592	K585-D588 IonicContact NZ-OD2 3.11Å; I586-D588 PolarHBondContact O-N 3.28Å; D588-D590 PolarHBondContact O-N 2.65Å; D588-D590 VanDerWaalsContact O-N 3.16Å; D588-E591 PolarHBondContact O-N 3.02Å; D588-Q592 PolarHBondContact O-N 3.03Å
589	P	86.3	Confident	82.8	Confident	97 Å²	97	72.2 Å²	72.2	63%	0.63	37%	0.368	S	S	*	.	H	α-helix	trans	-55.1	-35.5	-178.8	-27.4	35.4	0	0	0	114.4	Q592 Q593	P589-Q592 WeakPolarHBondContact O-CB 3.46Å; P589-Q592 PolarHBondContact O-N 2.87Å; P589-Q593 PolarHBondContact O-N 3.27Å; P589-Q593 VanDerWaalsContact O-N 3.08Å
590	D	85.6	Confident	83.7	Confident	142 Å²	142	72.6 Å²	72.6	76%	0.759	37%	0.367	S	S	*	.	H	α-helix	trans	-68.4	-41.2	177.1	-64.3	-30.5	0	0	0	111.8	D588 Q593 F594	D588-D590 PolarHBondContact O-N 2.65Å; D588-D590 VanDerWaalsContact O-N 3.16Å; D590-Q593 PolarHBondContact O-N 2.89Å; D590-F594 PolarHBondContact O-N 2.98Å; D590-F594 VanDerWaalsContact O-N 3.13Å
591	E	84.9	Confident	84.9	Confident	33 Å²	33	71.6 Å²	71.6	15%	0.154	37%	0.366	C	S	.	.	H	α-helix	trans	-68.7	-36.2	174.7	-71.9	-167.6	140	0	0	111.5	K585 I587 D588 Q593 F594 F595	K585-E591 WeakPolarHBondContact CE-OE2 3.37Å; K585-E591 IonicContact NZ-OE1 3.27Å; K585-E591 PolarHBondContact NZ-OE1 2.95Å; K585-E591 IonicContact NZ-OE2 3.86Å; K585-E591 PolarHBondContact NZ-OE2 3.03Å; I587-E591 HydrophobicContact CG2-CB 4Å; D588-E591 PolarHBondContact O-N 3.02Å; E591-Q593 VanDerWaalsContact C-N 3.35Å; E591-Q593 PolarHBondContact O-N 3.44Å; E591-F594 WeakPolarHBondContact O-CB 3.4Å; E591-F594 PolarHBondContact O-N 3.42Å; E591-F595 HydrophobicContact CB-CD2 4.48Å; E591-F595 HydrophobicContact CB-CE2 4.08Å; E591-F595 WeakPolarHBondContact O-CD2 3.26Å; E591-F595 WeakPolarHBondContact O-CG 3.35Å; E591-F595 PolarHBondContact O-N 3.42Å
592	Q	87.9	Confident	86.3	Confident	55 Å²	55	64.2 Å²	64.2	26%	0.257	33%	0.334	S	S	.	.	H	α-helix	trans	-57.8	-48.6	174.6	-175	176.7	35.3	0	0	110.8	P570 V573 I587 D588 P589 F594 F595 I596	P570-Q592 PolarHBondContact O-NE2 3.13Å; V573-Q592 HydrophobicContact CB-CG 4.08Å; V573-Q592 HydrophobicContact CG1-CG 4.05Å; V573-Q592 HydrophobicContact CG2-CG 3.86Å; I587-Q592 HydrophobicContact CG2-CB 3.94Å; D588-Q592 PolarHBondContact O-N 3.03Å; P589-Q592 WeakPolarHBondContact O-CB 3.46Å; P589-Q592 PolarHBondContact O-N 2.87Å; Q592-F594 VanDerWaalsContact C-N 3.3Å; Q592-F594 PolarHBondContact O-N 2.92Å; Q592-F595 PolarHBondContact O-N 2.91Å; Q592-I596 HydrophobicContact CG-CD1 4.04Å; Q592-I596 VanDerWaalsContact O-CG1 3.29Å; Q592-I596 WeakPolarHBondContact O-CG1 3.42Å; Q592-I596 PolarHBondContact O-N 2.79Å
593	Q	89.1	Confident	87.8	Confident	122 Å²	122	62.4 Å²	62.4	57%	0.57	31%	0.311	S	S	*	.	H	α-helix	trans	-63.3	-38.1	178.4	-169.8	63.9	15.1	0	0	111.9	P589 D590 E591 I596 A597	P589-Q593 PolarHBondContact O-N 3.27Å; P589-Q593 VanDerWaalsContact O-N 3.08Å; D590-Q593 PolarHBondContact O-N 2.89Å; E591-Q593 VanDerWaalsContact C-N 3.35Å; E591-Q593 PolarHBondContact O-N 3.44Å; Q593-I596 PolarHBondContact O-N 3.35Å; Q593-A597 PolarHBondContact O-N 3.24Å
594	F	89.4	Confident	88.8	Confident	76 Å²	76	57.9 Å²	57.9	33%	0.333	30%	0.301	S	S	.	.	H	α-helix	trans	-60.4	-49.7	174.2	175.5	-95.6	0	0	0	112.1	A544 D590 E591 Q592 I596 A597 E598	A544-F594 HydrophobicContact CB-CE1 4.08Å; A544-F594 HydrophobicContact CB-CE2 4.41Å; A544-F594 HydrophobicContact CB-CZ 3.45Å; A544-F594 VanDerWaalsContact CB-CZ 3.45Å; D590-F594 PolarHBondContact O-N 2.98Å; D590-F594 VanDerWaalsContact O-N 3.13Å; E591-F594 WeakPolarHBondContact O-CB 3.4Å; E591-F594 PolarHBondContact O-N 3.42Å; Q592-F594 VanDerWaalsContact C-N 3.3Å; Q592-F594 PolarHBondContact O-N 2.92Å; F594-I596 VanDerWaalsContact C-N 3.33Å; F594-I596 PolarHBondContact O-N 2.85Å; F594-A597 PolarHBondContact O-N 3.17Å; F594-E598 HydrophobicContact CE1-CG 3.89Å; F594-E598 HydrophobicContact CE2-CG 4.13Å; F594-E598 HydrophobicContact CZ-CG 3.63Å; F594-E598 PolarHBondContact O-N 3.03Å
595	F	90.9	Very high	89.4	Confident	1 Å²	1	56.5 Å²	56.5	0%	0.004	30%	0.298	C	S	.	.	H	α-helix	trans	-64	-37.4	179.7	-67.8	-54.2	0	0	0	112.9	R549 V552 V553 I556 I587 E591 Q592 A597 E598 A599	R549-F595 HydrophobicContact CB-CE1 3.86Å; R549-F595 HydrophobicContact CB-CZ 4.46Å; R549-F595 HydrophobicContact CG-CE1 3.82Å; R549-F595 HydrophobicContact CG-CZ 3.98Å; V552-F595 HydrophobicContact CB-CD1 4.44Å; V552-F595 HydrophobicContact CB-CE1 4.39Å; V552-F595 HydrophobicContact CG1-CB 4.3Å; V552-F595 HydrophobicContact CG1-CD1 4.09Å; V552-F595 HydrophobicContact CG1-CD2 3.83Å; V552-F595 HydrophobicContact CG1-CE1 4.37Å; V552-F595 HydrophobicContact CG1-CE2 4.12Å; V552-F595 HydrophobicContact CG1-CG 3.82Å; V552-F595 HydrophobicContact CG1-CZ 4.39Å; V553-F595 HydrophobicContact CG2-CD1 3.98Å; I556-F595 HydrophobicContact CD1-CB 3.63Å; I587-F595 HydrophobicContact CD1-CD2 4.25Å; I587-F595 HydrophobicContact CD1-CE2 4.09Å; I587-F595 HydrophobicContact CG2-CD2 4.13Å; I587-F595 HydrophobicContact CG2-CE2 4.13Å; E591-F595 HydrophobicContact CB-CD2 4.48Å; E591-F595 HydrophobicContact CB-CE2 4.08Å; E591-F595 WeakPolarHBondContact O-CD2 3.26Å; E591-F595 WeakPolarHBondContact O-CG 3.35Å; E591-F595 PolarHBondContact O-N 3.42Å; Q592-F595 PolarHBondContact O-N 2.91Å; F595-A597 VanDerWaalsContact C-N 3.34Å; F595-E598 PolarHBondContact O-N 3.26Å; F595-A599 VanDerWaalsContact O-CB 3.3Å; F595-A599 WeakPolarHBondContact O-CB 3.48Å; F595-A599 PolarHBondContact O-N 3.47Å
596	I	91.7	Very high	89.7	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.015	29%	0.285	C	S	.	.	H	α-helix	trans	-63	-42.7	175	-68.9	166.4	0	0	0	110.6	I568 P570 V573 Q592 Q593 F594 A599 K600	I568-I596 HydrophobicContact CG2-CG2 4.25Å; P570-I596 HydrophobicContact CG-CD1 4.24Å; V573-I596 HydrophobicContact CG2-CD1 3.95Å; V573-I596 HydrophobicContact CG2-CG1 3.69Å; Q592-I596 HydrophobicContact CG-CD1 4.04Å; Q592-I596 VanDerWaalsContact O-CG1 3.29Å; Q592-I596 WeakPolarHBondContact O-CG1 3.42Å; Q592-I596 PolarHBondContact O-N 2.79Å; Q593-I596 PolarHBondContact O-N 3.35Å; F594-I596 VanDerWaalsContact C-N 3.33Å; F594-I596 PolarHBondContact O-N 2.85Å; I596-A599 PolarHBondContact O-N 3.12Å; I596-K600 HydrophobicContact CG2-CD 3.99Å; I596-K600 HydrophobicContact CG2-CG 4.43Å; I596-K600 WeakPolarHBondContact O-CB 3.28Å; I596-K600 VanDerWaalsContact O-CG 3.31Å; I596-K600 WeakPolarHBondContact O-CG 3.4Å; I596-K600 PolarHBondContact O-N 3.11Å
597	A	91.6	Very high	89.9	Confident	55 Å²	55	53 Å²	53	46%	0.455	28%	0.28	S	S	.	.	H	α-helix	trans	-62.9	-46.3	178.5	0	0	0	0	0	111.7	Q593 F594 F595 K600 G601	Q593-A597 PolarHBondContact O-N 3.24Å; F594-A597 PolarHBondContact O-N 3.17Å; F595-A597 VanDerWaalsContact C-N 3.34Å; A597-K600 PolarHBondContact O-N 3.42Å; A597-G601 PolarHBondContact O-N 3.32Å
598	E	90.8	Very high	90.2	Very high	33 Å²	33	56 Å²	56	15%	0.154	30%	0.296	C	S	.	.	H	α-helix	trans	-63.2	-44.3	176.7	-70.8	-69	86.2	0	0	111.6	L540 T541 V553 F594 F595 K600 G601 I602	L540-E598 HydrophobicContact CD2-CB 4.21Å; L540-E598 HydrophobicContact CD2-CG 4.28Å; T541-E598 PolarHBondContact N-OE2 3.25Å; T541-E598 PolarHBondContact OG1-OE2 2.9Å; V553-E598 HydrophobicContact CG2-CB 4.36Å; F594-E598 HydrophobicContact CE1-CG 3.89Å; F594-E598 HydrophobicContact CE2-CG 4.13Å; F594-E598 HydrophobicContact CZ-CG 3.63Å; F594-E598 PolarHBondContact O-N 3.03Å; F595-E598 PolarHBondContact O-N 3.26Å; E598-K600 PolarHBondContact O-N 3.43Å; E598-G601 PolarHBondContact O-N 2.83Å; E598-I602 WeakPolarHBondContact O-CG1 3.28Å; E598-I602 PolarHBondContact O-N 2.89Å
599	A	92.2	Very high	90.2	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.9	-43.2	177.4	0	0	0	0	0	111.9	V553 I556 L557 I568 F595 I596 G601 I602 W603	V553-A599 HydrophobicContact CG1-CB 4.2Å; I556-A599 HydrophobicContact CB-CB 4.33Å; I556-A599 HydrophobicContact CG2-CB 3.7Å; L557-A599 HydrophobicContact CD2-CB 4.33Å; L557-A599 HydrophobicContact CG-CB 4.45Å; I568-A599 HydrophobicContact CD1-CB 4.23Å; I568-A599 HydrophobicContact CG2-CB 4.45Å; F595-A599 VanDerWaalsContact O-CB 3.3Å; F595-A599 WeakPolarHBondContact O-CB 3.48Å; F595-A599 PolarHBondContact O-N 3.47Å; I596-A599 PolarHBondContact O-N 3.12Å; A599-G601 VanDerWaalsContact C-N 3.34Å; A599-G601 PolarHBondContact O-N 3.34Å; A599-I602 PolarHBondContact O-N 3.45Å; A599-W603 WeakPolarHBondContact O-CB 3.38Å; A599-W603 PolarHBondContact O-N 3.2Å
600	K	94.1	Very high	90.1	Very high	84 Å²	84	58.9 Å²	58.9	37%	0.365	29%	0.289	S	S	.	.	H	α-helix	trans	-61.4	-41.5	173.4	-77.1	176.6	179.3	174.9	0	112	I568 I596 A597 E598 W603 N604	I568-K600 HydrophobicContact CB-CG 4.05Å; I568-K600 HydrophobicContact CD1-CG 4.14Å; I568-K600 WeakPolarHBondContact O-CE 3.18Å; I568-K600 PolarHBondContact O-NZ 3.05Å; I596-K600 HydrophobicContact CG2-CD 3.99Å; I596-K600 HydrophobicContact CG2-CG 4.43Å; I596-K600 WeakPolarHBondContact O-CB 3.28Å; I596-K600 VanDerWaalsContact O-CG 3.31Å; I596-K600 WeakPolarHBondContact O-CG 3.4Å; I596-K600 PolarHBondContact O-N 3.11Å; A597-K600 PolarHBondContact O-N 3.42Å; E598-K600 PolarHBondContact O-N 3.43Å; K600-W603 PolarHBondContact O-N 2.98Å; K600-N604 WeakPolarHBondContact O-CB 3.49Å; K600-N604 VanDerWaalsContact O-CG 3.27Å; K600-N604 PolarHBondContact O-N 2.94Å; K600-N604 PolarHBondContact O-ND2 3.24Å
601	G	91.6	Very high	90.2	Very high	33 Å²	33	54.9 Å²	54.9	34%	0.34	27%	0.266	S	S	.	.	H	α-helix	trans	-59.9	-46.2	176	0	0	0	0	0	112.2	A597 E598 A599 K605	A597-G601 PolarHBondContact O-N 3.32Å; E598-G601 PolarHBondContact O-N 2.83Å; A599-G601 VanDerWaalsContact C-N 3.34Å; A599-G601 PolarHBondContact O-N 3.34Å; G601-K605 WeakPolarHBondContact O-CG 3.49Å; G601-K605 PolarHBondContact O-N 3.03Å
602	I	91.3	Very high	90.1	Very high	8 Å²	8	57.1 Å²	57.1	4%	0.041	28%	0.275	C	S	.	.	H	α-helix	trans	-65.6	-46.4	176.5	-68.4	166.6	0	0	0	111	I536 V553 L557 E598 A599 N604 K605 M606 Y617	I536-I602 HydrophobicContact CG2-CD1 4.03Å; V553-I602 HydrophobicContact CG1-CD1 3.71Å; L557-I602 HydrophobicContact CD1-CB 4.43Å; L557-I602 HydrophobicContact CD1-CG2 3.85Å; E598-I602 WeakPolarHBondContact O-CG1 3.28Å; E598-I602 PolarHBondContact O-N 2.89Å; A599-I602 PolarHBondContact O-N 3.45Å; I602-N604 VanDerWaalsContact C-N 3.33Å; I602-N604 PolarHBondContact O-N 3.42Å; I602-K605 CarbonylContact O-C 3.54Å; I602-K605 PolarHBondContact O-N 3.33Å; I602-K605 VanDerWaalsContact O-N 3.13Å; I602-M606 HydrophobicContact CG2-CE 3.6Å; I602-M606 HydrophobicContact CG2-CG 4.32Å; I602-M606 HydrophobicContact CG2-SD 4.1Å; I602-M606 WeakPolarHBondContact O-CG 3.49Å; I602-M606 PolarHBondContact O-N 2.76Å; I602-Y617 HydrophobicContact CG1-CE1 4.41Å
603	W	93.7	Very high	89.8	Confident	15 Å²	15	58.6 Å²	58.6	6%	0.057	29%	0.291	C	S	.	.	H	α-helix	trans	-59.1	-41.1	178.3	178.4	-118.4	0	0	0	112.8	L557 F560 M561 I568 A599 K600 K605 M606 K607 M619 K626 L627 L630	L557-W603 HydrophobicContact CD2-CB 4.12Å; F560-W603 HydrophobicContact CE1-CD2 4.16Å; F560-W603 AromaticContact CE1-CE2 3.73Å; F560-W603 AromaticContact CE1-CZ2 3.94Å; F560-W603 HydrophobicContact CE1-CZ2 3.94Å; F560-W603 AromaticContact CE1-NE1 3.83Å; M561-W603 HydrophobicContact CG-CZ3 4.27Å; M561-W603 HydrophobicContact SD-CZ3 4.23Å; I568-W603 HydrophobicContact CD1-CB 4.02Å; I568-W603 HydrophobicContact CD1-CG 4.33Å; A599-W603 WeakPolarHBondContact O-CB 3.38Å; A599-W603 PolarHBondContact O-N 3.2Å; K600-W603 PolarHBondContact O-N 2.98Å; W603-K605 VanDerWaalsContact C-N 3.33Å; W603-K605 PolarHBondContact O-N 3.35Å; W603-M606 HydrophobicContact CE3-CB 4.35Å; W603-M606 HydrophobicContact CE3-SD 3.97Å; W603-M606 HydrophobicContact CZ3-SD 4.49Å; W603-M606 WeakPolarHBondContact O-CB 3.48Å; W603-M606 PolarHBondContact O-N 3.33Å; W603-K607 HydrophobicContact CZ2-CG 4.44Å; W603-K607 WeakPolarHBondContact O-CG 3.35Å; W603-K607 PolarHBondContact O-N 3.4Å; W603-M619 HydrophobicContact CZ3-SD 4.42Å; W603-K626 HydrophobicContact CH2-CB 4.16Å; W603-K626 HydrophobicContact CH2-CG 4.15Å; W603-K626 HydrophobicContact CZ2-CG 4.22Å; W603-L627 HydrophobicContact CH2-CD2 4.1Å; W603-L627 HydrophobicContact CH2-CG 4.05Å; W603-L627 HydrophobicContact CZ2-CD2 3.59Å; W603-L627 HydrophobicContact CZ2-CG 4.07Å; W603-L630 HydrophobicContact CZ2-CD1 4.5Å
604	N	93.3	Very high	89.5	Confident	88 Å²	88	56.4 Å²	56.4	47%	0.471	28%	0.28	S	S	.	.	H	α-helix	trans	-62.9	-39.7	175.9	-74.8	-25.4	0	0	0	112.2	K600 I602 K607 D608	K600-N604 WeakPolarHBondContact O-CB 3.49Å; K600-N604 VanDerWaalsContact O-CG 3.27Å; K600-N604 PolarHBondContact O-N 2.94Å; K600-N604 PolarHBondContact O-ND2 3.24Å; I602-N604 VanDerWaalsContact C-N 3.33Å; I602-N604 PolarHBondContact O-N 3.42Å; N604-K607 PolarHBondContact O-N 3.19Å; N604-K607 WeakPolarHBondContact OD1-CE 3.44Å; N604-K607 PolarHBondContact OD1-NZ 3.41Å; N604-D608 PolarHBondContact O-N 3.45Å
605	K	91.3	Very high	89	Confident	87 Å²	87	58.9 Å²	58.9	38%	0.378	29%	0.293	S	S	.	.	H	α-helix	trans	-71.3	-29.7	173.9	-67.9	178.2	178	179	0	112.9	K526 G601 I602 W603 E611 Y617	K526-K605 PolarHBondContact NZ-O 2.64Å; G601-K605 WeakPolarHBondContact O-CG 3.49Å; G601-K605 PolarHBondContact O-N 3.03Å; I602-K605 CarbonylContact O-C 3.54Å; I602-K605 PolarHBondContact O-N 3.33Å; I602-K605 VanDerWaalsContact O-N 3.13Å; W603-K605 VanDerWaalsContact C-N 3.33Å; W603-K605 PolarHBondContact O-N 3.35Å; K605-E611 HydrophobicContact CB-CG 4.2Å; K605-E611 HydrophobicContact CG-CG 4.43Å; K605-Y617 HydrophobicContact CB-CD1 3.77Å; K605-Y617 HydrophobicContact CB-CD2 4.31Å; K605-Y617 HydrophobicContact CB-CE1 4.17Å; K605-Y617 HydrophobicContact CB-CG 3.87Å; K605-Y617 HydrophobicContact CD-CD1 3.99Å; K605-Y617 HydrophobicContact CD-CD2 4.16Å; K605-Y617 HydrophobicContact CD-CE1 3.52Å; K605-Y617 HydrophobicContact CD-CE2 3.69Å; K605-Y617 HydrophobicContact CD-CG 4.31Å; K605-Y617 PolarHBondContact NZ-OH 3.42Å; K605-Y617 VanDerWaalsContact NZ-OH 3.07Å
606	M	91.1	Very high	88.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.3	-45.8	171.4	-72.4	172.3	169.4	0	0	111.1	K526 V531 L557 I602 W603 D608 A616 Y617 M619	K526-M606 PolarHBondContact NZ-O 3.29Å; V531-M606 HydrophobicContact CB-CE 4.46Å; V531-M606 HydrophobicContact CG1-CE 4.02Å; V531-M606 HydrophobicContact CG2-CE 3.69Å; L557-M606 HydrophobicContact CD1-CE 4.07Å; I602-M606 HydrophobicContact CG2-CE 3.6Å; I602-M606 HydrophobicContact CG2-CG 4.32Å; I602-M606 HydrophobicContact CG2-SD 4.1Å; I602-M606 WeakPolarHBondContact O-CG 3.49Å; I602-M606 PolarHBondContact O-N 2.76Å; W603-M606 HydrophobicContact CE3-CB 4.35Å; W603-M606 HydrophobicContact CE3-SD 3.97Å; W603-M606 HydrophobicContact CZ3-SD 4.49Å; W603-M606 WeakPolarHBondContact O-CB 3.48Å; W603-M606 PolarHBondContact O-N 3.33Å; M606-D608 VanDerWaalsContact C-N 3.34Å; M606-D608 PolarHBondContact O-N 3.19Å; M606-A616 WeakPolarHBondContact CE-O 3.49Å; M606-Y617 WeakPolarHBondContact CA-O 3.4Å; M606-M619 HydrophobicContact CB-CE 4.03Å; M606-M619 WeakPolarHBondContact O-CE 3.27Å
607	K	90.6	Very high	88.5	Confident	80 Å²	80	59 Å²	59	35%	0.348	29%	0.293	S	S	.	.	H	α-helix	trans	-58.9	-40.6	177	-72.8	-175.5	-65.8	176.9	0	113.2	Y521 W603 N604 V609 L627	Y521-K607 PolarHBondContact OH-O 3.36Å; W603-K607 HydrophobicContact CZ2-CG 4.44Å; W603-K607 WeakPolarHBondContact O-CG 3.35Å; W603-K607 PolarHBondContact O-N 3.4Å; N604-K607 PolarHBondContact O-N 3.19Å; N604-K607 WeakPolarHBondContact OD1-CE 3.44Å; N604-K607 PolarHBondContact OD1-NZ 3.41Å; K607-V609 PolarHBondContact O-N 2.91Å; K607-V609 VanDerWaalsContact O-N 3.13Å; K607-L627 HydrophobicContact CD-CD2 3.91Å; K607-L627 HydrophobicContact CG-CD1 4.39Å; K607-L627 HydrophobicContact CG-CD2 3.87Å
608	D	90.1	Very high	88.4	Confident	83 Å²	83	59.1 Å²	59.1	44%	0.444	28%	0.282	S	S	.	.			trans	-70.8	105.2	-178.8	-177.4	-0.4	0	0	0	112.3	K526 N604 M606 R610 E611	K526-D608 PolarHBondContact NZ-O 3.11Å; N604-D608 PolarHBondContact O-N 3.45Å; M606-D608 VanDerWaalsContact C-N 3.34Å; M606-D608 PolarHBondContact O-N 3.19Å; D608-R610 PolarHBondContact O-N 3.34Å; D608-R610 PolarHBondContact OD1-N 3.39Å; D608-E611 HydrophobicContact CB-CB 4.29Å; D608-E611 PolarHBondContact O-N 3.11Å
609	V	87	Confident	88.4	Confident	9 Å²	9	57.6 Å²	57.6	6%	0.055	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-21.8	-176.7	-170.1	0	0	0	0	113.6	R520 Y521 H524 K607	R520-V609 HydrophobicContact CG-CG2 4.4Å; Y521-V609 HydrophobicContact CD1-CG2 4.38Å; Y521-V609 HydrophobicContact CE1-CG2 3.84Å; H524-V609 HydrophobicContact CB-CG1 3.48Å; H524-V609 VanDerWaalsContact CB-CG1 3.48Å; H524-V609 WeakPolarHBondContact CD2-CG1 3.5Å; K607-V609 PolarHBondContact O-N 2.91Å; K607-V609 VanDerWaalsContact O-N 3.13Å
610	R	84.8	Confident	88.4	Confident	230 Å²	230	57.8 Å²	57.8	87%	0.868	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-24.7	-178.4	-61.8	-179.2	179.6	-177.4	0.5	113.2	D608 K612	D608-R610 PolarHBondContact O-N 3.34Å; D608-R610 PolarHBondContact OD1-N 3.39Å; R610-K612 PolarHBondContact O-N 2.94Å
611	E	85.9	Confident	88.2	Confident	57 Å²	57	55 Å²	55	27%	0.266	26%	0.264	S	S	.	.			trans	-80.5	106.8	-176.1	179.8	53.8	-94.6	0	0	111.3	K526 K605 D608 S613 Y617	K526-E611 WeakPolarHBondContact CE-O 3.3Å; K526-E611 PolarHBondContact NZ-O 2.93Å; K605-E611 HydrophobicContact CB-CG 4.2Å; K605-E611 HydrophobicContact CG-CG 4.43Å; D608-E611 HydrophobicContact CB-CB 4.29Å; D608-E611 PolarHBondContact O-N 3.11Å; E611-S613 WeakPolarHBondContact OE1-CB 3.43Å; E611-S613 PolarHBondContact OE1-N 2.86Å; E611-S613 PolarHBondContact OE1-OG 3.34Å; E611-Y617 HydrophobicContact CG-CD2 3.72Å; E611-Y617 HydrophobicContact CG-CE2 4.37Å; E611-Y617 HydrophobicContact CG-CG 4.35Å
612	K	83.3	Confident	88.2	Confident	81 Å²	81	56.6 Å²	56.6	35%	0.352	27%	0.265	S	S	.	.			trans	-124	8.4	-179.3	-63.1	-175.6	179.3	-173.6	0	113.9	H524 K526 R610 K614 Y618	H524-K612 WeakPolarHBondContact O-CE 3.31Å; H524-K612 PolarHBondContact O-NZ 2.94Å; K526-K612 HydrophobicContact CG-CG 4.44Å; R610-K612 PolarHBondContact O-N 2.94Å; K612-K614 PolarHBondContact O-N 2.77Å; K612-Y618 HydrophobicContact CB-CE2 4.44Å
613	S	81.9	Confident	88.2	Confident	86 Å²	86	56.2 Å²	56.2	60%	0.601	26%	0.263	S	S	*	.	S	Bend	trans	-61.3	-28.9	-172	59	0	0	0	0	114.2	E611 Y617	E611-S613 WeakPolarHBondContact OE1-CB 3.43Å; E611-S613 PolarHBondContact OE1-N 2.86Å; E611-S613 PolarHBondContact OE1-OG 3.34Å; S613-Y617 WeakPolarHBondContact OG-CE2 3.43Å
614	K	82.3	Confident	88.2	Confident	76 Å²	76	55.7 Å²	55.7	33%	0.33	26%	0.261	S	S	.	.	S	Bend	trans	-132.7	143.5	179.5	-55.8	-170.8	-174.5	-174.5	0	111	L538 A539 K612 A616 Y617 Y618	L538-K614 PolarHBondContact O-NZ 2.96Å; A539-K614 HydrophobicContact CB-CD 3.88Å; K612-K614 PolarHBondContact O-N 2.77Å; K614-A616 PolarHBondContact O-N 3.35Å; K614-Y617 HydrophobicContact CB-CD2 3.78Å; K614-Y617 HydrophobicContact CB-CE2 3.72Å; K614-Y617 HydrophobicContact CB-CG 4.29Å; K614-Y617 HydrophobicContact CD-CE2 3.87Å; K614-Y617 HydrophobicContact CG-CD2 4.24Å; K614-Y617 HydrophobicContact CG-CE2 3.71Å; K614-Y617 WeakPolarHBondContact O-CB 3.37Å; K614-Y617 PolarHBondContact O-N 3.14Å; K614-Y618 WeakPolarHBondContact O-CD2 3.49Å
615	Q	80.3	Confident	88.2	Confident	128 Å²	128	51.6 Å²	51.6	60%	0.598	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-60.7	-28.9	177.7	-165.5	175.8	15.9	0	0	112.9	Y617 Y618	Q615-Y617 PolarHBondContact O-N 3.34Å; Q615-Y618 WeakPolarHBondContact O-CB 3.41Å; Q615-Y618 PolarHBondContact O-N 3Å
616	A	83.1	Confident	88.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-65.4	-15.5	175.1	0	0	0	0	0	114	S535 I536 A539 M606 K614 Y618	S535-A616 WeakPolarHBondContact O-CB 3.35Å; I536-A616 HydrophobicContact CG1-CB 4.28Å; A539-A616 HydrophobicContact CB-CB 3.65Å; M606-A616 WeakPolarHBondContact CE-O 3.49Å; K614-A616 PolarHBondContact O-N 3.35Å; A616-Y618 VanDerWaalsContact C-N 3.34Å
617	Y	88.7	Confident	88.5	Confident	5 Å²	5	48.9 Å²	48.9	2%	0.02	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-90.5	-0.7	177.8	-54	-29	0	0	0	112.5	K526 A539 I602 K605 M606 E611 S613 K614 Q615	K526-Y617 WeakPolarHBondContact CE-O 3.43Å; K526-Y617 PolarHBondContact NZ-O 2.99Å; K526-Y617 VanDerWaalsContact NZ-O 3.08Å; A539-Y617 HydrophobicContact CB-CE1 3.99Å; I602-Y617 HydrophobicContact CG1-CE1 4.41Å; K605-Y617 HydrophobicContact CB-CD1 3.77Å; K605-Y617 HydrophobicContact CB-CD2 4.31Å; K605-Y617 HydrophobicContact CB-CE1 4.17Å; K605-Y617 HydrophobicContact CB-CG 3.87Å; K605-Y617 HydrophobicContact CD-CD1 3.99Å; K605-Y617 HydrophobicContact CD-CD2 4.16Å; K605-Y617 HydrophobicContact CD-CE1 3.52Å; K605-Y617 HydrophobicContact CD-CE2 3.69Å; K605-Y617 HydrophobicContact CD-CG 4.31Å; K605-Y617 PolarHBondContact NZ-OH 3.42Å; K605-Y617 VanDerWaalsContact NZ-OH 3.07Å; M606-Y617 WeakPolarHBondContact CA-O 3.4Å; E611-Y617 HydrophobicContact CG-CD2 3.72Å; E611-Y617 HydrophobicContact CG-CE2 4.37Å; E611-Y617 HydrophobicContact CG-CG 4.35Å; S613-Y617 WeakPolarHBondContact OG-CE2 3.43Å; K614-Y617 HydrophobicContact CB-CD2 3.78Å; K614-Y617 HydrophobicContact CB-CE2 3.72Å; K614-Y617 HydrophobicContact CB-CG 4.29Å; K614-Y617 HydrophobicContact CD-CE2 3.87Å; K614-Y617 HydrophobicContact CG-CD2 4.24Å; K614-Y617 HydrophobicContact CG-CE2 3.71Å; K614-Y617 WeakPolarHBondContact O-CB 3.37Å; K614-Y617 PolarHBondContact O-N 3.14Å; Q615-Y617 PolarHBondContact O-N 3.34Å
618	Y	89.1	Confident	88.6	Confident	59 Å²	59	45.2 Å²	45.2	23%	0.231	21%	0.213	C	C	.	.	S	Bend	trans	-73.7	147.4	178	-76.9	-125.9	0	0	0	110.1	E525 K526 K612 K614 Q615 A616 P620	E525-Y618 WeakPolarHBondContact O-CE1 3.43Å; K526-Y618 HydrophobicContact CG-CD1 4.39Å; K526-Y618 HydrophobicContact CG-CG 4.38Å; K612-Y618 HydrophobicContact CB-CE2 4.44Å; K614-Y618 WeakPolarHBondContact O-CD2 3.49Å; Q615-Y618 WeakPolarHBondContact O-CB 3.41Å; Q615-Y618 PolarHBondContact O-N 3Å; A616-Y618 VanDerWaalsContact C-N 3.34Å; Y618-P620 WeakPolarHBondContact O-CD 3.41Å
619	M	91.3	Very high	88.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	117.7	-175.5	-175.9	58	72.2	0	0	110.3	Y521 K526 L527 T528 W603 M606 G623 L627	Y521-M619 HydrophobicContact CD1-CB 3.62Å; Y521-M619 HydrophobicContact CD1-CG 4.03Å; Y521-M619 HydrophobicContact CD2-CG 4.28Å; Y521-M619 HydrophobicContact CE1-CB 4.02Å; Y521-M619 HydrophobicContact CE1-CE 3.78Å; Y521-M619 HydrophobicContact CE1-CG 4.21Å; Y521-M619 HydrophobicContact CE2-CE 4.3Å; Y521-M619 HydrophobicContact CE2-CG 4.45Å; Y521-M619 HydrophobicContact CG-CB 4.02Å; Y521-M619 HydrophobicContact CG-CG 4.08Å; K526-M619 PolarHBondContact O-N 2.75Å; L527-M619 WeakPolarHBondContact CA-O 3.48Å; L527-M619 HydrophobicContact CD2-CB 4.41Å; T528-M619 PolarHBondContact N-O 3.35Å; W603-M619 HydrophobicContact CZ3-SD 4.42Å; M606-M619 HydrophobicContact CB-CE 4.03Å; M606-M619 WeakPolarHBondContact O-CE 3.27Å; M619-G623 VanDerWaalsContact SD-CA 3.5Å; M619-L627 HydrophobicContact CE-CD1 3.64Å
620	P	91.7	Very high	89.2	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.032	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	164.5	170.7	31	-34.2	0	0	0	111.9	T528 V531 M561 Y618 D622 G623 Y624	T528-P620 HydrophobicContact CG2-CB 4.39Å; T528-P620 WeakPolarHBondContact O-CA 3.23Å; V531-P620 HydrophobicContact CG2-CB 4.25Å; V531-P620 HydrophobicContact CG2-CG 3.98Å; M561-P620 HydrophobicContact CE-CG 4Å; M561-P620 HydrophobicContact SD-CG 3.61Å; Y618-P620 WeakPolarHBondContact O-CD 3.41Å; P620-D622 VanDerWaalsContact C-N 3.33Å; P620-D622 PolarHBondContact O-N 3.28Å; P620-G623 WeakPolarHBondContact O-CA 3.45Å; P620-G623 PolarHBondContact O-N 2.77Å; P620-Y624 PolarHBondContact O-N 3.09Å
621	H	89.9	Confident	89.4	Confident	25 Å²	25	37.5 Å²	37.5	12%	0.116	18%	0.179	C	C	.	.	H	α-helix	trans	-59.7	-42.2	177.8	-71.7	-86.9	0	0	0	113.1	G623 Y624 L625	H621-G623 PolarHBondContact O-N 3.07Å; H621-Y624 HydrophobicContact CB-CE1 3.91Å; H621-Y624 AromaticContact CG-CE1 3.87Å; H621-Y624 AromaticContact ND1-CE1 3.37Å; H621-Y624 WeakPolarHBondContact ND1-CE1 3.39Å; H621-Y624 AromaticContact ND1-CZ 3.59Å; H621-Y624 PolarHBondContact ND1-OH 2.94Å; H621-L625 PolarHBondContact O-N 2.85Å
622	D	90.6	Very high	89.4	Confident	67 Å²	67	42.4 Å²	42.4	36%	0.358	21%	0.207	S	C	.	.	H	α-helix	trans	-68.1	-20	174.8	-61.5	-29.2	0	0	0	112.4	H510 M561 P620 K626	H510-D622 IonicContact CD2-OD1 2.8Å; H510-D622 IonicContact CE1-OD1 2.76Å; H510-D622 IonicContact NE2-OD1 2.64Å; H510-D622 PolarHBondContact NE2-OD1 3.06Å; M561-D622 HydrophobicContact CB-CB 4.17Å; M561-D622 HydrophobicContact SD-CB 4.43Å; P620-D622 VanDerWaalsContact C-N 3.33Å; P620-D622 PolarHBondContact O-N 3.28Å; D622-K626 WeakPolarHBondContact O-CB 3.47Å; D622-K626 PolarHBondContact O-N 3.01Å
623	G	92.6	Very high	89.3	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-73.6	-47.4	178.6	0	0	0	0	0	112.5	M561 M619 P620 H621 L625 K626 L627	M561-G623 VanDerWaalsContact SD-CA 3.53Å; M619-G623 VanDerWaalsContact SD-CA 3.5Å; P620-G623 WeakPolarHBondContact O-CA 3.45Å; P620-G623 PolarHBondContact O-N 2.77Å; H621-G623 PolarHBondContact O-N 3.07Å; G623-L625 VanDerWaalsContact C-N 3.29Å; G623-L625 PolarHBondContact O-N 3.47Å; G623-K626 WeakPolarHBondContact O-CB 3.23Å; G623-K626 PolarHBondContact O-N 2.8Å; G623-L627 WeakPolarHBondContact O-CG 3.36Å; G623-L627 PolarHBondContact O-N 3.05Å
624	Y	93.1	Very high	89.4	Confident	3 Å²	3	42.7 Å²	42.7	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-69.8	-30.6	174.6	68.2	-112.8	0	0	0	111.7	A513 Y514 L527 P620 H621 K626 L627 W628	A513-Y624 HydrophobicContact CB-CD2 3.97Å; A513-Y624 HydrophobicContact CB-CE2 4.01Å; Y514-Y624 HydrophobicContact CD2-CE1 4.33Å; L527-Y624 HydrophobicContact CD2-CD1 4Å; L527-Y624 HydrophobicContact CD2-CE1 4.27Å; P620-Y624 PolarHBondContact O-N 3.09Å; H621-Y624 HydrophobicContact CB-CE1 3.91Å; H621-Y624 AromaticContact CG-CE1 3.87Å; H621-Y624 AromaticContact ND1-CE1 3.37Å; H621-Y624 WeakPolarHBondContact ND1-CE1 3.39Å; H621-Y624 AromaticContact ND1-CZ 3.59Å; H621-Y624 PolarHBondContact ND1-OH 2.94Å; Y624-K626 VanDerWaalsContact C-N 3.33Å; Y624-L627 PolarHBondContact O-N 2.99Å; Y624-W628 WeakPolarHBondContact O-CB 3.35Å; Y624-W628 PolarHBondContact O-N 3.49Å
625	L	93.7	Very high	89.5	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-61.7	-43.8	172	179.4	70.5	0	0	0	110.6	A513 H621 G623 L627 W628 Q629 I656	A513-L625 HydrophobicContact CB-CB 4.39Å; A513-L625 HydrophobicContact CB-CD1 3.63Å; H621-L625 PolarHBondContact O-N 2.85Å; G623-L625 VanDerWaalsContact C-N 3.29Å; G623-L625 PolarHBondContact O-N 3.47Å; L625-L627 VanDerWaalsContact C-N 3.35Å; L625-L627 PolarHBondContact O-N 3.15Å; L625-W628 HydrophobicContact CD1-CE3 3.88Å; L625-W628 HydrophobicContact CD1-CZ3 4.22Å; L625-W628 WeakPolarHBondContact O-CB 3.5Å; L625-W628 PolarHBondContact O-N 2.91Å; L625-Q629 PolarHBondContact O-N 3.33Å; L625-I656 HydrophobicContact CD1-CG1 4.43Å; L625-I656 HydrophobicContact CD2-CD1 4.09Å; L625-I656 HydrophobicContact CD2-CG1 3.75Å
626	K	94.6	Very high	89.5	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.2	-42.6	173.3	-176.7	59.9	175.3	175.6	0	111.7	F560 M561 S563 D565 W603 D622 G623 Y624 W628 Q629 L630	F560-K626 HydrophobicContact CE1-CG 4.01Å; F560-K626 VanDerWaalsContact CZ-CE 3.47Å; F560-K626 HydrophobicContact CZ-CG 4.33Å; F560-K626 WeakPolarHBondContact O-CE 3.44Å; F560-K626 PolarHBondContact O-NZ 3Å; M561-K626 HydrophobicContact CB-CB 4.39Å; M561-K626 HydrophobicContact CG-CB 4.3Å; S563-K626 PolarHBondContact O-NZ 2.85Å; D565-K626 WeakPolarHBondContact O-CE 3.34Å; D565-K626 PolarHBondContact O-NZ 3Å; W603-K626 HydrophobicContact CH2-CB 4.16Å; W603-K626 HydrophobicContact CH2-CG 4.15Å; W603-K626 HydrophobicContact CZ2-CG 4.22Å; D622-K626 WeakPolarHBondContact O-CB 3.47Å; D622-K626 PolarHBondContact O-N 3.01Å; G623-K626 WeakPolarHBondContact O-CB 3.23Å; G623-K626 PolarHBondContact O-N 2.8Å; Y624-K626 VanDerWaalsContact C-N 3.33Å; K626-W628 VanDerWaalsContact C-N 3.29Å; K626-W628 PolarHBondContact O-N 3.38Å; K626-Q629 PolarHBondContact O-N 2.83Å; K626-L630 HydrophobicContact CD-CD1 4.36Å; K626-L630 HydrophobicContact CD-CG 4.3Å; K626-L630 HydrophobicContact CG-CD1 4.05Å; K626-L630 HydrophobicContact CG-CG 4.43Å; K626-L630 VanDerWaalsContact O-CG 3.23Å; K626-L630 WeakPolarHBondContact O-CG 3.32Å; K626-L630 PolarHBondContact O-N 3.44Å
627	L	93.9	Very high	89.6	Confident	31 Å²	31	37.1 Å²	37.1	16%	0.162	19%	0.192	C	C	.	.	H	α-helix	trans	-63.5	-34.8	175.2	-69.1	177.6	0	0	0	113.2	V517 Y521 W603 K607 M619 G623 Y624 L625 L630 R631	V517-L627 HydrophobicContact CG1-CB 4.04Å; V517-L627 HydrophobicContact CG1-CD1 4.4Å; Y521-L627 HydrophobicContact CE2-CD1 4.01Å; Y521-L627 WeakPolarHBondContact OH-CD1 3.18Å; W603-L627 HydrophobicContact CH2-CD2 4.1Å; W603-L627 HydrophobicContact CH2-CG 4.05Å; W603-L627 HydrophobicContact CZ2-CD2 3.59Å; W603-L627 HydrophobicContact CZ2-CG 4.07Å; K607-L627 HydrophobicContact CD-CD2 3.91Å; K607-L627 HydrophobicContact CG-CD1 4.39Å; K607-L627 HydrophobicContact CG-CD2 3.87Å; M619-L627 HydrophobicContact CE-CD1 3.64Å; G623-L627 WeakPolarHBondContact O-CG 3.36Å; G623-L627 PolarHBondContact O-N 3.05Å; Y624-L627 PolarHBondContact O-N 2.99Å; L625-L627 VanDerWaalsContact C-N 3.35Å; L625-L627 PolarHBondContact O-N 3.15Å; L627-L630 PolarHBondContact O-N 2.63Å; L627-R631 WeakPolarHBondContact O-CG 3.25Å
628	W	93.7	Very high	89.1	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-66.1	-41.8	173.2	179.9	69.7	0	0	0	111.7	L512 A513 E516 V517 Y624 L625 K626 L630 R631 P635 V659	L512-W628 HydrophobicContact CB-CH2 4.17Å; L512-W628 HydrophobicContact CB-CZ2 4.1Å; L512-W628 HydrophobicContact CD1-CH2 4.49Å; A513-W628 HydrophobicContact CB-CB 3.71Å; A513-W628 HydrophobicContact CB-CD2 3.71Å; A513-W628 HydrophobicContact CB-CE3 3.81Å; A513-W628 HydrophobicContact CB-CG 3.7Å; E516-W628 PolarHBondContact OE2-NE1 2.88Å; V517-W628 HydrophobicContact CG2-CB 3.95Å; Y624-W628 WeakPolarHBondContact O-CB 3.35Å; Y624-W628 PolarHBondContact O-N 3.49Å; L625-W628 HydrophobicContact CD1-CE3 3.88Å; L625-W628 HydrophobicContact CD1-CZ3 4.22Å; L625-W628 WeakPolarHBondContact O-CB 3.5Å; L625-W628 PolarHBondContact O-N 2.91Å; K626-W628 VanDerWaalsContact C-N 3.29Å; K626-W628 PolarHBondContact O-N 3.38Å; W628-L630 VanDerWaalsContact C-N 3.34Å; W628-L630 PolarHBondContact O-N 3.39Å; W628-R631 WeakPolarHBondContact O-CG 3.39Å; W628-R631 PolarHBondContact O-N 3.14Å; W628-P635 HydrophobicContact CD2-CG 3.95Å; W628-P635 VanDerWaalsContact CE2-CG 3.41Å; W628-P635 HydrophobicContact CG-CG 4.1Å; W628-P635 HydrophobicContact CZ2-CB 3.8Å; W628-P635 HydrophobicContact CZ2-CG 3.9Å; W628-V659 HydrophobicContact CE3-CB 4.47Å; W628-V659 HydrophobicContact CE3-CG1 4.23Å; W628-V659 HydrophobicContact CE3-CG2 4.03Å; W628-V659 HydrophobicContact CH2-CB 4.17Å; W628-V659 HydrophobicContact CH2-CG1 3.41Å; W628-V659 VanDerWaalsContact CH2-CG1 3.41Å; W628-V659 HydrophobicContact CZ2-CG1 3.91Å; W628-V659 HydrophobicContact CZ3-CB 3.87Å; W628-V659 HydrophobicContact CZ3-CG1 3.59Å; W628-V659 HydrophobicContact CZ3-CG2 3.92Å
629	Q	94.6	Very high	88.8	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-64.5	-34.5	174.4	178.9	-91	-34.2	0	0	113.4	A564 L625 K626 R631 A655 D658 V659	A564-Q629 PolarHBondContact O-NE2 3.25Å; L625-Q629 PolarHBondContact O-N 3.33Å; K626-Q629 PolarHBondContact O-N 2.83Å; Q629-R631 VanDerWaalsContact C-N 3.27Å; Q629-R631 PolarHBondContact O-N 3.08Å; Q629-A655 WeakPolarHBondContact CG-O 3.2Å; Q629-D658 HydrophobicContact CG-CB 4.45Å; Q629-D658 PolarHBondContact NE2-OD2 3.09Å; Q629-V659 HydrophobicContact CB-CG2 3.66Å; Q629-V659 HydrophobicContact CG-CG2 3.72Å
630	L	93.4	Very high	88.6	Confident	40 Å²	40	51 Å²	51	21%	0.209	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	2.5	-180	-66.7	173.7	0	0	0	114.2	F560 W603 K626 L627 W628	F560-L630 HydrophobicContact CZ-CD1 4.2Å; W603-L630 HydrophobicContact CZ2-CD1 4.5Å; K626-L630 HydrophobicContact CD-CD1 4.36Å; K626-L630 HydrophobicContact CD-CG 4.3Å; K626-L630 HydrophobicContact CG-CD1 4.05Å; K626-L630 HydrophobicContact CG-CG 4.43Å; K626-L630 VanDerWaalsContact O-CG 3.23Å; K626-L630 WeakPolarHBondContact O-CG 3.32Å; K626-L630 PolarHBondContact O-N 3.44Å; L627-L630 PolarHBondContact O-N 2.63Å; W628-L630 VanDerWaalsContact C-N 3.34Å; W628-L630 PolarHBondContact O-N 3.39Å
631	R	90.4	Very high	88.7	Confident	119 Å²	119	51.2 Å²	51.2	45%	0.449	26%	0.255	S	S	.	.			trans	-67.6	141.3	176.8	-67.6	-176.3	72.3	173.8	4.2	110.5	E516 L627 W628 Q629 P633 K634	E516-R631 IonicContact OE2-CZ 3.84Å; E516-R631 IonicContact OE2-NH1 2.8Å; E516-R631 PolarHBondContact OE2-NH1 3.14Å; L627-R631 WeakPolarHBondContact O-CG 3.25Å; W628-R631 WeakPolarHBondContact O-CG 3.39Å; W628-R631 PolarHBondContact O-N 3.14Å; Q629-R631 VanDerWaalsContact C-N 3.27Å; Q629-R631 PolarHBondContact O-N 3.08Å; R631-P633 CarbonylContact C-O 3.55Å; R631-P633 CarbonylContact O-C 3.48Å; R631-K634 WeakPolarHBondContact O-CA 3.4Å; R631-K634 PolarHBondContact O-N 3.47Å
632	D	84.7	Confident	88.9	Confident	160 Å²	160	52.3 Å²	52.3	86%	0.856	26%	0.261	S	S	*	.	S	Bend	trans	-128.6	118.1	174.7	-170.2	22.6	0	0	0	109.5
633	P	82.3	Confident	89.1	Confident	109 Å²	109	49.1 Å²	49.1	71%	0.708	24%	0.244	S	C	*	.	S	Bend	cis	-63.8	157.8	-4	29.4	-35.4	0	0	0	112	R631	R631-P633 CarbonylContact C-O 3.55Å; R631-P633 CarbonylContact O-C 3.48Å
634	K	84.4	Confident	89.2	Confident	65 Å²	65	49.1 Å²	49.1	28%	0.283	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-57.6	154.8	175.9	-69.7	-157.7	-165.9	-168.3	0	110.8	R631 C636 D658 A662	R631-K634 WeakPolarHBondContact O-CA 3.4Å; R631-K634 PolarHBondContact O-N 3.47Å; K634-C636 PolarHBondContact O-N 3.13Å; K634-C636 VanDerWaalsContact O-N 3.12Å; K634-D658 PolarHBondContact NZ-O 3.08Å; K634-D658 IonicContact NZ-OD1 3.84Å; K634-D658 PolarHBondContact NZ-OD1 2.64Å; K634-D658 IonicContact NZ-OD2 2.68Å; K634-D658 PolarHBondContact NZ-OD2 3.1Å; K634-A662 HydrophobicContact CD-CB 3.57Å
635	P	82.5	Confident	89.4	Confident	8 Å²	8	49 Å²	49	5%	0.052	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-52.5	120.9	176.7	-24.8	33.6	0	0	0	111.2	W628 L637 V659 Q663	W628-P635 HydrophobicContact CD2-CG 3.95Å; W628-P635 VanDerWaalsContact CE2-CG 3.41Å; W628-P635 HydrophobicContact CG-CG 4.1Å; W628-P635 HydrophobicContact CZ2-CB 3.8Å; W628-P635 HydrophobicContact CZ2-CG 3.9Å; P635-L637 PolarHBondContact O-N 2.77Å; P635-V659 HydrophobicContact CB-CG1 4.46Å; P635-V659 HydrophobicContact CG-CG1 4.23Å; P635-Q663 PolarHBondContact O-NE2 3.49Å; P635-Q663 PolarHBondContact O-OE1 3.14Å
636	C	82.3	Confident	89.5	Confident	69 Å²	69	48.9 Å²	48.9	47%	0.466	24%	0.243	S	C	.	.			trans	-85.4	101.7	-179.6	-171.8	0	0	0	0	109.7	K634 E639	K634-C636 PolarHBondContact O-N 3.13Å; K634-C636 VanDerWaalsContact O-N 3.12Å; C636-E639 PolarHBondContact SG-OE1 2.88Å
637	L	83.9	Confident	89.4	Confident	9 Å²	9	49.1 Å²	49.1	5%	0.047	25%	0.245	C	C	.	.			trans	-94.5	-20.2	173.4	-56.9	176.5	0	0	0	111.6	L484 P635 E639 R640 Y641 L660 Q663	L484-L637 HydrophobicContact CD2-CD1 3.97Å; P635-L637 PolarHBondContact O-N 2.77Å; L637-E639 VanDerWaalsContact C-N 3.31Å; L637-E639 PolarHBondContact O-N 3.45Å; L637-R640 PolarHBondContact O-N 3.14Å; L637-R640 VanDerWaalsContact O-N 3.08Å; L637-Y641 HydrophobicContact CB-CD2 4.27Å; L637-Y641 WeakPolarHBondContact O-CD2 3.46Å; L637-Y641 PolarHBondContact O-N 3.44Å; L637-L660 HydrophobicContact CD1-CD2 4.37Å; L637-Q663 HydrophobicContact CB-CG 4.22Å; L637-Q663 HydrophobicContact CD1-CG 4.28Å
638	T	78.8	Confident	89.2	Confident	40 Å²	40	49 Å²	49	25%	0.245	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-32.6	-175.3	-57.9	0	0	0	0	114	R640 H664 C665	T638-R640 PolarHBondContact O-N 2.98Å; T638-H664 HydrophobicContact CG2-CB 4.04Å; T638-H664 WeakPolarHBondContact CG2-O 3.48Å; T638-H664 PolarHBondContact OG1-N 2.59Å; T638-C665 HydrophobicContact CG2-CB 4.28Å
639	E	81.8	Confident	89.1	Confident	150 Å²	150	49 Å²	49	70%	0.701	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-25.7	177.6	-70.6	169.5	-154.8	0	0	112.8	R482 C636 L637	R482-E639 PolarHBondContact NH1-O 3.12Å; R482-E639 PolarHBondContact NH2-O 2.94Å; R482-E639 VanDerWaalsContact NH2-O 3.08Å; C636-E639 PolarHBondContact SG-OE1 2.88Å; L637-E639 VanDerWaalsContact C-N 3.31Å; L637-E639 PolarHBondContact O-N 3.45Å
640	R	87.6	Confident	88.8	Confident	165 Å²	165	48.9 Å²	48.9	62%	0.623	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-25.8	-175	-63.5	-174	-175.7	179.5	2.4	113.7	R482 L637 T638	R482-R640 PolarHBondContact NE-O 2.86Å; R482-R640 PolarHBondContact NH1-O 3.28Å; L637-R640 PolarHBondContact O-N 3.14Å; L637-R640 VanDerWaalsContact O-N 3.08Å; T638-R640 PolarHBondContact O-N 2.98Å
641	Y	93.5	Very high	88.6	Confident	11 Å²	11	47.1 Å²	47.1	4%	0.043	23%	0.233	C	C	.	.			trans	-137.4	137.9	-172.3	-47.2	-74.1	0	0	0	111.5	L484 D505 L637	L484-Y641 HydrophobicContact CB-CD1 3.82Å; L484-Y641 HydrophobicContact CB-CD2 3.73Å; L484-Y641 HydrophobicContact CB-CE1 4.04Å; L484-Y641 HydrophobicContact CB-CE2 3.94Å; L484-Y641 HydrophobicContact CB-CG 3.64Å; L484-Y641 HydrophobicContact CD1-CE1 4.38Å; L484-Y641 HydrophobicContact CD1-CE2 4.08Å; L484-Y641 HydrophobicContact CD2-CD2 4.03Å; L484-Y641 HydrophobicContact CD2-CE2 3.88Å; L484-Y641 HydrophobicContact CG-CD2 4.36Å; L484-Y641 HydrophobicContact CG-CE2 4.18Å; D505-Y641 HydrophobicContact CB-CE1 3.78Å; D505-Y641 PolarHBondContact OD2-OH 3.49Å; L637-Y641 HydrophobicContact CB-CD2 4.27Å; L637-Y641 WeakPolarHBondContact O-CD2 3.46Å; L637-Y641 PolarHBondContact O-N 3.44Å
642	D	94	Very high	88.5	Confident	47 Å²	47	41.7 Å²	41.7	25%	0.251	21%	0.214	S	C	.	.	S	Bend	trans	-87.3	-25.4	-179.9	-44.6	-45.6	0	0	0	110.7	L481 R482 C665 G666	L481-D642 WeakPolarHBondContact CA-OD2 3.44Å; L481-D642 HydrophobicContact CD2-CB 4.16Å; R482-D642 PolarHBondContact N-OD2 3.2Å; R482-D642 IonicContact NE-OD1 2.76Å; R482-D642 IonicContact NE-OD2 3.87Å; R482-D642 IonicContact NH2-OD1 3.46Å; R482-D642 PolarHBondContact NH2-OD1 3.35Å; R482-D642 PolarHBondContact O-N 3.33Å; D642-C665 WeakPolarHBondContact O-CB 3.29Å; D642-G666 PolarHBondContact O-N 2.86Å; D642-G666 VanDerWaalsContact O-N 3.17Å
643	A	95.3	Very high	88.9	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	155.2	171.4	0	0	0	0	0	113.7	I451 R482 F483 L484 G666	I451-A643 HydrophobicContact CG1-CB 4.41Å; I451-A643 HydrophobicContact CG2-CB 4.3Å; R482-A643 PolarHBondContact O-N 2.94Å; F483-A643 WeakPolarHBondContact CA-O 3.37Å; F483-A643 HydrophobicContact CD1-CB 3.74Å; F483-A643 HydrophobicContact CE1-CB 3.79Å; L484-A643 PolarHBondContact N-O 3.18Å; A643-G666 CarbonylContact C-O 3.39Å; A643-G666 WeakPolarHBondContact CA-O 3.43Å; A643-G666 WeakPolarHBondContact CB-O 3.4Å
644	I	95.9	Very high	89.3	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.4	-179.2	-55.6	173.8	0	0	0	109.9	L484 V486 I646 L660 Q663 C665 G666 I668	L484-I644 HydrophobicContact CB-CG1 4.31Å; L484-I644 HydrophobicContact CB-CG2 4.49Å; L484-I644 HydrophobicContact CD2-CG1 4.44Å; L484-I644 HydrophobicContact CD2-CG2 4.39Å; L484-I644 HydrophobicContact CG-CG2 4.5Å; L484-I644 CarbonylContact O-C 3.37Å; L484-I644 WeakPolarHBondContact O-CA 3.42Å; V486-I644 HydrophobicContact CG2-CG2 3.98Å; I644-I646 HydrophobicContact CG2-CD1 4.46Å; I644-I646 HydrophobicContact CG2-CG1 3.89Å; I644-L660 HydrophobicContact CG2-CD2 4.48Å; I644-Q663 HydrophobicContact CD1-CB 3.93Å; I644-Q663 HydrophobicContact CD1-CG 3.72Å; I644-C665 VanDerWaalsContact CD1-SG 3.57Å; I644-G666 PolarHBondContact N-O 3.36Å; I644-I668 PolarHBondContact O-N 2.81Å
645	F	96.4	Very high	89.7	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	128.4	167.2	-57.1	-22.1	0	0	0	109.7	L471 Y474 A475 F483 L484 Y485 V486 F500 I668	L471-F645 HydrophobicContact CB-CD2 4.18Å; L471-F645 HydrophobicContact CB-CE2 4.3Å; L471-F645 HydrophobicContact CD1-CB 4.22Å; L471-F645 HydrophobicContact CD1-CD2 4.42Å; L471-F645 HydrophobicContact CD1-CG 4.42Å; L471-F645 HydrophobicContact CD2-CB 4.43Å; L471-F645 HydrophobicContact CD2-CD1 4.04Å; L471-F645 HydrophobicContact CD2-CD2 4.09Å; L471-F645 HydrophobicContact CD2-CE1 4.32Å; L471-F645 HydrophobicContact CD2-CE2 4.35Å; L471-F645 HydrophobicContact CD2-CG 3.93Å; L471-F645 HydrophobicContact CD2-CZ 4.47Å; L471-F645 HydrophobicContact CG-CD2 4.47Å; Y474-F645 HydrophobicContact CD1-CE1 4.03Å; Y474-F645 AromaticContact CD1-CZ 3.78Å; Y474-F645 HydrophobicContact CD1-CZ 3.78Å; Y474-F645 HydrophobicContact CE1-CE1 4.37Å; Y474-F645 HydrophobicContact CE1-CZ 4.47Å; A475-F645 HydrophobicContact CB-CE2 4.02Å; A475-F645 HydrophobicContact CB-CZ 4.23Å; F483-F645 HydrophobicContact CB-CE2 4.23Å; F483-F645 HydrophobicContact CB-CZ 4.32Å; F483-F645 HydrophobicContact CD1-CD1 4.3Å; F483-F645 AromaticContact CD1-CE1 3.43Å; F483-F645 HydrophobicContact CD1-CE1 3.43Å; F483-F645 VanDerWaalsContact CD1-CE1 3.43Å; F483-F645 AromaticContact CD1-CE2 4Å; F483-F645 HydrophobicContact CD1-CE2 4Å; F483-F645 AromaticContact CD1-CZ 3.25Å; F483-F645 HydrophobicContact CD1-CZ 3.25Å; F483-F645 HydrophobicContact CD2-CZ 4.49Å; F483-F645 AromaticContact CE1-CE1 3.69Å; F483-F645 HydrophobicContact CE1-CE1 3.69Å; F483-F645 AromaticContact CE1-CZ 3.54Å; F483-F645 HydrophobicContact CE1-CZ 3.54Å; F483-F645 HydrophobicContact CG-CE1 4.34Å; F483-F645 HydrophobicContact CG-CE2 4.12Å; F483-F645 AromaticContact CG-CZ 3.78Å; F483-F645 HydrophobicContact CG-CZ 3.78Å; F483-F645 HydrophobicContact CZ-CZ 4.28Å; L484-F645 PolarHBondContact O-N 3.35Å; Y485-F645 HydrophobicContact CD2-CB 3.92Å; Y485-F645 HydrophobicContact CD2-CD2 4.3Å; V486-F645 PolarHBondContact N-O 3.05Å; F500-F645 AromaticContact CE1-CD2 3.95Å; F500-F645 HydrophobicContact CE1-CD2 3.95Å; F500-F645 AromaticContact CE1-CE2 3.97Å; F500-F645 HydrophobicContact CE1-CE2 3.97Å; F500-F645 HydrophobicContact CZ-CD2 4.49Å; F645-I668 HydrophobicContact CD1-CB 3.95Å; F645-I668 HydrophobicContact CD1-CD1 4.03Å; F645-I668 HydrophobicContact CD1-CG1 4.13Å; F645-I668 HydrophobicContact CE1-CB 4.48Å; F645-I668 HydrophobicContact CE1-CD1 3.67Å; F645-I668 HydrophobicContact CE1-CG1 4.23Å
646	I	94.8	Very high	90.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	97.9	179.7	-49.9	178.4	0	0	0	106.6	I644 A649 M657 L660 I668 L669 V670	I644-I646 HydrophobicContact CG2-CD1 4.46Å; I644-I646 HydrophobicContact CG2-CG1 3.89Å; I646-A649 HydrophobicContact CG2-CB 4.15Å; I646-M657 HydrophobicContact CD1-CE 3.58Å; I646-M657 HydrophobicContact CG2-CE 4.27Å; I646-L660 HydrophobicContact CD1-CB 3.78Å; I646-L660 HydrophobicContact CD1-CD1 3.78Å; I646-L660 HydrophobicContact CD1-CG 4.38Å; I646-L660 HydrophobicContact CG1-CD1 4.03Å; I646-L660 HydrophobicContact CG2-CD1 4.11Å; I646-I668 PolarHBondContact N-O 2.87Å; I646-L669 HydrophobicContact CB-CG 4.34Å; I646-L669 HydrophobicContact CD1-CD1 4.09Å; I646-L669 HydrophobicContact CD1-CG 4.14Å; I646-V670 PolarHBondContact O-N 3.49Å
647	D	92.6	Very high	90.6	Very high	5 Å²	5	25.8 Å²	25.8	3%	0.027	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	154.2	179.4	-162.6	17.8	0	0	0	111.5	Y485 V486 A649 V670	Y485-D647 HydrophobicContact CE2-CB 3.73Å; Y485-D647 PolarHBondContact OH-OD2 3.3Å; V486-D647 PolarHBondContact O-N 2.82Å; V486-D647 VanDerWaalsContact O-N 3.11Å; D647-A649 PolarHBondContact O-N 2.95Å; D647-V670 CarbonylContact C-O 3.58Å
648	E	90.9	Very high	91.1	Very high	30 Å²	30	27.4 Å²	27.4	14%	0.14	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	40.2	-173.6	-59	-69.6	142.2	0	0	112.2	K467 Q650 D651 V670 K891	K467-E648 VanDerWaalsContact CE-OE1 3.24Å; K467-E648 WeakPolarHBondContact CE-OE1 3.19Å; K467-E648 IonicContact NZ-OE1 3.95Å; K467-E648 PolarHBondContact NZ-OE1 3.03Å; E648-Q650 PolarHBondContact O-N 3.5Å; E648-Q650 PolarHBondContact OE2-NE2 3.32Å; E648-D651 PolarHBondContact O-N 3.38Å; E648-V670 PolarHBondContact N-O 3.04Å; E648-K891 WeakPolarHBondContact OE2-CE 3.18Å; E648-K891 IonicContact OE2-NZ 3.47Å; E648-K891 PolarHBondContact OE2-NZ 3.42Å
649	A	90.4	Very high	91.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-57	-21.8	-173.5	0	0	0	0	0	113.8	I646 D647 D651 C652 L669 V670 A686 L687	I646-A649 HydrophobicContact CG2-CB 4.15Å; D647-A649 PolarHBondContact O-N 2.95Å; A649-D651 PolarHBondContact O-N 3.23Å; A649-C652 PolarHBondContact O-N 3.4Å; A649-L669 HydrophobicContact CB-CB 4.06Å; A649-L669 HydrophobicContact CB-CD2 4.37Å; A649-L669 HydrophobicContact CB-CG 4.34Å; A649-V670 PolarHBondContact N-O 3.35Å; A649-A686 VanDerWaalsContact O-CB 3.23Å; A649-A686 WeakPolarHBondContact O-CB 3.48Å; A649-L687 HydrophobicContact CB-CD2 4.11Å; A649-L687 HydrophobicContact CB-CG 4.17Å
650	Q	89.2	Confident	92.2	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-66.2	-22.2	174.1	76	-76	-19	0	0	114.2	E648 G671 D672 Q676 L687	E648-Q650 PolarHBondContact O-N 3.5Å; E648-Q650 PolarHBondContact OE2-NE2 3.32Å; Q650-G671 VanDerWaalsContact OE1-CA 3.29Å; Q650-D672 VanDerWaalsContact CD-O 3.32Å; Q650-D672 VanDerWaalsContact CG-O 3.23Å; Q650-D672 WeakPolarHBondContact CG-O 3.27Å; Q650-Q676 HydrophobicContact CB-CB 4.13Å; Q650-Q676 HydrophobicContact CG-CB 3.86Å; Q650-Q676 HydrophobicContact CG-CG 4.48Å; Q650-Q676 WeakPolarHBondContact O-CG 3.49Å; Q650-Q676 PolarHBondContact O-NE2 3.21Å; Q650-L687 HydrophobicContact CB-CD1 4.19Å
651	D	88.8	Confident	92.4	Very high	2 Å²	2	13.2 Å²	13.2	1%	0.011	7%	0.072	C	C	.	.	G	3₁₀ helix	trans	-100.2	-0	-178.2	-65.9	-50.4	0	0	0	112.9	F488 E648 A649 Q676 I677 Y678 A683 K891	F488-D651 HydrophobicContact CD2-CB 4.34Å; F488-D651 HydrophobicContact CE2-CB 4.34Å; F488-D651 VanDerWaalsContact CE2-O 3.26Å; F488-D651 WeakPolarHBondContact CE2-O 3.35Å; E648-D651 PolarHBondContact O-N 3.38Å; A649-D651 PolarHBondContact O-N 3.23Å; D651-Q676 WeakPolarHBondContact OD1-CA 3.4Å; D651-I677 PolarHBondContact OD1-N 2.95Å; D651-Y678 HydrophobicContact CB-CD2 3.89Å; D651-Y678 VanDerWaalsContact CG-CD2 3.49Å; D651-Y678 WeakPolarHBondContact OD1-CD2 3.29Å; D651-A683 VanDerWaalsContact O-CB 3.31Å; D651-A683 WeakPolarHBondContact O-CB 3.31Å; D651-K891 IonicContact OD2-NZ 3.77Å; D651-K891 PolarHBondContact OD2-NZ 2.91Å
652	C	89.3	Confident	92.3	Very high	6 Å²	6	14.6 Å²	14.6	4%	0.041	9%	0.085	C	C	.	.			trans	-70.8	142	175.6	-70.2	0	0	0	0	111.8	A649 M657 V684	A649-C652 PolarHBondContact O-N 3.4Å; C652-M657 HydrophobicContact CB-CG 3.72Å; C652-M657 HydrophobicContact CB-SD 3.9Å; C652-V684 PolarHBondContact O-N 3.27Å
653	T	91.4	Very high	92.1	Very high	18 Å²	18	12.7 Å²	12.7	11%	0.11	8%	0.075	C	C	.	.			trans	-79.1	153.1	171.9	59.1	0	0	0	0	110.7	A562 A655 I656 M657	A562-T653 HydrophobicContact CB-CG2 4.15Å; T653-A655 PolarHBondContact O-N 3.09Å; T653-I656 PolarHBondContact O-N 3.3Å; T653-I656 VanDerWaalsContact O-N 3.11Å; T653-I656 WeakPolarHBondContact OG1-CG1 3.46Å; T653-M657 PolarHBondContact O-N 3.38Å
654	P	92.3	Very high	91.8	Very high	39 Å²	39	20.1 Å²	20.1	25%	0.253	11%	0.109	S	C	.	.	H	α-helix	trans	-52.1	-35.6	173.1	-28.6	33.7	0	0	0	114	A562 M657 D658 G682 V684	A562-P654 WeakPolarHBondContact O-CB 3.44Å; A562-P654 WeakPolarHBondContact O-CD 3.22Å; P654-M657 PolarHBondContact O-N 3.07Å; P654-D658 VanDerWaalsContact O-CB 3.29Å; P654-D658 WeakPolarHBondContact O-CB 3.24Å; P654-D658 PolarHBondContact O-N 3.17Å; P654-G682 WeakPolarHBondContact CD-O 3.16Å; P654-V684 HydrophobicContact CG-CB 4.09Å; P654-V684 HydrophobicContact CG-CG2 3.69Å
655	A	92.1	Very high	91.7	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.008	11%	0.11	C	C	.	.	H	α-helix	trans	-59.9	-46.6	175.8	0	0	0	0	0	112.7	M561 A562 S563 Q629 T653 M657	M561-A655 WeakPolarHBondContact O-CB 3.1Å; A562-A655 PolarHBondContact O-N 3.48Å; S563-A655 WeakPolarHBondContact O-CB 3.35Å; Q629-A655 WeakPolarHBondContact CG-O 3.2Å; T653-A655 PolarHBondContact O-N 3.09Å; A655-M657 VanDerWaalsContact C-N 3.33Å
656	I	92.4	Very high	91.6	Very high	6 Å²	6	20.2 Å²	20.2	3%	0.031	11%	0.11	C	C	.	.	H	α-helix	trans	-63.7	-44.6	176.4	-65.8	169.3	0	0	0	109.6	A509 L625 T653 D658 V659 L660	A509-I656 HydrophobicContact CB-CD1 3.91Å; A509-I656 HydrophobicContact CB-CG1 3.97Å; A509-I656 HydrophobicContact CB-CG2 3.75Å; L625-I656 HydrophobicContact CD1-CG1 4.43Å; L625-I656 HydrophobicContact CD2-CD1 4.09Å; L625-I656 HydrophobicContact CD2-CG1 3.75Å; T653-I656 PolarHBondContact O-N 3.3Å; T653-I656 VanDerWaalsContact O-N 3.11Å; T653-I656 WeakPolarHBondContact OG1-CG1 3.46Å; I656-D658 VanDerWaalsContact C-N 3.33Å; I656-D658 PolarHBondContact O-N 3.34Å; I656-V659 PolarHBondContact O-N 2.77Å; I656-L660 HydrophobicContact CG2-CD1 3.68Å; I656-L660 HydrophobicContact CG2-CG 4.26Å; I656-L660 WeakPolarHBondContact O-CG 3.32Å; I656-L660 PolarHBondContact O-N 3.22Å; I656-L660 VanDerWaalsContact O-N 3.13Å
657	M	92.1	Very high	91.6	Very high	12 Å²	12	20.9 Å²	20.9	6%	0.059	11%	0.113	C	C	.	.	H	α-helix	trans	-67.8	-34.5	-174.9	-67.8	-84.5	38.4	0	0	113.2	I646 C652 T653 P654 A655 V659 L660 L661 L669 A686	I646-M657 HydrophobicContact CD1-CE 3.58Å; I646-M657 HydrophobicContact CG2-CE 4.27Å; C652-M657 HydrophobicContact CB-CG 3.72Å; C652-M657 HydrophobicContact CB-SD 3.9Å; T653-M657 PolarHBondContact O-N 3.38Å; P654-M657 PolarHBondContact O-N 3.07Å; A655-M657 VanDerWaalsContact C-N 3.33Å; M657-V659 VanDerWaalsContact C-N 3.28Å; M657-V659 PolarHBondContact O-N 3.11Å; M657-L660 HydrophobicContact CE-CB 3.99Å; M657-L660 HydrophobicContact CE-CD1 4.16Å; M657-L660 PolarHBondContact O-N 3.02Å; M657-L661 HydrophobicContact CB-CD1 4.43Å; M657-L661 HydrophobicContact CE-CD1 4.45Å; M657-L661 HydrophobicContact CE-CD2 4.44Å; M657-L661 HydrophobicContact CE-CG 4.06Å; M657-L661 VanDerWaalsContact O-CB 3.28Å; M657-L661 WeakPolarHBondContact O-CB 3.44Å; M657-L661 VanDerWaalsContact O-CG 3.26Å; M657-L661 WeakPolarHBondContact O-CG 3.28Å; M657-L661 PolarHBondContact O-N 3.49Å; M657-L669 HydrophobicContact SD-CD2 4.43Å; M657-A686 HydrophobicContact CG-CB 4.14Å; M657-A686 HydrophobicContact SD-CB 3.48Å; M657-A686 WeakPolarHBondContact SD-CB 3.49Å
658	D	92.8	Very high	91.8	Very high	44 Å²	44	20.8 Å²	20.8	24%	0.235	11%	0.112	C	C	.	.	H	α-helix	trans	-62.3	-33.9	175.7	-179.3	58	0	0	0	112.6	A564 Q629 K634 P654 I656 A662	A564-D658 HydrophobicContact CB-CB 3.89Å; Q629-D658 HydrophobicContact CG-CB 4.45Å; Q629-D658 PolarHBondContact NE2-OD2 3.09Å; K634-D658 PolarHBondContact NZ-O 3.08Å; K634-D658 IonicContact NZ-OD1 3.84Å; K634-D658 PolarHBondContact NZ-OD1 2.64Å; K634-D658 IonicContact NZ-OD2 2.68Å; K634-D658 PolarHBondContact NZ-OD2 3.1Å; P654-D658 VanDerWaalsContact O-CB 3.29Å; P654-D658 WeakPolarHBondContact O-CB 3.24Å; P654-D658 PolarHBondContact O-N 3.17Å; I656-D658 VanDerWaalsContact C-N 3.33Å; I656-D658 PolarHBondContact O-N 3.34Å; D658-A662 VanDerWaalsContact O-CB 3.3Å; D658-A662 WeakPolarHBondContact O-CB 3.44Å
659	V	92.3	Very high	92	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-75.7	-47.2	174.6	-177.2	0	0	0	0	111.3	W628 Q629 P635 I656 M657 A662 Q663	W628-V659 HydrophobicContact CE3-CB 4.47Å; W628-V659 HydrophobicContact CE3-CG1 4.23Å; W628-V659 HydrophobicContact CE3-CG2 4.03Å; W628-V659 HydrophobicContact CH2-CB 4.17Å; W628-V659 HydrophobicContact CH2-CG1 3.41Å; W628-V659 VanDerWaalsContact CH2-CG1 3.41Å; W628-V659 HydrophobicContact CZ2-CG1 3.91Å; W628-V659 HydrophobicContact CZ3-CB 3.87Å; W628-V659 HydrophobicContact CZ3-CG1 3.59Å; W628-V659 HydrophobicContact CZ3-CG2 3.92Å; Q629-V659 HydrophobicContact CB-CG2 3.66Å; Q629-V659 HydrophobicContact CG-CG2 3.72Å; P635-V659 HydrophobicContact CB-CG1 4.46Å; P635-V659 HydrophobicContact CG-CG1 4.23Å; I656-V659 PolarHBondContact O-N 2.77Å; M657-V659 VanDerWaalsContact C-N 3.28Å; M657-V659 PolarHBondContact O-N 3.11Å; V659-A662 PolarHBondContact O-N 3.25Å; V659-Q663 PolarHBondContact O-NE2 2.93Å
660	L	92.6	Very high	92.2	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-69.4	-35.6	-175	-62.5	177.8	0	0	0	113	V486 L637 I644 I646 I656 M657 Q663	V486-L660 HydrophobicContact CB-CD1 4.44Å; V486-L660 HydrophobicContact CG1-CD1 4.17Å; V486-L660 HydrophobicContact CG2-CD1 4.43Å; V486-L660 HydrophobicContact CG2-CD2 4.07Å; L637-L660 HydrophobicContact CD1-CD2 4.37Å; I644-L660 HydrophobicContact CG2-CD2 4.48Å; I646-L660 HydrophobicContact CD1-CB 3.78Å; I646-L660 HydrophobicContact CD1-CD1 3.78Å; I646-L660 HydrophobicContact CD1-CG 4.38Å; I646-L660 HydrophobicContact CG1-CD1 4.03Å; I646-L660 HydrophobicContact CG2-CD1 4.11Å; I656-L660 HydrophobicContact CG2-CD1 3.68Å; I656-L660 HydrophobicContact CG2-CG 4.26Å; I656-L660 WeakPolarHBondContact O-CG 3.32Å; I656-L660 PolarHBondContact O-N 3.22Å; I656-L660 VanDerWaalsContact O-N 3.13Å; M657-L660 HydrophobicContact CE-CB 3.99Å; M657-L660 HydrophobicContact CE-CD1 4.16Å; M657-L660 PolarHBondContact O-N 3.02Å; L660-Q663 WeakPolarHBondContact O-CG 3.29Å
661	L	91.4	Very high	92.4	Very high	55 Å²	55	19.4 Å²	19.4	29%	0.288	11%	0.106	S	C	.	.	H	α-helix	trans	-77.5	-22.3	179.2	-66.8	173.6	0	0	0	113.3	M657 Q663 L669 V690	M657-L661 HydrophobicContact CB-CD1 4.43Å; M657-L661 HydrophobicContact CE-CD1 4.45Å; M657-L661 HydrophobicContact CE-CD2 4.44Å; M657-L661 HydrophobicContact CE-CG 4.06Å; M657-L661 VanDerWaalsContact O-CB 3.28Å; M657-L661 WeakPolarHBondContact O-CB 3.44Å; M657-L661 VanDerWaalsContact O-CG 3.26Å; M657-L661 WeakPolarHBondContact O-CG 3.28Å; M657-L661 PolarHBondContact O-N 3.49Å; L661-Q663 PolarHBondContact O-N 2.73Å; L661-L669 HydrophobicContact CD2-CD1 4.45Å; L661-V690 HydrophobicContact CD1-CB 4.48Å; L661-V690 HydrophobicContact CD1-CG1 3.83Å; L661-V690 HydrophobicContact CD1-CG2 3.77Å; L661-V690 HydrophobicContact CD2-CG1 3.97Å
662	A	91	Very high	92.7	Very high	39 Å²	39	19.3 Å²	19.3	32%	0.322	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-9.3	178.2	0	0	0	0	0	114	K634 D658 V659	K634-A662 HydrophobicContact CD-CB 3.57Å; D658-A662 VanDerWaalsContact O-CB 3.3Å; D658-A662 WeakPolarHBondContact O-CB 3.44Å; V659-A662 PolarHBondContact O-N 3.25Å
663	Q	90.6	Very high	92.8	Very high	8 Å²	8	19.5 Å²	19.5	4%	0.037	11%	0.106	C	C	.	.	S	Bend	trans	-70.8	144.1	179.3	-52.9	-54.4	-48.3	0	0	110.7	P635 L637 I644 V659 L660 L661 C665 K667	P635-Q663 PolarHBondContact O-NE2 3.49Å; P635-Q663 PolarHBondContact O-OE1 3.14Å; L637-Q663 HydrophobicContact CB-CG 4.22Å; L637-Q663 HydrophobicContact CD1-CG 4.28Å; I644-Q663 HydrophobicContact CD1-CB 3.93Å; I644-Q663 HydrophobicContact CD1-CG 3.72Å; V659-Q663 PolarHBondContact O-NE2 2.93Å; L660-Q663 WeakPolarHBondContact O-CG 3.29Å; L661-Q663 PolarHBondContact O-N 2.73Å; Q663-C665 VanDerWaalsContact C-N 3.3Å; Q663-C665 PolarHBondContact O-N 3.29Å; Q663-K667 WeakPolarHBondContact O-CE 3.29Å; Q663-K667 PolarHBondContact O-NZ 2.84Å
664	H	89.4	Confident	92.8	Very high	156 Å²	156	19.2 Å²	19.2	72%	0.722	10%	0.104	S	C	*	.	S	Bend	trans	-91.6	51.3	178.3	-67.2	-77.7	0	0	0	112.3	T638	T638-H664 HydrophobicContact CG2-CB 4.04Å; T638-H664 WeakPolarHBondContact CG2-O 3.48Å; T638-H664 PolarHBondContact OG1-N 2.59Å
665	C	92.5	Very high	92.7	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.007	9%	0.093	C	C	.	.	S	Bend	trans	-141.6	168.2	-179.8	63.8	0	0	0	0	110.7	D453 T638 D642 I644 Q663 K667	D453-C665 CarbonylContact O-C 3.4Å; D453-C665 VanDerWaalsContact O-O 3.09Å; T638-C665 HydrophobicContact CG2-CB 4.28Å; D642-C665 WeakPolarHBondContact O-CB 3.29Å; I644-C665 VanDerWaalsContact CD1-SG 3.57Å; Q663-C665 VanDerWaalsContact C-N 3.3Å; Q663-C665 PolarHBondContact O-N 3.29Å; C665-K667 WeakPolarHBondContact O-CD 3.36Å; C665-K667 WeakPolarHBondContact O-CE 3.36Å; C665-K667 PolarHBondContact O-N 3.05Å; C665-K667 PolarHBondContact O-NZ 3.29Å
666	G	93.8	Very high	92.6	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	138.9	178.2	0	0	0	0	0	112.5	Q452 D642 A643 I644	Q452-G666 VanDerWaalsContact O-CA 3.31Å; Q452-G666 WeakPolarHBondContact O-CA 3.3Å; D642-G666 PolarHBondContact O-N 2.86Å; D642-G666 VanDerWaalsContact O-N 3.17Å; A643-G666 CarbonylContact C-O 3.39Å; A643-G666 WeakPolarHBondContact CA-O 3.43Å; A643-G666 WeakPolarHBondContact CB-O 3.4Å; I644-G666 PolarHBondContact N-O 3.36Å
667	K	95.4	Very high	92.4	Very high	15 Å²	15	18.3 Å²	18.3	7%	0.065	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.6	176.9	-53.1	96.4	-177.5	158.2	0	111.2	H455 V456 V457 Q663 C665 L669	H455-K667 PolarHBondContact O-N 3.09Å; V456-K667 HydrophobicContact CG2-CD 4.07Å; V457-K667 PolarHBondContact N-O 3.48Å; Q663-K667 WeakPolarHBondContact O-CE 3.29Å; Q663-K667 PolarHBondContact O-NZ 2.84Å; C665-K667 WeakPolarHBondContact O-CD 3.36Å; C665-K667 WeakPolarHBondContact O-CE 3.36Å; C665-K667 PolarHBondContact O-N 3.05Å; C665-K667 PolarHBondContact O-NZ 3.29Å; K667-L669 HydrophobicContact CB-CD1 4.07Å
668	I	96.4	Very high	92	Very high	3 Å²	3	18.3 Å²	18.3	2%	0.015	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	106.4	175.5	-49	-169.8	0	0	0	109	I451 V457 I459 L471 Y474 I644 F645 I646 V670	I451-I668 HydrophobicContact CD1-CD1 4.38Å; I451-I668 HydrophobicContact CD1-CG1 4.09Å; V457-I668 HydrophobicContact CB-CG1 4.27Å; V457-I668 HydrophobicContact CB-CG2 4.36Å; V457-I668 HydrophobicContact CG1-CG2 4.36Å; V457-I668 WeakPolarHBondContact O-CA 3.22Å; I459-I668 HydrophobicContact CD1-CG2 3.56Å; I459-I668 HydrophobicContact CG1-CG2 4.08Å; L471-I668 HydrophobicContact CD2-CG2 4.32Å; Y474-I668 HydrophobicContact CD1-CD1 4.28Å; Y474-I668 HydrophobicContact CE1-CD1 3.84Å; I644-I668 PolarHBondContact O-N 2.81Å; F645-I668 HydrophobicContact CD1-CB 3.95Å; F645-I668 HydrophobicContact CD1-CD1 4.03Å; F645-I668 HydrophobicContact CD1-CG1 4.13Å; F645-I668 HydrophobicContact CE1-CB 4.48Å; F645-I668 HydrophobicContact CE1-CD1 3.67Å; F645-I668 HydrophobicContact CE1-CG1 4.23Å; I646-I668 PolarHBondContact N-O 2.87Å; I668-V670 HydrophobicContact CG2-CG2 3.9Å
669	L	96	Very high	91.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	121.7	177	-72.6	73.2	0	0	0	109.1	V456 V457 K458 I459 I646 A649 M657 L661 K667 A686 L687 V690	V456-L669 HydrophobicContact CG1-CD1 3.99Å; V457-L669 PolarHBondContact O-N 3.12Å; K458-L669 CarbonylContact C-O 3.33Å; K458-L669 WeakPolarHBondContact CA-O 3.28Å; K458-L669 HydrophobicContact CG-CB 4.47Å; I459-L669 PolarHBondContact N-O 2.74Å; I646-L669 HydrophobicContact CB-CG 4.34Å; I646-L669 HydrophobicContact CD1-CD1 4.09Å; I646-L669 HydrophobicContact CD1-CG 4.14Å; A649-L669 HydrophobicContact CB-CB 4.06Å; A649-L669 HydrophobicContact CB-CD2 4.37Å; A649-L669 HydrophobicContact CB-CG 4.34Å; M657-L669 HydrophobicContact SD-CD2 4.43Å; L661-L669 HydrophobicContact CD2-CD1 4.45Å; K667-L669 HydrophobicContact CB-CD1 4.07Å; L669-A686 HydrophobicContact CD2-CB 4.36Å; L669-L687 HydrophobicContact CB-CD2 4.1Å; L669-V690 HydrophobicContact CD2-CB 4.37Å; L669-V690 HydrophobicContact CD2-CG1 4.32Å; L669-V690 HydrophobicContact CD2-CG2 4.34Å
670	V	95	Very high	90.8	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	140.3	-177.8	-171.6	0	0	0	0	109.9	I459 K467 L471 I646 D647 E648 A649 I668	I459-V670 HydrophobicContact CB-CB 4.42Å; I459-V670 HydrophobicContact CB-CG1 4.19Å; I459-V670 HydrophobicContact CB-CG2 3.98Å; I459-V670 HydrophobicContact CD1-CG2 3.82Å; I459-V670 HydrophobicContact CG1-CG2 4.23Å; I459-V670 HydrophobicContact CG2-CG1 4.28Å; K467-V670 HydrophobicContact CB-CG1 3.8Å; K467-V670 HydrophobicContact CD-CG1 3.98Å; K467-V670 HydrophobicContact CG-CG1 4.18Å; L471-V670 HydrophobicContact CD1-CB 4.36Å; L471-V670 HydrophobicContact CD1-CG2 3.93Å; L471-V670 HydrophobicContact CD2-CG2 3.82Å; L471-V670 HydrophobicContact CG-CG2 4.15Å; I646-V670 PolarHBondContact O-N 3.49Å; D647-V670 CarbonylContact C-O 3.58Å; E648-V670 PolarHBondContact N-O 3.04Å; A649-V670 PolarHBondContact N-O 3.35Å; I668-V670 HydrophobicContact CG2-CG2 3.9Å
671	G	93.4	Very high	90	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.4	-175.6	173.5	0	0	0	0	0	113.8	I459 A461 Q650 L687	I459-G671 PolarHBondContact O-N 2.9Å; A461-G671 PolarHBondContact N-O 2.76Å; Q650-G671 VanDerWaalsContact OE1-CA 3.29Å; G671-L687 WeakPolarHBondContact O-CD1 3.41Å
672	D	93.8	Very high	89.3	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.144	C	C	.	.			trans	-115.1	109.5	178.9	-169	-20.7	0	0	0	109.8	A461 F462 A463 Q650 H674 Q675 Y934	A461-D672 VanDerWaalsContact O-CA 3.27Å; A461-D672 WeakPolarHBondContact O-CA 3.48Å; A461-D672 WeakPolarHBondContact O-CB 3.49Å; F462-D672 WeakPolarHBondContact CA-OD2 3.41Å; A463-D672 PolarHBondContact N-OD2 3.19Å; Q650-D672 VanDerWaalsContact CD-O 3.32Å; Q650-D672 VanDerWaalsContact CG-O 3.23Å; Q650-D672 WeakPolarHBondContact CG-O 3.27Å; D672-H674 PolarHBondContact O-N 3.22Å; D672-H674 WeakPolarHBondContact OD1-CA 3.41Å; D672-H674 WeakPolarHBondContact OD1-CB 3.47Å; D672-H674 IonicContact OD1-CD2 2.59Å; D672-H674 IonicContact OD1-CG 3.45Å; D672-H674 PolarHBondContact OD1-N 2.96Å; D672-Q675 HydrophobicContact CB-CB 4.02Å; D672-Q675 HydrophobicContact CB-CG 3.81Å; D672-Q675 PolarHBondContact O-N 2.93Å; D672-Q675 WeakPolarHBondContact OD2-CG 3.26Å; D672-Q675 PolarHBondContact OD2-NE2 3.34Å; D672-Y934 WeakPolarHBondContact OD2-CE1 3.13Å
673	P	91.5	Very high	88.8	Confident	10 Å²	10	25.9 Å²	25.9	7%	0.065	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-11.8	179.1	28.4	-35.3	0	0	0	113	V460 N685 L687	V460-P673 HydrophobicContact CG1-CG 3.92Å; P673-N685 PolarHBondContact O-ND2 3.37Å; P673-N685 VanDerWaalsContact O-ND2 3.11Å; P673-L687 HydrophobicContact CB-CB 4.46Å
674	H	92.1	Very high	88.4	Confident	12 Å²	12	29 Å²	29	6%	0.056	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	1.4	176.7	-51.1	-61.5	0	0	0	113.7	F462 D672 L716 V722 N931 Y934	F462-H674 AromaticContact CE1-CD2 3.77Å; D672-H674 PolarHBondContact O-N 3.22Å; D672-H674 WeakPolarHBondContact OD1-CA 3.41Å; D672-H674 WeakPolarHBondContact OD1-CB 3.47Å; D672-H674 IonicContact OD1-CD2 2.59Å; D672-H674 IonicContact OD1-CG 3.45Å; D672-H674 PolarHBondContact OD1-N 2.96Å; H674-L716 HydrophobicContact CB-CD2 3.62Å; H674-V722 WeakPolarHBondContact CE1-CG2 3.48Å; H674-N931 WeakPolarHBondContact CA-OD1 3.2Å; H674-N931 WeakPolarHBondContact O-CA 3.38Å; H674-N931 VanDerWaalsContact O-CB 3.22Å; H674-N931 WeakPolarHBondContact O-CB 3.46Å; H674-N931 PolarHBondContact O-OD1 3.02Å; H674-Y934 HydrophobicContact CB-CD1 3.98Å; H674-Y934 HydrophobicContact CB-CE1 4.02Å; H674-Y934 WeakPolarHBondContact O-CD1 3.39Å
675	Q	90.8	Very high	88.1	Confident	4 Å²	4	22.1 Å²	22.1	2%	0.019	12%	0.118	C	C	.	.			trans	-111.5	20.1	171	-60	-176.3	39.8	0	0	112.7	D672 I677 K891 Y934 V935	D672-Q675 HydrophobicContact CB-CB 4.02Å; D672-Q675 HydrophobicContact CB-CG 3.81Å; D672-Q675 PolarHBondContact O-N 2.93Å; D672-Q675 WeakPolarHBondContact OD2-CG 3.26Å; D672-Q675 PolarHBondContact OD2-NE2 3.34Å; Q675-I677 PolarHBondContact O-N 3.28Å; Q675-K891 PolarHBondContact O-NZ 3.37Å; Q675-Y934 HydrophobicContact CG-CD1 4.11Å; Q675-Y934 HydrophobicContact CG-CE1 3.89Å; Q675-V935 HydrophobicContact CB-CG2 3.82Å; Q675-V935 HydrophobicContact CG-CG2 3.69Å
676	Q	90.2	Very high	87.4	Confident	17 Å²	17	22.2 Å²	22.2	8%	0.079	12%	0.12	C	C	.	.			trans	-71.8	110.7	171.8	-174.9	-175.5	19.2	0	0	109.3	Q650 D651 A683 N685 N931	Q650-Q676 HydrophobicContact CB-CB 4.13Å; Q650-Q676 HydrophobicContact CG-CB 3.86Å; Q650-Q676 HydrophobicContact CG-CG 4.48Å; Q650-Q676 WeakPolarHBondContact O-CG 3.49Å; Q650-Q676 PolarHBondContact O-NE2 3.21Å; D651-Q676 WeakPolarHBondContact OD1-CA 3.4Å; Q676-A683 PolarHBondContact NE2-O 3.38Å; Q676-N685 VanDerWaalsContact NE2-N 3.14Å; Q676-N685 VanDerWaalsContact OE1-CB 3.27Å; Q676-N685 PolarHBondContact OE1-ND2 3.19Å; Q676-N931 WeakPolarHBondContact O-CB 3.33Å; Q676-N931 PolarHBondContact O-ND2 3.31Å
677	I	86.4	Confident	87	Confident	5 Å²	5	22.8 Å²	22.8	3%	0.026	12%	0.122	C	C	.	.			trans	-130.7	0.9	-177.8	64.3	172.7	0	0	0	113	D651 Q675 F680 K891 N931 L932 V935	D651-I677 PolarHBondContact OD1-N 2.95Å; Q675-I677 PolarHBondContact O-N 3.28Å; I677-F680 WeakPolarHBondContact O-CE1 3.45Å; I677-K891 HydrophobicContact CD1-CB 4.11Å; I677-K891 HydrophobicContact CD1-CD 3.62Å; I677-K891 HydrophobicContact CD1-CG 4.41Å; I677-K891 HydrophobicContact CG1-CD 4.03Å; I677-N931 HydrophobicContact CG2-CB 4.14Å; I677-L932 HydrophobicContact CB-CD2 3.94Å; I677-L932 HydrophobicContact CB-CG 4.44Å; I677-L932 HydrophobicContact CD1-CD2 4.28Å; I677-L932 HydrophobicContact CG2-CD2 3.64Å; I677-L932 HydrophobicContact CG2-CG 3.9Å; I677-V935 HydrophobicContact CG2-CG2 4.22Å
678	Y	83.8	Confident	86.4	Confident	12 Å²	12	28.5 Å²	28.5	5%	0.047	14%	0.144	C	C	.	.			trans	-101.9	21.4	-179.3	-66.2	-77.2	0	0	0	114.3	F488 D651 F680 K681 A683 K891	F488-Y678 HydrophobicContact CE1-CD1 4.5Å; F488-Y678 HydrophobicContact CE1-CD2 4.08Å; F488-Y678 HydrophobicContact CE1-CE1 4.43Å; F488-Y678 AromaticContact CE1-CE2 3.99Å; F488-Y678 HydrophobicContact CE1-CE2 3.99Å; F488-Y678 HydrophobicContact CE1-CG 4.33Å; F488-Y678 HydrophobicContact CZ-CD2 4.32Å; F488-Y678 HydrophobicContact CZ-CG 4.26Å; D651-Y678 HydrophobicContact CB-CD2 3.89Å; D651-Y678 VanDerWaalsContact CG-CD2 3.49Å; D651-Y678 WeakPolarHBondContact OD1-CD2 3.29Å; Y678-F680 AromaticContact CD1-CE1 3.82Å; Y678-F680 HydrophobicContact CD1-CE1 3.82Å; Y678-F680 AromaticContact CD1-CZ 3.77Å; Y678-F680 HydrophobicContact CD1-CZ 3.77Å; Y678-F680 HydrophobicContact CE1-CZ 4.33Å; Y678-F680 PolarHBondContact O-N 3.46Å; Y678-F680 VanDerWaalsContact O-N 3.11Å; Y678-K681 HydrophobicContact CD1-CD 4.43Å; Y678-K681 WeakPolarHBondContact O-CB 3.28Å; Y678-K681 PolarHBondContact O-N 2.84Å; Y678-A683 WeakPolarHBondContact O-CB 3.31Å; Y678-K891 HydrophobicContact CE2-CD 4.21Å
679	T	83.4	Confident	85.9	Confident	52 Å²	52	31.5 Å²	31.5	32%	0.319	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-56.1	-29.8	177.7	-47.9	0	0	0	0	112.7	K681 G682 D928	T679-K681 PolarHBondContact O-N 2.92Å; T679-G682 PolarHBondContact O-N 3.41Å; T679-D928 WeakPolarHBondContact CB-OD2 3.5Å; T679-D928 WeakPolarHBondContact CG2-OD2 3.14Å; T679-D928 PolarHBondContact OG1-OD1 2.92Å; T679-D928 PolarHBondContact OG1-OD2 3.16Å
680	F	77.1	Confident	85.4	Confident	140 Å²	140	32.6 Å²	32.6	61%	0.614	18%	0.175	S	C	*	.	G	3₁₀ helix	trans	-63.7	-18.3	175	69.8	-91.8	0	0	0	114.1	I677 Y678	I677-F680 WeakPolarHBondContact O-CE1 3.45Å; Y678-F680 AromaticContact CD1-CE1 3.82Å; Y678-F680 HydrophobicContact CD1-CE1 3.82Å; Y678-F680 AromaticContact CD1-CZ 3.77Å; Y678-F680 HydrophobicContact CD1-CZ 3.77Å; Y678-F680 HydrophobicContact CE1-CZ 4.33Å; Y678-F680 PolarHBondContact O-N 3.46Å; Y678-F680 VanDerWaalsContact O-N 3.11Å
681	K	75.3	Confident	85.1	Confident	73 Å²	73	41 Å²	41	32%	0.317	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-91.1	3.9	171.2	-65.2	-165.2	171.6	-173.4	0	113.1	Y678 T679	Y678-K681 HydrophobicContact CD1-CD 4.43Å; Y678-K681 WeakPolarHBondContact O-CB 3.28Å; Y678-K681 PolarHBondContact O-N 2.84Å; T679-K681 PolarHBondContact O-N 2.92Å
682	G	76.8	Confident	85	Confident	30 Å²	30	45.1 Å²	45.1	31%	0.309	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.3	15.7	-174.6	0	0	0	0	0	114.1	P654 T679	P654-G682 WeakPolarHBondContact CD-O 3.16Å; T679-G682 PolarHBondContact O-N 3.41Å
683	A	81.2	Confident	85	Confident	4 Å²	4	48.3 Å²	48.3	3%	0.033	25%	0.253	C	S	.	.			trans	-64.2	136	173.1	0	0	0	0	0	110.9	D651 Q676 Y678	D651-A683 VanDerWaalsContact O-CB 3.31Å; D651-A683 WeakPolarHBondContact O-CB 3.31Å; Q676-A683 PolarHBondContact NE2-O 3.38Å; Y678-A683 WeakPolarHBondContact O-CB 3.31Å
684	V	82.9	Confident	85.1	Confident	73 Å²	73	51.1 Å²	51.1	44%	0.442	27%	0.265	S	S	.	.			trans	-120.7	138.2	176.8	177.8	0	0	0	0	107.9	C652 P654 A686	C652-V684 PolarHBondContact O-N 3.27Å; P654-V684 HydrophobicContact CG-CB 4.09Å; P654-V684 HydrophobicContact CG-CG2 3.69Å; V684-A686 PolarHBondContact O-N 2.98Å
685	N	82.6	Confident	85.1	Confident	12 Å²	12	53.3 Å²	53.3	6%	0.064	28%	0.277	C	S	.	.			trans	-66.4	89.8	-173.8	-158.1	-52.5	0	0	0	111.6	P673 Q676 L687 R688 A689	P673-N685 PolarHBondContact O-ND2 3.37Å; P673-N685 VanDerWaalsContact O-ND2 3.11Å; Q676-N685 VanDerWaalsContact NE2-N 3.14Å; Q676-N685 VanDerWaalsContact OE1-CB 3.27Å; Q676-N685 PolarHBondContact OE1-ND2 3.19Å; N685-L687 PolarHBondContact O-N 3.49Å; N685-L687 WeakPolarHBondContact OD1-CB 3.32Å; N685-R688 HydrophobicContact CB-CB 4.3Å; N685-R688 HydrophobicContact CB-CG 4.37Å; N685-R688 PolarHBondContact O-N 2.79Å; N685-R688 PolarHBondContact OD1-N 3.2Å; N685-A689 PolarHBondContact O-N 2.93Å
686	A	78.5	Confident	85.3	Confident	4 Å²	4	54.1 Å²	54.1	3%	0.033	28%	0.28	C	S	.	.	H	α-helix	trans	-62.9	-30.6	-176	0	0	0	0	0	112.1	K458 A649 M657 L669 V684 R688 A689 V690	K458-A686 PolarHBondContact NZ-O 3.27Å; A649-A686 VanDerWaalsContact O-CB 3.23Å; A649-A686 WeakPolarHBondContact O-CB 3.48Å; M657-A686 HydrophobicContact CG-CB 4.14Å; M657-A686 HydrophobicContact SD-CB 3.48Å; M657-A686 WeakPolarHBondContact SD-CB 3.49Å; L669-A686 HydrophobicContact CD2-CB 4.36Å; V684-A686 PolarHBondContact O-N 2.98Å; A686-R688 PolarHBondContact O-N 3.28Å; A686-A689 PolarHBondContact O-N 3.44Å; A686-V690 HydrophobicContact CB-CG2 3.97Å; A686-V690 WeakPolarHBondContact O-CB 3.41Å; A686-V690 WeakPolarHBondContact O-CG2 3.47Å; A686-V690 PolarHBondContact O-N 3.26Å
687	L	83.9	Confident	85.4	Confident	11 Å²	11	57.2 Å²	57.2	6%	0.058	29%	0.291	C	S	.	.	H	α-helix	trans	-62.1	-26	175	-64.7	173.3	0	0	0	112.5	K458 A649 Q650 L669 G671 P673 N685	K458-L687 VanDerWaalsContact NZ-C 3.28Å; K458-L687 PolarHBondContact NZ-O 3.38Å; A649-L687 HydrophobicContact CB-CD2 4.11Å; A649-L687 HydrophobicContact CB-CG 4.17Å; Q650-L687 HydrophobicContact CB-CD1 4.19Å; L669-L687 HydrophobicContact CB-CD2 4.1Å; G671-L687 WeakPolarHBondContact O-CD1 3.41Å; P673-L687 HydrophobicContact CB-CB 4.46Å; N685-L687 PolarHBondContact O-N 3.49Å; N685-L687 WeakPolarHBondContact OD1-CB 3.32Å
688	R	84.3	Confident	85.7	Confident	136 Å²	136	57 Å²	57	51%	0.513	29%	0.291	S	S	.	.	H	α-helix	trans	-92	-42.1	171.5	-65.7	-178.8	179.2	-179.9	0.2	113	N685 A686 D927	N685-R688 HydrophobicContact CB-CB 4.3Å; N685-R688 HydrophobicContact CB-CG 4.37Å; N685-R688 PolarHBondContact O-N 2.79Å; N685-R688 PolarHBondContact OD1-N 3.2Å; A686-R688 PolarHBondContact O-N 3.28Å; R688-D927 IonicContact CZ-OD2 3.3Å; R688-D927 IonicContact NH1-OD2 2.84Å; R688-D927 PolarHBondContact NH1-OD2 3.23Å; R688-D927 VanDerWaalsContact NH1-OD2 3.15Å; R688-D927 IonicContact NH2-OD2 2.84Å
689	A	84.1	Confident	86.1	Confident	65 Å²	65	56.6 Å²	56.6	54%	0.537	29%	0.289	S	S	.	.	H	α-helix	trans	-79.2	-36.9	-169.3	0	0	0	0	0	114.7	N685 A686	N685-A689 PolarHBondContact O-N 2.93Å; A686-A689 PolarHBondContact O-N 3.44Å
690	V	87.1	Confident	86.5	Confident	24 Å²	24	54.4 Å²	54.4	15%	0.145	28%	0.275	C	S	.	.	S	Bend	trans	-75.1	139.2	-170.7	176.1	0	0	0	0	111.7	V456 K458 L661 L669 A686	V456-V690 HydrophobicContact CG1-CG1 4.2Å; K458-V690 WeakPolarHBondContact CE-O 3.25Å; K458-V690 PolarHBondContact NZ-O 2.95Å; L661-V690 HydrophobicContact CD1-CB 4.48Å; L661-V690 HydrophobicContact CD1-CG1 3.83Å; L661-V690 HydrophobicContact CD1-CG2 3.77Å; L661-V690 HydrophobicContact CD2-CG1 3.97Å; L669-V690 HydrophobicContact CD2-CB 4.37Å; L669-V690 HydrophobicContact CD2-CG1 4.32Å; L669-V690 HydrophobicContact CD2-CG2 4.34Å; A686-V690 HydrophobicContact CB-CG2 3.97Å; A686-V690 WeakPolarHBondContact O-CB 3.41Å; A686-V690 WeakPolarHBondContact O-CG2 3.47Å; A686-V690 PolarHBondContact O-N 3.26Å
691	H	87.8	Confident	87.1	Confident	178 Å²	178	47.7 Å²	47.7	82%	0.824	25%	0.246	S	C	*	.			trans	-70	142.9	170.3	-68.9	-74.7	0	0	0	110.2	V456	V456-H691 WeakPolarHBondContact CG1-O 3.22Å
692	H	92.4	Very high	87.8	Confident	85 Å²	85	47.7 Å²	47.7	39%	0.394	25%	0.246	S	C	.	.			trans	-132.6	148.8	-176.9	59.7	-79.8	0	0	0	110.9	K458	K458-H692 HydrophobicContact CB-CB 4.44Å; K458-H692 HydrophobicContact CD-CB 3.68Å; K458-H692 HydrophobicContact CG-CB 3.74Å
693	T	93.1	Very high	88.4	Confident	68 Å²	68	47.4 Å²	47.4	42%	0.417	24%	0.236	S	C	.	.	S	Bend	trans	-82.1	-42.9	170.8	60.1	0	0	0	0	110.3	V456	V456-T693 PolarHBondContact N-OG1 3.11Å; V456-T693 VanDerWaalsContact N-OG1 3.17Å; V456-T693 PolarHBondContact O-N 3.11Å; V456-T693 PolarHBondContact O-OG1 3.48Å
694	H	92.6	Very high	88.9	Confident	68 Å²	68	47.2 Å²	47.2	32%	0.315	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	145.2	-175.2	-61.9	84.2	0	0	0	110.8	H449 H455 V456 V457 K458 F696	H449-H694 AromaticContact CE1-CD2 3.93Å; H449-H694 AromaticContact CE1-CE1 3.78Å; H449-H694 AromaticContact CE1-CG 3.88Å; H449-H694 AromaticContact CE1-ND1 3.77Å; H449-H694 AromaticContact CE1-NE2 3.88Å; H455-H694 AromaticContact CE1-CE1 3.9Å; H455-H694 AromaticContact NE2-CE1 3.89Å; V456-H694 PolarHBondContact O-N 3.28Å; V457-H694 HydrophobicContact CG1-CB 4.42Å; V457-H694 HydrophobicContact CG2-CB 4.34Å; K458-H694 PolarHBondContact N-O 3.37Å; H694-F696 HydrophobicContact CB-CE2 4.1Å; H694-F696 HydrophobicContact CB-CZ 4.41Å
695	I	93.5	Very high	89.3	Confident	59 Å²	59	43.7 Å²	43.7	30%	0.303	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	124.2	175.7	-172.4	165	0	0	0	110.9	K458 V460 Y697	K458-I695 HydrophobicContact CB-CG1 4.23Å; K458-I695 CarbonylContact O-C 3.52Å; K458-I695 WeakPolarHBondContact O-CA 3.48Å; V460-I695 HydrophobicContact CG2-CD1 4Å; V460-I695 HydrophobicContact CG2-CG1 4.29Å; I695-Y697 HydrophobicContact CD1-CE1 4.41Å; I695-Y697 HydrophobicContact CD1-CE2 4.18Å; I695-Y697 WeakPolarHBondContact CD1-OH 3.48Å; I695-Y697 HydrophobicContact CG1-CE2 3.96Å; I695-Y697 HydrophobicContact CG2-CE2 4.43Å
696	F	93.6	Very high	89.7	Confident	20 Å²	20	44 Å²	44	9%	0.088	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	156	174.7	-58.2	-72.2	0	0	0	109.8	E445 I446 H449 V457 K458 I459 V460 H694	E445-F696 HydrophobicContact CG-CD1 4.09Å; E445-F696 HydrophobicContact CG-CE1 3.89Å; I446-F696 HydrophobicContact CD1-CB 3.93Å; I446-F696 HydrophobicContact CG1-CB 3.53Å; I446-F696 HydrophobicContact CG1-CD1 4.15Å; I446-F696 HydrophobicContact CG1-CD2 4Å; I446-F696 HydrophobicContact CG1-CG 3.63Å; H449-F696 HydrophobicContact CB-CE2 4.24Å; H449-F696 HydrophobicContact CB-CZ 3.95Å; V457-F696 HydrophobicContact CG1-CD2 3.6Å; V457-F696 HydrophobicContact CG1-CE2 3.59Å; K458-F696 PolarHBondContact O-N 2.92Å; I459-F696 HydrophobicContact CG1-CB 4.42Å; I459-F696 HydrophobicContact CG1-CD2 4.47Å; V460-F696 PolarHBondContact N-O 3.2Å; H694-F696 HydrophobicContact CB-CE2 4.1Å; H694-F696 HydrophobicContact CB-CZ 4.41Å
697	Y	92.3	Very high	90.3	Very high	82 Å²	82	45.6 Å²	45.6	32%	0.322	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.7	179.4	-67.8	-87.2	0	0	0	109.8	E442 V460 I695 K724	E442-Y697 WeakPolarHBondContact CB-O 3.41Å; E442-Y697 VanDerWaalsContact CD-O 3.3Å; V460-Y697 HydrophobicContact CB-CD1 3.74Å; V460-Y697 HydrophobicContact CB-CE1 3.83Å; V460-Y697 HydrophobicContact CG1-CD1 3.94Å; V460-Y697 HydrophobicContact CG1-CE1 3.94Å; V460-Y697 HydrophobicContact CG2-CE1 4.26Å; V460-Y697 CarbonylContact O-C 3.57Å; V460-Y697 VanDerWaalsContact O-CA 3.26Å; V460-Y697 WeakPolarHBondContact O-CA 3.44Å; I695-Y697 HydrophobicContact CD1-CE1 4.41Å; I695-Y697 HydrophobicContact CD1-CE2 4.18Å; I695-Y697 WeakPolarHBondContact CD1-OH 3.48Å; I695-Y697 HydrophobicContact CG1-CE2 3.96Å; I695-Y697 HydrophobicContact CG2-CE2 4.43Å; Y697-K724 HydrophobicContact CD1-CG 4.34Å; Y697-K724 HydrophobicContact CE1-CG 4.35Å
698	L	93.2	Very high	90.8	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	111.4	166.1	-61.2	176.4	0	0	0	108.2	E442 Q443 I446 I459 V460 A461 F462 T465	E442-L698 HydrophobicContact CB-CD2 3.82Å; E442-L698 WeakPolarHBondContact OE2-CA 3.45Å; Q443-L698 HydrophobicContact CG-CD2 3.67Å; I446-L698 HydrophobicContact CD1-CD1 4.31Å; I446-L698 HydrophobicContact CD1-CD2 3.66Å; I446-L698 HydrophobicContact CD1-CG 3.95Å; I459-L698 HydrophobicContact CG2-CD1 3.91Å; I459-L698 HydrophobicContact CG2-CG 4.01Å; V460-L698 PolarHBondContact O-N 3.5Å; A461-L698 HydrophobicContact CB-CB 3.8Å; A461-L698 HydrophobicContact CB-CD1 3.92Å; A461-L698 HydrophobicContact CB-CG 4.22Å; F462-L698 PolarHBondContact N-O 2.84Å; T465-L698 HydrophobicContact CG2-CB 4.23Å; T465-L698 WeakPolarHBondContact CG2-O 3.36Å
699	T	92.3	Very high	91.3	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.018	20%	0.196	C	C	.	.			trans	-110.2	-19.8	-171.3	64.7	0	0	0	0	114.2	E442 F462 V727	E442-T699 WeakPolarHBondContact OE1-CG2 3.28Å; E442-T699 PolarHBondContact OE1-OG1 2.9Å; E442-T699 PolarHBondContact OE2-N 3.46Å; E442-T699 PolarHBondContact OE2-OG1 3.06Å; F462-T699 HydrophobicContact CD2-CG2 4.35Å; F462-T699 HydrophobicContact CE2-CG2 4.07Å; T699-V727 PolarHBondContact O-N 2.84Å
700	Q	91.6	Very high	91.8	Very high	5 Å²	5	35.6 Å²	35.6	2%	0.023	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-93.6	118.5	179.7	-175.6	173.9	11.4	0	0	112.8	Y418 T465 V727	Y418-Q700 HydrophobicContact CE1-CB 4.01Å; Y418-Q700 HydrophobicContact CE1-CG 4.31Å; T465-Q700 VanDerWaalsContact CA-O 3.3Å; T465-Q700 WeakPolarHBondContact CA-O 3.31Å; T465-Q700 WeakPolarHBondContact CB-O 3.34Å; T465-Q700 VanDerWaalsContact CG2-O 3.28Å; T465-Q700 WeakPolarHBondContact CG2-O 3.36Å; Q700-V727 CarbonylContact C-O 3.54Å; Q700-V727 WeakPolarHBondContact CA-O 3.45Å
701	S	91.2	Very high	92.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.164	C	C	.	.			trans	-80.3	139.3	173.1	179.7	0	0	0	0	111.2	A463 R703 F704 V727 G728 G729	A463-S701 VanDerWaalsContact O-CB 3.31Å; A463-S701 WeakPolarHBondContact O-CB 3.49Å; A463-S701 PolarHBondContact O-OG 2.81Å; S701-R703 PolarHBondContact OG-N 3.09Å; S701-R703 VanDerWaalsContact OG-N 3.12Å; S701-F704 WeakPolarHBondContact OG-CE1 3.32Å; S701-F704 WeakPolarHBondContact OG-CZ 3.24Å; S701-V727 PolarHBondContact N-O 2.9Å; S701-G728 CarbonylContact O-C 3.58Å; S701-G729 WeakPolarHBondContact O-CA 3.39Å; S701-G729 PolarHBondContact O-N 3.37Å
702	F	89.8	Confident	92.4	Very high	73 Å²	73	26 Å²	26	32%	0.32	13%	0.125	S	C	.	.	S	Bend	trans	-101.5	5.2	168.8	-56.7	-80.9	0	0	0	112.5	T440 G464 Q731	T440-F702 HydrophobicContact CG2-CE1 4.14Å; T440-F702 HydrophobicContact CG2-CE2 4.38Å; T440-F702 HydrophobicContact CG2-CZ 3.5Å; T440-F702 VanDerWaalsContact CG2-CZ 3.5Å; G464-F702 PolarHBondContact O-N 3.46Å; F702-Q731 PolarHBondContact O-NE2 2.74Å; F702-Q731 PolarHBondContact O-OE1 3.09Å
703	R	88.7	Confident	92.5	Very high	23 Å²	23	22.1 Å²	22.1	9%	0.087	11%	0.108	C	C	.	.	S	Bend	trans	-91.7	-34.8	-177.5	-177.4	-173.6	-64.4	156.1	-2.7	113.4	S701 Q731 E894 T938 M941	S701-R703 PolarHBondContact OG-N 3.09Å; S701-R703 VanDerWaalsContact OG-N 3.12Å; R703-Q731 PolarHBondContact O-OE1 2.92Å; R703-E894 IonicContact CZ-OE1 3.15Å; R703-E894 IonicContact NE-OE1 3.75Å; R703-E894 PolarHBondContact NE-OE1 3.4Å; R703-E894 IonicContact NE-OE2 3.88Å; R703-E894 IonicContact NH2-OE1 3.01Å; R703-E894 PolarHBondContact NH2-OE1 3.48Å; R703-T938 VanDerWaalsContact CD-O 3.24Å; R703-T938 WeakPolarHBondContact CD-O 3.48Å; R703-T938 PolarHBondContact NH1-O 2.66Å; R703-M941 HydrophobicContact CG-CG 3.81Å; R703-M941 VanDerWaalsContact O-CA 3.28Å; R703-M941 WeakPolarHBondContact O-CA 3.32Å
704	F	91.6	Very high	92.6	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.088	C	C	.	.	S	Bend	trans	-146.6	158.6	-172.7	49	-105.5	0	0	0	111.5	A463 S701 I708 A709 L726 G728 G729 T938 A940	A463-F704 HydrophobicContact CB-CE1 4.4Å; A463-F704 HydrophobicContact CB-CZ 4.44Å; S701-F704 WeakPolarHBondContact OG-CE1 3.32Å; S701-F704 WeakPolarHBondContact OG-CZ 3.24Å; F704-I708 HydrophobicContact CB-CB 3.98Å; F704-I708 HydrophobicContact CB-CD1 4.07Å; F704-I708 HydrophobicContact CB-CG2 3.99Å; F704-I708 HydrophobicContact CD1-CG2 4.11Å; F704-I708 HydrophobicContact CD2-CB 4.12Å; F704-I708 HydrophobicContact CD2-CG2 3.94Å; F704-I708 HydrophobicContact CG-CB 4.1Å; F704-I708 HydrophobicContact CG-CG2 3.73Å; F704-A709 HydrophobicContact CD2-CB 3.95Å; F704-A709 HydrophobicContact CE2-CB 3.76Å; F704-L726 HydrophobicContact CE2-CD1 4.32Å; F704-L726 HydrophobicContact CE2-CD2 4.02Å; F704-L726 HydrophobicContact CE2-CG 4.34Å; F704-L726 HydrophobicContact CZ-CD1 4.29Å; F704-L726 HydrophobicContact CZ-CD2 3.99Å; F704-G728 CarbonylContact O-C 3.58Å; F704-G728 VanDerWaalsContact O-CA 3.25Å; F704-G728 WeakPolarHBondContact O-CA 3.42Å; F704-G729 PolarHBondContact O-N 3.26Å; F704-T938 HydrophobicContact CE1-CG2 4.07Å; F704-T938 HydrophobicContact CZ-CG2 4.01Å; F704-A940 WeakPolarHBondContact CD1-O 3.42Å
705	G	91	Very high	92.6	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.073	C	C	.	.			trans	-84.9	-169.1	179.8	0	0	0	0	0	115.4	E707 A709 Q731 S733	G705-E707 PolarHBondContact O-N 3.5Å; G705-A709 VanDerWaalsContact O-CB 3.26Å; G705-A709 WeakPolarHBondContact O-CB 3.44Å; G705-A709 PolarHBondContact O-N 3.49Å; G705-A709 VanDerWaalsContact O-N 3.07Å; G705-Q731 WeakPolarHBondContact CA-O 3.36Å; G705-S733 WeakPolarHBondContact CA-OG 3.32Å; G705-S733 PolarHBondContact N-OG 2.78Å; G705-S733 PolarHBondContact O-OG 3.14Å
706	A	91.3	Very high	92.6	Very high	17 Å²	17	13 Å²	13	14%	0.14	6%	0.06	C	C	.	.	H	α-helix	trans	-59	-37.5	-170.9	0	0	0	0	0	115.2	V365 Y411 Y415 F710	V365-A706 HydrophobicContact CB-CB 3.97Å; V365-A706 HydrophobicContact CG1-CB 4.48Å; V365-A706 HydrophobicContact CG2-CB 3.7Å; Y411-A706 PolarHBondContact OH-O 3.17Å; Y415-A706 HydrophobicContact CD2-CB 4.32Å; Y415-A706 HydrophobicContact CE1-CB 4.27Å; Y415-A706 HydrophobicContact CE2-CB 3.67Å; Y415-A706 PolarHBondContact OH-N 3.07Å; A706-F710 WeakPolarHBondContact O-CB 3.43Å; A706-F710 PolarHBondContact O-N 3.32Å
707	E	91.5	Very high	92.5	Very high	39 Å²	39	14.5 Å²	14.5	18%	0.182	7%	0.066	C	C	.	.	H	α-helix	trans	-72.3	-46.1	-173.5	-64.1	-57.9	143.8	0	0	112.1	S364 R408 G705 F710 V711 S733 V735	S364-E707 WeakPolarHBondContact CB-OE1 3.39Å; R408-E707 IonicContact CZ-OE1 3.77Å; R408-E707 IonicContact CZ-OE2 2.64Å; R408-E707 VanDerWaalsContact CZ-OE2 3.27Å; R408-E707 IonicContact NH1-OE2 3.73Å; R408-E707 PolarHBondContact NH1-OE2 2.91Å; R408-E707 IonicContact NH2-OE1 2.74Å; R408-E707 PolarHBondContact NH2-OE1 3.48Å; R408-E707 IonicContact NH2-OE2 2.77Å; R408-E707 PolarHBondContact NH2-OE2 3.42Å; G705-E707 PolarHBondContact O-N 3.5Å; E707-F710 PolarHBondContact O-N 3.18Å; E707-V711 PolarHBondContact O-N 3Å; E707-S733 WeakPolarHBondContact CB-O 3.2Å; E707-S733 WeakPolarHBondContact CG-O 3.43Å; E707-V735 HydrophobicContact CB-CG2 4.01Å
708	I	93.8	Very high	92.3	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-67.6	-40.8	174.7	-63.5	175.1	0	0	0	109.8	F704 F710 V711 G712 V735 V937 A940 L944	F704-I708 HydrophobicContact CB-CB 3.98Å; F704-I708 HydrophobicContact CB-CD1 4.07Å; F704-I708 HydrophobicContact CB-CG2 3.99Å; F704-I708 HydrophobicContact CD1-CG2 4.11Å; F704-I708 HydrophobicContact CD2-CB 4.12Å; F704-I708 HydrophobicContact CD2-CG2 3.94Å; F704-I708 HydrophobicContact CG-CB 4.1Å; F704-I708 HydrophobicContact CG-CG2 3.73Å; I708-F710 VanDerWaalsContact C-N 3.27Å; I708-F710 PolarHBondContact O-N 3.12Å; I708-V711 PolarHBondContact O-N 3.14Å; I708-V711 VanDerWaalsContact O-N 3.17Å; I708-G712 PolarHBondContact O-N 3.38Å; I708-V735 HydrophobicContact CG1-CG2 4.2Å; I708-V937 HydrophobicContact CG2-CG1 4.48Å; I708-A940 HydrophobicContact CD1-CB 3.8Å; I708-L944 HydrophobicContact CD1-CB 4.36Å; I708-L944 HydrophobicContact CG1-CB 4.17Å
709	A	94.7	Very high	92.1	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-58.3	-39	175.2	0	0	0	0	0	112.1	Y411 F704 G705 G712 A713 L726	Y411-A709 VanDerWaalsContact OH-CB 3.22Å; Y411-A709 WeakPolarHBondContact OH-CB 3.4Å; F704-A709 HydrophobicContact CD2-CB 3.95Å; F704-A709 HydrophobicContact CE2-CB 3.76Å; G705-A709 VanDerWaalsContact O-CB 3.26Å; G705-A709 WeakPolarHBondContact O-CB 3.44Å; G705-A709 PolarHBondContact O-N 3.49Å; G705-A709 VanDerWaalsContact O-N 3.07Å; A709-G712 PolarHBondContact O-N 3.47Å; A709-A713 VanDerWaalsContact O-CB 3.27Å; A709-A713 WeakPolarHBondContact O-CB 3.29Å; A709-A713 PolarHBondContact O-N 2.9Å; A709-L726 HydrophobicContact CB-CG 4.3Å
710	F	94.1	Very high	91.9	Very high	1 Å²	1	14 Å²	14	0%	0.004	7%	0.069	C	C	.	.	H	α-helix	trans	-63.1	-44.6	175.9	174	-103.6	0	0	0	111.9	Y407 R408 Y411 A706 E707 I708 G712 A713 A714 L954 E959	Y407-F710 AromaticContact CD1-CE2 3.94Å; Y407-F710 HydrophobicContact CD1-CE2 3.94Å; Y407-F710 HydrophobicContact CE1-CE2 4.31Å; R408-F710 HydrophobicContact CB-CD2 4.48Å; R408-F710 HydrophobicContact CB-CE1 4.47Å; R408-F710 HydrophobicContact CB-CE2 3.62Å; R408-F710 HydrophobicContact CB-CZ 3.61Å; R408-F710 HydrophobicContact CG-CD2 4.19Å; R408-F710 HydrophobicContact CG-CE1 4.33Å; R408-F710 HydrophobicContact CG-CE2 3.78Å; R408-F710 HydrophobicContact CG-CZ 3.86Å; R408-F710 VanDerWaalsContact NH1-CD1 3.31Å; Y411-F710 HydrophobicContact CD1-CB 4.16Å; Y411-F710 AromaticContact CD1-CD2 3.58Å; Y411-F710 HydrophobicContact CD1-CD2 3.58Å; Y411-F710 HydrophobicContact CD1-CE2 4.48Å; Y411-F710 HydrophobicContact CD1-CG 4.28Å; Y411-F710 HydrophobicContact CD2-CD2 4.2Å; Y411-F710 HydrophobicContact CE1-CB 3.65Å; Y411-F710 AromaticContact CE1-CD2 3.96Å; Y411-F710 HydrophobicContact CE1-CD2 3.96Å; Y411-F710 HydrophobicContact CE1-CG 4.26Å; Y411-F710 AromaticContact CG-CD2 3.71Å; Y411-F710 HydrophobicContact CG-CD2 3.71Å; Y411-F710 HydrophobicContact CG-CE2 4.36Å; Y411-F710 PolarHBondContact OH-N 3.32Å; A706-F710 WeakPolarHBondContact O-CB 3.43Å; A706-F710 PolarHBondContact O-N 3.32Å; E707-F710 PolarHBondContact O-N 3.18Å; I708-F710 VanDerWaalsContact C-N 3.27Å; I708-F710 PolarHBondContact O-N 3.12Å; F710-G712 PolarHBondContact O-N 3.38Å; F710-A713 PolarHBondContact O-N 3.41Å; F710-A714 VanDerWaalsContact O-CB 3.29Å; F710-A714 WeakPolarHBondContact O-CB 2.95Å; F710-A714 PolarHBondContact O-N 2.85Å; F710-L954 HydrophobicContact CE1-CD2 4.17Å; F710-E959 HydrophobicContact CE1-CB 4.18Å; F710-E959 HydrophobicContact CE1-CG 3.89Å; F710-E959 HydrophobicContact CZ-CB 4.12Å; F710-E959 HydrophobicContact CZ-CG 4.2Å
711	V	94.4	Very high	91.7	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.006	10%	0.095	C	C	.	.	H	α-helix	trans	-61.1	-46.1	177.1	-179.8	0	0	0	0	110.5	E707 I708 A714 I715 V735 V937 L944 I950 L954	E707-V711 PolarHBondContact O-N 3Å; I708-V711 PolarHBondContact O-N 3.14Å; I708-V711 VanDerWaalsContact O-N 3.17Å; V711-A714 PolarHBondContact O-N 2.77Å; V711-I715 HydrophobicContact CG1-CD1 4.15Å; V711-I715 WeakPolarHBondContact O-CG1 3.44Å; V711-I715 PolarHBondContact O-N 3.32Å; V711-V735 HydrophobicContact CG2-CG1 4.22Å; V711-V735 HydrophobicContact CG2-CG2 3.82Å; V711-V937 HydrophobicContact CB-CG1 4.22Å; V711-V937 HydrophobicContact CG1-CG1 3.89Å; V711-V937 HydrophobicContact CG1-CG2 4.42Å; V711-L944 HydrophobicContact CB-CD2 4.46Å; V711-L944 HydrophobicContact CG1-CD2 4.25Å; V711-I950 HydrophobicContact CG1-CG2 3.89Å; V711-L954 HydrophobicContact CG2-CD1 4.37Å
712	G	94.8	Very high	91.6	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-59.1	-48	174.6	0	0	0	0	0	112.5	I708 A709 F710 A714 I715 L716	I708-G712 PolarHBondContact O-N 3.38Å; A709-G712 PolarHBondContact O-N 3.47Å; F710-G712 PolarHBondContact O-N 3.38Å; G712-A714 VanDerWaalsContact C-N 3.33Å; G712-A714 PolarHBondContact O-N 3.29Å; G712-I715 PolarHBondContact O-N 3.08Å; G712-L716 WeakPolarHBondContact O-CG 3.3Å; G712-L716 PolarHBondContact O-N 2.94Å
713	A	94.6	Very high	91.3	Very high	4 Å²	4	22.2 Å²	22.2	3%	0.033	12%	0.122	C	C	.	.	H	α-helix	trans	-62.5	-37.6	178.1	0	0	0	0	0	112.5	Y411 A709 F710 L716 K717 L726	Y411-A713 HydrophobicContact CD2-CB 4.32Å; Y411-A713 HydrophobicContact CE2-CB 3.87Å; A709-A713 VanDerWaalsContact O-CB 3.27Å; A709-A713 WeakPolarHBondContact O-CB 3.29Å; A709-A713 PolarHBondContact O-N 2.9Å; F710-A713 PolarHBondContact O-N 3.41Å; A713-L716 PolarHBondContact O-N 2.71Å; A713-K717 VanDerWaalsContact O-CB 3.24Å; A713-K717 WeakPolarHBondContact O-CB 3.47Å; A713-K717 PolarHBondContact O-N 3.09Å; A713-L726 HydrophobicContact CB-CB 4.26Å
714	A	93.2	Very high	91.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66.9	-42.5	177.2	0	0	0	0	0	111.7	F710 V711 G712 K717 V718 L954 A957	F710-A714 VanDerWaalsContact O-CB 3.29Å; F710-A714 WeakPolarHBondContact O-CB 2.95Å; F710-A714 PolarHBondContact O-N 2.85Å; V711-A714 PolarHBondContact O-N 2.77Å; G712-A714 VanDerWaalsContact C-N 3.33Å; G712-A714 PolarHBondContact O-N 3.29Å; A714-K717 PolarHBondContact O-N 3.07Å; A714-V718 WeakPolarHBondContact O-CB 3.4Å; A714-V718 WeakPolarHBondContact O-CG2 3.41Å; A714-V718 PolarHBondContact O-N 3.42Å; A714-L954 HydrophobicContact CB-CD2 3.62Å; A714-A957 HydrophobicContact CB-CB 4.35Å
715	I	93.2	Very high	91.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.2	-49.2	173.9	-67.9	164.3	0	0	0	110.1	V711 G712 K717 C719 L933 V937 I953	V711-I715 HydrophobicContact CG1-CD1 4.15Å; V711-I715 WeakPolarHBondContact O-CG1 3.44Å; V711-I715 PolarHBondContact O-N 3.32Å; G712-I715 PolarHBondContact O-N 3.08Å; I715-K717 VanDerWaalsContact C-N 3.31Å; I715-K717 PolarHBondContact O-N 3.14Å; I715-C719 VanDerWaalsContact O-CB 3.23Å; I715-C719 WeakPolarHBondContact O-CB 3.48Å; I715-C719 PolarHBondContact O-N 3.34Å; I715-L933 HydrophobicContact CD1-CD2 4.27Å; I715-L933 HydrophobicContact CD1-CG 4.17Å; I715-V937 HydrophobicContact CD1-CB 4.47Å; I715-V937 HydrophobicContact CD1-CG2 3.95Å; I715-I953 HydrophobicContact CG1-CG2 4.36Å
716	L	93.4	Very high	91.4	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.016	14%	0.142	C	C	.	.	H	α-helix	trans	-61.7	-38.9	179.2	-67.8	-178.3	0	0	0	112.4	F462 H674 G712 A713 K720 G721 V722 Y934	F462-L716 HydrophobicContact CE1-CD1 4.25Å; H674-L716 HydrophobicContact CB-CD2 3.62Å; G712-L716 WeakPolarHBondContact O-CG 3.3Å; G712-L716 PolarHBondContact O-N 2.94Å; A713-L716 PolarHBondContact O-N 2.71Å; L716-K720 HydrophobicContact CD2-CD 4.37Å; L716-K720 CarbonylContact O-C 3.41Å; L716-K720 WeakPolarHBondContact O-CA 3.38Å; L716-K720 WeakPolarHBondContact O-CB 3.24Å; L716-K720 PolarHBondContact O-N 3.07Å; L716-G721 PolarHBondContact O-N 2.6Å; L716-G721 VanDerWaalsContact O-N 3.07Å; L716-V722 HydrophobicContact CB-CB 4.01Å; L716-V722 HydrophobicContact CB-CG2 3.99Å; L716-V722 HydrophobicContact CD2-CG2 4.45Å; L716-V722 WeakPolarHBondContact O-CG2 3.45Å; L716-V722 PolarHBondContact O-N 3.22Å; L716-Y934 HydrophobicContact CD1-CD2 4.2Å; L716-Y934 HydrophobicContact CD1-CE2 3.65Å; L716-Y934 HydrophobicContact CD2-CD1 4.4Å; L716-Y934 HydrophobicContact CD2-CD2 3.87Å; L716-Y934 HydrophobicContact CD2-CE2 4.12Å; L716-Y934 HydrophobicContact CD2-CG 4.02Å; L716-Y934 HydrophobicContact CG-CD2 3.84Å; L716-Y934 HydrophobicContact CG-CE2 3.82Å; L716-Y934 HydrophobicContact CG-CG 4.49Å
717	K	91.1	Very high	91.3	Very high	51 Å²	51	25.7 Å²	25.7	22%	0.222	14%	0.136	C	C	.	.	H	α-helix	trans	-72.8	-50.8	179.9	-178.2	169.5	179.6	167.5	0	112.7	E399 Y407 A713 A714 I715 G721	E399-K717 WeakPolarHBondContact OE1-CE 3.34Å; E399-K717 IonicContact OE1-NZ 3.57Å; E399-K717 PolarHBondContact OE1-NZ 3.47Å; E399-K717 IonicContact OE2-NZ 3.47Å; E399-K717 PolarHBondContact OE2-NZ 3.37Å; Y407-K717 HydrophobicContact CD1-CD 3.84Å; Y407-K717 HydrophobicContact CD2-CD 3.76Å; Y407-K717 HydrophobicContact CE1-CB 4.45Å; Y407-K717 HydrophobicContact CE1-CD 3.65Å; Y407-K717 HydrophobicContact CE2-CD 3.55Å; Y407-K717 HydrophobicContact CG-CD 3.88Å; Y407-K717 VanDerWaalsContact CZ-CD 3.48Å; A713-K717 VanDerWaalsContact O-CB 3.24Å; A713-K717 WeakPolarHBondContact O-CB 3.47Å; A713-K717 PolarHBondContact O-N 3.09Å; A714-K717 PolarHBondContact O-N 3.07Å; I715-K717 VanDerWaalsContact C-N 3.31Å; I715-K717 PolarHBondContact O-N 3.14Å; K717-G721 VanDerWaalsContact O-CA 3.27Å; K717-G721 WeakPolarHBondContact O-CA 3.33Å; K717-G721 PolarHBondContact O-N 3.1Å; K717-G721 VanDerWaalsContact O-N 3.09Å
718	V	89.3	Confident	91.2	Very high	31 Å²	31	23.9 Å²	23.9	19%	0.188	13%	0.127	C	C	.	.	H	α-helix	trans	-73.9	-48.6	-174.8	173.4	0	0	0	0	111.3	A714 F922 I953 V956 A957	A714-V718 WeakPolarHBondContact O-CB 3.4Å; A714-V718 WeakPolarHBondContact O-CG2 3.41Å; A714-V718 PolarHBondContact O-N 3.42Å; V718-F922 HydrophobicContact CG1-CE1 4Å; V718-F922 HydrophobicContact CG1-CE2 4.19Å; V718-F922 HydrophobicContact CG1-CZ 3.8Å; V718-I953 HydrophobicContact CB-CG2 4.28Å; V718-I953 HydrophobicContact CG1-CG2 4.27Å; V718-V956 HydrophobicContact CG1-CB 3.98Å; V718-V956 HydrophobicContact CG1-CG1 3.57Å; V718-V956 HydrophobicContact CG2-CG1 4.5Å; V718-A957 HydrophobicContact CG2-CB 3.72Å
719	C	88.4	Confident	90.7	Very high	11 Å²	11	24.1 Å²	24.1	7%	0.074	13%	0.13	C	C	.	.	H	α-helix	trans	-83.8	-32	-172.6	-56.6	0	0	0	0	112.5	I715 F922 W930	I715-C719 VanDerWaalsContact O-CB 3.23Å; I715-C719 WeakPolarHBondContact O-CB 3.48Å; I715-C719 PolarHBondContact O-N 3.34Å; C719-F922 HydrophobicContact CB-CD1 4.36Å; C719-W930 HydrophobicContact CB-CB 4.25Å; C719-W930 HydrophobicContact CB-CD2 3.51Å; C719-W930 HydrophobicContact CB-CE3 3.84Å; C719-W930 HydrophobicContact CB-CG 3.7Å; C719-W930 HydrophobicContact CB-CZ2 4.36Å; C719-W930 HydrophobicContact CB-CZ3 4.41Å; C719-W930 VanDerWaalsContact SG-CE3 3.52Å; C719-W930 VanDerWaalsContact SG-CZ3 3.59Å
720	K	88.1	Confident	89.7	Confident	34 Å²	34	28.7 Å²	28.7	15%	0.148	15%	0.152	C	C	.	.	H	α-helix	trans	-120.3	-5.6	-171.9	-54.8	-165	66.6	138.1	0	115.2	L716 V722 D927 W930 N931	L716-K720 HydrophobicContact CD2-CD 4.37Å; L716-K720 CarbonylContact O-C 3.41Å; L716-K720 WeakPolarHBondContact O-CA 3.38Å; L716-K720 WeakPolarHBondContact O-CB 3.24Å; L716-K720 PolarHBondContact O-N 3.07Å; K720-V722 VanDerWaalsContact C-N 3.29Å; K720-V722 HydrophobicContact CB-CG2 3.95Å; K720-V722 PolarHBondContact O-N 3.42Å; K720-D927 VanDerWaalsContact CE-OD2 3.24Å; K720-D927 WeakPolarHBondContact CE-OD2 3.47Å; K720-D927 PolarHBondContact NZ-O 2.82Å; K720-D927 VanDerWaalsContact NZ-O 3.14Å; K720-D927 IonicContact NZ-OD1 2.97Å; K720-D927 IonicContact NZ-OD2 2.69Å; K720-D927 PolarHBondContact NZ-OD2 2.96Å; K720-W930 HydrophobicContact CD-CB 4.12Å; K720-W930 HydrophobicContact CG-CB 4.1Å; K720-N931 PolarHBondContact NZ-OD1 3.33Å
721	G	87.4	Confident	89.1	Confident	55 Å²	55	32.8 Å²	32.8	57%	0.567	17%	0.171	S	C	*	.			trans	66.2	25.1	178.7	0	0	0	0	0	114.8	L716 K717	L716-G721 PolarHBondContact O-N 2.6Å; L716-G721 VanDerWaalsContact O-N 3.07Å; K717-G721 VanDerWaalsContact O-CA 3.27Å; K717-G721 WeakPolarHBondContact O-CA 3.33Å; K717-G721 PolarHBondContact O-N 3.1Å; K717-G721 VanDerWaalsContact O-N 3.09Å
722	V	88.3	Confident	88.4	Confident	27 Å²	27	42.5 Å²	42.5	16%	0.164	21%	0.213	C	C	.	.			trans	-68.9	133.2	-178.2	-176.6	0	0	0	0	110.5	F462 H674 L716 K720	F462-V722 HydrophobicContact CZ-CG1 4.39Å; H674-V722 WeakPolarHBondContact CE1-CG2 3.48Å; L716-V722 HydrophobicContact CB-CB 4.01Å; L716-V722 HydrophobicContact CB-CG2 3.99Å; L716-V722 HydrophobicContact CD2-CG2 4.45Å; L716-V722 WeakPolarHBondContact O-CG2 3.45Å; L716-V722 PolarHBondContact O-N 3.22Å; K720-V722 VanDerWaalsContact C-N 3.29Å; K720-V722 HydrophobicContact CB-CG2 3.95Å; K720-V722 PolarHBondContact O-N 3.42Å
723	K	84.3	Confident	87.9	Confident	169 Å²	169	43.4 Å²	43.4	74%	0.735	22%	0.22	S	C	*	.			trans	-90.6	-32.4	-177.1	-62.9	177.4	-173.2	165.3	0	113.8
724	K	88.6	Confident	87.3	Confident	99 Å²	99	43.8 Å²	43.8	43%	0.43	22%	0.224	S	C	.	.	S	Bend	trans	-73.8	141.5	176.3	-70.9	-69.9	-171.3	168.9	0	108.8	F462 Y697	F462-K724 HydrophobicContact CE2-CB 4.21Å; F462-K724 HydrophobicContact CZ-CB 3.82Å; Y697-K724 HydrophobicContact CD1-CG 4.34Å; Y697-K724 HydrophobicContact CE1-CG 4.35Å
725	I	91	Very high	86.9	Confident	14 Å²	14	44.5 Å²	44.5	7%	0.072	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-103.8	126.6	-173	-60.1	177.8	0	0	0	108.4	Y411 Y414	Y411-I725 HydrophobicContact CD2-CG2 3.56Å; Y411-I725 HydrophobicContact CE2-CG2 3.53Å; Y414-I725 HydrophobicContact CD1-CB 4.07Å; Y414-I725 HydrophobicContact CD1-CD1 3.77Å; Y414-I725 HydrophobicContact CD1-CG2 3.89Å; Y414-I725 HydrophobicContact CD2-CD1 4.14Å; Y414-I725 HydrophobicContact CE1-CB 3.67Å; Y414-I725 HydrophobicContact CE1-CD1 4.01Å; Y414-I725 HydrophobicContact CE1-CG1 4.35Å; Y414-I725 HydrophobicContact CE1-CG2 3.87Å; Y414-I725 HydrophobicContact CE2-CD1 4.33Å; Y414-I725 HydrophobicContact CG-CD1 3.84Å
726	L	92.9	Very high	86.2	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-70.2	126.1	169.7	169.2	63.9	0	0	0	109	Y411 F462 F704 A709 A713 Y934	Y411-L726 WeakPolarHBondContact CE2-O 3.37Å; Y411-L726 PolarHBondContact OH-O 2.89Å; F462-L726 HydrophobicContact CB-CD1 3.74Å; F462-L726 HydrophobicContact CD2-CB 3.89Å; F462-L726 HydrophobicContact CD2-CD1 3.96Å; F462-L726 HydrophobicContact CE2-CB 4.19Å; F462-L726 HydrophobicContact CG-CD1 4.21Å; F704-L726 HydrophobicContact CE2-CD1 4.32Å; F704-L726 HydrophobicContact CE2-CD2 4.02Å; F704-L726 HydrophobicContact CE2-CG 4.34Å; F704-L726 HydrophobicContact CZ-CD1 4.29Å; F704-L726 HydrophobicContact CZ-CD2 3.99Å; A709-L726 HydrophobicContact CB-CG 4.3Å; A713-L726 HydrophobicContact CB-CB 4.26Å; L726-Y934 HydrophobicContact CD2-CE2 4.1Å
727	V	91.1	Very high	85.6	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-111.9	140.2	177.2	-174.8	0	0	0	0	108.2	Y414 Y415 Y418 T699 Q700 S701	Y414-V727 HydrophobicContact CD1-CG2 4.49Å; Y414-V727 HydrophobicContact CE1-CG2 3.83Å; Y415-V727 HydrophobicContact CD1-CG1 4.38Å; Y415-V727 HydrophobicContact CD2-CG1 3.69Å; Y415-V727 HydrophobicContact CE1-CG1 4.25Å; Y415-V727 HydrophobicContact CE2-CB 4.42Å; Y415-V727 HydrophobicContact CE2-CG1 3.55Å; Y415-V727 HydrophobicContact CG-CG1 4.12Å; Y418-V727 HydrophobicContact CD1-CB 4.34Å; Y418-V727 HydrophobicContact CD1-CG1 3.76Å; Y418-V727 HydrophobicContact CD1-CG2 4.24Å; Y418-V727 HydrophobicContact CD2-CG2 4.4Å; Y418-V727 HydrophobicContact CE1-CB 4.41Å; Y418-V727 HydrophobicContact CE1-CG1 4.11Å; Y418-V727 HydrophobicContact CG-CG1 4.4Å; Y418-V727 HydrophobicContact CG-CG2 4.18Å; T699-V727 PolarHBondContact O-N 2.84Å; Q700-V727 CarbonylContact C-O 3.54Å; Q700-V727 WeakPolarHBondContact CA-O 3.45Å; S701-V727 PolarHBondContact N-O 2.9Å
728	G	88	Confident	85.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.264	C	S	.	.			trans	-85.2	173.4	176	0	0	0	0	0	112.2	Y415 S701 F704	Y415-G728 VanDerWaalsContact OH-CA 3.27Å; Y415-G728 WeakPolarHBondContact OH-CA 3.33Å; Y415-G728 PolarHBondContact OH-N 3.1Å; Y415-G728 PolarHBondContact OH-O 2.89Å; S701-G728 CarbonylContact O-C 3.58Å; F704-G728 CarbonylContact O-C 3.58Å; F704-G728 VanDerWaalsContact O-CA 3.25Å; F704-G728 WeakPolarHBondContact O-CA 3.42Å
729	G	83.4	Confident	84.6	Confident	6 Å²	6	52.9 Å²	52.9	6%	0.062	27%	0.273	C	S	.	.			trans	-80.5	-168.9	173.5	0	0	0	0	0	111.8	Y415 S701 F704	Y415-G729 PolarHBondContact OH-O 3.38Å; S701-G729 WeakPolarHBondContact O-CA 3.39Å; S701-G729 PolarHBondContact O-N 3.37Å; F704-G729 PolarHBondContact O-N 3.26Å
730	M	73.9	Confident	84.3	Confident	95 Å²	95	52.4 Å²	52.4	47%	0.468	27%	0.269	S	S	.	.	S	Bend	trans	-82.2	-2.3	172.3	-63.5	-60.7	-171.6	0	0	113.2	L419	L419-M730 HydrophobicContact CD1-CE 3.81Å; L419-M730 HydrophobicContact CD1-SD 3.94Å; L419-M730 HydrophobicContact CD2-CE 3.57Å; L419-M730 HydrophobicContact CD2-SD 4.26Å; L419-M730 HydrophobicContact CG-CE 4.16Å
731	Q	81	Confident	84	Confident	87 Å²	87	52.9 Å²	52.9	41%	0.407	27%	0.272	S	S	.	.	S	Bend	trans	-65.2	142	179.8	-68.5	160.3	-1.4	0	0	110.5	F702 R703 G705 S733	F702-Q731 PolarHBondContact O-NE2 2.74Å; F702-Q731 PolarHBondContact O-OE1 3.09Å; R703-Q731 PolarHBondContact O-OE1 2.92Å; G705-Q731 WeakPolarHBondContact CA-O 3.36Å; Q731-S733 PolarHBondContact O-N 3.49Å
732	K	80.1	Confident	83.9	Confident	205 Å²	205	57 Å²	57	89%	0.891	28%	0.275	S	S	*	.			trans	-72.1	122.9	171.4	-70.1	-176.8	-180	176.5	0	108.4
733	S	83.6	Confident	83.6	Confident	20 Å²	20	56 Å²	56	14%	0.14	27%	0.269	C	S	.	.			trans	-133.4	143.4	174.1	68.5	0	0	0	0	111.2	G705 E707 Q731 S942	G705-S733 WeakPolarHBondContact CA-OG 3.32Å; G705-S733 PolarHBondContact N-OG 2.78Å; G705-S733 PolarHBondContact O-OG 3.14Å; E707-S733 WeakPolarHBondContact CB-O 3.2Å; E707-S733 WeakPolarHBondContact CG-O 3.43Å; Q731-S733 PolarHBondContact O-N 3.49Å; S733-S942 CarbonylContact C-O 3.5Å; S733-S942 WeakPolarHBondContact CA-O 3.04Å
734	G	83.7	Confident	83.6	Confident	11 Å²	11	48.2 Å²	48.2	11%	0.113	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	157.3	177.3	0	0	0	0	0	113.1	S942 S943 L944	G734-S942 PolarHBondContact N-O 3.32Å; G734-S943 WeakPolarHBondContact O-CA 3.42Å; G734-L944 PolarHBondContact O-N 2.89Å; G734-L944 VanDerWaalsContact O-N 3.14Å
735	V	83.4	Confident	83.4	Confident	15 Å²	15	47.6 Å²	47.6	9%	0.091	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	119.4	170.3	178	0	0	0	0	107	E707 I708 V711 D737 L944 I946	E707-V735 HydrophobicContact CB-CG2 4.01Å; I708-V735 HydrophobicContact CG1-CG2 4.2Å; V711-V735 HydrophobicContact CG2-CG1 4.22Å; V711-V735 HydrophobicContact CG2-CG2 3.82Å; V735-D737 PolarHBondContact O-N 3.38Å; V735-L944 HydrophobicContact CG2-CB 4.42Å; V735-L944 HydrophobicContact CG2-CD2 4.37Å; V735-I946 HydrophobicContact CG1-CD1 4.26Å; V735-I946 HydrophobicContact CG1-CG1 4.29Å; V735-I946 HydrophobicContact CG1-CG2 3.82Å
736	C	78.6	Confident	83	Confident	9 Å²	9	47.5 Å²	47.5	6%	0.061	24%	0.235	C	C	.	.	S	Bend	trans	50	39.9	-171.3	-68	0	0	0	0	112.8	L944 I946 M1001 Q1002	C736-L944 PolarHBondContact N-O 3.32Å; C736-I946 VanDerWaalsContact SG-CG1 3.54Å; C736-M1001 HydrophobicContact CB-CB 4.39Å; C736-Q1002 PolarHBondContact SG-O 3.23Å
737	D	80.6	Confident	82.6	Confident	46 Å²	46	48.2 Å²	48.2	25%	0.246	24%	0.239	C	C	.	.			trans	-78.8	-179.4	173	69.8	-36.6	0	0	0	111.8	V735 T739 A740 E741 S943	V735-D737 PolarHBondContact O-N 3.38Å; D737-T739 PolarHBondContact O-N 2.92Å; D737-T739 VanDerWaalsContact OD2-CB 3.31Å; D737-T739 WeakPolarHBondContact OD2-CB 3.36Å; D737-T739 PolarHBondContact OD2-OG1 2.91Å; D737-A740 WeakPolarHBondContact O-CA 3.45Å; D737-A740 WeakPolarHBondContact O-CB 3.41Å; D737-A740 PolarHBondContact O-N 2.91Å; D737-A740 VanDerWaalsContact OD1-CB 3.32Å; D737-A740 WeakPolarHBondContact OD1-CB 3.27Å; D737-A740 PolarHBondContact OD1-N 3.36Å; D737-E741 PolarHBondContact O-N 2.86Å; D737-S943 WeakPolarHBondContact OD1-CB 3.46Å; D737-S943 PolarHBondContact OD1-OG 3.46Å
738	E	80.8	Confident	82.3	Confident	146 Å²	146	53.9 Å²	53.9	68%	0.682	26%	0.264	S	S	*	.	H	α-helix	trans	-58.1	-33.6	178.6	-63.4	177.9	-171.5	0	0	112.4	E741 K742	E738-E741 PolarHBondContact O-N 3.22Å; E738-K742 WeakPolarHBondContact O-CG 3.29Å; E738-K742 PolarHBondContact O-N 3.25Å
739	T	79.9	Confident	82.2	Confident	60 Å²	60	60.8 Å²	60.8	37%	0.368	29%	0.293	S	S	.	.	H	α-helix	trans	-64.7	-44.8	174.6	-41.3	0	0	0	0	111.2	D737 E741 K742 A743	D737-T739 PolarHBondContact O-N 2.92Å; D737-T739 VanDerWaalsContact OD2-CB 3.31Å; D737-T739 WeakPolarHBondContact OD2-CB 3.36Å; D737-T739 PolarHBondContact OD2-OG1 2.91Å; T739-E741 VanDerWaalsContact C-N 3.35Å; T739-K742 PolarHBondContact O-N 3.37Å; T739-A743 WeakPolarHBondContact O-CB 3.45Å; T739-A743 PolarHBondContact O-N 3.43Å
740	A	80.9	Confident	81.9	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.008	29%	0.29	C	S	.	.	H	α-helix	trans	-62.1	-39.3	173.4	0	0	0	0	0	112.4	D737 A743 L744 S943 V945	D737-A740 WeakPolarHBondContact O-CA 3.45Å; D737-A740 WeakPolarHBondContact O-CB 3.41Å; D737-A740 PolarHBondContact O-N 2.91Å; D737-A740 VanDerWaalsContact OD1-CB 3.32Å; D737-A740 WeakPolarHBondContact OD1-CB 3.27Å; D737-A740 PolarHBondContact OD1-N 3.36Å; A740-A743 PolarHBondContact O-N 2.71Å; A740-L744 WeakPolarHBondContact O-CB 3.46Å; A740-L744 PolarHBondContact O-N 3.34Å; A740-S943 VanDerWaalsContact CB-OG 3.31Å; A740-S943 WeakPolarHBondContact CB-OG 3.46Å; A740-S943 PolarHBondContact N-OG 3.35Å; A740-V945 HydrophobicContact CB-CG2 3.62Å
741	E	83	Confident	82.2	Confident	45 Å²	45	62 Å²	62	21%	0.21	30%	0.297	C	S	.	.	H	α-helix	trans	-62.9	-46.6	175.3	-65.2	-163.3	141.4	0	0	111.1	D737 E738 T739 A743 L744 E745 Q1002	D737-E741 PolarHBondContact O-N 2.86Å; E738-E741 PolarHBondContact O-N 3.22Å; T739-E741 VanDerWaalsContact C-N 3.35Å; E741-A743 VanDerWaalsContact C-N 3.32Å; E741-A743 PolarHBondContact O-N 3.42Å; E741-L744 PolarHBondContact O-N 3.48Å; E741-E745 WeakPolarHBondContact O-CG 3.23Å; E741-E745 PolarHBondContact O-N 3.49Å; E741-Q1002 HydrophobicContact CG-CB 4.27Å; E741-Q1002 HydrophobicContact CG-CG 4.13Å; E741-Q1002 WeakPolarHBondContact OE1-CG 3.32Å; E741-Q1002 PolarHBondContact OE1-NE2 3.49Å
742	K	83.9	Confident	82.1	Confident	142 Å²	142	58.3 Å²	58.3	62%	0.617	28%	0.28	S	S	*	.	H	α-helix	trans	-59.8	-40.8	174.5	-71.9	173.2	-176.5	175	0	112	E738 T739 E745 A746	E738-K742 WeakPolarHBondContact O-CG 3.29Å; E738-K742 PolarHBondContact O-N 3.25Å; T739-K742 PolarHBondContact O-N 3.37Å; K742-E745 PolarHBondContact O-N 2.85Å; K742-A746 WeakPolarHBondContact O-CB 3.34Å; K742-A746 PolarHBondContact O-N 3.5Å
743	A	82.8	Confident	81.3	Confident	5 Å²	5	54.8 Å²	54.8	4%	0.041	28%	0.28	C	S	.	.	H	α-helix	trans	-65.6	-37.4	176.8	0	0	0	0	0	112.3	T739 A740 E741 A746 M747 I758 T897 I899	T739-A743 WeakPolarHBondContact O-CB 3.45Å; T739-A743 PolarHBondContact O-N 3.43Å; A740-A743 PolarHBondContact O-N 2.71Å; E741-A743 VanDerWaalsContact C-N 3.32Å; E741-A743 PolarHBondContact O-N 3.42Å; A743-A746 WeakPolarHBondContact O-CB 3.29Å; A743-A746 PolarHBondContact O-N 3.4Å; A743-M747 WeakPolarHBondContact O-CB 3.24Å; A743-M747 PolarHBondContact O-N 2.81Å; A743-I758 HydrophobicContact CB-CD1 4.01Å; A743-T897 HydrophobicContact CB-CG2 3.79Å; A743-I899 HydrophobicContact CB-CD1 4.46Å
744	L	83.9	Confident	80.6	Confident	6 Å²	6	58.3 Å²	58.3	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-72.6	-36.2	176	-167	68.4	0	0	0	112	A740 E741 M747 K748 V945 Q1002 T1004	A740-L744 WeakPolarHBondContact O-CB 3.46Å; A740-L744 PolarHBondContact O-N 3.34Å; E741-L744 PolarHBondContact O-N 3.48Å; L744-M747 HydrophobicContact CD1-SD 4.27Å; L744-M747 PolarHBondContact O-N 3.36Å; L744-K748 WeakPolarHBondContact O-CG 3.37Å; L744-K748 PolarHBondContact O-N 3.23Å; L744-V945 HydrophobicContact CD1-CG1 4.5Å; L744-Q1002 HydrophobicContact CD2-CB 3.93Å; L744-T1004 HydrophobicContact CD1-CG2 4.47Å
745	E	84.4	Confident	80.4	Confident	86 Å²	86	63.8 Å²	63.8	40%	0.402	31%	0.314	S	S	.	.	H	α-helix	trans	-63.8	-42.7	170.6	-74.1	-178.1	-172.6	0	0	111.8	E741 K742 M747 K748 K749	E741-E745 WeakPolarHBondContact O-CG 3.23Å; E741-E745 PolarHBondContact O-N 3.49Å; K742-E745 PolarHBondContact O-N 2.85Å; E745-M747 VanDerWaalsContact C-N 3.33Å; E745-M747 PolarHBondContact O-N 2.88Å; E745-K748 PolarHBondContact O-N 2.79Å; E745-K749 WeakPolarHBondContact O-CG 3.43Å; E745-K749 PolarHBondContact O-N 3.05Å
746	A	83.9	Confident	80	Confident	12 Å²	12	63.4 Å²	63.4	10%	0.099	31%	0.314	C	S	.	.	H	α-helix	trans	-58.5	-45.6	172.5	0	0	0	0	0	110.9	K742 A743 K748 K749 G750 E751 I758 F882	K742-A746 WeakPolarHBondContact O-CB 3.34Å; K742-A746 PolarHBondContact O-N 3.5Å; A743-A746 WeakPolarHBondContact O-CB 3.29Å; A743-A746 PolarHBondContact O-N 3.4Å; A746-K748 VanDerWaalsContact C-N 3.31Å; A746-K748 PolarHBondContact O-N 3.38Å; A746-K749 CarbonylContact O-C 3.53Å; A746-K749 PolarHBondContact O-N 3.23Å; A746-G750 PolarHBondContact O-N 3.06Å; A746-E751 WeakPolarHBondContact CA-O 3.38Å; A746-E751 VanDerWaalsContact CB-O 3.24Å; A746-E751 WeakPolarHBondContact CB-O 3.38Å; A746-E751 PolarHBondContact O-N 3.42Å; A746-I758 HydrophobicContact CB-CD1 4.45Å; A746-F882 HydrophobicContact CB-CE1 4.42Å; A746-F882 HydrophobicContact CB-CZ 4.02Å
747	M	84.4	Confident	80.3	Confident	15 Å²	15	67.7 Å²	67.7	7%	0.074	33%	0.331	C	S	.	.	H	α-helix	trans	-60.9	-37.6	176	-175.9	-175.2	174.5	0	0	112.3	A743 L744 E745 L775 F882 I899	A743-M747 WeakPolarHBondContact O-CB 3.24Å; A743-M747 PolarHBondContact O-N 2.81Å; L744-M747 HydrophobicContact CD1-SD 4.27Å; L744-M747 PolarHBondContact O-N 3.36Å; E745-M747 VanDerWaalsContact C-N 3.33Å; E745-M747 PolarHBondContact O-N 2.88Å; M747-L775 HydrophobicContact CB-CD2 4.39Å; M747-L775 HydrophobicContact CG-CD2 3.78Å; M747-F882 HydrophobicContact CB-CE1 4.25Å; M747-I899 HydrophobicContact CB-CD1 4.31Å; M747-I899 HydrophobicContact SD-CD1 4.08Å; M747-I899 HydrophobicContact SD-CG2 4.15Å
748	K	85	Confident	80.8	Confident	120 Å²	120	65.9 Å²	65.9	52%	0.522	32%	0.322	S	S	.	.	H	α-helix	trans	-71.3	-33.3	176.3	-73.3	170.7	-176.1	168.7	0	113	L744 E745 A746 A778	L744-K748 WeakPolarHBondContact O-CG 3.37Å; L744-K748 PolarHBondContact O-N 3.23Å; E745-K748 PolarHBondContact O-N 2.79Å; A746-K748 VanDerWaalsContact C-N 3.31Å; A746-K748 PolarHBondContact O-N 3.38Å; K748-A778 WeakPolarHBondContact O-CB 3.49Å
749	K	83.9	Confident	81.4	Confident	144 Å²	144	58.9 Å²	58.9	63%	0.626	29%	0.289	S	S	*	.	H	α-helix	trans	-83.2	-20.7	177.2	-70.1	175.6	-179.2	173.4	0	112.6	E745 A746 E751 N779	E745-K749 WeakPolarHBondContact O-CG 3.43Å; E745-K749 PolarHBondContact O-N 3.05Å; A746-K749 CarbonylContact O-C 3.53Å; A746-K749 PolarHBondContact O-N 3.23Å; K749-E751 VanDerWaalsContact C-N 3.31Å; K749-N779 WeakPolarHBondContact O-CB 3.5Å
750	G	78.3	Confident	82	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	72	23.5	-175.1	0	0	0	0	0	113.4	A746 N779 C782	A746-G750 PolarHBondContact O-N 3.06Å; G750-N779 WeakPolarHBondContact O-CB 3.38Å; G750-N779 PolarHBondContact O-ND2 2.86Å; G750-C782 VanDerWaalsContact O-CB 3.32Å; G750-C782 WeakPolarHBondContact O-CB 3.28Å; G750-C782 PolarHBondContact O-SG 3.22Å
751	E	80.6	Confident	82.6	Confident	128 Å²	128	56 Å²	56	60%	0.598	27%	0.271	S	S	*	.			trans	-144.3	133.4	179.1	-174.4	177.6	-164.9	0	0	109.3	A746 K749	A746-E751 WeakPolarHBondContact CA-O 3.38Å; A746-E751 VanDerWaalsContact CB-O 3.24Å; A746-E751 WeakPolarHBondContact CB-O 3.38Å; A746-E751 PolarHBondContact O-N 3.42Å; K749-E751 VanDerWaalsContact C-N 3.31Å
752	S	77.8	Confident	83.1	Confident	8 Å²	8	53.9 Å²	53.9	6%	0.056	26%	0.261	C	S	.	.			trans	-111.7	129.7	178.2	-178.5	0	0	0	0	110.4	N754 I758 D881	S752-N754 PolarHBondContact O-N 3.33Å; S752-N754 PolarHBondContact OG-N 2.98Å; S752-N754 VanDerWaalsContact OG-N 3.13Å; S752-N754 PolarHBondContact OG-O 3.43Å; S752-I758 WeakPolarHBondContact OG-CD1 3.41Å; S752-D881 WeakPolarHBondContact CB-O 3.29Å
753	C	63.4	Low	83.3	Confident	132 Å²	132	50.1 Å²	50.1	89%	0.892	24%	0.243	S	C	*	.	S	Bend	trans	-69.8	-18.5	170.5	-50.5	0	0	0	0	112.1
754	N	70.3	Confident	83.5	Confident	94 Å²	94	51.9 Å²	51.9	50%	0.503	26%	0.255	S	S	.	.	S	Bend	trans	-119.6	89.7	-174.4	-72.7	-12.1	0	0	0	109.6	S752 K757	S752-N754 PolarHBondContact O-N 3.33Å; S752-N754 PolarHBondContact OG-N 2.98Å; S752-N754 VanDerWaalsContact OG-N 3.13Å; S752-N754 PolarHBondContact OG-O 3.43Å; N754-K757 HydrophobicContact CB-CB 4.43Å; N754-K757 HydrophobicContact CB-CD 4.17Å
755	R	78.1	Confident	83.6	Confident	125 Å²	125	53.8 Å²	53.8	47%	0.472	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	144.7	-179.5	-58	177.9	-175.3	-169.8	-2.5	111.3	K757 H878 A880	R755-K757 VanDerWaalsContact C-N 3.25Å; R755-K757 PolarHBondContact O-N 3.31Å; R755-H878 CarbonylContact C-O 3.14Å; R755-H878 VanDerWaalsContact CB-O 3.23Å; R755-H878 WeakPolarHBondContact CB-O 3.4Å; R755-A880 CarbonylContact C-O 3.52Å; R755-A880 WeakPolarHBondContact CA-O 3.41Å
756	G	75.5	Confident	83.6	Confident	8 Å²	8	52.4 Å²	52.4	8%	0.082	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	72	5.2	176	0	0	0	0	0	116.3	F877 A880 I883	G756-F877 VanDerWaalsContact CA-O 3.23Å; G756-F877 WeakPolarHBondContact CA-O 3.42Å; G756-F877 VanDerWaalsContact O-CE1 3.23Å; G756-F877 WeakPolarHBondContact O-CE1 3.15Å; G756-A880 PolarHBondContact N-O 3.3Å; G756-I883 WeakPolarHBondContact O-CD1 3.35Å
757	K	84.6	Confident	83.7	Confident	98 Å²	98	52.2 Å²	52.2	43%	0.426	26%	0.259	S	S	.	.			trans	-107.2	-20.9	-170.4	-70.4	-173.8	171.5	-170.5	0	115.2	N754 R755 D896 T897	N754-K757 HydrophobicContact CB-CB 4.43Å; N754-K757 HydrophobicContact CB-CD 4.17Å; R755-K757 VanDerWaalsContact C-N 3.25Å; R755-K757 PolarHBondContact O-N 3.31Å; K757-D896 HydrophobicContact CB-CB 4.03Å; K757-D896 WeakPolarHBondContact CD-OD2 3.23Å; K757-D896 VanDerWaalsContact CE-OD2 3.25Å; K757-D896 WeakPolarHBondContact CE-OD2 3.4Å; K757-D896 HydrophobicContact CG-CB 4.32Å; K757-D896 VanDerWaalsContact CG-OD2 3.29Å; K757-D896 WeakPolarHBondContact CG-OD2 3.41Å; K757-D896 IonicContact NZ-OD2 2.89Å; K757-D896 PolarHBondContact O-N 3.36Å; K757-T897 PolarHBondContact O-N 3.09Å
758	I	90.9	Very high	83.9	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.041	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	113.8	-172.8	-54.1	177.5	0	0	0	110.5	A743 A746 S752 F882 I883 T897 I899	A743-I758 HydrophobicContact CB-CD1 4.01Å; A746-I758 HydrophobicContact CB-CD1 4.45Å; S752-I758 WeakPolarHBondContact OG-CD1 3.41Å; I758-F882 HydrophobicContact CB-CD1 4.11Å; I758-F882 HydrophobicContact CB-CE1 4.45Å; I758-F882 HydrophobicContact CD1-CE1 4.03Å; I758-F882 HydrophobicContact CG2-CD1 3.82Å; I758-F882 HydrophobicContact CG2-CE1 4.1Å; I758-I883 PolarHBondContact O-N 2.64Å; I758-T897 WeakPolarHBondContact CA-O 3.41Å; I758-I899 HydrophobicContact CG2-CD1 3.81Å; I758-I899 HydrophobicContact CG2-CG1 4.13Å
759	G	93	Very high	84.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	124.6	173.3	0	0	0	0	0	112.6	I883 T897 V898 I899	G759-I883 CarbonylContact C-O 3.47Å; G759-I883 WeakPolarHBondContact CA-O 3.37Å; G759-T897 PolarHBondContact N-O 3.43Å; G759-V898 CarbonylContact O-C 3.59Å; G759-V898 WeakPolarHBondContact O-CA 3.46Å; G759-I899 PolarHBondContact O-N 3.13Å
760	V	93.3	Very high	84.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	110.4	171.8	-174.6	0	0	0	0	108.8	F882 I883 V884 G885 I899 T901	V760-F882 HydrophobicContact CG2-CD1 4.41Å; V760-I883 PolarHBondContact N-O 3.19Å; V760-V884 HydrophobicContact CB-CG1 4.35Å; V760-V884 HydrophobicContact CB-CG2 4.19Å; V760-V884 HydrophobicContact CG2-CG2 4.47Å; V760-V884 WeakPolarHBondContact O-CA 3.38Å; V760-G885 PolarHBondContact O-N 3.43Å; V760-G885 VanDerWaalsContact O-N 3.14Å; V760-I899 WeakPolarHBondContact CA-O 3.41Å; V760-I899 HydrophobicContact CG2-CB 4.32Å; V760-I899 HydrophobicContact CG2-CD1 4.43Å; V760-T901 HydrophobicContact CG1-CG2 3.8Å
761	L	94.4	Very high	84.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128	-172.1	-59.8	-173.3	0	0	0	112.1	I787 V887 A890 F895 V898 I899 T901 R939	L761-I787 HydrophobicContact CD2-CD1 4.08Å; L761-V887 HydrophobicContact CB-CG2 4.38Å; L761-A890 HydrophobicContact CD1-CB 4.25Å; L761-A890 HydrophobicContact CD2-CB 3.54Å; L761-F895 HydrophobicContact CD1-CE2 4.41Å; L761-F895 HydrophobicContact CD2-CE2 4.05Å; L761-F895 HydrophobicContact CD2-CZ 4.47Å; L761-V898 HydrophobicContact CB-CG1 4.42Å; L761-V898 HydrophobicContact CD1-CG1 3.75Å; L761-V898 HydrophobicContact CD1-CG2 4.46Å; L761-V898 HydrophobicContact CG-CG1 3.96Å; L761-I899 PolarHBondContact N-O 3.27Å; L761-T901 PolarHBondContact O-N 3.14Å; L761-T901 VanDerWaalsContact O-N 3.11Å; L761-T901 PolarHBondContact O-OG1 3.34Å; L761-T901 VanDerWaalsContact O-OG1 3.09Å; L761-R939 HydrophobicContact CD1-CB 3.9Å; L761-R939 HydrophobicContact CD1-CG 3.86Å
762	S	92.3	Very high	85.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	152.8	-179.7	-60.5	0	0	0	0	113.6	G885 T886 V887 T901 D903	S762-G885 PolarHBondContact N-O 2.78Å; S762-T886 CarbonylContact O-C 3.55Å; S762-T886 WeakPolarHBondContact O-CA 3.43Å; S762-V887 PolarHBondContact O-N 3.46Å; S762-T901 WeakPolarHBondContact CA-OG1 3.48Å; S762-T901 VanDerWaalsContact CB-OG1 3.28Å; S762-T901 WeakPolarHBondContact CB-OG1 3.41Å; S762-T901 WeakPolarHBondContact OG-CG2 3.34Å; S762-T901 PolarHBondContact OG-OG1 2.9Å; S762-D903 WeakPolarHBondContact CB-OD2 3.49Å
763	R	88.8	Confident	85.7	Confident	63 Å²	63	36.5 Å²	36.5	24%	0.238	19%	0.189	C	C	.	.	S	Bend	trans	-68.6	-36.4	173.5	172	59.8	-173.8	90.5	-9.2	112.3	D903 F904 E929 L932	R763-D903 WeakPolarHBondContact CA-OD2 3.48Å; R763-D903 HydrophobicContact CB-CB 4.47Å; R763-D903 WeakPolarHBondContact CB-O 3.47Å; R763-D903 WeakPolarHBondContact CB-OD2 3.08Å; R763-D903 PolarHBondContact N-OD1 2.89Å; R763-D903 PolarHBondContact N-OD2 3.33Å; R763-F904 HydrophobicContact CB-CD1 4.02Å; R763-F904 HydrophobicContact CB-CD2 4.32Å; R763-F904 HydrophobicContact CB-CE1 4.01Å; R763-F904 HydrophobicContact CB-CE2 4.31Å; R763-F904 HydrophobicContact CB-CG 4.19Å; R763-F904 HydrophobicContact CB-CZ 4.16Å; R763-E929 IonicContact CZ-OE1 3.97Å; R763-E929 IonicContact CZ-OE2 2.64Å; R763-E929 IonicContact NE-OE1 3.27Å; R763-E929 PolarHBondContact NE-OE1 2.99Å; R763-E929 IonicContact NE-OE2 2.76Å; R763-E929 PolarHBondContact NE-OE2 3.19Å; R763-E929 IonicContact NH2-OE1 3.64Å; R763-E929 PolarHBondContact NH2-OE1 3.26Å; R763-E929 IonicContact NH2-OE2 2.69Å; R763-L932 VanDerWaalsContact CZ-CD1 3.46Å
764	C	86.1	Confident	86.9	Confident	43 Å²	43	35 Å²	35	29%	0.291	17%	0.169	S	C	.	.	S	Bend	trans	-133.5	161	-171.1	69.1	0	0	0	0	113.7	L766 G767 V768 D903	C764-L766 PolarHBondContact O-N 3.27Å; C764-G767 PolarHBondContact O-N 2.69Å; C764-G767 PolarHBondContact SG-N 3.44Å; C764-V768 PolarHBondContact O-N 2.97Å; C764-V768 VanDerWaalsContact O-N 3.13Å; C764-D903 PolarHBondContact N-OD2 2.68Å; C764-D903 PolarHBondContact SG-OD2 3.46Å
765	N	85.8	Confident	87.8	Confident	46 Å²	46	30.5 Å²	30.5	25%	0.246	15%	0.145	C	C	.	.	H	α-helix	trans	-62.8	-29.8	176.8	-69.5	-14.9	0	0	0	112.3	V768 F769 T886	N765-V768 PolarHBondContact O-N 3.38Å; N765-F769 PolarHBondContact O-N 3.19Å; N765-T886 VanDerWaalsContact OD1-CG2 3.28Å; N765-T886 WeakPolarHBondContact OD1-CG2 3.45Å
766	L	85	Confident	88.2	Confident	57 Å²	57	24.6 Å²	24.6	30%	0.298	12%	0.123	S	C	.	.	H	α-helix	trans	-63.3	-41	172.4	169.9	63.7	0	0	0	111.5	C764 F769 K770 I854	C764-L766 PolarHBondContact O-N 3.27Å; L766-F769 PolarHBondContact O-N 3.29Å; L766-K770 WeakPolarHBondContact O-CB 3.31Å; L766-K770 PolarHBondContact O-N 3.35Å; L766-I854 HydrophobicContact CD1-CD1 4.2Å; L766-I854 HydrophobicContact CD1-CG1 3.37Å
767	G	86.6	Confident	88.8	Confident	7 Å²	7	27.9 Å²	27.9	7%	0.072	14%	0.139	C	C	.	.	H	α-helix	trans	-62.4	-45.2	174.9	0	0	0	0	0	111.9	C764 F769 K770 G771	C764-G767 PolarHBondContact O-N 2.69Å; C764-G767 PolarHBondContact SG-N 3.44Å; G767-F769 PolarHBondContact O-N 2.85Å; G767-K770 PolarHBondContact O-N 2.92Å; G767-G771 PolarHBondContact O-N 3.17Å
768	V	89.1	Confident	89	Confident	5 Å²	5	25.5 Å²	25.5	3%	0.03	14%	0.137	C	C	.	.	H	α-helix	trans	-57.4	-47.1	173.7	171.6	0	0	0	0	111.4	C764 N765 G771 A772 F786 V884 G885 T886	C764-V768 PolarHBondContact O-N 2.97Å; C764-V768 VanDerWaalsContact O-N 3.13Å; N765-V768 PolarHBondContact O-N 3.38Å; V768-G771 PolarHBondContact O-N 3.24Å; V768-A772 WeakPolarHBondContact O-CB 3.27Å; V768-A772 PolarHBondContact O-N 2.95Å; V768-F786 HydrophobicContact CG1-CD1 4.14Å; V768-F786 HydrophobicContact CG1-CE1 4.18Å; V768-V884 HydrophobicContact CB-CG1 4.41Å; V768-V884 HydrophobicContact CG1-CG1 3.9Å; V768-G885 VanDerWaalsContact CG2-C 3.41Å; V768-T886 HydrophobicContact CG2-CG2 3.67Å
769	F	89.1	Confident	88.7	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.009	15%	0.146	C	C	.	.	H	α-helix	trans	-63.8	-45.7	178.1	-171.3	-88.2	0	0	0	111.7	N765 L766 G767 G771 A772 V773 L795 I798 I854 Y858 I862 L865 L869	N765-F769 PolarHBondContact O-N 3.19Å; L766-F769 PolarHBondContact O-N 3.29Å; G767-F769 PolarHBondContact O-N 2.85Å; F769-G771 PolarHBondContact O-N 3.07Å; F769-A772 PolarHBondContact O-N 3.37Å; F769-V773 HydrophobicContact CD1-CG2 3.84Å; F769-V773 HydrophobicContact CE1-CG2 3.52Å; F769-V773 HydrophobicContact CZ-CG2 3.98Å; F769-V773 WeakPolarHBondContact O-CB 3.35Å; F769-V773 VanDerWaalsContact O-CG2 3.27Å; F769-V773 WeakPolarHBondContact O-CG2 3.3Å; F769-V773 PolarHBondContact O-N 2.68Å; F769-L795 HydrophobicContact CD2-CD2 4.15Å; F769-L795 HydrophobicContact CE2-CD2 3.99Å; F769-I798 HydrophobicContact CD2-CD1 4.11Å; F769-I798 HydrophobicContact CE2-CD1 4.18Å; F769-I854 HydrophobicContact CB-CD1 3.83Å; F769-I854 HydrophobicContact CD1-CD1 4.23Å; F769-I854 HydrophobicContact CD1-CG1 4.28Å; F769-I854 HydrophobicContact CD1-CG2 3.7Å; F769-I854 HydrophobicContact CD2-CD1 4.33Å; F769-I854 HydrophobicContact CD2-CG2 4.49Å; F769-I854 HydrophobicContact CE1-CG2 3.48Å; F769-I854 VanDerWaalsContact CE1-CG2 3.48Å; F769-I854 HydrophobicContact CE2-CG2 4.31Å; F769-I854 HydrophobicContact CG-CD1 3.87Å; F769-I854 HydrophobicContact CG-CG1 4.43Å; F769-I854 HydrophobicContact CG-CG2 4.21Å; F769-I854 HydrophobicContact CZ-CG2 3.81Å; F769-Y858 HydrophobicContact CD1-CE2 4.08Å; F769-Y858 AromaticContact CE1-CD2 3.97Å; F769-Y858 HydrophobicContact CE1-CD2 3.97Å; F769-Y858 AromaticContact CE1-CE2 3.91Å; F769-Y858 HydrophobicContact CE1-CE2 3.91Å; F769-I862 HydrophobicContact CZ-CD1 4.47Å; F769-L865 HydrophobicContact CE1-CD1 4.47Å; F769-L865 HydrophobicContact CZ-CB 4.42Å; F769-L865 HydrophobicContact CZ-CD1 4.45Å; F769-L869 HydrophobicContact CD2-CD1 3.99Å; F769-L869 HydrophobicContact CE2-CD1 3.57Å; F769-L869 HydrophobicContact CZ-CD1 4.16Å
770	K	88.1	Confident	88	Confident	71 Å²	71	33.7 Å²	33.7	31%	0.309	18%	0.176	S	C	.	.	H	α-helix	trans	-58.5	-45.7	176.3	-179.5	-171.3	169.3	-162.5	0	111.2	L766 G767 V773 Q774 D902	L766-K770 WeakPolarHBondContact O-CB 3.31Å; L766-K770 PolarHBondContact O-N 3.35Å; G767-K770 PolarHBondContact O-N 2.92Å; K770-V773 PolarHBondContact O-N 3.07Å; K770-Q774 WeakPolarHBondContact O-CB 3.23Å; K770-Q774 PolarHBondContact O-N 2.97Å; K770-D902 IonicContact NZ-OD1 2.85Å; K770-D902 PolarHBondContact NZ-OD1 3.18Å; K770-D902 IonicContact NZ-OD2 3.75Å; K770-D902 PolarHBondContact NZ-OD2 2.65Å
771	G	87.3	Confident	87.4	Confident	4 Å²	4	41.8 Å²	41.8	4%	0.041	21%	0.214	C	C	.	.	H	α-helix	trans	-63.8	-44.1	178	0	0	0	0	0	112.5	G767 V768 F769 Q774 L775	G767-G771 PolarHBondContact O-N 3.17Å; V768-G771 PolarHBondContact O-N 3.24Å; F769-G771 PolarHBondContact O-N 3.07Å; G771-Q774 WeakPolarHBondContact O-CB 2.98Å; G771-Q774 PolarHBondContact O-N 2.87Å; G771-L775 WeakPolarHBondContact O-CG 3.33Å; G771-L775 PolarHBondContact O-N 3.46Å
772	A	89.6	Confident	87	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67	-38.9	177.5	0	0	0	0	0	112.6	V768 F769 Q774 L775 T776 I784 F786 L869	V768-A772 WeakPolarHBondContact O-CB 3.27Å; V768-A772 PolarHBondContact O-N 2.95Å; F769-A772 PolarHBondContact O-N 3.37Å; A772-Q774 VanDerWaalsContact C-N 3.34Å; A772-L775 PolarHBondContact O-N 3.34Å; A772-T776 WeakPolarHBondContact O-CG2 3.04Å; A772-T776 PolarHBondContact O-N 3.02Å; A772-T776 PolarHBondContact O-OG1 2.86Å; A772-I784 HydrophobicContact CB-CD1 4.36Å; A772-F786 HydrophobicContact CB-CE1 3.79Å; A772-F786 HydrophobicContact CB-CZ 3.83Å; A772-L869 HydrophobicContact CB-CD2 3.62Å
773	V	89.3	Confident	86.8	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.024	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-42.1	172.5	172.1	0	0	0	0	110.8	F769 K770 L775 T776 D777 Y858 L865 L869	F769-V773 HydrophobicContact CD1-CG2 3.84Å; F769-V773 HydrophobicContact CE1-CG2 3.52Å; F769-V773 HydrophobicContact CZ-CG2 3.98Å; F769-V773 WeakPolarHBondContact O-CB 3.35Å; F769-V773 VanDerWaalsContact O-CG2 3.27Å; F769-V773 WeakPolarHBondContact O-CG2 3.3Å; F769-V773 PolarHBondContact O-N 2.68Å; K770-V773 PolarHBondContact O-N 3.07Å; V773-L775 VanDerWaalsContact C-N 3.35Å; V773-L775 PolarHBondContact O-N 3.33Å; V773-T776 WeakPolarHBondContact CA-OG1 3.33Å; V773-T776 PolarHBondContact O-N 3.23Å; V773-T776 PolarHBondContact O-OG1 2.88Å; V773-D777 VanDerWaalsContact O-CB 3.32Å; V773-D777 WeakPolarHBondContact O-CB 3.42Å; V773-D777 PolarHBondContact O-N 2.79Å; V773-Y858 HydrophobicContact CG1-CE1 4.24Å; V773-L865 HydrophobicContact CG1-CD1 4.46Å; V773-L865 HydrophobicContact CG1-CD2 4.02Å; V773-L865 HydrophobicContact CG2-CD1 4.19Å; V773-L865 HydrophobicContact CG2-CD2 4.2Å; V773-L869 HydrophobicContact CG2-CD1 4.49Å
774	Q	88.9	Confident	86.9	Confident	100 Å²	100	41.6 Å²	41.6	47%	0.467	21%	0.214	S	C	.	.	H	α-helix	trans	-61.3	-42.2	177.4	-176.5	178	-0.2	0	0	112.4	K770 G771 A772 A778	K770-Q774 WeakPolarHBondContact O-CB 3.23Å; K770-Q774 PolarHBondContact O-N 2.97Å; G771-Q774 WeakPolarHBondContact O-CB 2.98Å; G771-Q774 PolarHBondContact O-N 2.87Å; A772-Q774 VanDerWaalsContact C-N 3.34Å; Q774-A778 PolarHBondContact O-N 2.95Å
775	L	88.4	Confident	87.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.6	-43.5	176.7	-71.6	170.2	0	0	0	112.1	M747 G771 A772 V773 A778 N779 I784 F882 V884	M747-L775 HydrophobicContact CB-CD2 4.39Å; M747-L775 HydrophobicContact CG-CD2 3.78Å; G771-L775 WeakPolarHBondContact O-CG 3.33Å; G771-L775 PolarHBondContact O-N 3.46Å; A772-L775 PolarHBondContact O-N 3.34Å; V773-L775 VanDerWaalsContact C-N 3.35Å; V773-L775 PolarHBondContact O-N 3.33Å; L775-A778 PolarHBondContact O-N 3.12Å; L775-N779 PolarHBondContact O-N 3.18Å; L775-I784 HydrophobicContact CB-CD1 3.87Å; L775-I784 HydrophobicContact CD1-CD1 4.06Å; L775-I784 HydrophobicContact CD1-CG1 4.43Å; L775-F882 HydrophobicContact CD1-CB 3.91Å; L775-F882 HydrophobicContact CD1-CD2 4.18Å; L775-F882 HydrophobicContact CD1-CG 3.97Å; L775-F882 HydrophobicContact CD2-CD1 4.26Å; L775-F882 HydrophobicContact CD2-CD2 3.82Å; L775-F882 HydrophobicContact CD2-CE1 4.28Å; L775-F882 HydrophobicContact CD2-CE2 3.86Å; L775-F882 HydrophobicContact CD2-CG 4.04Å; L775-F882 HydrophobicContact CD2-CZ 4.1Å; L775-V884 HydrophobicContact CD1-CG2 3.87Å
776	T	87.1	Confident	87.3	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-78.9	-21.5	-178.5	55.3	0	0	0	0	114.7	A772 V773 N779 I784 R868 L869 C872	A772-T776 WeakPolarHBondContact O-CG2 3.04Å; A772-T776 PolarHBondContact O-N 3.02Å; A772-T776 PolarHBondContact O-OG1 2.86Å; V773-T776 WeakPolarHBondContact CA-OG1 3.33Å; V773-T776 PolarHBondContact O-N 3.23Å; V773-T776 PolarHBondContact O-OG1 2.88Å; T776-N779 WeakPolarHBondContact CA-O 3.44Å; T776-N779 CarbonylContact O-C 3.58Å; T776-I784 HydrophobicContact CG2-CD1 3.74Å; T776-R868 PolarHBondContact O-NH1 2.86Å; T776-L869 HydrophobicContact CG2-CD2 3.93Å; T776-C872 HydrophobicContact CG2-CB 4.07Å
777	D	88.1	Confident	87.3	Confident	78 Å²	78	37 Å²	37	42%	0.417	19%	0.185	S	C	.	.	H	α-helix	trans	-75.3	-27.9	168.7	-83.6	-12.7	0	0	0	110.8	V773 R861 R868	V773-D777 VanDerWaalsContact O-CB 3.32Å; V773-D777 WeakPolarHBondContact O-CB 3.42Å; V773-D777 PolarHBondContact O-N 2.79Å; D777-R861 IonicContact OD1-NH2 2.69Å; D777-R861 PolarHBondContact OD1-NH2 3.46Å; D777-R861 VanDerWaalsContact OD1-NH2 3.11Å; D777-R861 IonicContact OD2-CZ 2.6Å; D777-R861 IonicContact OD2-NH2 3.11Å; D777-R861 PolarHBondContact OD2-NH2 3.29Å; D777-R868 IonicContact OD1-CZ 2.77Å; D777-R868 IonicContact OD1-NH1 3.04Å; D777-R868 PolarHBondContact OD1-NH1 3.2Å
778	A	86.9	Confident	86.8	Confident	48 Å²	48	39 Å²	39	40%	0.397	21%	0.205	S	C	.	.	H	α-helix	trans	-75.8	-46.7	174.1	0	0	0	0	0	112.7	K748 Q774 L775	K748-A778 WeakPolarHBondContact O-CB 3.49Å; Q774-A778 PolarHBondContact O-N 2.95Å; L775-A778 PolarHBondContact O-N 3.12Å
779	N	85	Confident	86.5	Confident	41 Å²	41	40.3 Å²	40.3	22%	0.219	22%	0.22	C	C	.	.			trans	-140.7	121.8	174.8	-176	-0.3	0	0	0	110.7	K749 G750 L775 T776 Q781 C782	K749-N779 WeakPolarHBondContact O-CB 3.5Å; G750-N779 WeakPolarHBondContact O-CB 3.38Å; G750-N779 PolarHBondContact O-ND2 2.86Å; L775-N779 PolarHBondContact O-N 3.18Å; T776-N779 WeakPolarHBondContact CA-O 3.44Å; T776-N779 CarbonylContact O-C 3.58Å; N779-Q781 PolarHBondContact O-N 2.82Å; N779-Q781 PolarHBondContact OD1-N 3.33Å; N779-C782 HydrophobicContact CB-CB 4.32Å; N779-C782 VanDerWaalsContact O-CB 3.29Å; N779-C782 WeakPolarHBondContact O-CB 3.31Å; N779-C782 PolarHBondContact O-N 2.83Å
780	Q	79.6	Confident	85.9	Confident	138 Å²	138	42.2 Å²	42.2	65%	0.645	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-16.2	-179.6	-64.9	-178.5	3	0	0	113.5	C872	Q780-C872 PolarHBondContact O-SG 2.91Å; Q780-C872 VanDerWaalsContact O-SG 3.36Å
781	Q	80.9	Confident	85.2	Confident	170 Å²	170	47.2 Å²	47.2	79%	0.794	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	9.7	177.5	-64.3	-174.4	-18.4	0	0	113	N779 R783	N779-Q781 PolarHBondContact O-N 2.82Å; N779-Q781 PolarHBondContact OD1-N 3.33Å; Q781-R783 PolarHBondContact O-N 3.36Å
782	C	85.6	Confident	84.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.			trans	-61.7	130.3	178.2	-178.3	0	0	0	0	111	G750 N779 C872	G750-C782 VanDerWaalsContact O-CB 3.32Å; G750-C782 WeakPolarHBondContact O-CB 3.28Å; G750-C782 PolarHBondContact O-SG 3.22Å; N779-C782 HydrophobicContact CB-CB 4.32Å; N779-C782 VanDerWaalsContact O-CB 3.29Å; N779-C782 WeakPolarHBondContact O-CB 3.31Å; N779-C782 PolarHBondContact O-N 2.83Å; C782-C872 WeakPolarHBondContact O-CB 3.21Å
783	R	88.4	Confident	83.6	Confident	60 Å²	60	49.8 Å²	49.8	23%	0.226	27%	0.266	C	S	.	.			trans	-94.9	116.8	176.3	-66.9	165.7	-64.1	159	13.1	110	Q781 C872 E874 Q879 D881 F882	Q781-R783 PolarHBondContact O-N 3.36Å; R783-C872 WeakPolarHBondContact CA-O 3.32Å; R783-E874 HydrophobicContact CB-CB 4.23Å; R783-Q879 VanDerWaalsContact CZ-O 3.29Å; R783-Q879 PolarHBondContact NH1-O 2.89Å; R783-Q879 PolarHBondContact NH2-O 2.77Å; R783-D881 WeakPolarHBondContact CB-OD2 3.49Å; R783-D881 IonicContact CZ-OD1 3Å; R783-D881 IonicContact CZ-OD2 2.69Å; R783-D881 PolarHBondContact N-OD2 2.74Å; R783-D881 IonicContact NE-OD1 3.63Å; R783-D881 IonicContact NE-OD2 3.8Å; R783-D881 PolarHBondContact NE-OD2 3.48Å; R783-D881 IonicContact NH2-OD1 3.81Å; R783-D881 PolarHBondContact NH2-OD1 2.94Å; R783-D881 IonicContact NH2-OD2 2.87Å; R783-D881 PolarHBondContact O-N 3.36Å; R783-F882 PolarHBondContact O-N 2.89Å
784	I	89.9	Confident	83	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.5	-174.7	-59.2	176.8	0	0	0	109	A772 L775 T776 F786 C872 A873 E874 F882 V884	A772-I784 HydrophobicContact CB-CD1 4.36Å; L775-I784 HydrophobicContact CB-CD1 3.87Å; L775-I784 HydrophobicContact CD1-CD1 4.06Å; L775-I784 HydrophobicContact CD1-CG1 4.43Å; T776-I784 HydrophobicContact CG2-CD1 3.74Å; I784-F786 HydrophobicContact CB-CE2 4.35Å; I784-F786 HydrophobicContact CG2-CD1 4.37Å; I784-F786 HydrophobicContact CG2-CD2 4.25Å; I784-F786 HydrophobicContact CG2-CE1 4.04Å; I784-F786 HydrophobicContact CG2-CE2 3.92Å; I784-F786 HydrophobicContact CG2-CG 4.49Å; I784-F786 HydrophobicContact CG2-CZ 3.82Å; I784-C872 PolarHBondContact N-O 3.3Å; I784-A873 WeakPolarHBondContact O-CA 3.4Å; I784-E874 PolarHBondContact O-N 3.28Å; I784-F882 WeakPolarHBondContact CA-O 3.23Å; I784-V884 HydrophobicContact CG2-CB 4.18Å; I784-V884 HydrophobicContact CG2-CG2 3.65Å
785	H	91.1	Very high	82.7	Confident	33 Å²	33	45.4 Å²	45.4	15%	0.153	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.5	168	-175	79	0	0	0	109.8	E874 T875 A880 F882 I883 V884	H785-E874 PolarHBondContact ND1-O 3.39Å; H785-T875 PolarHBondContact CE1-O 3.35Å; H785-T875 PolarHBondContact ND1-O 3.32Å; H785-A880 HydrophobicContact CB-CB 3.49Å; H785-A880 VanDerWaalsContact CB-CB 3.49Å; H785-F882 PolarHBondContact N-O 3.42Å; H785-I883 HydrophobicContact CB-CG1 4.08Å; H785-I883 CarbonylContact O-C 3.57Å; H785-I883 WeakPolarHBondContact O-CA 3.48Å; H785-V884 PolarHBondContact O-N 3.35Å
786	F	89.8	Confident	82.5	Confident	5 Å²	5	49 Å²	49	2%	0.022	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123.7	175.7	-69.1	-79.8	0	0	0	110.5	V768 A772 I784 G788 G789 V790 I793 L869 A873 V884	V768-F786 HydrophobicContact CG1-CD1 4.14Å; V768-F786 HydrophobicContact CG1-CE1 4.18Å; A772-F786 HydrophobicContact CB-CE1 3.79Å; A772-F786 HydrophobicContact CB-CZ 3.83Å; I784-F786 HydrophobicContact CB-CE2 4.35Å; I784-F786 HydrophobicContact CG2-CD1 4.37Å; I784-F786 HydrophobicContact CG2-CD2 4.25Å; I784-F786 HydrophobicContact CG2-CE1 4.04Å; I784-F786 HydrophobicContact CG2-CE2 3.92Å; I784-F786 HydrophobicContact CG2-CG 4.49Å; I784-F786 HydrophobicContact CG2-CZ 3.82Å; F786-G788 PolarHBondContact O-N 2.92Å; F786-G788 VanDerWaalsContact O-N 3.14Å; F786-G789 WeakPolarHBondContact O-CA 3.29Å; F786-G789 PolarHBondContact O-N 3.48Å; F786-V790 HydrophobicContact CD2-CG2 4.06Å; F786-I793 HydrophobicContact CB-CD1 4.03Å; F786-I793 HydrophobicContact CD1-CD1 3.16Å; F786-I793 HydrophobicContact CD1-CG1 4.05Å; F786-I793 HydrophobicContact CD2-CD1 3.79Å; F786-I793 HydrophobicContact CE1-CD1 3.33Å; F786-I793 HydrophobicContact CE1-CG1 4.48Å; F786-I793 HydrophobicContact CE2-CD1 3.93Å; F786-I793 HydrophobicContact CG-CD1 3.39Å; F786-I793 HydrophobicContact CG-CG1 4.32Å; F786-I793 HydrophobicContact CZ-CD1 3.7Å; F786-L869 HydrophobicContact CZ-CD2 4.3Å; F786-A873 HydrophobicContact CD2-CB 4.31Å; F786-A873 HydrophobicContact CE2-CB 4.28Å; F786-V884 WeakPolarHBondContact CA-O 3.46Å; F786-V884 HydrophobicContact CD1-CB 4.42Å
787	I	84.8	Confident	82.2	Confident	12 Å²	12	50.5 Å²	50.5	6%	0.062	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	120.1	-179.8	-53.5	176.7	0	0	0	109.6	L761 I883 V884 K889 A890 L893 F895	L761-I787 HydrophobicContact CD2-CD1 4.08Å; I787-I883 HydrophobicContact CD1-CG2 3.92Å; I787-I883 HydrophobicContact CG1-CG2 3.5Å; I787-I883 VanDerWaalsContact CG1-CG2 3.5Å; I787-V884 PolarHBondContact N-O 3.36Å; I787-K889 HydrophobicContact CB-CB 4.36Å; I787-K889 HydrophobicContact CG2-CB 3.76Å; I787-K889 VanDerWaalsContact O-CD 3.29Å; I787-K889 WeakPolarHBondContact O-CD 3.33Å; I787-A890 HydrophobicContact CD1-CB 3.86Å; I787-L893 HydrophobicContact CD1-CD1 4.4Å; I787-L893 HydrophobicContact CG2-CD1 3.64Å; I787-F895 HydrophobicContact CD1-CZ 3.78Å
788	G	76.5	Confident	82.1	Confident	48 Å²	48	46.8 Å²	46.8	50%	0.495	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	13.4	-173.4	0	0	0	0	0	114.1	F786 N792	F786-G788 PolarHBondContact O-N 2.92Å; F786-G788 VanDerWaalsContact O-N 3.14Å; G788-N792 WeakPolarHBondContact O-CB 3.34Å; G788-N792 PolarHBondContact O-ND2 3.45Å
789	G	81.3	Confident	81.9	Confident	32 Å²	32	46.1 Å²	46.1	33%	0.33	24%	0.24	S	C	.	.			trans	84.6	158.8	172.2	0	0	0	0	0	116.2	F786 K791 N792	F786-G789 WeakPolarHBondContact O-CA 3.29Å; F786-G789 PolarHBondContact O-N 3.48Å; G789-K791 VanDerWaalsContact C-N 3.34Å; G789-K791 PolarHBondContact O-N 3.49Å; G789-N792 PolarHBondContact O-N 2.93Å; G789-N792 VanDerWaalsContact O-N 3.15Å
790	V	78.1	Confident	81.9	Confident	43 Å²	43	44.4 Å²	44.4	26%	0.261	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-63.6	-36.7	-174.3	-172.5	0	0	0	0	112.8	F786 N792 I793 L795 A873	F786-V790 HydrophobicContact CD2-CG2 4.06Å; V790-N792 PolarHBondContact O-N 3.39Å; V790-I793 PolarHBondContact O-N 3.5Å; V790-L795 HydrophobicContact CG1-CD1 3.61Å; V790-L795 HydrophobicContact CG1-CG 4.47Å; V790-A873 HydrophobicContact CG2-CB 3.29Å
791	K	73.1	Confident	82.1	Confident	176 Å²	176	37.9 Å²	37.9	77%	0.765	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-57.7	-33.3	178.2	-66.3	-176.9	-179	177.6	0	111	G789 I793 G794	G789-K791 VanDerWaalsContact C-N 3.34Å; G789-K791 PolarHBondContact O-N 3.49Å; K791-I793 VanDerWaalsContact C-N 3.32Å; K791-I793 PolarHBondContact O-N 3.29Å; K791-G794 PolarHBondContact O-N 2.92Å
792	N	69.3	Low	82.2	Confident	45 Å²	45	31.4 Å²	31.4	24%	0.241	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-82.7	-5.1	-172.6	-66.7	-3.3	0	0	0	114.3	A144 G788 G789 V790 G794 K889	A144-N792 HydrophobicContact CB-CB 4.42Å; A144-N792 VanDerWaalsContact CB-CG 3.47Å; A144-N792 WeakPolarHBondContact CB-OD1 3.45Å; G788-N792 WeakPolarHBondContact O-CB 3.34Å; G788-N792 PolarHBondContact O-ND2 3.45Å; G789-N792 PolarHBondContact O-N 2.93Å; G789-N792 VanDerWaalsContact O-N 3.15Å; V790-N792 PolarHBondContact O-N 3.39Å; N792-G794 VanDerWaalsContact C-N 3.26Å; N792-K889 PolarHBondContact O-NZ 3.2Å
793	I	73.7	Confident	82.1	Confident	12 Å²	12	33.5 Å²	33.5	6%	0.062	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-77.8	-22.5	165	-53.6	166.7	0	0	0	109.6	F786 V790 K791 L795	F786-I793 HydrophobicContact CB-CD1 4.03Å; F786-I793 HydrophobicContact CD1-CD1 3.16Å; F786-I793 HydrophobicContact CD1-CG1 4.05Å; F786-I793 HydrophobicContact CD2-CD1 3.79Å; F786-I793 HydrophobicContact CE1-CD1 3.33Å; F786-I793 HydrophobicContact CE1-CG1 4.48Å; F786-I793 HydrophobicContact CE2-CD1 3.93Å; F786-I793 HydrophobicContact CG-CD1 3.39Å; F786-I793 HydrophobicContact CG-CG1 4.32Å; F786-I793 HydrophobicContact CZ-CD1 3.7Å; V790-I793 PolarHBondContact O-N 3.5Å; K791-I793 VanDerWaalsContact C-N 3.32Å; K791-I793 PolarHBondContact O-N 3.29Å; I793-L795 HydrophobicContact CB-CD2 4.36Å; I793-L795 HydrophobicContact CB-CG 4.25Å; I793-L795 HydrophobicContact CG2-CD2 3.79Å; I793-L795 HydrophobicContact CG2-CG 4.23Å
794	G	76.5	Confident	81.5	Confident	9 Å²	9	31 Å²	31	9%	0.093	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	36.9	-175.8	0	0	0	0	0	112.6	K791 N792 E796 K797 I798	K791-G794 PolarHBondContact O-N 2.92Å; N792-G794 VanDerWaalsContact C-N 3.26Å; G794-E796 PolarHBondContact O-N 3.43Å; G794-K797 WeakPolarHBondContact O-CA 2.95Å; G794-K797 WeakPolarHBondContact O-CB 3.27Å; G794-K797 PolarHBondContact O-N 2.82Å; G794-I798 PolarHBondContact O-N 3.45Å
795	L	82.8	Confident	81	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-54.1	-35.4	176.2	-64.6	-177.2	0	0	0	112.1	F769 V790 I793 I798 M799 V866 L869 K870	F769-L795 HydrophobicContact CD2-CD2 4.15Å; F769-L795 HydrophobicContact CE2-CD2 3.99Å; V790-L795 HydrophobicContact CG1-CD1 3.61Å; V790-L795 HydrophobicContact CG1-CG 4.47Å; I793-L795 HydrophobicContact CB-CD2 4.36Å; I793-L795 HydrophobicContact CB-CG 4.25Å; I793-L795 HydrophobicContact CG2-CD2 3.79Å; I793-L795 HydrophobicContact CG2-CG 4.23Å; L795-I798 HydrophobicContact CD2-CD1 4.38Å; L795-I798 PolarHBondContact O-N 3.46Å; L795-M799 PolarHBondContact O-N 3.46Å; L795-M799 VanDerWaalsContact O-N 3.07Å; L795-V866 HydrophobicContact CB-CG1 4.07Å; L795-L869 HydrophobicContact CD1-CB 4.18Å; L795-L869 HydrophobicContact CD2-CD1 4.17Å; L795-K870 HydrophobicContact CD1-CG 4.05Å
796	E	83.3	Confident	80.2	Confident	75 Å²	75	33.3 Å²	33.3	35%	0.35	18%	0.184	S	C	.	.	H	α-helix	trans	-64.9	-39.7	175.4	-53.6	-157.6	138.1	0	0	111.9	G794 I798 M799 D800 K818 K870	G794-E796 PolarHBondContact O-N 3.43Å; E796-I798 VanDerWaalsContact C-N 3.35Å; E796-I798 PolarHBondContact O-N 3.29Å; E796-M799 WeakPolarHBondContact O-CB 3.45Å; E796-M799 PolarHBondContact O-N 3.38Å; E796-D800 VanDerWaalsContact O-CG 3.32Å; E796-D800 PolarHBondContact O-N 3.09Å; E796-K818 IonicContact OE1-NZ 2.74Å; E796-K818 PolarHBondContact OE1-NZ 3.4Å; E796-K818 WeakPolarHBondContact OE2-CD 3.31Å; E796-K818 IonicContact OE2-NZ 2.77Å; E796-K870 IonicContact OE1-NZ 2.96Å
797	K	82.3	Confident	78.7	Confident	32 Å²	32	41 Å²	41	14%	0.139	22%	0.219	C	C	.	.	H	α-helix	trans	-67.7	-35.8	176.1	-59.7	-167.4	177.7	-148.8	0	112.1	E146 G794 M799 D800 I801 D819 K851	E146-K797 WeakPolarHBondContact OE2-CE 3.41Å; E146-K797 IonicContact OE2-NZ 3.28Å; E146-K797 PolarHBondContact OE2-NZ 3.47Å; G794-K797 WeakPolarHBondContact O-CA 2.95Å; G794-K797 WeakPolarHBondContact O-CB 3.27Å; G794-K797 PolarHBondContact O-N 2.82Å; K797-M799 VanDerWaalsContact C-N 3.31Å; K797-D800 PolarHBondContact O-N 3.29Å; K797-I801 WeakPolarHBondContact O-CD1 3.36Å; K797-I801 WeakPolarHBondContact O-CG1 3.38Å; K797-I801 PolarHBondContact O-N 2.94Å; K797-D819 WeakPolarHBondContact CE-OD2 3.44Å; K797-D819 IonicContact NZ-OD2 2.77Å; K797-D819 PolarHBondContact NZ-OD2 3.18Å; K797-K851 HydrophobicContact CB-CD 4.16Å
798	I	84.8	Confident	77.1	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-62.6	-41.6	173.8	-64.5	171	0	0	0	110	F769 G794 L795 E796 I801 Y802 K851 I854 V855 I862	F769-I798 HydrophobicContact CD2-CD1 4.11Å; F769-I798 HydrophobicContact CE2-CD1 4.18Å; G794-I798 PolarHBondContact O-N 3.45Å; L795-I798 HydrophobicContact CD2-CD1 4.38Å; L795-I798 PolarHBondContact O-N 3.46Å; E796-I798 VanDerWaalsContact C-N 3.35Å; E796-I798 PolarHBondContact O-N 3.29Å; I798-I801 PolarHBondContact O-N 2.99Å; I798-Y802 WeakPolarHBondContact O-CB 3.33Å; I798-Y802 PolarHBondContact O-N 3.41Å; I798-K851 HydrophobicContact CD1-CG 4.46Å; I798-K851 HydrophobicContact CG1-CB 4.13Å; I798-K851 HydrophobicContact CG1-CD 4.27Å; I798-K851 HydrophobicContact CG1-CG 3.91Å; I798-I854 HydrophobicContact CD1-CD1 3.87Å; I798-I854 HydrophobicContact CD1-CG2 4.47Å; I798-I854 HydrophobicContact CG2-CG2 4.21Å; I798-V855 HydrophobicContact CG2-CG2 3.82Å; I798-I862 HydrophobicContact CG2-CD1 4.15Å; I798-I862 HydrophobicContact CG2-CG2 3.94Å
799	M	84.1	Confident	76	Confident	33 Å²	33	43 Å²	43	16%	0.163	24%	0.243	C	C	.	.	H	α-helix	trans	-64	-43	173.3	-71.6	-60	-60.4	0	0	112.4	L795 E796 K797 I801 Y802 H803 I862 P863 V866	L795-M799 PolarHBondContact O-N 3.46Å; L795-M799 VanDerWaalsContact O-N 3.07Å; E796-M799 WeakPolarHBondContact O-CB 3.45Å; E796-M799 PolarHBondContact O-N 3.38Å; K797-M799 VanDerWaalsContact C-N 3.31Å; M799-I801 VanDerWaalsContact C-N 3.34Å; M799-I801 PolarHBondContact O-N 3.33Å; M799-Y802 WeakPolarHBondContact O-CB 3.01Å; M799-Y802 PolarHBondContact O-N 3.46Å; M799-H803 PolarHBondContact O-CD2 2.87Å; M799-H803 PolarHBondContact O-N 3.43Å; M799-I862 HydrophobicContact SD-CG2 3.8Å; M799-P863 HydrophobicContact CE-CB 4.06Å; M799-P863 HydrophobicContact CE-CG 4.18Å; M799-V866 HydrophobicContact CG-CB 4.1Å; M799-V866 HydrophobicContact CG-CG1 3.77Å; M799-V866 HydrophobicContact CG-CG2 3.97Å; M799-V866 HydrophobicContact SD-CB 3.85Å; M799-V866 HydrophobicContact SD-CG1 4.15Å; M799-V866 HydrophobicContact SD-CG2 3.79Å
800	D	83.5	Confident	74.8	Confident	6 Å²	6	48.7 Å²	48.7	3%	0.032	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-40.7	177.9	-71.4	-10.9	0	0	0	111.7	E796 K797 H803 L804 I817 K818 D819 I822	E796-D800 VanDerWaalsContact O-CG 3.32Å; E796-D800 PolarHBondContact O-N 3.09Å; K797-D800 PolarHBondContact O-N 3.29Å; D800-H803 PolarHBondContact O-N 3.02Å; D800-L804 PolarHBondContact O-N 3.49Å; D800-I817 HydrophobicContact CB-CG1 4.41Å; D800-I817 HydrophobicContact CB-CG2 4.09Å; D800-I817 WeakPolarHBondContact OD1-CA 3.34Å; D800-K818 PolarHBondContact OD1-N 3.2Å; D800-K818 PolarHBondContact OD2-N 3.21Å; D800-D819 WeakPolarHBondContact OD2-CB 3.38Å; D800-D819 PolarHBondContact OD2-N 3.4Å; D800-I822 HydrophobicContact CB-CD1 3.85Å; D800-I822 HydrophobicContact CB-CG2 4.24Å
801	I	83.6	Confident	73.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-67.3	-38.2	174.4	-64.3	165.1	0	0	0	111.1	K797 I798 M799 L804 M805 I822 F836 K851 L852 V855	K797-I801 WeakPolarHBondContact O-CD1 3.36Å; K797-I801 WeakPolarHBondContact O-CG1 3.38Å; K797-I801 PolarHBondContact O-N 2.94Å; I798-I801 PolarHBondContact O-N 2.99Å; M799-I801 VanDerWaalsContact C-N 3.34Å; M799-I801 PolarHBondContact O-N 3.33Å; I801-L804 WeakPolarHBondContact O-CB 3.24Å; I801-L804 PolarHBondContact O-N 2.83Å; I801-M805 PolarHBondContact O-N 3.33Å; I801-M805 VanDerWaalsContact O-N 3.13Å; I801-I822 HydrophobicContact CG1-CD1 4.09Å; I801-F836 HydrophobicContact CD1-CE1 4Å; I801-F836 HydrophobicContact CD1-CZ 4.18Å; I801-F836 HydrophobicContact CG1-CE1 3.75Å; I801-F836 HydrophobicContact CG1-CZ 4.04Å; I801-F836 HydrophobicContact CG2-CE1 4.29Å; I801-K851 HydrophobicContact CD1-CB 3.75Å; I801-L852 HydrophobicContact CG2-CD1 4Å; I801-V855 HydrophobicContact CB-CG2 4.12Å; I801-V855 HydrophobicContact CG2-CB 4.2Å; I801-V855 HydrophobicContact CG2-CG1 4.34Å; I801-V855 HydrophobicContact CG2-CG2 3.87Å
802	Y	84.3	Confident	72.9	Confident	35 Å²	35	50.8 Å²	50.8	14%	0.137	28%	0.282	C	S	.	.	H	α-helix	trans	-63	-42.2	173.2	173.6	-100.8	0	0	0	111.8	I798 M799 L804 M805 T806 V855 R859 I862 P863	I798-Y802 WeakPolarHBondContact O-CB 3.33Å; I798-Y802 PolarHBondContact O-N 3.41Å; M799-Y802 WeakPolarHBondContact O-CB 3.01Å; M799-Y802 PolarHBondContact O-N 3.46Å; Y802-L804 VanDerWaalsContact C-N 3.26Å; Y802-L804 PolarHBondContact O-N 2.85Å; Y802-M805 HydrophobicContact CD2-CE 3.95Å; Y802-M805 HydrophobicContact CE2-CE 4.1Å; Y802-M805 PolarHBondContact O-N 2.76Å; Y802-T806 HydrophobicContact CD1-CG2 4.38Å; Y802-T806 HydrophobicContact CD2-CG2 4.42Å; Y802-T806 HydrophobicContact CE1-CG2 3.83Å; Y802-T806 HydrophobicContact CE2-CG2 3.86Å; Y802-T806 PolarHBondContact O-N 2.64Å; Y802-V855 HydrophobicContact CD2-CG1 4.33Å; Y802-R859 WeakPolarHBondContact CE2-O 3.19Å; Y802-I862 HydrophobicContact CD2-CB 4.12Å; Y802-I862 HydrophobicContact CD2-CG1 4.43Å; Y802-I862 HydrophobicContact CD2-CG2 4.46Å; Y802-I862 HydrophobicContact CG-CB 4.3Å; Y802-I862 HydrophobicContact CG-CG2 4.17Å; Y802-P863 HydrophobicContact CD1-CG 4.04Å; Y802-P863 HydrophobicContact CE1-CG 3.51Å
803	H	82.4	Confident	72.5	Confident	44 Å²	44	50.9 Å²	50.9	20%	0.204	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-32.8	175	-70.7	-47.1	0	0	0	112.6	M799 D800 T806 I817	M799-H803 PolarHBondContact O-CD2 2.87Å; M799-H803 PolarHBondContact O-N 3.43Å; D800-H803 PolarHBondContact O-N 3.02Å; H803-T806 PolarHBondContact O-OG1 2.99Å; H803-I817 HydrophobicContact CB-CG1 4.34Å
804	L	77.3	Confident	71.7	Confident	7 Å²	7	54.9 Å²	54.9	4%	0.037	30%	0.295	C	S	.	.	H	α-helix	trans	-64.2	-37.8	170.1	-83.6	172.6	0	0	0	113.2	D800 I801 Y802 I822 F826 P832 F836	D800-L804 PolarHBondContact O-N 3.49Å; I801-L804 WeakPolarHBondContact O-CB 3.24Å; I801-L804 PolarHBondContact O-N 2.83Å; Y802-L804 VanDerWaalsContact C-N 3.26Å; Y802-L804 PolarHBondContact O-N 2.85Å; L804-I822 HydrophobicContact CD1-CG2 3.32Å; L804-I822 HydrophobicContact CG-CG2 3.91Å; L804-F826 HydrophobicContact CD2-CD2 3.52Å; L804-F826 HydrophobicContact CD2-CE2 3.27Å; L804-F826 HydrophobicContact CD2-CZ 4.22Å; L804-F826 HydrophobicContact CG-CD2 4.45Å; L804-F826 HydrophobicContact CG-CE2 3.92Å; L804-P832 HydrophobicContact CD2-CB 3.58Å; L804-F836 HydrophobicContact CD1-CB 4.22Å; L804-F836 HydrophobicContact CD1-CD1 4.14Å; L804-F836 HydrophobicContact CD1-CD2 4.42Å; L804-F836 HydrophobicContact CD1-CG 4.01Å
805	M	78.1	Confident	70.9	Confident	44 Å²	44	64.7 Å²	64.7	22%	0.217	33%	0.329	C	S	.	.	H	α-helix	trans	-74.7	-28.6	-177.3	-170.7	-177.7	68.5	0	0	113.1	I801 Y802 H807 Y833 V855 R859	I801-M805 PolarHBondContact O-N 3.33Å; I801-M805 VanDerWaalsContact O-N 3.13Å; Y802-M805 HydrophobicContact CD2-CE 3.95Å; Y802-M805 HydrophobicContact CE2-CE 4.1Å; Y802-M805 PolarHBondContact O-N 2.76Å; M805-H807 PolarHBondContact O-N 2.84Å; M805-Y833 HydrophobicContact CB-CD2 3.9Å; M805-Y833 HydrophobicContact CB-CE2 3.97Å; M805-Y833 HydrophobicContact CG-CD2 4.25Å; M805-Y833 HydrophobicContact CG-CE2 4.05Å; M805-V855 HydrophobicContact CE-CG1 3.88Å; M805-V855 HydrophobicContact SD-CG1 3.89Å; M805-R859 HydrophobicContact CE-CB 4.34Å; M805-R859 HydrophobicContact CE-CG 4.4Å
806	T	73.9	Confident	69.9	Low	38 Å²	38	66.7 Å²	66.7	23%	0.233	35%	0.346	C	S	.	.	S	Bend	trans	-81.1	114.2	-174.8	57.2	0	0	0	0	113.5	Y802 H803 G808 K813	Y802-T806 HydrophobicContact CD1-CG2 4.38Å; Y802-T806 HydrophobicContact CD2-CG2 4.42Å; Y802-T806 HydrophobicContact CE1-CG2 3.83Å; Y802-T806 HydrophobicContact CE2-CG2 3.86Å; Y802-T806 PolarHBondContact O-N 2.64Å; H803-T806 PolarHBondContact O-OG1 2.99Å; T806-G808 PolarHBondContact O-N 3.41Å; T806-K813 PolarHBondContact O-NZ 2.93Å; T806-K813 PolarHBondContact OG1-NZ 3.49Å
807	H	58.5	Low	69.2	Low	166 Å²	166	63.3 Å²	63.3	77%	0.769	33%	0.33	S	S	*	.			trans	-72.2	106.7	175.5	-60.4	-67	0	0	0	111.8	M805	M805-H807 PolarHBondContact O-N 2.84Å
808	G	52.5	Low	68.5	Low	44 Å²	44	68.1 Å²	68.1	45%	0.454	35%	0.351	S	S	.	.	S	Bend	trans	166.5	139.8	169.4	0	0	0	0	0	113.9	T806 K813	T806-G808 PolarHBondContact O-N 3.41Å; G808-K813 WeakPolarHBondContact O-CD 3.4Å; G808-K813 WeakPolarHBondContact O-CE 3.37Å; G808-K813 PolarHBondContact O-NZ 3.28Å
809	G	52.1	Low	67.9	Low	58 Å²	58	68.4 Å²	68.4	60%	0.598	35%	0.353	S	S	*	.			trans	46.9	84.1	170.4	0	0	0	0	0	117.1	E811	G809-E811 PolarHBondContact O-N 3.24Å
810	Q	56.3	Low	67.1	Low	152 Å²	152	69.6 Å²	69.6	71%	0.71	36%	0.362	S	S	*	.	H	α-helix	trans	-66.4	-24.7	-167.1	-74.1	-176.4	-25.4	0	0	116.5	R814	Q810-R814 PolarHBondContact O-N 3.07Å
811	E	55.5	Low	66.6	Low	161 Å²	161	70.1 Å²	70.1	75%	0.752	37%	0.365	S	S	*	.	H	α-helix	trans	-91.2	-39.8	-166.6	-132.1	159.3	-167.1	0	0	113.8	G809 K813	G809-E811 PolarHBondContact O-N 3.24Å; E811-K813 VanDerWaalsContact C-N 3.34Å
812	S	56.4	Low	66.1	Low	101 Å²	101	70.1 Å²	70.1	71%	0.706	37%	0.365	S	S	*	.	H	α-helix	trans	-69.5	-32.2	174.8	-45.8	0	0	0	0	112.1	R815	S812-R815 PolarHBondContact O-N 3.2Å
813	K	60.4	Low	65.5	Low	48 Å²	48	74.6 Å²	74.6	21%	0.209	38%	0.382	C	S	.	.	H	α-helix	trans	-76.5	-31.8	179.7	-68.3	-172.4	-177.3	177	0	113.7	T806 G808 E811 R815 A816 I817	T806-K813 PolarHBondContact O-NZ 2.93Å; T806-K813 PolarHBondContact OG1-NZ 3.49Å; G808-K813 WeakPolarHBondContact O-CD 3.4Å; G808-K813 WeakPolarHBondContact O-CE 3.37Å; G808-K813 PolarHBondContact O-NZ 3.28Å; E811-K813 VanDerWaalsContact C-N 3.34Å; K813-R815 PolarHBondContact O-N 3.29Å; K813-A816 WeakPolarHBondContact O-CB 3.42Å; K813-A816 PolarHBondContact O-N 3.35Å; K813-I817 PolarHBondContact O-N 3.14Å
814	R	57.1	Low	65	Low	96 Å²	96	75.1 Å²	75.1	36%	0.362	39%	0.388	S	S	.	.	H	α-helix	trans	-59.3	-29.9	171.7	-97.4	-176.2	177.3	179.8	0.3	113.1	Q810 F826	Q810-R814 PolarHBondContact O-N 3.07Å; R814-F826 HydrophobicContact CG-CB 3.94Å; R814-F826 HydrophobicContact CG-CD1 3.71Å; R814-F826 HydrophobicContact CG-CE1 4.43Å; R814-F826 HydrophobicContact CG-CG 3.88Å; R814-F826 PolarHBondContact NH2-O 3.35Å
815	R	59.4	Low	64.8	Low	215 Å²	215	75 Å²	75	81%	0.811	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.3	176.2	-64.9	-176.7	-177.4	179.7	1.2	113	S812 K813	S812-R815 PolarHBondContact O-N 3.2Å; K813-R815 PolarHBondContact O-N 3.29Å
816	A	62.9	Low	64.2	Low	45 Å²	45	74 Å²	74	37%	0.372	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-24	-179.6	0	0	0	0	0	113.3	K813 K818	K813-A816 WeakPolarHBondContact O-CB 3.42Å; K813-A816 PolarHBondContact O-N 3.35Å; A816-K818 PolarHBondContact O-N 3.07Å
817	I	68.3	Low	63.4	Low	4 Å²	4	76.3 Å²	76.3	2%	0.021	40%	0.4	C	S	.	.			trans	-78.1	121.4	179.3	-66.7	169.9	0	0	0	110.2	D800 H803 K813 I822 R823 F826	D800-I817 HydrophobicContact CB-CG1 4.41Å; D800-I817 HydrophobicContact CB-CG2 4.09Å; D800-I817 WeakPolarHBondContact OD1-CA 3.34Å; H803-I817 HydrophobicContact CB-CG1 4.34Å; K813-I817 PolarHBondContact O-N 3.14Å; I817-I822 HydrophobicContact CG2-CB 4.09Å; I817-I822 HydrophobicContact CG2-CG2 4.05Å; I817-R823 HydrophobicContact CG2-CB 4.08Å; I817-F826 HydrophobicContact CD1-CD2 3.49Å; I817-F826 VanDerWaalsContact CD1-CD2 3.49Å; I817-F826 HydrophobicContact CD1-CE2 3.08Å; I817-F826 HydrophobicContact CD1-CZ 3.99Å
818	K	67.9	Low	63.5	Low	132 Å²	132	70.9 Å²	70.9	57%	0.574	38%	0.381	S	S	*	.			trans	-87.3	-37.3	-178.5	-63.5	-175.4	-178.2	-173.3	0	112.1	E796 D800 A816 P820	E796-K818 IonicContact OE1-NZ 2.74Å; E796-K818 PolarHBondContact OE1-NZ 3.4Å; E796-K818 WeakPolarHBondContact OE2-CD 3.31Å; E796-K818 IonicContact OE2-NZ 2.77Å; D800-K818 PolarHBondContact OD1-N 3.2Å; D800-K818 PolarHBondContact OD2-N 3.21Å; A816-K818 PolarHBondContact O-N 3.07Å; K818-P820 VanDerWaalsContact O-CD 3.31Å; K818-P820 WeakPolarHBondContact O-CD 3.49Å
819	D	71	Confident	63.7	Low	8 Å²	8	79.5 Å²	79.5	4%	0.043	41%	0.406	C	S	.	.			trans	-69.4	118.1	-177.1	-174.9	-52	0	0	0	111	E146 K797 D800 L821 I822 R823	E146-D819 VanDerWaalsContact OE2-CG 3.29Å; K797-D819 WeakPolarHBondContact CE-OD2 3.44Å; K797-D819 IonicContact NZ-OD2 2.77Å; K797-D819 PolarHBondContact NZ-OD2 3.18Å; D800-D819 WeakPolarHBondContact OD2-CB 3.38Å; D800-D819 PolarHBondContact OD2-N 3.4Å; D819-L821 VanDerWaalsContact C-N 3.27Å; D819-L821 PolarHBondContact O-N 2.97Å; D819-L821 WeakPolarHBondContact OD1-CA 3.46Å; D819-L821 VanDerWaalsContact OD1-CB 3.27Å; D819-L821 WeakPolarHBondContact OD1-CB 3.38Å; D819-L821 PolarHBondContact OD1-N 3.12Å; D819-I822 HydrophobicContact CB-CB 4.03Å; D819-I822 HydrophobicContact CB-CD1 3.83Å; D819-I822 HydrophobicContact CB-CG1 3.88Å; D819-I822 PolarHBondContact O-N 3.36Å; D819-I822 PolarHBondContact OD1-N 2.93Å; D819-R823 WeakPolarHBondContact O-CB 3.36Å; D819-R823 PolarHBondContact O-N 2.95Å
820	P	67.5	Low	64.2	Low	57 Å²	57	85.2 Å²	85.2	37%	0.37	41%	0.409	S	S	.	.	H	α-helix	trans	-61.9	-32.7	-178	-23.7	34.4	0	0	0	113.5	L148 K818 T824	L148-P820 HydrophobicContact CD1-CG 3.79Å; K818-P820 VanDerWaalsContact O-CD 3.31Å; K818-P820 WeakPolarHBondContact O-CD 3.49Å; P820-T824 VanDerWaalsContact O-CG2 3.32Å; P820-T824 WeakPolarHBondContact O-CG2 3.45Å; P820-T824 PolarHBondContact O-N 3.31Å
821	L	73.1	Confident	65	Low	17 Å²	17	80.6 Å²	80.6	9%	0.089	39%	0.389	C	S	.	.	H	α-helix	trans	-71.6	-48	179.7	176.9	145	0	0	0	109.9	K532 F534 D819 R823 T824 F825 Y839	K532-L821 HydrophobicContact CD-CD1 4.29Å; F534-L821 HydrophobicContact CB-CD1 3.68Å; F534-L821 HydrophobicContact CD2-CD1 4.45Å; F534-L821 HydrophobicContact CG-CD1 3.99Å; F534-L821 HydrophobicContact CG-CG 4.45Å; D819-L821 VanDerWaalsContact C-N 3.27Å; D819-L821 PolarHBondContact O-N 2.97Å; D819-L821 WeakPolarHBondContact OD1-CA 3.46Å; D819-L821 VanDerWaalsContact OD1-CB 3.27Å; D819-L821 WeakPolarHBondContact OD1-CB 3.38Å; D819-L821 PolarHBondContact OD1-N 3.12Å; L821-R823 PolarHBondContact O-N 3.23Å; L821-T824 PolarHBondContact O-N 3.23Å; L821-T824 VanDerWaalsContact O-N 3.09Å; L821-T824 PolarHBondContact O-OG1 3.45Å; L821-F825 HydrophobicContact CD2-CE2 3.74Å; L821-F825 HydrophobicContact CG-CE2 4.19Å; L821-F825 WeakPolarHBondContact O-CD2 3.38Å; L821-F825 WeakPolarHBondContact O-CE2 3.41Å; L821-Y839 HydrophobicContact CD2-CE1 4.41Å
822	I	73.6	Confident	66	Low	1 Å²	1	74 Å²	74	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-60.7	-38.5	177.8	-60.6	-178	0	0	0	110.6	D800 I801 L804 I817 D819 T824 F825 F836	D800-I822 HydrophobicContact CB-CD1 3.85Å; D800-I822 HydrophobicContact CB-CG2 4.24Å; I801-I822 HydrophobicContact CG1-CD1 4.09Å; L804-I822 HydrophobicContact CD1-CG2 3.32Å; L804-I822 HydrophobicContact CG-CG2 3.91Å; I817-I822 HydrophobicContact CG2-CB 4.09Å; I817-I822 HydrophobicContact CG2-CG2 4.05Å; D819-I822 HydrophobicContact CB-CB 4.03Å; D819-I822 HydrophobicContact CB-CD1 3.83Å; D819-I822 HydrophobicContact CB-CG1 3.88Å; D819-I822 PolarHBondContact O-N 3.36Å; D819-I822 PolarHBondContact OD1-N 2.93Å; I822-T824 VanDerWaalsContact C-N 3.26Å; I822-T824 PolarHBondContact O-N 2.96Å; I822-F825 PolarHBondContact O-N 2.77Å; I822-F836 HydrophobicContact CG1-CE2 4.24Å
823	R	71.8	Confident	67.1	Low	129 Å²	129	70.5 Å²	70.5	49%	0.487	33%	0.332	S	S	.	.	H	α-helix	trans	-61.9	-29.3	177.1	-172.6	171.5	171.9	171.5	-3.2	113.6	I817 D819 L821 F825 F826	I817-R823 HydrophobicContact CG2-CB 4.08Å; D819-R823 WeakPolarHBondContact O-CB 3.36Å; D819-R823 PolarHBondContact O-N 2.95Å; L821-R823 PolarHBondContact O-N 3.23Å; R823-F825 VanDerWaalsContact C-N 3.3Å; R823-F825 PolarHBondContact O-N 2.96Å; R823-F826 WeakPolarHBondContact O-CB 3.37Å; R823-F826 PolarHBondContact O-N 3.46Å
824	T	71.8	Confident	68.1	Low	54 Å²	54	72.7 Å²	72.7	33%	0.331	35%	0.345	S	S	.	.	H	α-helix	trans	-67.3	-29.4	178.7	64.8	0	0	0	0	113.4	F534 P820 L821 I822 F826 S827	F534-T824 HydrophobicContact CE1-CG2 4.3Å; F534-T824 WeakPolarHBondContact CE2-OG1 3.36Å; F534-T824 HydrophobicContact CZ-CG2 3.75Å; P820-T824 VanDerWaalsContact O-CG2 3.32Å; P820-T824 WeakPolarHBondContact O-CG2 3.45Å; P820-T824 PolarHBondContact O-N 3.31Å; L821-T824 PolarHBondContact O-N 3.23Å; L821-T824 VanDerWaalsContact O-N 3.09Å; L821-T824 PolarHBondContact O-OG1 3.45Å; I822-T824 VanDerWaalsContact C-N 3.26Å; I822-T824 PolarHBondContact O-N 2.96Å; T824-F826 PolarHBondContact O-N 3.08Å; T824-S827 WeakPolarHBondContact O-CB 3.32Å; T824-S827 PolarHBondContact O-N 2.96Å; T824-S827 VanDerWaalsContact O-N 3.13Å
825	F	73.1	Confident	69.2	Low	5 Å²	5	69 Å²	69	2%	0.022	33%	0.333	C	S	.	.	H	α-helix	trans	-70.9	-20	179.7	-64.6	-78.3	0	0	0	113.1	Y547 L821 I822 R823 S827 S828 T835 F836 Y839	Y547-F825 HydrophobicContact CE2-CE1 4.47Å; L821-F825 HydrophobicContact CD2-CE2 3.74Å; L821-F825 HydrophobicContact CG-CE2 4.19Å; L821-F825 WeakPolarHBondContact O-CD2 3.38Å; L821-F825 WeakPolarHBondContact O-CE2 3.41Å; I822-F825 PolarHBondContact O-N 2.77Å; R823-F825 VanDerWaalsContact C-N 3.3Å; R823-F825 PolarHBondContact O-N 2.96Å; F825-S827 PolarHBondContact O-N 3.07Å; F825-S828 PolarHBondContact O-N 3.05Å; F825-T835 HydrophobicContact CD1-CG2 3.93Å; F825-T835 HydrophobicContact CE1-CG2 4.45Å; F825-F836 AromaticContact CD2-CD2 3.85Å; F825-F836 HydrophobicContact CD2-CD2 3.85Å; F825-F836 AromaticContact CE2-CD2 3.91Å; F825-F836 HydrophobicContact CE2-CD2 3.91Å; F825-F836 HydrophobicContact CE2-CE2 4.39Å; F825-F836 HydrophobicContact CG-CD2 4.36Å; F825-F836 HydrophobicContact CZ-CD2 4.45Å; F825-Y839 HydrophobicContact CE1-CD2 4.26Å; F825-Y839 HydrophobicContact CE1-CG 4.09Å; F825-Y839 HydrophobicContact CZ-CD1 4.04Å; F825-Y839 AromaticContact CZ-CD2 3.73Å; F825-Y839 HydrophobicContact CZ-CD2 3.73Å; F825-Y839 HydrophobicContact CZ-CE2 4.29Å; F825-Y839 AromaticContact CZ-CG 3.59Å; F825-Y839 HydrophobicContact CZ-CG 3.59Å
826	F	64.8	Low	70.4	Confident	22 Å²	22	58.8 Å²	58.8	10%	0.096	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-15.8	171.6	-103	-88.1	0	0	0	113.7	L804 R814 I817 R823 T824	L804-F826 HydrophobicContact CD2-CD2 3.52Å; L804-F826 HydrophobicContact CD2-CE2 3.27Å; L804-F826 HydrophobicContact CD2-CZ 4.22Å; L804-F826 HydrophobicContact CG-CD2 4.45Å; L804-F826 HydrophobicContact CG-CE2 3.92Å; R814-F826 HydrophobicContact CG-CB 3.94Å; R814-F826 HydrophobicContact CG-CD1 3.71Å; R814-F826 HydrophobicContact CG-CE1 4.43Å; R814-F826 HydrophobicContact CG-CG 3.88Å; R814-F826 PolarHBondContact NH2-O 3.35Å; I817-F826 HydrophobicContact CD1-CD2 3.49Å; I817-F826 VanDerWaalsContact CD1-CD2 3.49Å; I817-F826 HydrophobicContact CD1-CE2 3.08Å; I817-F826 HydrophobicContact CD1-CZ 3.99Å; R823-F826 WeakPolarHBondContact O-CB 3.37Å; R823-F826 PolarHBondContact O-N 3.46Å; T824-F826 PolarHBondContact O-N 3.08Å
827	S	58	Low	71.3	Confident	88 Å²	88	59.4 Å²	59.4	62%	0.615	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.7	179.5	-61.9	0	0	0	0	113.7	T824 F825	T824-S827 WeakPolarHBondContact O-CB 3.32Å; T824-S827 PolarHBondContact O-N 2.96Å; T824-S827 VanDerWaalsContact O-N 3.13Å; F825-S827 PolarHBondContact O-N 3.07Å
828	S	60.1	Low	71.9	Confident	52 Å²	52	63.5 Å²	63.5	36%	0.364	31%	0.308	S	S	.	.	S	Bend	trans	-76.3	146.1	179	-166.1	0	0	0	0	111.7	F825 R830	F825-S828 PolarHBondContact O-N 3.05Å; S828-R830 PolarHBondContact O-N 3.01Å
829	K	55.8	Low	72.7	Confident	225 Å²	225	57.4 Å²	57.4	98%	0.978	28%	0.282	S	S	*	.	S	Bend	trans	-70.9	-9.9	178.1	-69.6	-177.3	178.9	-180	0	113.7
830	R	63.1	Low	73.2	Confident	178 Å²	178	57.2 Å²	57.2	67%	0.672	28%	0.281	S	S	*	.	S	Bend	trans	-101.6	171.5	179.5	-69.3	-175.4	-178.9	175.3	0.7	110.8	S828 P832	S828-R830 PolarHBondContact O-N 3.01Å; R830-P832 VanDerWaalsContact O-CD 3.27Å; R830-P832 WeakPolarHBondContact O-CD 3.27Å; R830-P832 VanDerWaalsContact O-N 3.1Å
831	D	74.1	Confident	73.9	Confident	54 Å²	54	56.5 Å²	56.5	29%	0.289	27%	0.273	S	S	.	.			trans	-49.9	116.3	171.3	-173.8	-6.1	0	0	0	110.3	Y833 L834 T835	D831-Y833 PolarHBondContact O-N 3.19Å; D831-Y833 PolarHBondContact OD1-N 3.36Å; D831-Y833 VanDerWaalsContact OD1-N 3.17Å; D831-L834 HydrophobicContact CB-CB 4.13Å; D831-L834 HydrophobicContact CB-CD1 3.92Å; D831-L834 HydrophobicContact CB-CG 4.07Å; D831-L834 PolarHBondContact O-N 2.7Å; D831-T835 PolarHBondContact O-N 2.77Å; D831-T835 VanDerWaalsContact O-N 3.09Å; D831-T835 PolarHBondContact O-OG1 3.34Å
832	P	76	Confident	74.2	Confident	22 Å²	22	58 Å²	58	14%	0.143	28%	0.28	C	S	.	.	H	α-helix	trans	-57.3	-35.6	-178.4	-27.1	36.1	0	0	0	112.8	L804 R830 F836	L804-P832 HydrophobicContact CD2-CB 3.58Å; R830-P832 VanDerWaalsContact O-CD 3.27Å; R830-P832 WeakPolarHBondContact O-CD 3.27Å; R830-P832 VanDerWaalsContact O-N 3.1Å; P832-F836 WeakPolarHBondContact O-CB 3.3Å; P832-F836 PolarHBondContact O-N 3.2Å
833	Y	80.4	Confident	74.4	Confident	28 Å²	28	58.1 Å²	58.1	11%	0.11	28%	0.28	C	S	.	.	H	α-helix	trans	-68.3	-46.6	-179.6	-179.3	-102.2	0	0	0	111.9	M805 D831 T835 F836 K837 L852 E856	M805-Y833 HydrophobicContact CB-CD2 3.9Å; M805-Y833 HydrophobicContact CB-CE2 3.97Å; M805-Y833 HydrophobicContact CG-CD2 4.25Å; M805-Y833 HydrophobicContact CG-CE2 4.05Å; D831-Y833 PolarHBondContact O-N 3.19Å; D831-Y833 PolarHBondContact OD1-N 3.36Å; D831-Y833 VanDerWaalsContact OD1-N 3.17Å; Y833-T835 VanDerWaalsContact C-N 3.34Å; Y833-T835 PolarHBondContact O-N 2.78Å; Y833-F836 PolarHBondContact O-N 3.27Å; Y833-K837 PolarHBondContact O-N 2.74Å; Y833-L852 HydrophobicContact CE2-CD1 3.64Å; Y833-L852 WeakPolarHBondContact OH-CD1 3.48Å; Y833-E856 VanDerWaalsContact OH-CG 3.22Å; Y833-E856 WeakPolarHBondContact OH-CG 3.23Å; Y833-E856 PolarHBondContact OH-OE1 3.33Å
834	L	79.7	Confident	74.7	Confident	94 Å²	94	55.7 Å²	55.7	49%	0.492	28%	0.275	S	S	.	.	H	α-helix	trans	-63.3	-41	177.4	-68.8	176.4	0	0	0	111.7	D831 F836 K837 E838	D831-L834 HydrophobicContact CB-CB 4.13Å; D831-L834 HydrophobicContact CB-CD1 3.92Å; D831-L834 HydrophobicContact CB-CG 4.07Å; D831-L834 PolarHBondContact O-N 2.7Å; L834-F836 VanDerWaalsContact C-N 3.32Å; L834-F836 PolarHBondContact O-N 2.95Å; L834-K837 PolarHBondContact O-N 2.76Å; L834-E838 WeakPolarHBondContact O-CG 3.35Å; L834-E838 PolarHBondContact O-N 3.03Å
835	T	80.9	Confident	75.1	Confident	19 Å²	19	55.5 Å²	55.5	12%	0.117	27%	0.272	C	S	.	.	H	α-helix	trans	-63.7	-39.2	177.6	-49.5	0	0	0	0	111.4	F825 D831 Y833 E838 Y839	F825-T835 HydrophobicContact CD1-CG2 3.93Å; F825-T835 HydrophobicContact CE1-CG2 4.45Å; D831-T835 PolarHBondContact O-N 2.77Å; D831-T835 VanDerWaalsContact O-N 3.09Å; D831-T835 PolarHBondContact O-OG1 3.34Å; Y833-T835 VanDerWaalsContact C-N 3.34Å; Y833-T835 PolarHBondContact O-N 2.78Å; T835-E838 PolarHBondContact O-N 3.17Å; T835-Y839 PolarHBondContact O-N 3.1Å
836	F	83.6	Confident	75.3	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-67.6	-39.9	175.7	-177	-110.6	0	0	0	112.2	I801 L804 I822 F825 P832 Y833 L834 Y839 I840 L848	I801-F836 HydrophobicContact CD1-CE1 4Å; I801-F836 HydrophobicContact CD1-CZ 4.18Å; I801-F836 HydrophobicContact CG1-CE1 3.75Å; I801-F836 HydrophobicContact CG1-CZ 4.04Å; I801-F836 HydrophobicContact CG2-CE1 4.29Å; L804-F836 HydrophobicContact CD1-CB 4.22Å; L804-F836 HydrophobicContact CD1-CD1 4.14Å; L804-F836 HydrophobicContact CD1-CD2 4.42Å; L804-F836 HydrophobicContact CD1-CG 4.01Å; I822-F836 HydrophobicContact CG1-CE2 4.24Å; F825-F836 AromaticContact CD2-CD2 3.85Å; F825-F836 HydrophobicContact CD2-CD2 3.85Å; F825-F836 AromaticContact CE2-CD2 3.91Å; F825-F836 HydrophobicContact CE2-CD2 3.91Å; F825-F836 HydrophobicContact CE2-CE2 4.39Å; F825-F836 HydrophobicContact CG-CD2 4.36Å; F825-F836 HydrophobicContact CZ-CD2 4.45Å; P832-F836 WeakPolarHBondContact O-CB 3.3Å; P832-F836 PolarHBondContact O-N 3.2Å; Y833-F836 PolarHBondContact O-N 3.27Å; L834-F836 VanDerWaalsContact C-N 3.32Å; L834-F836 PolarHBondContact O-N 2.95Å; F836-Y839 WeakPolarHBondContact O-CB 3.31Å; F836-Y839 PolarHBondContact O-N 2.89Å; F836-I840 HydrophobicContact CD1-CD1 3.8Å; F836-I840 HydrophobicContact CE1-CD1 3.37Å; F836-I840 HydrophobicContact CE1-CG1 4.25Å; F836-I840 HydrophobicContact CZ-CD1 3.79Å; F836-I840 HydrophobicContact CZ-CG1 4.27Å; F836-I840 WeakPolarHBondContact O-CG1 3.41Å; F836-I840 PolarHBondContact O-N 2.92Å; F836-L848 HydrophobicContact CE2-CD1 4.47Å; F836-L848 HydrophobicContact CZ-CD1 4.36Å; F836-L848 HydrophobicContact CZ-CD2 4.39Å
837	K	83.4	Confident	76.1	Confident	59 Å²	59	67.8 Å²	67.8	26%	0.257	33%	0.326	S	S	.	.	H	α-helix	trans	-62.6	-42.1	173.9	-170	165.4	-172.9	159.1	0	111.8	Y833 L834 Y839 I840 I841 L852 E856	Y833-K837 PolarHBondContact O-N 2.74Å; L834-K837 PolarHBondContact O-N 2.76Å; K837-Y839 VanDerWaalsContact C-N 3.34Å; K837-Y839 PolarHBondContact O-N 2.97Å; K837-I840 PolarHBondContact O-N 3.13Å; K837-I841 HydrophobicContact CG-CD1 4.06Å; K837-I841 WeakPolarHBondContact O-CD1 3.18Å; K837-I841 VanDerWaalsContact O-CG1 3.26Å; K837-I841 WeakPolarHBondContact O-CG1 3.47Å; K837-I841 PolarHBondContact O-N 3.03Å; K837-I841 VanDerWaalsContact O-N 3.09Å; K837-L852 HydrophobicContact CD-CD2 4.3Å; K837-L852 HydrophobicContact CG-CD2 4.04Å; K837-E856 IonicContact NZ-OE1 3.28Å; K837-E856 PolarHBondContact NZ-OE1 2.85Å; K837-E856 IonicContact NZ-OE2 3.55Å
838	E	80.9	Confident	77.4	Confident	89 Å²	89	64.2 Å²	64.2	42%	0.416	30%	0.3	S	S	.	.	H	α-helix	trans	-59.9	-42.7	172.2	-74.3	175.4	-176.4	0	0	111.8	L834 T835 I841 Q842	L834-E838 WeakPolarHBondContact O-CG 3.35Å; L834-E838 PolarHBondContact O-N 3.03Å; T835-E838 PolarHBondContact O-N 3.17Å; E838-I841 PolarHBondContact O-N 2.87Å; E838-Q842 WeakPolarHBondContact O-CB 3.48Å; E838-Q842 VanDerWaalsContact O-CG 3.26Å; E838-Q842 WeakPolarHBondContact O-CG 3.35Å; E838-Q842 PolarHBondContact O-N 3.42Å
839	Y	83.2	Confident	78.5	Confident	5 Å²	5	65.2 Å²	65.2	2%	0.02	30%	0.302	C	S	.	.	H	α-helix	trans	-60.2	-47.1	175.7	170.4	-93	0	0	0	112.5	Y547 L821 F825 T835 F836 K837 I841 Q842 T843 L848	Y547-Y839 AromaticContact CD1-CD2 3.54Å; Y547-Y839 HydrophobicContact CD1-CD2 3.54Å; Y547-Y839 AromaticContact CD1-CE2 3.62Å; Y547-Y839 HydrophobicContact CD1-CE2 3.62Å; Y547-Y839 AromaticContact CD2-CD2 3.87Å; Y547-Y839 HydrophobicContact CD2-CD2 3.87Å; Y547-Y839 AromaticContact CE1-CD2 3.84Å; Y547-Y839 HydrophobicContact CE1-CD2 3.84Å; Y547-Y839 HydrophobicContact CE1-CE2 4Å; Y547-Y839 HydrophobicContact CE2-CD2 4.14Å; Y547-Y839 AromaticContact CG-CD2 3.55Å; Y547-Y839 HydrophobicContact CG-CD2 3.55Å; Y547-Y839 HydrophobicContact CG-CE2 4.03Å; L821-Y839 HydrophobicContact CD2-CE1 4.41Å; F825-Y839 HydrophobicContact CE1-CD2 4.26Å; F825-Y839 HydrophobicContact CE1-CG 4.09Å; F825-Y839 HydrophobicContact CZ-CD1 4.04Å; F825-Y839 AromaticContact CZ-CD2 3.73Å; F825-Y839 HydrophobicContact CZ-CD2 3.73Å; F825-Y839 HydrophobicContact CZ-CE2 4.29Å; F825-Y839 AromaticContact CZ-CG 3.59Å; F825-Y839 HydrophobicContact CZ-CG 3.59Å; T835-Y839 PolarHBondContact O-N 3.1Å; F836-Y839 WeakPolarHBondContact O-CB 3.31Å; F836-Y839 PolarHBondContact O-N 2.89Å; K837-Y839 VanDerWaalsContact C-N 3.34Å; K837-Y839 PolarHBondContact O-N 2.97Å; Y839-I841 VanDerWaalsContact C-N 3.32Å; Y839-I841 PolarHBondContact O-N 3.41Å; Y839-Q842 PolarHBondContact O-N 3.3Å; Y839-T843 HydrophobicContact CD2-CG2 3.9Å; Y839-T843 HydrophobicContact CE1-CG2 4.26Å; Y839-T843 HydrophobicContact CE2-CG2 3.52Å; Y839-T843 HydrophobicContact CG-CG2 4.42Å; Y839-T843 WeakPolarHBondContact O-CB 3.28Å; Y839-T843 WeakPolarHBondContact O-CG2 3.39Å; Y839-T843 PolarHBondContact O-N 2.93Å; Y839-T843 PolarHBondContact O-OG1 2.96Å; Y839-L848 HydrophobicContact CE1-CD1 3.96Å
840	I	83.1	Confident	79.8	Confident	4 Å²	4	55.3 Å²	55.3	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-59.3	-46.2	178.4	-69.1	170	0	0	0	110.4	F836 K837 Q842 T843 E844 D845 L848 D849 L852	F836-I840 HydrophobicContact CD1-CD1 3.8Å; F836-I840 HydrophobicContact CE1-CD1 3.37Å; F836-I840 HydrophobicContact CE1-CG1 4.25Å; F836-I840 HydrophobicContact CZ-CD1 3.79Å; F836-I840 HydrophobicContact CZ-CG1 4.27Å; F836-I840 WeakPolarHBondContact O-CG1 3.41Å; F836-I840 PolarHBondContact O-N 2.92Å; K837-I840 PolarHBondContact O-N 3.13Å; I840-Q842 PolarHBondContact O-N 3.35Å; I840-T843 PolarHBondContact O-N 2.96Å; I840-T843 PolarHBondContact O-OG1 3.2Å; I840-E844 PolarHBondContact O-N 2.95Å; I840-D845 PolarHBondContact O-N 3.18Å; I840-L848 HydrophobicContact CD1-CB 3.9Å; I840-L848 HydrophobicContact CG1-CB 3.84Å; I840-L848 HydrophobicContact CG1-CD1 4.4Å; I840-D849 HydrophobicContact CG2-CB 3.69Å; I840-L852 HydrophobicContact CD1-CB 4.18Å; I840-L852 HydrophobicContact CD1-CD2 3.99Å
841	I	81.7	Confident	80.9	Confident	42 Å²	42	47.1 Å²	47.1	22%	0.215	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-43.5	178.7	-69.1	162.3	0	0	0	111.2	K581 K837 E838 Y839	K581-I841 HydrophobicContact CB-CD1 4.14Å; K581-I841 HydrophobicContact CB-CG1 4.49Å; K581-I841 HydrophobicContact CB-CG2 4.04Å; K581-I841 HydrophobicContact CD-CD1 4.44Å; K837-I841 HydrophobicContact CG-CD1 4.06Å; K837-I841 WeakPolarHBondContact O-CD1 3.18Å; K837-I841 VanDerWaalsContact O-CG1 3.26Å; K837-I841 WeakPolarHBondContact O-CG1 3.47Å; K837-I841 PolarHBondContact O-N 3.03Å; K837-I841 VanDerWaalsContact O-N 3.09Å; E838-I841 PolarHBondContact O-N 2.87Å; Y839-I841 VanDerWaalsContact C-N 3.32Å; Y839-I841 PolarHBondContact O-N 3.41Å
842	Q	79.1	Confident	81.4	Confident	49 Å²	49	44.7 Å²	44.7	23%	0.229	22%	0.22	C	C	.	.	H	α-helix	trans	-72.1	-29	-178.9	-76	177.9	1.1	0	0	113.5	S548 I579 E838 Y839 I840	S548-Q842 WeakPolarHBondContact OG-CB 3.38Å; S548-Q842 WeakPolarHBondContact OG-CG 3.44Å; I579-Q842 WeakPolarHBondContact O-CG 3.38Å; E838-Q842 WeakPolarHBondContact O-CB 3.48Å; E838-Q842 VanDerWaalsContact O-CG 3.26Å; E838-Q842 WeakPolarHBondContact O-CG 3.35Å; E838-Q842 PolarHBondContact O-N 3.42Å; Y839-Q842 PolarHBondContact O-N 3.3Å; I840-Q842 PolarHBondContact O-N 3.35Å
843	T	77.6	Confident	81.9	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.012	23%	0.227	C	C	.	.	H	α-helix	trans	-95.6	-8.5	-178.8	55.8	0	0	0	0	114	P533 K551 Y839 I840 D845	P533-T843 HydrophobicContact CB-CG2 4.23Å; K551-T843 WeakPolarHBondContact CD-O 3.22Å; K551-T843 WeakPolarHBondContact CE-O 3.4Å; K551-T843 PolarHBondContact NZ-O 2.9Å; Y839-T843 HydrophobicContact CD2-CG2 3.9Å; Y839-T843 HydrophobicContact CE1-CG2 4.26Å; Y839-T843 HydrophobicContact CE2-CG2 3.52Å; Y839-T843 HydrophobicContact CG-CG2 4.42Å; Y839-T843 WeakPolarHBondContact O-CB 3.28Å; Y839-T843 WeakPolarHBondContact O-CG2 3.39Å; Y839-T843 PolarHBondContact O-N 2.93Å; Y839-T843 PolarHBondContact O-OG1 2.96Å; I840-T843 PolarHBondContact O-N 2.96Å; I840-T843 PolarHBondContact O-OG1 3.2Å; T843-D845 PolarHBondContact O-N 3.44Å
844	E	77.6	Confident	82.1	Confident	79 Å²	79	44.6 Å²	44.6	37%	0.369	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	39.5	-175	-60.1	-176.6	156.4	0	0	112.1	A578 R584 I840 K846	A578-E844 HydrophobicContact CB-CG 3.84Å; A578-E844 WeakPolarHBondContact CB-OE1 3.47Å; R584-E844 IonicContact CZ-OE1 2.84Å; R584-E844 IonicContact NE-OE1 3.61Å; R584-E844 PolarHBondContact NE-OE1 3.49Å; R584-E844 IonicContact NH2-OE1 3.88Å; R584-E844 PolarHBondContact NH2-OE1 3.09Å; R584-E844 IonicContact NH2-OE2 3.94Å; R584-E844 PolarHBondContact NH2-OE2 3.1Å; I840-E844 PolarHBondContact O-N 2.95Å; E844-K846 PolarHBondContact O-N 3.12Å; E844-K846 VanDerWaalsContact O-N 3.11Å
845	D	80.1	Confident	82.5	Confident	50 Å²	50	40.1 Å²	40.1	27%	0.267	20%	0.2	S	C	.	.			trans	-80.1	94	-179.3	-167.6	-32.9	0	0	0	110.7	I840 T843 E847 L848 D849	I840-D845 PolarHBondContact O-N 3.18Å; T843-D845 PolarHBondContact O-N 3.44Å; D845-E847 PolarHBondContact O-N 3.14Å; D845-E847 WeakPolarHBondContact OD1-CB 3.49Å; D845-E847 PolarHBondContact OD1-N 3.39Å; D845-L848 HydrophobicContact CB-CB 4.2Å; D845-L848 HydrophobicContact CB-CD1 4.22Å; D845-L848 HydrophobicContact CB-CG 4.34Å; D845-L848 PolarHBondContact O-N 3.09Å; D845-L848 PolarHBondContact OD1-N 3.19Å; D845-L848 VanDerWaalsContact OD1-N 3.15Å; D845-L848 WeakPolarHBondContact OD2-CD1 3.21Å; D845-D849 WeakPolarHBondContact O-CB 3.31Å; D845-D849 PolarHBondContact O-N 2.88Å
846	K	78.9	Confident	82.7	Confident	184 Å²	184	42.4 Å²	42.4	80%	0.8	21%	0.209	S	C	*	.	H	α-helix	trans	-59.8	-27.2	179.7	-63.6	-173.8	178.5	-175.7	0	113.5	E844 G850	E844-K846 PolarHBondContact O-N 3.12Å; E844-K846 VanDerWaalsContact O-N 3.11Å; K846-G850 PolarHBondContact O-N 3.47Å; K846-G850 VanDerWaalsContact O-N 3.09Å
847	E	81.5	Confident	82.9	Confident	100 Å²	100	48.5 Å²	48.5	47%	0.467	24%	0.236	S	C	.	.	H	α-helix	trans	-74.4	-46.5	179.7	-168.4	-167.2	150.1	0	0	110.6	D845 G850 K851	D845-E847 PolarHBondContact O-N 3.14Å; D845-E847 WeakPolarHBondContact OD1-CB 3.49Å; D845-E847 PolarHBondContact OD1-N 3.39Å; E847-G850 PolarHBondContact O-N 3.23Å; E847-K851 WeakPolarHBondContact O-CG 3.16Å; E847-K851 PolarHBondContact O-N 3.04Å; E847-K851 VanDerWaalsContact O-N 3.15Å; E847-K851 WeakPolarHBondContact OE1-CE 3.41Å; E847-K851 IonicContact OE1-NZ 2.8Å; E847-K851 PolarHBondContact OE1-NZ 3.41Å
848	L	83.6	Confident	82.9	Confident	14 Å²	14	47.4 Å²	47.4	7%	0.073	23%	0.23	C	C	.	.	H	α-helix	trans	-67.8	-37.5	176.3	-67	179.9	0	0	0	111.8	F836 Y839 I840 D845 K851 L852	F836-L848 HydrophobicContact CE2-CD1 4.47Å; F836-L848 HydrophobicContact CZ-CD1 4.36Å; F836-L848 HydrophobicContact CZ-CD2 4.39Å; Y839-L848 HydrophobicContact CE1-CD1 3.96Å; I840-L848 HydrophobicContact CD1-CB 3.9Å; I840-L848 HydrophobicContact CG1-CB 3.84Å; I840-L848 HydrophobicContact CG1-CD1 4.4Å; D845-L848 HydrophobicContact CB-CB 4.2Å; D845-L848 HydrophobicContact CB-CD1 4.22Å; D845-L848 HydrophobicContact CB-CG 4.34Å; D845-L848 PolarHBondContact O-N 3.09Å; D845-L848 PolarHBondContact OD1-N 3.19Å; D845-L848 VanDerWaalsContact OD1-N 3.15Å; D845-L848 WeakPolarHBondContact OD2-CD1 3.21Å; L848-K851 PolarHBondContact O-N 2.94Å; L848-L852 WeakPolarHBondContact O-CB 3.43Å; L848-L852 PolarHBondContact O-N 3.46Å
849	D	83.9	Confident	83.2	Confident	73 Å²	73	50.9 Å²	50.9	39%	0.39	24%	0.239	S	C	.	.	H	α-helix	trans	-62.1	-42	174.7	-170	63	0	0	0	112.3	I840 D845 K851 L852 S853	I840-D849 HydrophobicContact CG2-CB 3.69Å; D845-D849 WeakPolarHBondContact O-CB 3.31Å; D845-D849 PolarHBondContact O-N 2.88Å; D849-K851 VanDerWaalsContact C-N 3.35Å; D849-K851 PolarHBondContact O-N 3.35Å; D849-L852 WeakPolarHBondContact O-CB 3.39Å; D849-L852 PolarHBondContact O-N 2.93Å; D849-S853 WeakPolarHBondContact O-CB 3.47Å; D849-S853 PolarHBondContact O-N 3.42Å; D849-S853 PolarHBondContact O-OG 3.18Å
850	G	82.6	Confident	83.2	Confident	17 Å²	17	58.7 Å²	58.7	18%	0.175	28%	0.276	C	S	.	.	H	α-helix	trans	-60.4	-41.8	172.8	0	0	0	0	0	112.7	K846 E847 S853 I854	K846-G850 PolarHBondContact O-N 3.47Å; K846-G850 VanDerWaalsContact O-N 3.09Å; E847-G850 PolarHBondContact O-N 3.23Å; G850-S853 WeakPolarHBondContact O-CB 3.47Å; G850-S853 PolarHBondContact O-N 3.49Å; G850-I854 WeakPolarHBondContact O-CG1 3.32Å; G850-I854 PolarHBondContact O-N 3.03Å; G850-I854 VanDerWaalsContact O-N 3.14Å
851	K	86	Confident	83.4	Confident	5 Å²	5	63.2 Å²	63.2	2%	0.022	29%	0.293	C	S	.	.	H	α-helix	trans	-68.9	-38.6	176.2	-69.1	174.5	-171.6	163.1	0	112.4	K797 I798 I801 E847 L848 D849 S853 I854 V855	K797-K851 HydrophobicContact CB-CD 4.16Å; I798-K851 HydrophobicContact CD1-CG 4.46Å; I798-K851 HydrophobicContact CG1-CB 4.13Å; I798-K851 HydrophobicContact CG1-CD 4.27Å; I798-K851 HydrophobicContact CG1-CG 3.91Å; I801-K851 HydrophobicContact CD1-CB 3.75Å; E847-K851 WeakPolarHBondContact O-CG 3.16Å; E847-K851 PolarHBondContact O-N 3.04Å; E847-K851 VanDerWaalsContact O-N 3.15Å; E847-K851 WeakPolarHBondContact OE1-CE 3.41Å; E847-K851 IonicContact OE1-NZ 2.8Å; E847-K851 PolarHBondContact OE1-NZ 3.41Å; L848-K851 PolarHBondContact O-N 2.94Å; D849-K851 VanDerWaalsContact C-N 3.35Å; D849-K851 PolarHBondContact O-N 3.35Å; K851-S853 VanDerWaalsContact C-N 3.31Å; K851-S853 PolarHBondContact O-N 2.89Å; K851-I854 WeakPolarHBondContact O-CB 3.38Å; K851-I854 PolarHBondContact O-N 3.41Å; K851-V855 PolarHBondContact O-N 3.48Å; K851-V855 VanDerWaalsContact O-N 3.12Å
852	L	86.2	Confident	83.7	Confident	4 Å²	4	61.2 Å²	61.2	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-59.7	-45.1	173.7	-174.8	67.8	0	0	0	110.5	I801 Y833 K837 I840 L848 D849 I854 V855 E856	I801-L852 HydrophobicContact CG2-CD1 4Å; Y833-L852 HydrophobicContact CE2-CD1 3.64Å; Y833-L852 WeakPolarHBondContact OH-CD1 3.48Å; K837-L852 HydrophobicContact CD-CD2 4.3Å; K837-L852 HydrophobicContact CG-CD2 4.04Å; I840-L852 HydrophobicContact CD1-CB 4.18Å; I840-L852 HydrophobicContact CD1-CD2 3.99Å; L848-L852 WeakPolarHBondContact O-CB 3.43Å; L848-L852 PolarHBondContact O-N 3.46Å; D849-L852 WeakPolarHBondContact O-CB 3.39Å; D849-L852 PolarHBondContact O-N 2.93Å; L852-I854 VanDerWaalsContact C-N 3.3Å; L852-I854 PolarHBondContact O-N 3.03Å; L852-V855 PolarHBondContact O-N 3.48Å; L852-V855 VanDerWaalsContact O-N 3.11Å; L852-E856 HydrophobicContact CG-CG 4.45Å; L852-E856 WeakPolarHBondContact O-CG 3.43Å; L852-E856 PolarHBondContact O-N 3.48Å
853	S	85.7	Confident	84	Confident	43 Å²	43	61.1 Å²	61.1	30%	0.301	29%	0.287	S	S	.	.	H	α-helix	trans	-60.3	-36.8	176.8	-62.5	0	0	0	0	112.9	D849 G850 K851 K857	D849-S853 WeakPolarHBondContact O-CB 3.47Å; D849-S853 PolarHBondContact O-N 3.42Å; D849-S853 PolarHBondContact O-OG 3.18Å; G850-S853 WeakPolarHBondContact O-CB 3.47Å; G850-S853 PolarHBondContact O-N 3.49Å; K851-S853 VanDerWaalsContact C-N 3.31Å; K851-S853 PolarHBondContact O-N 2.89Å; S853-K857 VanDerWaalsContact O-CB 3.25Å; S853-K857 WeakPolarHBondContact O-CB 3.5Å; S853-K857 PolarHBondContact O-N 3.26Å; S853-K857 VanDerWaalsContact O-N 3.09Å
854	I	85.7	Confident	84.6	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.021	31%	0.309	C	S	.	.	H	α-helix	trans	-61.1	-50.7	172.4	-66	167.9	0	0	0	110.2	L766 F769 I798 G850 K851 L852 E856 K857 Y858 I862	L766-I854 HydrophobicContact CD1-CD1 4.2Å; L766-I854 HydrophobicContact CD1-CG1 3.37Å; F769-I854 HydrophobicContact CB-CD1 3.83Å; F769-I854 HydrophobicContact CD1-CD1 4.23Å; F769-I854 HydrophobicContact CD1-CG1 4.28Å; F769-I854 HydrophobicContact CD1-CG2 3.7Å; F769-I854 HydrophobicContact CD2-CD1 4.33Å; F769-I854 HydrophobicContact CD2-CG2 4.49Å; F769-I854 HydrophobicContact CE1-CG2 3.48Å; F769-I854 VanDerWaalsContact CE1-CG2 3.48Å; F769-I854 HydrophobicContact CE2-CG2 4.31Å; F769-I854 HydrophobicContact CG-CD1 3.87Å; F769-I854 HydrophobicContact CG-CG1 4.43Å; F769-I854 HydrophobicContact CG-CG2 4.21Å; F769-I854 HydrophobicContact CZ-CG2 3.81Å; I798-I854 HydrophobicContact CD1-CD1 3.87Å; I798-I854 HydrophobicContact CD1-CG2 4.47Å; I798-I854 HydrophobicContact CG2-CG2 4.21Å; G850-I854 WeakPolarHBondContact O-CG1 3.32Å; G850-I854 PolarHBondContact O-N 3.03Å; G850-I854 VanDerWaalsContact O-N 3.14Å; K851-I854 WeakPolarHBondContact O-CB 3.38Å; K851-I854 PolarHBondContact O-N 3.41Å; L852-I854 VanDerWaalsContact C-N 3.3Å; L852-I854 PolarHBondContact O-N 3.03Å; I854-E856 PolarHBondContact O-N 3.11Å; I854-K857 PolarHBondContact O-N 2.81Å; I854-Y858 HydrophobicContact CG2-CD2 4.02Å; I854-Y858 WeakPolarHBondContact O-CD2 3.3Å; I854-Y858 PolarHBondContact O-N 2.68Å; I854-I862 HydrophobicContact CG2-CD1 3.81Å
855	V	86.4	Confident	85.1	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-43	-178.4	176.7	0	0	0	0	111.3	I798 I801 Y802 M805 K851 L852 K857 R859	I798-V855 HydrophobicContact CG2-CG2 3.82Å; I801-V855 HydrophobicContact CB-CG2 4.12Å; I801-V855 HydrophobicContact CG2-CB 4.2Å; I801-V855 HydrophobicContact CG2-CG1 4.34Å; I801-V855 HydrophobicContact CG2-CG2 3.87Å; Y802-V855 HydrophobicContact CD2-CG1 4.33Å; M805-V855 HydrophobicContact CE-CG1 3.88Å; M805-V855 HydrophobicContact SD-CG1 3.89Å; K851-V855 PolarHBondContact O-N 3.48Å; K851-V855 VanDerWaalsContact O-N 3.12Å; L852-V855 PolarHBondContact O-N 3.48Å; L852-V855 VanDerWaalsContact O-N 3.11Å; V855-K857 VanDerWaalsContact C-N 3.29Å; V855-K857 PolarHBondContact O-N 3.1Å; V855-R859 WeakPolarHBondContact O-CA 3.32Å; V855-R859 PolarHBondContact O-N 3.2Å
856	E	86.6	Confident	85.4	Confident	67 Å²	67	60 Å²	60	31%	0.313	28%	0.28	S	S	.	.	H	α-helix	trans	-63.4	-33.8	178.2	-73.2	-172.1	161.6	0	0	112.5	Y833 K837 L852 I854 R859	Y833-E856 VanDerWaalsContact OH-CG 3.22Å; Y833-E856 WeakPolarHBondContact OH-CG 3.23Å; Y833-E856 PolarHBondContact OH-OE1 3.33Å; K837-E856 IonicContact NZ-OE1 3.28Å; K837-E856 PolarHBondContact NZ-OE1 2.85Å; K837-E856 IonicContact NZ-OE2 3.55Å; L852-E856 HydrophobicContact CG-CG 4.45Å; L852-E856 WeakPolarHBondContact O-CG 3.43Å; L852-E856 PolarHBondContact O-N 3.48Å; I854-E856 PolarHBondContact O-N 3.11Å; E856-R859 VanDerWaalsContact O-CG 3.31Å; E856-R859 WeakPolarHBondContact O-CG 3.42Å; E856-R859 PolarHBondContact O-NE 3.02Å; E856-R859 VanDerWaalsContact O-NE 3.16Å
857	K	86.7	Confident	85.8	Confident	129 Å²	129	54.3 Å²	54.3	56%	0.561	27%	0.267	S	S	*	.	H	α-helix	trans	-79.2	-47	-178.7	-175.6	177.8	179.9	-175.3	0	113.7	S853 I854 V855	S853-K857 VanDerWaalsContact O-CB 3.25Å; S853-K857 WeakPolarHBondContact O-CB 3.5Å; S853-K857 PolarHBondContact O-N 3.26Å; S853-K857 VanDerWaalsContact O-N 3.09Å; I854-K857 PolarHBondContact O-N 2.81Å; V855-K857 VanDerWaalsContact C-N 3.29Å; V855-K857 PolarHBondContact O-N 3.1Å
858	Y	84.2	Confident	86.1	Confident	36 Å²	36	51.1 Å²	51.1	14%	0.141	25%	0.251	C	S	.	.	H	α-helix	trans	-97.8	-17.5	-172.6	-64.8	-84.4	0	0	0	113.9	F769 V773 I854 E860 R861 L865	F769-Y858 HydrophobicContact CD1-CE2 4.08Å; F769-Y858 AromaticContact CE1-CD2 3.97Å; F769-Y858 HydrophobicContact CE1-CD2 3.97Å; F769-Y858 AromaticContact CE1-CE2 3.91Å; F769-Y858 HydrophobicContact CE1-CE2 3.91Å; V773-Y858 HydrophobicContact CG1-CE1 4.24Å; I854-Y858 HydrophobicContact CG2-CD2 4.02Å; I854-Y858 WeakPolarHBondContact O-CD2 3.3Å; I854-Y858 PolarHBondContact O-N 2.68Å; Y858-E860 PolarHBondContact O-N 3.23Å; Y858-E860 VanDerWaalsContact O-N 3.11Å; Y858-R861 PolarHBondContact O-N 3.45Å; Y858-L865 HydrophobicContact CD1-CD1 3.85Å; Y858-L865 HydrophobicContact CE1-CD1 4.48Å; Y858-L865 HydrophobicContact CG-CD1 4.11Å
859	R	86.3	Confident	86.3	Confident	161 Å²	161	50.5 Å²	50.5	61%	0.608	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	42.5	-110.8	173.3	-56.3	-175.3	-176	-175.6	-1.4	113.6	Y802 M805 V855 E856 R861 I862	Y802-R859 WeakPolarHBondContact CE2-O 3.19Å; M805-R859 HydrophobicContact CE-CB 4.34Å; M805-R859 HydrophobicContact CE-CG 4.4Å; V855-R859 WeakPolarHBondContact O-CA 3.32Å; V855-R859 PolarHBondContact O-N 3.2Å; E856-R859 VanDerWaalsContact O-CG 3.31Å; E856-R859 WeakPolarHBondContact O-CG 3.42Å; E856-R859 PolarHBondContact O-NE 3.02Å; E856-R859 VanDerWaalsContact O-NE 3.16Å; R859-R861 PolarHBondContact O-N 3.39Å; R859-I862 WeakPolarHBondContact O-CB 3.28Å; R859-I862 VanDerWaalsContact O-CG1 3.23Å; R859-I862 WeakPolarHBondContact O-CG1 3.38Å; R859-I862 PolarHBondContact O-N 2.96Å
860	E	84.8	Confident	86.5	Confident	170 Å²	170	51.7 Å²	51.7	79%	0.794	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-65.3	-21.9	-173.8	-62.4	-178.6	175.6	0	0	113.8	Y858 I862 P863	Y858-E860 PolarHBondContact O-N 3.23Å; Y858-E860 VanDerWaalsContact O-N 3.11Å; E860-I862 VanDerWaalsContact C-N 3.28Å; E860-I862 PolarHBondContact O-N 2.98Å; E860-P863 WeakPolarHBondContact O-CD 3.48Å
861	R	86.3	Confident	86.7	Confident	98 Å²	98	55 Å²	55	37%	0.37	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-76.5	-11.3	177.4	-69.5	-179.7	65.5	-164.4	-3.1	113.3	D777 Y858 R859 E864 L865	D777-R861 IonicContact OD1-NH2 2.69Å; D777-R861 PolarHBondContact OD1-NH2 3.46Å; D777-R861 VanDerWaalsContact OD1-NH2 3.11Å; D777-R861 IonicContact OD2-CZ 2.6Å; D777-R861 IonicContact OD2-NH2 3.11Å; D777-R861 PolarHBondContact OD2-NH2 3.29Å; Y858-R861 PolarHBondContact O-N 3.45Å; R859-R861 PolarHBondContact O-N 3.39Å; R861-E864 PolarHBondContact O-N 2.75Å; R861-L865 HydrophobicContact CB-CD1 4.02Å; R861-L865 HydrophobicContact CB-CG 4.26Å; R861-L865 WeakPolarHBondContact O-CB 3.43Å; R861-L865 VanDerWaalsContact O-CG 3.23Å; R861-L865 WeakPolarHBondContact O-CG 3.44Å; R861-L865 PolarHBondContact O-N 3Å
862	I	87.5	Confident	86.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.1	-48.9	-174.1	-68.4	-69.2	0	0	0	113.3	F769 I798 M799 Y802 I854 R859 E860 E864 L865 V866	F769-I862 HydrophobicContact CZ-CD1 4.47Å; I798-I862 HydrophobicContact CG2-CD1 4.15Å; I798-I862 HydrophobicContact CG2-CG2 3.94Å; M799-I862 HydrophobicContact SD-CG2 3.8Å; Y802-I862 HydrophobicContact CD2-CB 4.12Å; Y802-I862 HydrophobicContact CD2-CG1 4.43Å; Y802-I862 HydrophobicContact CD2-CG2 4.46Å; Y802-I862 HydrophobicContact CG-CB 4.3Å; Y802-I862 HydrophobicContact CG-CG2 4.17Å; I854-I862 HydrophobicContact CG2-CD1 3.81Å; R859-I862 WeakPolarHBondContact O-CB 3.28Å; R859-I862 VanDerWaalsContact O-CG1 3.23Å; R859-I862 WeakPolarHBondContact O-CG1 3.38Å; R859-I862 PolarHBondContact O-N 2.96Å; E860-I862 VanDerWaalsContact C-N 3.28Å; E860-I862 PolarHBondContact O-N 2.98Å; I862-E864 VanDerWaalsContact C-N 3.33Å; I862-E864 PolarHBondContact O-N 3.35Å; I862-L865 PolarHBondContact O-N 3.22Å; I862-V866 HydrophobicContact CG2-CG2 4.25Å; I862-V866 WeakPolarHBondContact O-CG2 3.24Å; I862-V866 PolarHBondContact O-N 3.46Å
863	P	86.9	Confident	86.7	Confident	48 Å²	48	56.2 Å²	56.2	31%	0.312	29%	0.286	S	S	.	.	H	α-helix	trans	-60.4	-41.9	-179.7	-24.1	35.5	0	0	0	113.1	M799 Y802 E860 A867	M799-P863 HydrophobicContact CE-CB 4.06Å; M799-P863 HydrophobicContact CE-CG 4.18Å; Y802-P863 HydrophobicContact CD1-CG 4.04Å; Y802-P863 HydrophobicContact CE1-CG 3.51Å; E860-P863 WeakPolarHBondContact O-CD 3.48Å; P863-A867 WeakPolarHBondContact O-CB 3.41Å; P863-A867 PolarHBondContact O-N 3.24Å; P863-A867 VanDerWaalsContact O-N 3.1Å
864	E	89.9	Confident	86.7	Confident	102 Å²	102	57 Å²	57	48%	0.477	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-49.2	177	-173.5	-163.2	170.5	0	0	111	R861 I862 V866 A867 R868	R861-E864 PolarHBondContact O-N 2.75Å; I862-E864 VanDerWaalsContact C-N 3.33Å; I862-E864 PolarHBondContact O-N 3.35Å; E864-V866 PolarHBondContact O-N 2.98Å; E864-A867 PolarHBondContact O-N 3.21Å; E864-R868 WeakPolarHBondContact O-CB 3.37Å; E864-R868 PolarHBondContact O-N 3.24Å; E864-R868 IonicContact OE1-CZ 3.9Å; E864-R868 IonicContact OE1-NH2 3.89Å; E864-R868 PolarHBondContact OE1-NH2 3.4Å
865	L	87.4	Confident	86.6	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-42.1	-179.6	-69	174.7	0	0	0	111.8	F769 V773 Y858 R861 I862 R868 L869	F769-L865 HydrophobicContact CE1-CD1 4.47Å; F769-L865 HydrophobicContact CZ-CB 4.42Å; F769-L865 HydrophobicContact CZ-CD1 4.45Å; V773-L865 HydrophobicContact CG1-CD1 4.46Å; V773-L865 HydrophobicContact CG1-CD2 4.02Å; V773-L865 HydrophobicContact CG2-CD1 4.19Å; V773-L865 HydrophobicContact CG2-CD2 4.2Å; Y858-L865 HydrophobicContact CD1-CD1 3.85Å; Y858-L865 HydrophobicContact CE1-CD1 4.48Å; Y858-L865 HydrophobicContact CG-CD1 4.11Å; R861-L865 HydrophobicContact CB-CD1 4.02Å; R861-L865 HydrophobicContact CB-CG 4.26Å; R861-L865 WeakPolarHBondContact O-CB 3.43Å; R861-L865 VanDerWaalsContact O-CG 3.23Å; R861-L865 WeakPolarHBondContact O-CG 3.44Å; R861-L865 PolarHBondContact O-N 3Å; I862-L865 PolarHBondContact O-N 3.22Å; L865-R868 PolarHBondContact O-N 3.02Å; L865-L869 WeakPolarHBondContact O-CB 3.22Å; L865-L869 WeakPolarHBondContact O-CG 3.44Å; L865-L869 PolarHBondContact O-N 2.74Å
866	V	87.1	Confident	86.5	Confident	5 Å²	5	66 Å²	66	3%	0.03	34%	0.338	C	S	.	.	H	α-helix	trans	-66.2	-41.3	178.6	170.6	0	0	0	0	111.5	L795 M799 I862 E864 R868 K870	L795-V866 HydrophobicContact CB-CG1 4.07Å; M799-V866 HydrophobicContact CG-CB 4.1Å; M799-V866 HydrophobicContact CG-CG1 3.77Å; M799-V866 HydrophobicContact CG-CG2 3.97Å; M799-V866 HydrophobicContact SD-CB 3.85Å; M799-V866 HydrophobicContact SD-CG1 4.15Å; M799-V866 HydrophobicContact SD-CG2 3.79Å; I862-V866 HydrophobicContact CG2-CG2 4.25Å; I862-V866 WeakPolarHBondContact O-CG2 3.24Å; I862-V866 PolarHBondContact O-N 3.46Å; E864-V866 PolarHBondContact O-N 2.98Å; V866-R868 VanDerWaalsContact C-N 3.34Å; V866-K870 HydrophobicContact CG1-CD 4.34Å; V866-K870 WeakPolarHBondContact O-CB 3.49Å; V866-K870 WeakPolarHBondContact O-CG 3.28Å; V866-K870 PolarHBondContact O-N 2.87Å; V866-K870 VanDerWaalsContact O-N 3.1Å
867	A	87.3	Confident	86.2	Confident	64 Å²	64	65.5 Å²	65.5	53%	0.529	34%	0.335	S	S	.	.	H	α-helix	trans	-62.4	-43.7	175.1	0	0	0	0	0	111.2	P863 E864 K870 A871	P863-A867 WeakPolarHBondContact O-CB 3.41Å; P863-A867 PolarHBondContact O-N 3.24Å; P863-A867 VanDerWaalsContact O-N 3.1Å; E864-A867 PolarHBondContact O-N 3.21Å; A867-K870 PolarHBondContact O-N 3.31Å; A867-A871 PolarHBondContact O-N 3.22Å; A867-A871 VanDerWaalsContact O-N 3.08Å
868	R	87.1	Confident	86.1	Confident	34 Å²	34	64.9 Å²	64.9	13%	0.128	33%	0.334	C	S	.	.	H	α-helix	trans	-63.8	-48	178.8	-163.2	-172.4	-57.1	171.7	4.8	112.4	T776 D777 E864 L865 V866 K870 A871 C872	T776-R868 PolarHBondContact O-NH1 2.86Å; D777-R868 IonicContact OD1-CZ 2.77Å; D777-R868 IonicContact OD1-NH1 3.04Å; D777-R868 PolarHBondContact OD1-NH1 3.2Å; E864-R868 WeakPolarHBondContact O-CB 3.37Å; E864-R868 PolarHBondContact O-N 3.24Å; E864-R868 IonicContact OE1-CZ 3.9Å; E864-R868 IonicContact OE1-NH2 3.89Å; E864-R868 PolarHBondContact OE1-NH2 3.4Å; L865-R868 PolarHBondContact O-N 3.02Å; V866-R868 VanDerWaalsContact C-N 3.34Å; R868-K870 VanDerWaalsContact C-N 3.27Å; R868-K870 PolarHBondContact O-N 3.44Å; R868-A871 PolarHBondContact O-N 3.1Å; R868-A871 VanDerWaalsContact O-N 3.09Å; R868-C872 WeakPolarHBondContact O-CB 3.38Å; R868-C872 PolarHBondContact O-N 3.39Å; R868-C872 PolarHBondContact O-SG 3.27Å
869	L	88.1	Confident	86.2	Confident	1 Å²	1	67 Å²	67	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-62.9	-33.6	178.6	-70.5	173	0	0	0	112.4	F769 A772 V773 T776 F786 L795 L865 A873	F769-L869 HydrophobicContact CD2-CD1 3.99Å; F769-L869 HydrophobicContact CE2-CD1 3.57Å; F769-L869 HydrophobicContact CZ-CD1 4.16Å; A772-L869 HydrophobicContact CB-CD2 3.62Å; V773-L869 HydrophobicContact CG2-CD1 4.49Å; T776-L869 HydrophobicContact CG2-CD2 3.93Å; F786-L869 HydrophobicContact CZ-CD2 4.3Å; L795-L869 HydrophobicContact CD1-CB 4.18Å; L795-L869 HydrophobicContact CD2-CD1 4.17Å; L865-L869 WeakPolarHBondContact O-CB 3.22Å; L865-L869 WeakPolarHBondContact O-CG 3.44Å; L865-L869 PolarHBondContact O-N 2.74Å; L869-A873 WeakPolarHBondContact O-CB 3.29Å; L869-A873 PolarHBondContact O-N 3.39Å
870	K	87.1	Confident	86.2	Confident	97 Å²	97	59.3 Å²	59.3	42%	0.422	32%	0.316	S	S	.	.	H	α-helix	trans	-68.6	-37.3	173	-75.9	-179.9	177.1	-171.7	0	112.4	L795 E796 V866 A867 R868	L795-K870 HydrophobicContact CD1-CG 4.05Å; E796-K870 IonicContact OE1-NZ 2.96Å; V866-K870 HydrophobicContact CG1-CD 4.34Å; V866-K870 WeakPolarHBondContact O-CB 3.49Å; V866-K870 WeakPolarHBondContact O-CG 3.28Å; V866-K870 PolarHBondContact O-N 2.87Å; V866-K870 VanDerWaalsContact O-N 3.1Å; A867-K870 PolarHBondContact O-N 3.31Å; R868-K870 VanDerWaalsContact C-N 3.27Å; R868-K870 PolarHBondContact O-N 3.44Å
871	A	86.7	Confident	86.4	Confident	87 Å²	87	51.5 Å²	51.5	72%	0.719	28%	0.28	S	S	*	.	H	α-helix	trans	-72.5	-33.9	177.6	0	0	0	0	0	112.8	A867 R868 A873	A867-A871 PolarHBondContact O-N 3.22Å; A867-A871 VanDerWaalsContact O-N 3.08Å; R868-A871 PolarHBondContact O-N 3.1Å; R868-A871 VanDerWaalsContact O-N 3.09Å; A871-A873 VanDerWaalsContact C-N 3.31Å
872	C	86	Confident	86.6	Confident	9 Å²	9	46.9 Å²	46.9	6%	0.061	26%	0.262	C	S	.	.	S	Bend	trans	-80.3	-10.3	178.1	-64.6	0	0	0	0	113.5	T776 Q780 C782 R783 I784 R868 E874	T776-C872 HydrophobicContact CG2-CB 4.07Å; Q780-C872 PolarHBondContact O-SG 2.91Å; Q780-C872 VanDerWaalsContact O-SG 3.36Å; C782-C872 WeakPolarHBondContact O-CB 3.21Å; R783-C872 WeakPolarHBondContact CA-O 3.32Å; I784-C872 PolarHBondContact N-O 3.3Å; R868-C872 WeakPolarHBondContact O-CB 3.38Å; R868-C872 PolarHBondContact O-N 3.39Å; R868-C872 PolarHBondContact O-SG 3.27Å; C872-E874 PolarHBondContact O-N 2.91Å
873	A	86.8	Confident	86.8	Confident	26 Å²	26	46.9 Å²	46.9	22%	0.215	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-76.2	121.7	-173.5	0	0	0	0	0	111.6	I784 F786 V790 L869 A871	I784-A873 WeakPolarHBondContact O-CA 3.4Å; F786-A873 HydrophobicContact CD2-CB 4.31Å; F786-A873 HydrophobicContact CE2-CB 4.28Å; V790-A873 HydrophobicContact CG2-CB 3.29Å; L869-A873 WeakPolarHBondContact O-CB 3.29Å; L869-A873 PolarHBondContact O-N 3.39Å; A871-A873 VanDerWaalsContact C-N 3.31Å
874	E	86.9	Confident	87.1	Confident	58 Å²	58	44.6 Å²	44.6	27%	0.271	25%	0.247	S	C	.	.			trans	-104.5	137.8	176.3	-174.4	51.4	-104.1	0	0	110.6	R783 I784 H785 C872 D876 Q879 A880	R783-E874 HydrophobicContact CB-CB 4.23Å; I784-E874 PolarHBondContact O-N 3.28Å; H785-E874 PolarHBondContact ND1-O 3.39Å; C872-E874 PolarHBondContact O-N 2.91Å; E874-D876 PolarHBondContact OE1-N 2.94Å; E874-Q879 HydrophobicContact CG-CB 4.32Å; E874-A880 HydrophobicContact CB-CB 4.41Å
875	T	83.1	Confident	87.2	Confident	129 Å²	129	39.9 Å²	39.9	79%	0.791	23%	0.226	S	C	*	.	S	Bend	trans	-83.4	-33.4	179.2	48.5	0	0	0	0	112.4	H785	H785-T875 PolarHBondContact CE1-O 3.35Å; H785-T875 PolarHBondContact ND1-O 3.32Å
876	D	83.4	Confident	87.4	Confident	66 Å²	66	40.3 Å²	40.3	35%	0.353	23%	0.229	S	C	.	.			trans	-83.1	130	179.1	-173.4	1.5	0	0	0	111.6	E874 H878 Q879	E874-D876 PolarHBondContact OE1-N 2.94Å; D876-H878 VanDerWaalsContact C-N 3.35Å; D876-H878 IonicContact OD1-CD2 3.31Å; D876-H878 PolarHBondContact OD1-N 3.38Å; D876-Q879 HydrophobicContact CB-CB 4.28Å; D876-Q879 HydrophobicContact CB-CG 4.32Å; D876-Q879 WeakPolarHBondContact OD2-CG 3.44Å
877	F	81.8	Confident	87.6	Confident	55 Å²	55	40.1 Å²	40.1	24%	0.241	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-40.5	176.3	-175.6	-88	0	0	0	111.8	G756 I883 F895	G756-F877 VanDerWaalsContact CA-O 3.23Å; G756-F877 WeakPolarHBondContact CA-O 3.42Å; G756-F877 VanDerWaalsContact O-CE1 3.23Å; G756-F877 WeakPolarHBondContact O-CE1 3.15Å; F877-I883 HydrophobicContact CD1-CD1 4.19Å; F877-I883 HydrophobicContact CD2-CD1 3.82Å; F877-I883 HydrophobicContact CD2-CG1 3.97Å; F877-I883 HydrophobicContact CD2-CG2 4.49Å; F877-I883 HydrophobicContact CE1-CD1 3.74Å; F877-I883 HydrophobicContact CE2-CB 4.49Å; F877-I883 HydrophobicContact CE2-CD1 3.36Å; F877-I883 HydrophobicContact CE2-CG1 3.84Å; F877-I883 HydrophobicContact CE2-CG2 4.12Å; F877-I883 HydrophobicContact CG-CD1 4.23Å; F877-I883 HydrophobicContact CZ-CD1 3.31Å; F877-I883 HydrophobicContact CZ-CG1 4.3Å; F877-F895 HydrophobicContact CE2-CD1 4.34Å; F877-F895 AromaticContact CE2-CE1 3.75Å; F877-F895 HydrophobicContact CE2-CE1 3.75Å; F877-F895 AromaticContact CZ-CD1 3.97Å; F877-F895 HydrophobicContact CZ-CD1 3.97Å; F877-F895 AromaticContact CZ-CE1 3.84Å; F877-F895 HydrophobicContact CZ-CE1 3.84Å
878	H	84.1	Confident	87.5	Confident	117 Å²	117	38.7 Å²	38.7	54%	0.542	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-23.3	-171.9	-68.1	-74.4	0	0	0	113.3	R755 D876	R755-H878 CarbonylContact C-O 3.14Å; R755-H878 VanDerWaalsContact CB-O 3.23Å; R755-H878 WeakPolarHBondContact CB-O 3.4Å; D876-H878 VanDerWaalsContact C-N 3.35Å; D876-H878 IonicContact OD1-CD2 3.31Å; D876-H878 PolarHBondContact OD1-N 3.38Å
879	Q	85.4	Confident	87.4	Confident	79 Å²	79	38.9 Å²	38.9	37%	0.369	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-14.1	179.3	-65.5	-59.1	-28.8	0	0	114	R783 E874 D876	R783-Q879 VanDerWaalsContact CZ-O 3.29Å; R783-Q879 PolarHBondContact NH1-O 2.89Å; R783-Q879 PolarHBondContact NH2-O 2.77Å; E874-Q879 HydrophobicContact CG-CB 4.32Å; D876-Q879 HydrophobicContact CB-CB 4.28Å; D876-Q879 HydrophobicContact CB-CG 4.32Å; D876-Q879 WeakPolarHBondContact OD2-CG 3.44Å
880	A	86.9	Confident	87.4	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.211	C	C	.	.			trans	-72.4	141.7	-178.5	0	0	0	0	0	112.3	R755 G756 H785 E874	R755-A880 CarbonylContact C-O 3.52Å; R755-A880 WeakPolarHBondContact CA-O 3.41Å; G756-A880 PolarHBondContact N-O 3.3Å; H785-A880 HydrophobicContact CB-CB 3.49Å; H785-A880 VanDerWaalsContact CB-CB 3.49Å; E874-A880 HydrophobicContact CB-CB 4.41Å
881	D	87.9	Confident	87.4	Confident	7 Å²	7	35.7 Å²	35.7	4%	0.037	20%	0.198	C	C	.	.	S	Bend	trans	-74.7	-37.2	175.4	-57.4	-50.9	0	0	0	110.5	S752 R783	S752-D881 WeakPolarHBondContact CB-O 3.29Å; R783-D881 WeakPolarHBondContact CB-OD2 3.49Å; R783-D881 IonicContact CZ-OD1 3Å; R783-D881 IonicContact CZ-OD2 2.69Å; R783-D881 PolarHBondContact N-OD2 2.74Å; R783-D881 IonicContact NE-OD1 3.63Å; R783-D881 IonicContact NE-OD2 3.8Å; R783-D881 PolarHBondContact NE-OD2 3.48Å; R783-D881 IonicContact NH2-OD1 3.81Å; R783-D881 PolarHBondContact NH2-OD1 2.94Å; R783-D881 IonicContact NH2-OD2 2.87Å; R783-D881 PolarHBondContact O-N 3.36Å
882	F	90.9	Very high	87.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	139.7	176.9	-58.9	-86.2	0	0	0	111.5	A746 M747 I758 V760 L775 R783 I784 H785 V884	A746-F882 HydrophobicContact CB-CE1 4.42Å; A746-F882 HydrophobicContact CB-CZ 4.02Å; M747-F882 HydrophobicContact CB-CE1 4.25Å; I758-F882 HydrophobicContact CB-CD1 4.11Å; I758-F882 HydrophobicContact CB-CE1 4.45Å; I758-F882 HydrophobicContact CD1-CE1 4.03Å; I758-F882 HydrophobicContact CG2-CD1 3.82Å; I758-F882 HydrophobicContact CG2-CE1 4.1Å; V760-F882 HydrophobicContact CG2-CD1 4.41Å; L775-F882 HydrophobicContact CD1-CB 3.91Å; L775-F882 HydrophobicContact CD1-CD2 4.18Å; L775-F882 HydrophobicContact CD1-CG 3.97Å; L775-F882 HydrophobicContact CD2-CD1 4.26Å; L775-F882 HydrophobicContact CD2-CD2 3.82Å; L775-F882 HydrophobicContact CD2-CE1 4.28Å; L775-F882 HydrophobicContact CD2-CE2 3.86Å; L775-F882 HydrophobicContact CD2-CG 4.04Å; L775-F882 HydrophobicContact CD2-CZ 4.1Å; R783-F882 PolarHBondContact O-N 2.89Å; I784-F882 WeakPolarHBondContact CA-O 3.23Å; H785-F882 PolarHBondContact N-O 3.42Å; F882-V884 HydrophobicContact CB-CG2 4.41Å
883	I	92.3	Very high	87.1	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	117.7	171.9	-61.2	135.3	0	0	0	108.5	G756 I758 G759 V760 H785 I787 F877 F895	G756-I883 WeakPolarHBondContact O-CD1 3.35Å; I758-I883 PolarHBondContact O-N 2.64Å; G759-I883 CarbonylContact C-O 3.47Å; G759-I883 WeakPolarHBondContact CA-O 3.37Å; V760-I883 PolarHBondContact N-O 3.19Å; H785-I883 HydrophobicContact CB-CG1 4.08Å; H785-I883 CarbonylContact O-C 3.57Å; H785-I883 WeakPolarHBondContact O-CA 3.48Å; I787-I883 HydrophobicContact CD1-CG2 3.92Å; I787-I883 HydrophobicContact CG1-CG2 3.5Å; I787-I883 VanDerWaalsContact CG1-CG2 3.5Å; F877-I883 HydrophobicContact CD1-CD1 4.19Å; F877-I883 HydrophobicContact CD2-CD1 3.82Å; F877-I883 HydrophobicContact CD2-CG1 3.97Å; F877-I883 HydrophobicContact CD2-CG2 4.49Å; F877-I883 HydrophobicContact CE1-CD1 3.74Å; F877-I883 HydrophobicContact CE2-CB 4.49Å; F877-I883 HydrophobicContact CE2-CD1 3.36Å; F877-I883 HydrophobicContact CE2-CG1 3.84Å; F877-I883 HydrophobicContact CE2-CG2 4.12Å; F877-I883 HydrophobicContact CG-CD1 4.23Å; F877-I883 HydrophobicContact CZ-CD1 3.31Å; F877-I883 HydrophobicContact CZ-CG1 4.3Å; I883-F895 HydrophobicContact CB-CE1 4.02Å; I883-F895 HydrophobicContact CD1-CD1 4.1Å; I883-F895 HydrophobicContact CD1-CE1 4.06Å; I883-F895 HydrophobicContact CG2-CE1 3.67Å; I883-F895 HydrophobicContact CG2-CZ 4.19Å
884	V	92.6	Very high	87.3	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	132.2	-174.6	-169	0	0	0	0	110	V760 V768 L775 I784 H785 F786 I787 F882	V760-V884 HydrophobicContact CB-CG1 4.35Å; V760-V884 HydrophobicContact CB-CG2 4.19Å; V760-V884 HydrophobicContact CG2-CG2 4.47Å; V760-V884 WeakPolarHBondContact O-CA 3.38Å; V768-V884 HydrophobicContact CB-CG1 4.41Å; V768-V884 HydrophobicContact CG1-CG1 3.9Å; L775-V884 HydrophobicContact CD1-CG2 3.87Å; I784-V884 HydrophobicContact CG2-CB 4.18Å; I784-V884 HydrophobicContact CG2-CG2 3.65Å; H785-V884 PolarHBondContact O-N 3.35Å; F786-V884 WeakPolarHBondContact CA-O 3.46Å; F786-V884 HydrophobicContact CD1-CB 4.42Å; I787-V884 PolarHBondContact N-O 3.36Å; F882-V884 HydrophobicContact CB-CG2 4.41Å
885	G	91.8	Very high	87.5	Confident	3 Å²	3	37.4 Å²	37.4	3%	0.031	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	177.3	176.3	0	0	0	0	0	114.4	V760 S762 V768	V760-G885 PolarHBondContact O-N 3.43Å; V760-G885 VanDerWaalsContact O-N 3.14Å; S762-G885 PolarHBondContact N-O 2.78Å; V768-G885 VanDerWaalsContact CG2-C 3.41Å
886	T	91.3	Very high	87.8	Confident	10 Å²	10	33.8 Å²	33.8	6%	0.061	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	151.2	175.1	61	0	0	0	0	111	S762 N765 V768 H888 K889 A890	S762-T886 CarbonylContact O-C 3.55Å; S762-T886 WeakPolarHBondContact O-CA 3.43Å; N765-T886 VanDerWaalsContact OD1-CG2 3.28Å; N765-T886 WeakPolarHBondContact OD1-CG2 3.45Å; V768-T886 HydrophobicContact CG2-CG2 3.67Å; T886-H888 PolarHBondContact O-N 3.11Å; T886-K889 PolarHBondContact O-N 3.12Å; T886-A890 PolarHBondContact O-N 3.11Å
887	V	91.4	Very high	88.3	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-54.9	-36.6	176.7	178	0	0	0	0	112.3	L761 S762 K889 A890 K891 F904 L932 V935 A936	L761-V887 HydrophobicContact CB-CG2 4.38Å; S762-V887 PolarHBondContact O-N 3.46Å; V887-K889 VanDerWaalsContact C-N 3.32Å; V887-K889 PolarHBondContact O-N 3.36Å; V887-A890 PolarHBondContact O-N 3.03Å; V887-K891 PolarHBondContact O-N 2.99Å; V887-F904 HydrophobicContact CG2-CE1 3.87Å; V887-F904 HydrophobicContact CG2-CZ 3.54Å; V887-L932 HydrophobicContact CB-CD2 4.11Å; V887-L932 HydrophobicContact CG1-CD2 3.88Å; V887-V935 HydrophobicContact CG1-CB 3.77Å; V887-V935 HydrophobicContact CG1-CG1 3.53Å; V887-A936 HydrophobicContact CG1-CB 4.44Å; V887-A936 HydrophobicContact CG2-CB 3.7Å
888	H	87	Confident	88.9	Confident	34 Å²	34	28.4 Å²	28.4	16%	0.157	15%	0.153	C	C	.	.	H	α-helix	trans	-59.9	-41.5	177.8	-65	87	0	0	0	112.4	T886 L932	T886-H888 PolarHBondContact O-N 3.11Å; H888-L932 WeakPolarHBondContact CE1-CD2 3.45Å
889	K	85.1	Confident	89.3	Confident	39 Å²	39	22.8 Å²	22.8	17%	0.17	13%	0.127	C	C	.	.	H	α-helix	trans	-81.4	-28.7	179	-64.3	-176.4	-178.8	175.1	0	112.3	I787 N792 T886 V887 K891	I787-K889 HydrophobicContact CB-CB 4.36Å; I787-K889 HydrophobicContact CG2-CB 3.76Å; I787-K889 VanDerWaalsContact O-CD 3.29Å; I787-K889 WeakPolarHBondContact O-CD 3.33Å; N792-K889 PolarHBondContact O-NZ 3.2Å; T886-K889 PolarHBondContact O-N 3.12Å; V887-K889 VanDerWaalsContact C-N 3.32Å; V887-K889 PolarHBondContact O-N 3.36Å; K889-K891 PolarHBondContact O-N 3.17Å
890	A	87.4	Confident	89.7	Confident	0 Å²	0	19 Å²	19	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-74.3	-11.2	174.7	0	0	0	0	0	113.1	L761 I787 T886 V887 G892 L893 F895	L761-A890 HydrophobicContact CD1-CB 4.25Å; L761-A890 HydrophobicContact CD2-CB 3.54Å; I787-A890 HydrophobicContact CD1-CB 3.86Å; T886-A890 PolarHBondContact O-N 3.11Å; V887-A890 PolarHBondContact O-N 3.03Å; A890-G892 PolarHBondContact O-N 3.42Å; A890-L893 WeakPolarHBondContact O-CB 3.37Å; A890-L893 PolarHBondContact O-N 3.32Å; A890-F895 HydrophobicContact CB-CE2 4.27Å
891	K	85.8	Confident	89.8	Confident	31 Å²	31	19.8 Å²	19.8	14%	0.135	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	121.2	175.9	-177.5	172.3	175.6	166.8	0	109.3	E648 D651 Q675 I677 Y678 V887 K889	E648-K891 WeakPolarHBondContact OE2-CE 3.18Å; E648-K891 IonicContact OE2-NZ 3.47Å; E648-K891 PolarHBondContact OE2-NZ 3.42Å; D651-K891 IonicContact OD2-NZ 3.77Å; D651-K891 PolarHBondContact OD2-NZ 2.91Å; Q675-K891 PolarHBondContact O-NZ 3.37Å; I677-K891 HydrophobicContact CD1-CB 4.11Å; I677-K891 HydrophobicContact CD1-CD 3.62Å; I677-K891 HydrophobicContact CD1-CG 4.41Å; I677-K891 HydrophobicContact CG1-CD 4.03Å; Y678-K891 HydrophobicContact CE2-CD 4.21Å; V887-K891 PolarHBondContact O-N 2.99Å; K889-K891 PolarHBondContact O-N 3.17Å
892	G	80.6	Confident	89.7	Confident	60 Å²	60	22.3 Å²	22.3	62%	0.619	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	102	-20.4	-175	0	0	0	0	0	113.4	A890	A890-G892 PolarHBondContact O-N 3.42Å
893	L	87.1	Confident	89.4	Confident	71 Å²	71	24.2 Å²	24.2	37%	0.372	14%	0.138	S	C	.	.			trans	-89.8	163.4	172.7	-56.1	178.5	0	0	0	111.1	I787 A890 F895 R939	I787-L893 HydrophobicContact CD1-CD1 4.4Å; I787-L893 HydrophobicContact CG2-CD1 3.64Å; A890-L893 WeakPolarHBondContact O-CB 3.37Å; A890-L893 PolarHBondContact O-N 3.32Å; L893-F895 HydrophobicContact CB-CE2 4.2Å; L893-F895 HydrophobicContact CB-CZ 4.07Å; L893-F895 HydrophobicContact CD1-CZ 4.34Å; L893-R939 WeakPolarHBondContact O-CD 3.31Å; L893-R939 PolarHBondContact O-NH1 2.84Å; L893-R939 VanDerWaalsContact O-NH1 3.11Å
894	E	89.9	Confident	89.1	Confident	80 Å²	80	24.7 Å²	24.7	37%	0.374	14%	0.14	S	C	.	.			trans	-137.8	147.3	178.9	-53.6	-170.1	168.6	0	0	109	R703 M941	R703-E894 IonicContact CZ-OE1 3.15Å; R703-E894 IonicContact NE-OE1 3.75Å; R703-E894 PolarHBondContact NE-OE1 3.4Å; R703-E894 IonicContact NE-OE2 3.88Å; R703-E894 IonicContact NH2-OE1 3.01Å; R703-E894 PolarHBondContact NH2-OE1 3.48Å; E894-M941 HydrophobicContact CB-CG 4.25Å; E894-M941 HydrophobicContact CB-SD 3.92Å
895	F	91.3	Very high	88.6	Confident	4 Å²	4	25.6 Å²	25.6	2%	0.018	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	143	-178.5	-52.8	-85	0	0	0	110.8	L761 I787 F877 I883 A890 L893 T897 V898 R939 A940 M941	L761-F895 HydrophobicContact CD1-CE2 4.41Å; L761-F895 HydrophobicContact CD2-CE2 4.05Å; L761-F895 HydrophobicContact CD2-CZ 4.47Å; I787-F895 HydrophobicContact CD1-CZ 3.78Å; F877-F895 HydrophobicContact CE2-CD1 4.34Å; F877-F895 AromaticContact CE2-CE1 3.75Å; F877-F895 HydrophobicContact CE2-CE1 3.75Å; F877-F895 AromaticContact CZ-CD1 3.97Å; F877-F895 HydrophobicContact CZ-CD1 3.97Å; F877-F895 AromaticContact CZ-CE1 3.84Å; F877-F895 HydrophobicContact CZ-CE1 3.84Å; I883-F895 HydrophobicContact CB-CE1 4.02Å; I883-F895 HydrophobicContact CD1-CD1 4.1Å; I883-F895 HydrophobicContact CD1-CE1 4.06Å; I883-F895 HydrophobicContact CG2-CE1 3.67Å; I883-F895 HydrophobicContact CG2-CZ 4.19Å; A890-F895 HydrophobicContact CB-CE2 4.27Å; L893-F895 HydrophobicContact CB-CE2 4.2Å; L893-F895 HydrophobicContact CB-CZ 4.07Å; L893-F895 HydrophobicContact CD1-CZ 4.34Å; F895-T897 PolarHBondContact O-N 2.74Å; F895-V898 HydrophobicContact CB-CG2 3.84Å; F895-V898 HydrophobicContact CD2-CG2 4Å; F895-V898 HydrophobicContact CG-CG2 4.31Å; F895-R939 HydrophobicContact CD2-CB 4.18Å; F895-R939 PolarHBondContact N-O 2.78Å; F895-R939 VanDerWaalsContact N-O 3.08Å; F895-A940 CarbonylContact O-C 3.37Å; F895-A940 WeakPolarHBondContact O-CA 3.26Å; F895-M941 PolarHBondContact O-N 2.86Å
896	D	91	Very high	88.1	Confident	54 Å²	54	28.9 Å²	28.9	29%	0.289	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	-49.6	174.9	-77.7	-4.2	0	0	0	110.8	K757 S942 S943	K757-D896 HydrophobicContact CB-CB 4.03Å; K757-D896 WeakPolarHBondContact CD-OD2 3.23Å; K757-D896 VanDerWaalsContact CE-OD2 3.25Å; K757-D896 WeakPolarHBondContact CE-OD2 3.4Å; K757-D896 HydrophobicContact CG-CB 4.32Å; K757-D896 VanDerWaalsContact CG-OD2 3.29Å; K757-D896 WeakPolarHBondContact CG-OD2 3.41Å; K757-D896 IonicContact NZ-OD2 2.89Å; K757-D896 PolarHBondContact O-N 3.36Å; D896-S942 WeakPolarHBondContact O-CA 3.47Å; D896-S942 WeakPolarHBondContact O-CB 3.46Å; D896-S942 PolarHBondContact O-N 2.94Å; D896-S942 PolarHBondContact O-OG 3.36Å; D896-S943 PolarHBondContact O-N 2.65Å
897	T	92.3	Very high	87.5	Confident	7 Å²	7	28.4 Å²	28.4	4%	0.043	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.4	177.2	-57.3	0	0	0	0	111.1	A743 K757 I758 G759 F895 S943	A743-T897 HydrophobicContact CB-CG2 3.79Å; K757-T897 PolarHBondContact O-N 3.09Å; I758-T897 WeakPolarHBondContact CA-O 3.41Å; G759-T897 PolarHBondContact N-O 3.43Å; F895-T897 PolarHBondContact O-N 2.74Å; T897-S943 VanDerWaalsContact CA-O 3.3Å; T897-S943 WeakPolarHBondContact CA-O 3.41Å
898	V	94.3	Very high	86.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	130.8	175	175.7	0	0	0	0	111.4	G759 L761 F895 V900 R939 A940 S943 L944 V945	G759-V898 CarbonylContact O-C 3.59Å; G759-V898 WeakPolarHBondContact O-CA 3.46Å; L761-V898 HydrophobicContact CB-CG1 4.42Å; L761-V898 HydrophobicContact CD1-CG1 3.75Å; L761-V898 HydrophobicContact CD1-CG2 4.46Å; L761-V898 HydrophobicContact CG-CG1 3.96Å; F895-V898 HydrophobicContact CB-CG2 3.84Å; F895-V898 HydrophobicContact CD2-CG2 4Å; F895-V898 HydrophobicContact CG-CG2 4.31Å; V898-V900 HydrophobicContact CG1-CG2 4.05Å; V898-R939 HydrophobicContact CG2-CB 4.07Å; V898-A940 HydrophobicContact CB-CB 3.92Å; V898-A940 HydrophobicContact CG2-CB 3.78Å; V898-S943 PolarHBondContact N-O 2.88Å; V898-L944 HydrophobicContact CB-CD1 4.25Å; V898-L944 HydrophobicContact CG1-CD1 4.38Å; V898-V945 PolarHBondContact O-N 3.24Å
899	I	93.3	Very high	86.2	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	114.3	169.7	-53.2	-177.7	0	0	0	108.5	A743 M747 I758 G759 V760 L761 V945 T1004	A743-I899 HydrophobicContact CB-CD1 4.46Å; M747-I899 HydrophobicContact CB-CD1 4.31Å; M747-I899 HydrophobicContact SD-CD1 4.08Å; M747-I899 HydrophobicContact SD-CG2 4.15Å; I758-I899 HydrophobicContact CG2-CD1 3.81Å; I758-I899 HydrophobicContact CG2-CG1 4.13Å; G759-I899 PolarHBondContact O-N 3.13Å; V760-I899 WeakPolarHBondContact CA-O 3.41Å; V760-I899 HydrophobicContact CG2-CB 4.32Å; V760-I899 HydrophobicContact CG2-CD1 4.43Å; L761-I899 PolarHBondContact N-O 3.27Å; I899-V945 HydrophobicContact CB-CB 4.42Å; I899-V945 HydrophobicContact CG1-CB 4.18Å; I899-V945 HydrophobicContact CG1-CG2 3.91Å; I899-V945 HydrophobicContact CG2-CB 4.32Å; I899-V945 HydrophobicContact CG2-CG1 4.48Å; I899-T1004 HydrophobicContact CG2-CG2 3.53Å
900	V	93	Very high	85.9	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	128.5	177.2	-174.8	0	0	0	0	109.6	V898 F904 L933 A936 L944 V945 T947 I950 T1004	V898-V900 HydrophobicContact CG1-CG2 4.05Å; V900-F904 HydrophobicContact CG1-CD2 3.94Å; V900-F904 HydrophobicContact CG1-CE2 3.5Å; V900-F904 VanDerWaalsContact CG1-CE2 3.5Å; V900-F904 HydrophobicContact CG1-CZ 4.11Å; V900-L933 HydrophobicContact CG1-CD1 4.39Å; V900-A936 HydrophobicContact CG2-CB 4.41Å; V900-L944 HydrophobicContact CG2-CD1 4.05Å; V900-V945 PolarHBondContact N-O 3.12Å; V900-T947 HydrophobicContact CB-CG2 4.35Å; V900-T947 HydrophobicContact CG1-CG2 4.31Å; V900-T947 WeakPolarHBondContact O-CG2 3.44Å; V900-I950 HydrophobicContact CB-CD1 4.32Å; V900-I950 HydrophobicContact CG1-CD1 4.21Å; V900-I950 HydrophobicContact CG2-CD1 4.46Å; V900-T1004 WeakPolarHBondContact O-CG2 3.42Å
901	T	89.8	Confident	85.3	Confident	16 Å²	16	29 Å²	29	10%	0.098	18%	0.178	C	C	.	.			trans	-80.3	169.1	177.6	53.6	0	0	0	0	113.4	V760 L761 S762 D903 F904 T947	V760-T901 HydrophobicContact CG1-CG2 3.8Å; L761-T901 PolarHBondContact O-N 3.14Å; L761-T901 VanDerWaalsContact O-N 3.11Å; L761-T901 PolarHBondContact O-OG1 3.34Å; L761-T901 VanDerWaalsContact O-OG1 3.09Å; S762-T901 WeakPolarHBondContact CA-OG1 3.48Å; S762-T901 VanDerWaalsContact CB-OG1 3.28Å; S762-T901 WeakPolarHBondContact CB-OG1 3.41Å; S762-T901 WeakPolarHBondContact OG-CG2 3.34Å; S762-T901 PolarHBondContact OG-OG1 2.9Å; T901-D903 VanDerWaalsContact C-N 3.29Å; T901-D903 PolarHBondContact O-N 2.95Å; T901-D903 PolarHBondContact OG1-OD1 3.15Å; T901-F904 VanDerWaalsContact O-CD2 3.28Å; T901-F904 WeakPolarHBondContact O-CD2 3.3Å; T901-T947 VanDerWaalsContact O-CG2 3.27Å; T901-T947 WeakPolarHBondContact O-CG2 3.38Å
902	D	84.8	Confident	84.6	Confident	60 Å²	60	28.9 Å²	28.9	32%	0.321	18%	0.178	S	C	.	.	S	Bend	trans	-78.5	-2.5	-174.9	62.5	-35.5	0	0	0	115.1	K770 F904 E1005	K770-D902 IonicContact NZ-OD1 2.85Å; K770-D902 PolarHBondContact NZ-OD1 3.18Å; K770-D902 IonicContact NZ-OD2 3.75Å; K770-D902 PolarHBondContact NZ-OD2 2.65Å; D902-F904 PolarHBondContact O-N 2.84Å; D902-F904 VanDerWaalsContact O-N 3.17Å; D902-E1005 HydrophobicContact CB-CG 4.42Å; D902-E1005 WeakPolarHBondContact CB-OE1 3.49Å
903	D	84.6	Confident	84.1	Confident	39 Å²	39	28.1 Å²	28.1	21%	0.209	16%	0.16	C	C	.	.			trans	-82.6	14.5	-169.6	69.9	-32.2	0	0	0	115.3	S762 R763 C764 T901	S762-D903 WeakPolarHBondContact CB-OD2 3.49Å; R763-D903 WeakPolarHBondContact CA-OD2 3.48Å; R763-D903 HydrophobicContact CB-CB 4.47Å; R763-D903 WeakPolarHBondContact CB-O 3.47Å; R763-D903 WeakPolarHBondContact CB-OD2 3.08Å; R763-D903 PolarHBondContact N-OD1 2.89Å; R763-D903 PolarHBondContact N-OD2 3.33Å; C764-D903 PolarHBondContact N-OD2 2.68Å; C764-D903 PolarHBondContact SG-OD2 3.46Å; T901-D903 VanDerWaalsContact C-N 3.29Å; T901-D903 PolarHBondContact O-N 2.95Å; T901-D903 PolarHBondContact OG1-OD1 3.15Å
904	F	86.5	Confident	83.3	Confident	11 Å²	11	25.8 Å²	25.8	5%	0.048	15%	0.148	C	C	.	.	S	Bend	trans	-94.7	166.3	177	-65.1	-99.5	0	0	0	112.1	R763 V887 V900 T901 D902 T906 L932 L933 A936	R763-F904 HydrophobicContact CB-CD1 4.02Å; R763-F904 HydrophobicContact CB-CD2 4.32Å; R763-F904 HydrophobicContact CB-CE1 4.01Å; R763-F904 HydrophobicContact CB-CE2 4.31Å; R763-F904 HydrophobicContact CB-CG 4.19Å; R763-F904 HydrophobicContact CB-CZ 4.16Å; V887-F904 HydrophobicContact CG2-CE1 3.87Å; V887-F904 HydrophobicContact CG2-CZ 3.54Å; V900-F904 HydrophobicContact CG1-CD2 3.94Å; V900-F904 HydrophobicContact CG1-CE2 3.5Å; V900-F904 VanDerWaalsContact CG1-CE2 3.5Å; V900-F904 HydrophobicContact CG1-CZ 4.11Å; T901-F904 VanDerWaalsContact O-CD2 3.28Å; T901-F904 WeakPolarHBondContact O-CD2 3.3Å; D902-F904 PolarHBondContact O-N 2.84Å; D902-F904 VanDerWaalsContact O-N 3.17Å; F904-T906 WeakPolarHBondContact O-CG2 3.49Å; F904-T906 PolarHBondContact O-N 3.39Å; F904-L932 HydrophobicContact CE1-CB 4.38Å; F904-L933 HydrophobicContact CB-CD1 4.29Å; F904-L933 HydrophobicContact CD1-CB 4.21Å; F904-L933 HydrophobicContact CD1-CD1 4.01Å; F904-L933 HydrophobicContact CD2-CD1 4.49Å; F904-L933 HydrophobicContact CE1-CD1 4.46Å; F904-L933 HydrophobicContact CG-CD1 4.02Å; F904-A936 HydrophobicContact CE1-CB 4.24Å; F904-A936 HydrophobicContact CZ-CB 3.95Å
905	V	81.7	Confident	81.8	Confident	19 Å²	19	27.1 Å²	27.1	12%	0.115	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-55.5	126.4	179.3	178.2	0	0	0	0	112	I925 E929 W930 N949	V905-I925 HydrophobicContact CG1-CD1 3.54Å; V905-I925 HydrophobicContact CG1-CG1 4.06Å; V905-I925 HydrophobicContact CG1-CG2 3.95Å; V905-I925 HydrophobicContact CG2-CG2 4.24Å; V905-E929 HydrophobicContact CG2-CB 3.55Å; V905-E929 HydrophobicContact CG2-CG 3.74Å; V905-W930 HydrophobicContact CG1-CH2 4.4Å; V905-N949 PolarHBondContact O-ND2 3.26Å
906	T	81.1	Confident	80.2	Confident	71 Å²	71	32.8 Å²	32.8	44%	0.436	19%	0.186	S	C	.	.	P	Polyproline II helix	trans	-95.1	136.7	-172.2	59.4	0	0	0	0	113.4	F904 N949	F904-T906 WeakPolarHBondContact O-CG2 3.49Å; F904-T906 PolarHBondContact O-N 3.39Å; T906-N949 WeakPolarHBondContact CA-OD1 3.45Å
907	V	80.6	Confident	79.1	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-85.3	128.6	167.2	-177.6	0	0	0	0	108.1	A909 L914 F920 F922 W930 N949 R952 I953	V907-A909 WeakPolarHBondContact CG1-O 3.44Å; V907-A909 PolarHBondContact O-N 2.92Å; V907-L914 HydrophobicContact CG1-CD1 4.18Å; V907-F920 HydrophobicContact CG1-CE1 4.24Å; V907-F920 HydrophobicContact CG1-CZ 4.43Å; V907-F920 HydrophobicContact CG2-CZ 4.37Å; V907-F922 HydrophobicContact CG1-CZ 4.46Å; V907-F922 HydrophobicContact CG2-CE1 4.04Å; V907-F922 HydrophobicContact CG2-CZ 4.45Å; V907-W930 HydrophobicContact CG2-CH2 4.27Å; V907-N949 PolarHBondContact N-OD1 3.4Å; V907-R952 HydrophobicContact CB-CB 4.17Å; V907-R952 HydrophobicContact CG1-CB 4.39Å; V907-R952 WeakPolarHBondContact O-CD 3.18Å; V907-R952 PolarHBondContact O-NH1 3.06Å; V907-I953 HydrophobicContact CG2-CD1 4.32Å; V907-I953 HydrophobicContact CG2-CG1 3.6Å
908	P	75.2	Confident	77.5	Confident	15 Å²	15	41.2 Å²	41.2	10%	0.097	23%	0.225	C	C	.	.	S	Bend	trans	-67.4	-33.5	-168.4	24.2	-34.5	0	0	0	113.4	L914 I917 F920 R952	P908-L914 HydrophobicContact CG-CD1 3.97Å; P908-I917 HydrophobicContact CB-CD1 3.83Å; P908-I917 HydrophobicContact CG-CD1 3.93Å; P908-I917 HydrophobicContact CG-CG2 4.48Å; P908-F920 HydrophobicContact CG-CB 4Å; P908-F920 HydrophobicContact CG-CD1 4.22Å; P908-F920 HydrophobicContact CG-CD2 3.81Å; P908-F920 HydrophobicContact CG-CE2 4.33Å; P908-F920 HydrophobicContact CG-CG 3.73Å; P908-R952 PolarHBondContact O-NH1 3.36Å
909	A	75.3	Confident	76.1	Confident	14 Å²	14	47.6 Å²	47.6	12%	0.116	26%	0.259	C	S	.	.	S	Bend	trans	-146.3	163.8	-177.2	0	0	0	0	0	112.6	V907 N913 I917	V907-A909 WeakPolarHBondContact CG1-O 3.44Å; V907-A909 PolarHBondContact O-N 2.92Å; A909-N913 HydrophobicContact CB-CB 4.09Å; A909-I917 HydrophobicContact CB-CD1 3.73Å
910	S	78.8	Confident	75.2	Confident	36 Å²	36	49.1 Å²	49.1	25%	0.252	27%	0.265	S	S	.	.			trans	-64	154	170.4	-52	0	0	0	0	111.1	H912 N913 L914 T955	S910-H912 VanDerWaalsContact C-N 3.28Å; S910-H912 VanDerWaalsContact CB-CE1 3.43Å; S910-H912 WeakPolarHBondContact CB-CE1 3.46Å; S910-H912 PolarHBondContact O-N 2.81Å; S910-H912 VanDerWaalsContact O-N 3.1Å; S910-N913 PolarHBondContact O-N 3.44Å; S910-L914 PolarHBondContact O-N 3.42Å; S910-T955 WeakPolarHBondContact CA-OG1 3.42Å
911	G	73.8	Confident	74.4	Confident	20 Å²	20	51.3 Å²	51.3	21%	0.206	28%	0.281	C	S	.	.	H	α-helix	trans	-54.2	-36.8	-171.9	0	0	0	0	0	115.4	N913 L914 T955	G911-N913 PolarHBondContact O-N 3.35Å; G911-L914 PolarHBondContact O-N 3.24Å; G911-T955 PolarHBondContact N-OG1 2.71Å
912	H	71.4	Confident	73.9	Confident	29 Å²	29	52.1 Å²	52.1	13%	0.134	28%	0.283	C	S	.	.	H	α-helix	trans	-69.3	-16.7	177.2	58.6	-85.3	0	0	0	114.8	S910 Y960 T1020	S910-H912 VanDerWaalsContact C-N 3.28Å; S910-H912 VanDerWaalsContact CB-CE1 3.43Å; S910-H912 WeakPolarHBondContact CB-CE1 3.46Å; S910-H912 PolarHBondContact O-N 2.81Å; S910-H912 VanDerWaalsContact O-N 3.1Å; H912-Y960 AromaticContact CE1-CE1 3.86Å; H912-Y960 PolarHBondContact N-OH 3.21Å; H912-Y960 AromaticContact ND1-CE1 3.44Å; H912-Y960 WeakPolarHBondContact ND1-CE1 3.43Å; H912-Y960 AromaticContact ND1-CZ 3.56Å; H912-Y960 PolarHBondContact ND1-OH 3.41Å; H912-T1020 HydrophobicContact CB-CG2 4.25Å; H912-T1020 VanDerWaalsContact CB-O 3.31Å; H912-T1020 WeakPolarHBondContact CB-O 3.38Å
913	N	71.6	Confident	73.5	Confident	44 Å²	44	54.3 Å²	54.3	24%	0.235	30%	0.303	C	S	.	.	H	α-helix	trans	-107.4	-11.9	175.5	-68.7	-19.7	0	0	0	112.4	A909 S910 G911 C915 R916	A909-N913 HydrophobicContact CB-CB 4.09Å; S910-N913 PolarHBondContact O-N 3.44Å; G911-N913 PolarHBondContact O-N 3.35Å; N913-C915 VanDerWaalsContact C-N 3.34Å; N913-C915 PolarHBondContact O-N 3.01Å; N913-R916 WeakPolarHBondContact O-CB 3.49Å; N913-R916 PolarHBondContact O-N 3.18Å
914	L	69.1	Low	73.4	Confident	23 Å²	23	58.7 Å²	58.7	12%	0.12	32%	0.32	C	S	.	.	H	α-helix	trans	-66.2	-33.9	-174.5	-166.9	69.4	0	0	0	112.7	V907 P908 S910 G911 R916 I917 F920 F922 V956	V907-L914 HydrophobicContact CG1-CD1 4.18Å; P908-L914 HydrophobicContact CG-CD1 3.97Å; S910-L914 PolarHBondContact O-N 3.42Å; G911-L914 PolarHBondContact O-N 3.24Å; L914-R916 PolarHBondContact O-N 3.04Å; L914-I917 PolarHBondContact O-N 3.41Å; L914-F920 HydrophobicContact CD1-CD1 3.91Å; L914-F920 HydrophobicContact CD1-CE1 4.46Å; L914-F922 HydrophobicContact CD2-CE2 3.83Å; L914-F922 HydrophobicContact CD2-CZ 4.17Å; L914-V956 HydrophobicContact CD2-CG1 4.47Å; L914-V956 HydrophobicContact CD2-CG2 3.79Å
915	C	59.5	Low	73.2	Confident	107 Å²	107	59.3 Å²	59.3	72%	0.723	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-11.7	176.7	58.2	0	0	0	0	114.2	N913	N913-C915 VanDerWaalsContact C-N 3.34Å; N913-C915 PolarHBondContact O-N 3.01Å
916	R	57.4	Low	73.4	Confident	124 Å²	124	62 Å²	62	47%	0.468	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-12	178.5	-58	-178.9	177.7	-175.2	-2.6	113.4	N913 L914	N913-R916 WeakPolarHBondContact O-CB 3.49Å; N913-R916 PolarHBondContact O-N 3.18Å; L914-R916 PolarHBondContact O-N 3.04Å
917	I	68.3	Low	73.6	Confident	53 Å²	53	61.6 Å²	61.6	27%	0.272	34%	0.337	S	S	.	.			trans	-100	90.3	176.4	-55.7	178.8	0	0	0	106.9	P908 A909 L914 D919 F920	P908-I917 HydrophobicContact CB-CD1 3.83Å; P908-I917 HydrophobicContact CG-CD1 3.93Å; P908-I917 HydrophobicContact CG-CG2 4.48Å; A909-I917 HydrophobicContact CB-CD1 3.73Å; L914-I917 PolarHBondContact O-N 3.41Å; I917-D919 PolarHBondContact O-N 3.25Å; I917-F920 HydrophobicContact CG2-CB 4.01Å
918	Q	57.5	Low	73.8	Confident	185 Å²	185	63.6 Å²	63.6	86%	0.864	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-22.8	-175	-66.8	-177.3	5.6	0	0	113.1
919	D	65.6	Low	74.5	Confident	134 Å²	134	64.8 Å²	64.8	72%	0.717	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-16.2	-173.4	-64.3	-36.5	0	0	0	114.5	I917 K924	I917-D919 PolarHBondContact O-N 3.25Å; D919-K924 PolarHBondContact O-NZ 2.89Å
920	F	74.6	Confident	75.2	Confident	31 Å²	31	64.3 Å²	64.3	14%	0.136	35%	0.347	C	S	.	.			trans	-91.6	122.2	-177	-175.5	-94.8	0	0	0	111.6	V907 P908 L914 I917 F922 I925	V907-F920 HydrophobicContact CG1-CE1 4.24Å; V907-F920 HydrophobicContact CG1-CZ 4.43Å; V907-F920 HydrophobicContact CG2-CZ 4.37Å; P908-F920 HydrophobicContact CG-CB 4Å; P908-F920 HydrophobicContact CG-CD1 4.22Å; P908-F920 HydrophobicContact CG-CD2 3.81Å; P908-F920 HydrophobicContact CG-CE2 4.33Å; P908-F920 HydrophobicContact CG-CG 3.73Å; L914-F920 HydrophobicContact CD1-CD1 3.91Å; L914-F920 HydrophobicContact CD1-CE1 4.46Å; I917-F920 HydrophobicContact CG2-CB 4.01Å; F920-F922 HydrophobicContact CE1-CD1 4.21Å; F920-F922 HydrophobicContact CE1-CD2 4.14Å; F920-F922 HydrophobicContact CE1-CE1 4.04Å; F920-F922 AromaticContact CE1-CE2 3.97Å; F920-F922 HydrophobicContact CE1-CE2 3.97Å; F920-F922 HydrophobicContact CE1-CG 4.25Å; F920-F922 AromaticContact CE1-CZ 3.91Å; F920-F922 HydrophobicContact CE1-CZ 3.91Å; F920-F922 HydrophobicContact CZ-CD1 4.47Å; F920-F922 HydrophobicContact CZ-CE1 4.41Å; F920-I925 HydrophobicContact CE2-CD1 3.74Å; F920-I925 HydrophobicContact CZ-CD1 3.82Å
921	S	76.5	Confident	75.9	Confident	47 Å²	47	62.6 Å²	62.6	33%	0.329	34%	0.335	S	S	.	.			trans	-131.1	134.8	168.3	178.6	0	0	0	0	109.6	S923 K924	S921-S923 PolarHBondContact O-N 3.25Å; S921-S923 PolarHBondContact OG-N 3.45Å; S921-S923 PolarHBondContact OG-OG 3.26Å; S921-K924 PolarHBondContact O-N 2.92Å; S921-K924 VanDerWaalsContact O-N 3.09Å
922	F	78.9	Confident	76.8	Confident	33 Å²	33	61.8 Å²	61.8	15%	0.145	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-56.9	-29.5	173.8	-69.1	-86.7	0	0	0	112.3	V718 C719 V907 L914 F920 K924 I925 W930 V956	V718-F922 HydrophobicContact CG1-CE1 4Å; V718-F922 HydrophobicContact CG1-CE2 4.19Å; V718-F922 HydrophobicContact CG1-CZ 3.8Å; C719-F922 HydrophobicContact CB-CD1 4.36Å; V907-F922 HydrophobicContact CG1-CZ 4.46Å; V907-F922 HydrophobicContact CG2-CE1 4.04Å; V907-F922 HydrophobicContact CG2-CZ 4.45Å; L914-F922 HydrophobicContact CD2-CE2 3.83Å; L914-F922 HydrophobicContact CD2-CZ 4.17Å; F920-F922 HydrophobicContact CE1-CD1 4.21Å; F920-F922 HydrophobicContact CE1-CD2 4.14Å; F920-F922 HydrophobicContact CE1-CE1 4.04Å; F920-F922 AromaticContact CE1-CE2 3.97Å; F920-F922 HydrophobicContact CE1-CE2 3.97Å; F920-F922 HydrophobicContact CE1-CG 4.25Å; F920-F922 AromaticContact CE1-CZ 3.91Å; F920-F922 HydrophobicContact CE1-CZ 3.91Å; F920-F922 HydrophobicContact CZ-CD1 4.47Å; F920-F922 HydrophobicContact CZ-CE1 4.41Å; F922-K924 VanDerWaalsContact C-N 3.29Å; F922-K924 PolarHBondContact O-N 3.33Å; F922-I925 PolarHBondContact O-N 3.43Å; F922-W930 AromaticContact CD1-CH2 4Å; F922-W930 HydrophobicContact CD1-CH2 4Å; F922-W930 AromaticContact CD1-CZ2 3.63Å; F922-W930 HydrophobicContact CD1-CZ2 3.63Å; F922-W930 HydrophobicContact CE1-CH2 4.16Å; F922-W930 HydrophobicContact CE1-CZ2 4.26Å; F922-V956 HydrophobicContact CE2-CG1 4.23Å; F922-V956 HydrophobicContact CZ-CG1 4.25Å; F922-V956 HydrophobicContact CZ-CG2 4.26Å
923	S	75.9	Confident	77.8	Confident	105 Å²	105	60.5 Å²	60.5	73%	0.734	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-72.7	-15.3	179.6	69.3	0	0	0	0	114.5	S921 I925	S921-S923 PolarHBondContact O-N 3.25Å; S921-S923 PolarHBondContact OG-N 3.45Å; S921-S923 PolarHBondContact OG-OG 3.26Å; S923-I925 VanDerWaalsContact C-N 3.34Å
924	K	81.3	Confident	79	Confident	131 Å²	131	58.4 Å²	58.4	57%	0.57	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-78.8	-22.5	176.6	-70.8	178.9	-179.4	179	0	111.9	D919 S921 F922	D919-K924 PolarHBondContact O-NZ 2.89Å; S921-K924 PolarHBondContact O-N 2.92Å; S921-K924 VanDerWaalsContact O-N 3.09Å; F922-K924 VanDerWaalsContact C-N 3.29Å; F922-K924 PolarHBondContact O-N 3.33Å
925	I	84.2	Confident	80.2	Confident	24 Å²	24	57.3 Å²	57.3	12%	0.123	30%	0.303	C	S	.	.	S	Bend	trans	-85.5	134.7	-179.6	-67.9	157.6	0	0	0	108.4	V905 F920 F922 S923 D927 E929 W930	V905-I925 HydrophobicContact CG1-CD1 3.54Å; V905-I925 HydrophobicContact CG1-CG1 4.06Å; V905-I925 HydrophobicContact CG1-CG2 3.95Å; V905-I925 HydrophobicContact CG2-CG2 4.24Å; F920-I925 HydrophobicContact CE2-CD1 3.74Å; F920-I925 HydrophobicContact CZ-CD1 3.82Å; F922-I925 PolarHBondContact O-N 3.43Å; S923-I925 VanDerWaalsContact C-N 3.34Å; I925-D927 PolarHBondContact O-N 3.31Å; I925-E929 HydrophobicContact CG2-CB 4.12Å; I925-W930 HydrophobicContact CB-CZ2 4.17Å; I925-W930 HydrophobicContact CD1-CH2 4.17Å; I925-W930 HydrophobicContact CD1-CZ2 3.51Å; I925-W930 HydrophobicContact CG1-CZ2 4.44Å; I925-W930 HydrophobicContact CG2-CZ2 4.08Å
926	P	84.3	Confident	81.8	Confident	77 Å²	77	52.2 Å²	52.2	50%	0.5	27%	0.269	S	S	.	.			trans	-55.8	138.4	176.7	-25.9	34.6	0	0	0	112.9	D928 E929	P926-D928 PolarHBondContact O-N 3.41Å; P926-D928 VanDerWaalsContact O-N 3.08Å; P926-E929 PolarHBondContact O-N 3.04Å; P926-E929 VanDerWaalsContact O-N 3.13Å
927	D	85.6	Confident	83.6	Confident	62 Å²	62	46.3 Å²	46.3	33%	0.332	25%	0.246	S	C	.	.	H	α-helix	trans	-56.3	-27.7	-178.9	-115	24.8	0	0	0	113.2	R688 K720 I925 W930 N931	R688-D927 IonicContact CZ-OD2 3.3Å; R688-D927 IonicContact NH1-OD2 2.84Å; R688-D927 PolarHBondContact NH1-OD2 3.23Å; R688-D927 VanDerWaalsContact NH1-OD2 3.15Å; R688-D927 IonicContact NH2-OD2 2.84Å; K720-D927 VanDerWaalsContact CE-OD2 3.24Å; K720-D927 WeakPolarHBondContact CE-OD2 3.47Å; K720-D927 PolarHBondContact NZ-O 2.82Å; K720-D927 VanDerWaalsContact NZ-O 3.14Å; K720-D927 IonicContact NZ-OD1 2.97Å; K720-D927 IonicContact NZ-OD2 2.69Å; K720-D927 PolarHBondContact NZ-OD2 2.96Å; I925-D927 PolarHBondContact O-N 3.31Å; D927-W930 PolarHBondContact O-N 2.93Å; D927-N931 VanDerWaalsContact O-CG 3.29Å; D927-N931 PolarHBondContact O-N 3.15Å; D927-N931 VanDerWaalsContact O-N 3.1Å; D927-N931 PolarHBondContact O-OD1 3.1Å
928	D	85.6	Confident	84.8	Confident	41 Å²	41	43.8 Å²	43.8	22%	0.219	23%	0.233	C	C	.	.	H	α-helix	trans	-69	-34	-178.9	-65.7	-11.4	0	0	0	113	T679 P926 W930 N931 L932	T679-D928 WeakPolarHBondContact CB-OD2 3.5Å; T679-D928 WeakPolarHBondContact CG2-OD2 3.14Å; T679-D928 PolarHBondContact OG1-OD1 2.92Å; T679-D928 PolarHBondContact OG1-OD2 3.16Å; P926-D928 PolarHBondContact O-N 3.41Å; P926-D928 VanDerWaalsContact O-N 3.08Å; D928-W930 VanDerWaalsContact C-N 3.32Å; D928-W930 PolarHBondContact O-N 3.08Å; D928-N931 WeakPolarHBondContact O-CB 3.1Å; D928-N931 PolarHBondContact O-N 3.49Å; D928-L932 WeakPolarHBondContact O-CG 3.23Å; D928-L932 PolarHBondContact O-N 3.41Å
929	E	88.7	Confident	86.5	Confident	41 Å²	41	35.2 Å²	35.2	19%	0.192	19%	0.193	C	C	.	.	H	α-helix	trans	-69.6	-35.4	178.4	-69.6	-60.9	147.4	0	0	111.1	R763 V905 I925 P926 L932 L933	R763-E929 IonicContact CZ-OE1 3.97Å; R763-E929 IonicContact CZ-OE2 2.64Å; R763-E929 IonicContact NE-OE1 3.27Å; R763-E929 PolarHBondContact NE-OE1 2.99Å; R763-E929 IonicContact NE-OE2 2.76Å; R763-E929 PolarHBondContact NE-OE2 3.19Å; R763-E929 IonicContact NH2-OE1 3.64Å; R763-E929 PolarHBondContact NH2-OE1 3.26Å; R763-E929 IonicContact NH2-OE2 2.69Å; V905-E929 HydrophobicContact CG2-CB 3.55Å; V905-E929 HydrophobicContact CG2-CG 3.74Å; I925-E929 HydrophobicContact CG2-CB 4.12Å; P926-E929 PolarHBondContact O-N 3.04Å; P926-E929 VanDerWaalsContact O-N 3.13Å; E929-L932 PolarHBondContact O-N 3.32Å; E929-L933 PolarHBondContact O-N 3.24Å
930	W	91.3	Very high	87.8	Confident	3 Å²	3	28.8 Å²	28.8	1%	0.011	16%	0.159	C	C	.	.	H	α-helix	trans	-70.1	-35.2	171.6	-59.7	124.4	0	0	0	112.4	C719 K720 V905 V907 F922 I925 D927 D928 L932 L933 Y934 I953	C719-W930 HydrophobicContact CB-CB 4.25Å; C719-W930 HydrophobicContact CB-CD2 3.51Å; C719-W930 HydrophobicContact CB-CE3 3.84Å; C719-W930 HydrophobicContact CB-CG 3.7Å; C719-W930 HydrophobicContact CB-CZ2 4.36Å; C719-W930 HydrophobicContact CB-CZ3 4.41Å; C719-W930 VanDerWaalsContact SG-CE3 3.52Å; C719-W930 VanDerWaalsContact SG-CZ3 3.59Å; K720-W930 HydrophobicContact CD-CB 4.12Å; K720-W930 HydrophobicContact CG-CB 4.1Å; V905-W930 HydrophobicContact CG1-CH2 4.4Å; V907-W930 HydrophobicContact CG2-CH2 4.27Å; F922-W930 AromaticContact CD1-CH2 4Å; F922-W930 HydrophobicContact CD1-CH2 4Å; F922-W930 AromaticContact CD1-CZ2 3.63Å; F922-W930 HydrophobicContact CD1-CZ2 3.63Å; F922-W930 HydrophobicContact CE1-CH2 4.16Å; F922-W930 HydrophobicContact CE1-CZ2 4.26Å; I925-W930 HydrophobicContact CB-CZ2 4.17Å; I925-W930 HydrophobicContact CD1-CH2 4.17Å; I925-W930 HydrophobicContact CD1-CZ2 3.51Å; I925-W930 HydrophobicContact CG1-CZ2 4.44Å; I925-W930 HydrophobicContact CG2-CZ2 4.08Å; D927-W930 PolarHBondContact O-N 2.93Å; D928-W930 VanDerWaalsContact C-N 3.32Å; D928-W930 PolarHBondContact O-N 3.08Å; W930-L932 VanDerWaalsContact C-N 3.33Å; W930-L933 HydrophobicContact CE3-CD2 4.34Å; W930-L933 HydrophobicContact CZ3-CD2 4.36Å; W930-L933 PolarHBondContact O-N 3.47Å; W930-Y934 WeakPolarHBondContact O-CB 3.47Å; W930-Y934 PolarHBondContact O-N 3.03Å; W930-I953 HydrophobicContact CZ3-CD1 3.83Å
931	N	92.9	Very high	88.6	Confident	1 Å²	1	30 Å²	30	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-61.7	-42.1	172.6	-69.8	-15.2	0	0	0	111	H674 Q676 I677 K720 D927 D928 L933 Y934 V935	H674-N931 WeakPolarHBondContact CA-OD1 3.2Å; H674-N931 WeakPolarHBondContact O-CA 3.38Å; H674-N931 VanDerWaalsContact O-CB 3.22Å; H674-N931 WeakPolarHBondContact O-CB 3.46Å; H674-N931 PolarHBondContact O-OD1 3.02Å; Q676-N931 WeakPolarHBondContact O-CB 3.33Å; Q676-N931 PolarHBondContact O-ND2 3.31Å; I677-N931 HydrophobicContact CG2-CB 4.14Å; K720-N931 PolarHBondContact NZ-OD1 3.33Å; D927-N931 VanDerWaalsContact O-CG 3.29Å; D927-N931 PolarHBondContact O-N 3.15Å; D927-N931 VanDerWaalsContact O-N 3.1Å; D927-N931 PolarHBondContact O-OD1 3.1Å; D928-N931 WeakPolarHBondContact O-CB 3.1Å; D928-N931 PolarHBondContact O-N 3.49Å; N931-L933 PolarHBondContact O-N 3.01Å; N931-Y934 PolarHBondContact O-N 3.35Å; N931-V935 WeakPolarHBondContact O-CB 3.08Å; N931-V935 VanDerWaalsContact O-CG2 3.23Å; N931-V935 WeakPolarHBondContact O-CG2 3.33Å; N931-V935 PolarHBondContact O-N 2.97Å
932	L	92.2	Very high	89.3	Confident	3 Å²	3	29.8 Å²	29.8	2%	0.016	16%	0.164	C	C	.	.	H	α-helix	trans	-62.5	-42.3	177.8	-75.1	165.9	0	0	0	112.3	I677 R763 V887 H888 F904 D928 E929 W930 V935 A936	I677-L932 HydrophobicContact CB-CD2 3.94Å; I677-L932 HydrophobicContact CB-CG 4.44Å; I677-L932 HydrophobicContact CD1-CD2 4.28Å; I677-L932 HydrophobicContact CG2-CD2 3.64Å; I677-L932 HydrophobicContact CG2-CG 3.9Å; R763-L932 VanDerWaalsContact CZ-CD1 3.46Å; V887-L932 HydrophobicContact CB-CD2 4.11Å; V887-L932 HydrophobicContact CG1-CD2 3.88Å; H888-L932 WeakPolarHBondContact CE1-CD2 3.45Å; F904-L932 HydrophobicContact CE1-CB 4.38Å; D928-L932 WeakPolarHBondContact O-CG 3.23Å; D928-L932 PolarHBondContact O-N 3.41Å; E929-L932 PolarHBondContact O-N 3.32Å; W930-L932 VanDerWaalsContact C-N 3.33Å; L932-V935 PolarHBondContact O-N 3.21Å; L932-A936 WeakPolarHBondContact O-CB 3.44Å; L932-A936 PolarHBondContact O-N 2.91Å
933	L	93.6	Very high	89.9	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-64.8	-42.3	174.8	-173.3	63	0	0	0	112	I715 V900 F904 E929 W930 N931 A936 V937 I950 I953	I715-L933 HydrophobicContact CD1-CD2 4.27Å; I715-L933 HydrophobicContact CD1-CG 4.17Å; V900-L933 HydrophobicContact CG1-CD1 4.39Å; F904-L933 HydrophobicContact CB-CD1 4.29Å; F904-L933 HydrophobicContact CD1-CB 4.21Å; F904-L933 HydrophobicContact CD1-CD1 4.01Å; F904-L933 HydrophobicContact CD2-CD1 4.49Å; F904-L933 HydrophobicContact CE1-CD1 4.46Å; F904-L933 HydrophobicContact CG-CD1 4.02Å; E929-L933 PolarHBondContact O-N 3.24Å; W930-L933 HydrophobicContact CE3-CD2 4.34Å; W930-L933 HydrophobicContact CZ3-CD2 4.36Å; W930-L933 PolarHBondContact O-N 3.47Å; N931-L933 PolarHBondContact O-N 3.01Å; L933-A936 PolarHBondContact O-N 2.82Å; L933-V937 WeakPolarHBondContact O-CG2 3.35Å; L933-V937 PolarHBondContact O-N 2.91Å; L933-V937 VanDerWaalsContact O-N 3.08Å; L933-I950 HydrophobicContact CD1-CD1 3.95Å; L933-I950 HydrophobicContact CD1-CG1 3.93Å; L933-I950 HydrophobicContact CD2-CG1 4.31Å; L933-I953 HydrophobicContact CD2-CD1 3.6Å
934	Y	95	Very high	90.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.5	-44.5	176.2	173.3	-106.1	0	0	0	112	A463 D672 H674 Q675 L716 L726 W930 N931 A936 V937 T938	A463-Y934 HydrophobicContact CB-CE1 4.41Å; A463-Y934 PolarHBondContact N-OH 3Å; D672-Y934 WeakPolarHBondContact OD2-CE1 3.13Å; H674-Y934 HydrophobicContact CB-CD1 3.98Å; H674-Y934 HydrophobicContact CB-CE1 4.02Å; H674-Y934 WeakPolarHBondContact O-CD1 3.39Å; Q675-Y934 HydrophobicContact CG-CD1 4.11Å; Q675-Y934 HydrophobicContact CG-CE1 3.89Å; L716-Y934 HydrophobicContact CD1-CD2 4.2Å; L716-Y934 HydrophobicContact CD1-CE2 3.65Å; L716-Y934 HydrophobicContact CD2-CD1 4.4Å; L716-Y934 HydrophobicContact CD2-CD2 3.87Å; L716-Y934 HydrophobicContact CD2-CE2 4.12Å; L716-Y934 HydrophobicContact CD2-CG 4.02Å; L716-Y934 HydrophobicContact CG-CD2 3.84Å; L716-Y934 HydrophobicContact CG-CE2 3.82Å; L716-Y934 HydrophobicContact CG-CG 4.49Å; L726-Y934 HydrophobicContact CD2-CE2 4.1Å; W930-Y934 WeakPolarHBondContact O-CB 3.47Å; W930-Y934 PolarHBondContact O-N 3.03Å; N931-Y934 PolarHBondContact O-N 3.35Å; Y934-A936 VanDerWaalsContact C-N 3.35Å; Y934-A936 PolarHBondContact O-N 3.3Å; Y934-V937 PolarHBondContact O-N 2.87Å; Y934-T938 HydrophobicContact CD2-CG2 3.94Å; Y934-T938 HydrophobicContact CE1-CG2 4.33Å; Y934-T938 HydrophobicContact CE2-CG2 3.5Å; Y934-T938 WeakPolarHBondContact O-CB 3.35Å; Y934-T938 WeakPolarHBondContact O-CG2 3.44Å; Y934-T938 PolarHBondContact O-N 3.18Å; Y934-T938 PolarHBondContact O-OG1 2.88Å
935	V	94.6	Very high	91.2	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.4	-45.7	175.7	173.7	0	0	0	0	110.1	Q675 I677 V887 N931 L932 V937 T938 R939	Q675-V935 HydrophobicContact CB-CG2 3.82Å; Q675-V935 HydrophobicContact CG-CG2 3.69Å; I677-V935 HydrophobicContact CG2-CG2 4.22Å; V887-V935 HydrophobicContact CG1-CB 3.77Å; V887-V935 HydrophobicContact CG1-CG1 3.53Å; N931-V935 WeakPolarHBondContact O-CB 3.08Å; N931-V935 VanDerWaalsContact O-CG2 3.23Å; N931-V935 WeakPolarHBondContact O-CG2 3.33Å; N931-V935 PolarHBondContact O-N 2.97Å; L932-V935 PolarHBondContact O-N 3.21Å; V935-V937 PolarHBondContact O-N 2.95Å; V935-T938 PolarHBondContact O-N 3.24Å; V935-T938 PolarHBondContact O-OG1 3.23Å; V935-R939 WeakPolarHBondContact O-CG 3.43Å; V935-R939 PolarHBondContact O-N 3.42Å; V935-R939 PolarHBondContact O-NE 3.13Å
936	A	94.4	Very high	91.5	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-58	-48.8	179.5	0	0	0	0	0	112.4	V887 V900 F904 L932 L933 Y934 T938 R939	V887-A936 HydrophobicContact CG1-CB 4.44Å; V887-A936 HydrophobicContact CG2-CB 3.7Å; V900-A936 HydrophobicContact CG2-CB 4.41Å; F904-A936 HydrophobicContact CE1-CB 4.24Å; F904-A936 HydrophobicContact CZ-CB 3.95Å; L932-A936 WeakPolarHBondContact O-CB 3.44Å; L932-A936 PolarHBondContact O-N 2.91Å; L933-A936 PolarHBondContact O-N 2.82Å; Y934-A936 VanDerWaalsContact C-N 3.35Å; Y934-A936 PolarHBondContact O-N 3.3Å; A936-T938 PolarHBondContact O-N 3.32Å; A936-R939 PolarHBondContact O-N 2.87Å
937	V	94.5	Very high	91.8	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64.5	-40.7	-180	165.1	0	0	0	0	111.8	I708 V711 I715 L933 Y934 V935 R939 A940 L944 I950	I708-V937 HydrophobicContact CG2-CG1 4.48Å; V711-V937 HydrophobicContact CB-CG1 4.22Å; V711-V937 HydrophobicContact CG1-CG1 3.89Å; V711-V937 HydrophobicContact CG1-CG2 4.42Å; I715-V937 HydrophobicContact CD1-CB 4.47Å; I715-V937 HydrophobicContact CD1-CG2 3.95Å; L933-V937 WeakPolarHBondContact O-CG2 3.35Å; L933-V937 PolarHBondContact O-N 2.91Å; L933-V937 VanDerWaalsContact O-N 3.08Å; Y934-V937 PolarHBondContact O-N 2.87Å; V935-V937 PolarHBondContact O-N 2.95Å; V937-R939 PolarHBondContact O-N 2.8Å; V937-A940 PolarHBondContact O-N 3.09Å; V937-L944 HydrophobicContact CB-CD2 4.44Å; V937-L944 HydrophobicContact CG1-CD2 3.71Å; V937-L944 HydrophobicContact CG2-CD2 4.3Å; V937-I950 HydrophobicContact CG2-CD1 4.01Å
938	T	94.2	Very high	91.9	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	4.2	-176.3	56.6	0	0	0	0	114.3	A463 R703 F704 Y934 V935 A936	A463-T938 HydrophobicContact CB-CG2 3.86Å; R703-T938 VanDerWaalsContact CD-O 3.24Å; R703-T938 WeakPolarHBondContact CD-O 3.48Å; R703-T938 PolarHBondContact NH1-O 2.66Å; F704-T938 HydrophobicContact CE1-CG2 4.07Å; F704-T938 HydrophobicContact CZ-CG2 4.01Å; Y934-T938 HydrophobicContact CD2-CG2 3.94Å; Y934-T938 HydrophobicContact CE1-CG2 4.33Å; Y934-T938 HydrophobicContact CE2-CG2 3.5Å; Y934-T938 WeakPolarHBondContact O-CB 3.35Å; Y934-T938 WeakPolarHBondContact O-CG2 3.44Å; Y934-T938 PolarHBondContact O-N 3.18Å; Y934-T938 PolarHBondContact O-OG1 2.88Å; V935-T938 PolarHBondContact O-N 3.24Å; V935-T938 PolarHBondContact O-OG1 3.23Å; A936-T938 PolarHBondContact O-N 3.32Å
939	R	93	Very high	92	Very high	4 Å²	4	12.4 Å²	12.4	2%	0.015	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-19.9	169.4	-69.9	-48.8	107.3	174.3	7.7	113.5	L761 L893 F895 V898 V935 A936 V937	L761-R939 HydrophobicContact CD1-CB 3.9Å; L761-R939 HydrophobicContact CD1-CG 3.86Å; L893-R939 WeakPolarHBondContact O-CD 3.31Å; L893-R939 PolarHBondContact O-NH1 2.84Å; L893-R939 VanDerWaalsContact O-NH1 3.11Å; F895-R939 HydrophobicContact CD2-CB 4.18Å; F895-R939 PolarHBondContact N-O 2.78Å; F895-R939 VanDerWaalsContact N-O 3.08Å; V898-R939 HydrophobicContact CG2-CB 4.07Å; V935-R939 WeakPolarHBondContact O-CG 3.43Å; V935-R939 PolarHBondContact O-N 3.42Å; V935-R939 PolarHBondContact O-NE 3.13Å; A936-R939 PolarHBondContact O-N 2.87Å; V937-R939 PolarHBondContact O-N 2.8Å
940	A	93.6	Very high	92	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	136	178.5	0	0	0	0	0	111.4	F704 I708 F895 V898 V937 L944	F704-A940 WeakPolarHBondContact CD1-O 3.42Å; I708-A940 HydrophobicContact CD1-CB 3.8Å; F895-A940 CarbonylContact O-C 3.37Å; F895-A940 WeakPolarHBondContact O-CA 3.26Å; V898-A940 HydrophobicContact CB-CB 3.92Å; V898-A940 HydrophobicContact CG2-CB 3.78Å; V937-A940 PolarHBondContact O-N 3.09Å; A940-L944 HydrophobicContact CB-CB 4.26Å; A940-L944 HydrophobicContact CB-CD1 4.24Å
941	M	90.8	Very high	91.9	Very high	57 Å²	57	11.2 Å²	11.2	28%	0.281	6%	0.057	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-51.2	173.7	-61.9	177	73.1	0	0	111.6	R703 E894 F895	R703-M941 HydrophobicContact CG-CG 3.81Å; R703-M941 VanDerWaalsContact O-CA 3.28Å; R703-M941 WeakPolarHBondContact O-CA 3.32Å; E894-M941 HydrophobicContact CB-CG 4.25Å; E894-M941 HydrophobicContact CB-SD 3.92Å; F895-M941 PolarHBondContact O-N 2.86Å
942	S	90.1	Very high	91.7	Very high	42 Å²	42	13.4 Å²	13.4	29%	0.294	7%	0.066	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-45.6	-172.6	73	0	0	0	0	113.8	S733 G734 D896	S733-S942 CarbonylContact C-O 3.5Å; S733-S942 WeakPolarHBondContact CA-O 3.04Å; G734-S942 PolarHBondContact N-O 3.32Å; D896-S942 WeakPolarHBondContact O-CA 3.47Å; D896-S942 WeakPolarHBondContact O-CB 3.46Å; D896-S942 PolarHBondContact O-N 2.94Å; D896-S942 PolarHBondContact O-OG 3.36Å
943	S	92.1	Very high	91.6	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	140.6	-174.9	-179.4	0	0	0	0	112.3	G734 D737 A740 D896 T897 V898	G734-S943 WeakPolarHBondContact O-CA 3.42Å; D737-S943 WeakPolarHBondContact OD1-CB 3.46Å; D737-S943 PolarHBondContact OD1-OG 3.46Å; A740-S943 VanDerWaalsContact CB-OG 3.31Å; A740-S943 WeakPolarHBondContact CB-OG 3.46Å; A740-S943 PolarHBondContact N-OG 3.35Å; D896-S943 PolarHBondContact O-N 2.65Å; T897-S943 VanDerWaalsContact CA-O 3.3Å; T897-S943 WeakPolarHBondContact CA-O 3.41Å; V898-S943 PolarHBondContact N-O 2.88Å
944	L	93.7	Very high	91.4	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.1	178.9	178.7	72.7	0	0	0	110.8	I708 V711 G734 V735 C736 V898 V900 V937 A940 I946	I708-L944 HydrophobicContact CD1-CB 4.36Å; I708-L944 HydrophobicContact CG1-CB 4.17Å; V711-L944 HydrophobicContact CB-CD2 4.46Å; V711-L944 HydrophobicContact CG1-CD2 4.25Å; G734-L944 PolarHBondContact O-N 2.89Å; G734-L944 VanDerWaalsContact O-N 3.14Å; V735-L944 HydrophobicContact CG2-CB 4.42Å; V735-L944 HydrophobicContact CG2-CD2 4.37Å; C736-L944 PolarHBondContact N-O 3.32Å; V898-L944 HydrophobicContact CB-CD1 4.25Å; V898-L944 HydrophobicContact CG1-CD1 4.38Å; V900-L944 HydrophobicContact CG2-CD1 4.05Å; V937-L944 HydrophobicContact CB-CD2 4.44Å; V937-L944 HydrophobicContact CG1-CD2 3.71Å; V937-L944 HydrophobicContact CG2-CD2 4.3Å; A940-L944 HydrophobicContact CB-CB 4.26Å; A940-L944 HydrophobicContact CB-CD1 4.24Å; L944-I946 HydrophobicContact CD2-CG2 3.58Å; L944-I946 HydrophobicContact CG-CG2 3.83Å
945	V	91.9	Very high	91.2	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	112.1	168	-171.3	0	0	0	0	108.9	A740 L744 V898 I899 V900 T1004	A740-V945 HydrophobicContact CB-CG2 3.62Å; L744-V945 HydrophobicContact CD1-CG1 4.5Å; V898-V945 PolarHBondContact O-N 3.24Å; I899-V945 HydrophobicContact CB-CB 4.42Å; I899-V945 HydrophobicContact CG1-CB 4.18Å; I899-V945 HydrophobicContact CG1-CG2 3.91Å; I899-V945 HydrophobicContact CG2-CB 4.32Å; I899-V945 HydrophobicContact CG2-CG1 4.48Å; V900-V945 PolarHBondContact N-O 3.12Å; V945-T1004 HydrophobicContact CG1-CG2 3.81Å
946	I	90.6	Very high	90.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.081	C	C	.	.			trans	-89.9	158.1	-179.1	60	165	0	0	0	112.4	V735 C736 L944 I950 L951 L954 C1003 T1004	V735-I946 HydrophobicContact CG1-CD1 4.26Å; V735-I946 HydrophobicContact CG1-CG1 4.29Å; V735-I946 HydrophobicContact CG1-CG2 3.82Å; C736-I946 VanDerWaalsContact SG-CG1 3.54Å; L944-I946 HydrophobicContact CD2-CG2 3.58Å; L944-I946 HydrophobicContact CG-CG2 3.83Å; I946-I950 HydrophobicContact CB-CB 4.05Å; I946-I950 HydrophobicContact CB-CD1 4.17Å; I946-I950 HydrophobicContact CB-CG2 3.96Å; I946-I950 HydrophobicContact CD1-CG2 4.4Å; I946-I950 HydrophobicContact CG2-CB 4.4Å; I946-I950 HydrophobicContact CG2-CD1 4.19Å; I946-I950 HydrophobicContact CG2-CG2 3.82Å; I946-L951 HydrophobicContact CD1-CB 4.31Å; I946-L951 HydrophobicContact CD1-CD1 4.48Å; I946-L954 HydrophobicContact CD1-CD1 4.16Å; I946-C1003 VanDerWaalsContact O-CA 3.31Å; I946-C1003 WeakPolarHBondContact O-CA 3.43Å; I946-C1003 VanDerWaalsContact O-CB 3.3Å; I946-C1003 WeakPolarHBondContact O-CB 3.4Å; I946-T1004 PolarHBondContact O-N 3.47Å
947	T	89.9	Confident	90.4	Very high	3 Å²	3	16.4 Å²	16.4	2%	0.018	9%	0.085	C	C	.	.			trans	-88.5	164.3	172	61.9	0	0	0	0	111.5	V900 T901 N949 I950 L951	V900-T947 HydrophobicContact CB-CG2 4.35Å; V900-T947 HydrophobicContact CG1-CG2 4.31Å; V900-T947 WeakPolarHBondContact O-CG2 3.44Å; T901-T947 VanDerWaalsContact O-CG2 3.27Å; T901-T947 WeakPolarHBondContact O-CG2 3.38Å; T947-N949 PolarHBondContact O-N 3.33Å; T947-N949 VanDerWaalsContact O-N 3.17Å; T947-N949 PolarHBondContact OG1-N 2.96Å; T947-I950 PolarHBondContact O-N 3.34Å; T947-I950 PolarHBondContact OG1-N 2.8Å; T947-L951 PolarHBondContact O-N 3.36Å
948	K	86.4	Confident	90	Very high	91 Å²	91	16.9 Å²	16.9	40%	0.396	9%	0.09	S	C	.	.	H	α-helix	trans	-55.9	-31	169.6	-174.3	175.1	-178.8	177.2	0	112.2	R952	K948-R952 WeakPolarHBondContact O-CG 3.26Å; K948-R952 PolarHBondContact O-N 3.44Å
949	N	87.9	Confident	89.7	Confident	13 Å²	13	17.9 Å²	17.9	7%	0.07	10%	0.095	C	C	.	.	H	α-helix	trans	-68.8	-47.6	177.3	-177.3	44.7	0	0	0	112.8	V905 T906 V907 T947 L951 R952 I953	V905-N949 PolarHBondContact O-ND2 3.26Å; T906-N949 WeakPolarHBondContact CA-OD1 3.45Å; V907-N949 PolarHBondContact N-OD1 3.4Å; T947-N949 PolarHBondContact O-N 3.33Å; T947-N949 VanDerWaalsContact O-N 3.17Å; T947-N949 PolarHBondContact OG1-N 2.96Å; N949-L951 PolarHBondContact O-N 3.37Å; N949-R952 WeakPolarHBondContact O-CB 3.47Å; N949-R952 PolarHBondContact O-N 2.93Å; N949-I953 PolarHBondContact O-N 3.07Å
950	I	89.5	Confident	89.4	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-59.3	-41.7	173.7	-65.9	168	0	0	0	109.8	V711 V900 L933 V937 I946 T947 R952 I953 L954	V711-I950 HydrophobicContact CG1-CG2 3.89Å; V900-I950 HydrophobicContact CB-CD1 4.32Å; V900-I950 HydrophobicContact CG1-CD1 4.21Å; V900-I950 HydrophobicContact CG2-CD1 4.46Å; L933-I950 HydrophobicContact CD1-CD1 3.95Å; L933-I950 HydrophobicContact CD1-CG1 3.93Å; L933-I950 HydrophobicContact CD2-CG1 4.31Å; V937-I950 HydrophobicContact CG2-CD1 4.01Å; I946-I950 HydrophobicContact CB-CB 4.05Å; I946-I950 HydrophobicContact CB-CD1 4.17Å; I946-I950 HydrophobicContact CB-CG2 3.96Å; I946-I950 HydrophobicContact CD1-CG2 4.4Å; I946-I950 HydrophobicContact CG2-CB 4.4Å; I946-I950 HydrophobicContact CG2-CD1 4.19Å; I946-I950 HydrophobicContact CG2-CG2 3.82Å; T947-I950 PolarHBondContact O-N 3.34Å; T947-I950 PolarHBondContact OG1-N 2.8Å; I950-R952 VanDerWaalsContact C-N 3.3Å; I950-R952 PolarHBondContact O-N 3.22Å; I950-I953 WeakPolarHBondContact O-CB 3.44Å; I950-I953 PolarHBondContact O-N 2.89Å; I950-I953 VanDerWaalsContact O-N 3.08Å; I950-L954 HydrophobicContact CG2-CD1 4.31Å; I950-L954 HydrophobicContact CG2-CG 4.44Å; I950-L954 WeakPolarHBondContact O-CG 3.38Å; I950-L954 PolarHBondContact O-N 2.93Å
951	L	89.1	Confident	89	Confident	19 Å²	19	19.6 Å²	19.6	10%	0.099	10%	0.102	C	C	.	.	H	α-helix	trans	-57.6	-42.2	174.6	-175.8	63.5	0	0	0	111.8	I946 T947 N949 I953 L954 T955 F961 T1008	I946-L951 HydrophobicContact CD1-CB 4.31Å; I946-L951 HydrophobicContact CD1-CD1 4.48Å; T947-L951 PolarHBondContact O-N 3.36Å; N949-L951 PolarHBondContact O-N 3.37Å; L951-I953 PolarHBondContact O-N 3.32Å; L951-L954 PolarHBondContact O-N 2.83Å; L951-T955 WeakPolarHBondContact O-CG2 3.34Å; L951-T955 PolarHBondContact O-N 3.44Å; L951-F961 HydrophobicContact CD1-CD2 3.92Å; L951-F961 HydrophobicContact CD1-CE2 3.78Å; L951-T1008 HydrophobicContact CD2-CG2 4.17Å
952	R	88.6	Confident	88.8	Confident	47 Å²	47	18 Å²	18	18%	0.177	10%	0.095	C	C	.	.	H	α-helix	trans	-60.4	-42.4	174.3	-72.6	174.5	179.2	170.4	-0.5	112	V907 P908 K948 N949 I950 L954 T955 V956	V907-R952 HydrophobicContact CB-CB 4.17Å; V907-R952 HydrophobicContact CG1-CB 4.39Å; V907-R952 WeakPolarHBondContact O-CD 3.18Å; V907-R952 PolarHBondContact O-NH1 3.06Å; P908-R952 PolarHBondContact O-NH1 3.36Å; K948-R952 WeakPolarHBondContact O-CG 3.26Å; K948-R952 PolarHBondContact O-N 3.44Å; N949-R952 WeakPolarHBondContact O-CB 3.47Å; N949-R952 PolarHBondContact O-N 2.93Å; I950-R952 VanDerWaalsContact C-N 3.3Å; I950-R952 PolarHBondContact O-N 3.22Å; R952-L954 VanDerWaalsContact C-N 3.33Å; R952-L954 PolarHBondContact O-N 3Å; R952-T955 PolarHBondContact O-N 3.16Å; R952-T955 PolarHBondContact O-OG1 3.42Å; R952-V956 WeakPolarHBondContact O-CG2 3.44Å; R952-V956 PolarHBondContact O-N 3.13Å
953	I	89.8	Confident	88.7	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59.7	-44.5	175.2	-62.6	167.2	0	0	0	110.7	I715 V718 V907 W930 L933 N949 I950 L951 T955 V956 A957	I715-I953 HydrophobicContact CG1-CG2 4.36Å; V718-I953 HydrophobicContact CB-CG2 4.28Å; V718-I953 HydrophobicContact CG1-CG2 4.27Å; V907-I953 HydrophobicContact CG2-CD1 4.32Å; V907-I953 HydrophobicContact CG2-CG1 3.6Å; W930-I953 HydrophobicContact CZ3-CD1 3.83Å; L933-I953 HydrophobicContact CD2-CD1 3.6Å; N949-I953 PolarHBondContact O-N 3.07Å; I950-I953 WeakPolarHBondContact O-CB 3.44Å; I950-I953 PolarHBondContact O-N 2.89Å; I950-I953 VanDerWaalsContact O-N 3.08Å; L951-I953 PolarHBondContact O-N 3.32Å; I953-T955 VanDerWaalsContact C-N 3.32Å; I953-T955 PolarHBondContact O-N 3Å; I953-V956 WeakPolarHBondContact O-CB 3.28Å; I953-V956 PolarHBondContact O-N 3.42Å; I953-A957 PolarHBondContact O-N 3.39Å
954	L	90.6	Very high	88.5	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.7	-38.7	176.6	-64.5	176.4	0	0	0	112.2	F710 V711 A714 I946 I950 L951 R952 V956 A957 G958 E959 F961	F710-L954 HydrophobicContact CE1-CD2 4.17Å; V711-L954 HydrophobicContact CG2-CD1 4.37Å; A714-L954 HydrophobicContact CB-CD2 3.62Å; I946-L954 HydrophobicContact CD1-CD1 4.16Å; I950-L954 HydrophobicContact CG2-CD1 4.31Å; I950-L954 HydrophobicContact CG2-CG 4.44Å; I950-L954 WeakPolarHBondContact O-CG 3.38Å; I950-L954 PolarHBondContact O-N 2.93Å; L951-L954 PolarHBondContact O-N 2.83Å; R952-L954 VanDerWaalsContact C-N 3.33Å; R952-L954 PolarHBondContact O-N 3Å; L954-V956 PolarHBondContact O-N 3.08Å; L954-A957 CarbonylContact O-C 3.57Å; L954-A957 WeakPolarHBondContact O-CA 3.41Å; L954-A957 WeakPolarHBondContact O-CB 3.49Å; L954-A957 PolarHBondContact O-N 3.17Å; L954-G958 PolarHBondContact O-N 3.02Å; L954-E959 CarbonylContact C-O 3.57Å; L954-E959 HydrophobicContact CB-CB 4.34Å; L954-E959 PolarHBondContact O-N 3.15Å; L954-F961 HydrophobicContact CD1-CE2 3.68Å; L954-F961 HydrophobicContact CD1-CZ 3.66Å
955	T	89.7	Confident	88.2	Confident	10 Å²	10	22.4 Å²	22.4	6%	0.061	11%	0.109	C	C	.	.	H	α-helix	trans	-65.5	-24.8	175.1	66.1	0	0	0	0	113.8	S910 G911 L951 R952 I953 G958 E959 Y960	S910-T955 WeakPolarHBondContact CA-OG1 3.42Å; G911-T955 PolarHBondContact N-OG1 2.71Å; L951-T955 WeakPolarHBondContact O-CG2 3.34Å; L951-T955 PolarHBondContact O-N 3.44Å; R952-T955 PolarHBondContact O-N 3.16Å; R952-T955 PolarHBondContact O-OG1 3.42Å; I953-T955 VanDerWaalsContact C-N 3.32Å; I953-T955 PolarHBondContact O-N 3Å; T955-G958 PolarHBondContact O-N 3.09Å; T955-E959 VanDerWaalsContact CA-O 3.29Å; T955-E959 WeakPolarHBondContact CA-O 3.25Å; T955-E959 PolarHBondContact N-O 2.63Å; T955-Y960 HydrophobicContact CG2-CD1 3.64Å; T955-Y960 HydrophobicContact CG2-CE1 3.43Å; T955-Y960 VanDerWaalsContact CG2-CE1 3.43Å; T955-Y960 HydrophobicContact CG2-CG 4.3Å; T955-Y960 PolarHBondContact O-OH 3.18Å
956	V	87.1	Confident	87.9	Confident	48 Å²	48	24.5 Å²	24.5	29%	0.291	12%	0.119	S	C	.	.	H	α-helix	trans	-73.4	-34.1	172.1	178.3	0	0	0	0	110.6	V718 L914 F922 R952 I953 L954 G958	V718-V956 HydrophobicContact CG1-CB 3.98Å; V718-V956 HydrophobicContact CG1-CG1 3.57Å; V718-V956 HydrophobicContact CG2-CG1 4.5Å; L914-V956 HydrophobicContact CD2-CG1 4.47Å; L914-V956 HydrophobicContact CD2-CG2 3.79Å; F922-V956 HydrophobicContact CE2-CG1 4.23Å; F922-V956 HydrophobicContact CZ-CG1 4.25Å; F922-V956 HydrophobicContact CZ-CG2 4.26Å; R952-V956 WeakPolarHBondContact O-CG2 3.44Å; R952-V956 PolarHBondContact O-N 3.13Å; I953-V956 WeakPolarHBondContact O-CB 3.28Å; I953-V956 PolarHBondContact O-N 3.42Å; L954-V956 PolarHBondContact O-N 3.08Å; V956-G958 PolarHBondContact O-N 3.03Å
957	A	86.3	Confident	87.1	Confident	11 Å²	11	26.6 Å²	26.6	9%	0.091	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-1.2	168.6	0	0	0	0	0	113.6	Y407 A714 V718 I953 L954	Y407-A957 WeakPolarHBondContact CB-O 3.41Å; Y407-A957 PolarHBondContact N-O 3.43Å; A714-A957 HydrophobicContact CB-CB 4.35Å; V718-A957 HydrophobicContact CG2-CB 3.72Å; I953-A957 PolarHBondContact O-N 3.39Å; L954-A957 CarbonylContact O-C 3.57Å; L954-A957 WeakPolarHBondContact O-CA 3.41Å; L954-A957 WeakPolarHBondContact O-CB 3.49Å; L954-A957 PolarHBondContact O-N 3.17Å
958	G	85.1	Confident	85.9	Confident	10 Å²	10	31.4 Å²	31.4	10%	0.103	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.4	8.6	-178	0	0	0	0	0	114.4	S406 L954 T955 V956	S406-G958 WeakPolarHBondContact CB-O 3.36Å; L954-G958 PolarHBondContact O-N 3.02Å; T955-G958 PolarHBondContact O-N 3.09Å; V956-G958 PolarHBondContact O-N 3.03Å
959	E	89.1	Confident	84.7	Confident	20 Å²	20	30.9 Å²	30.9	9%	0.093	18%	0.175	C	C	.	.			trans	-93.9	124.8	-180	-171	50.7	-120.7	0	0	111.9	S406 R408 F710 L954 T955 F961	S406-E959 PolarHBondContact OG-OE2 3.48Å; R408-E959 VanDerWaalsContact CB-OE2 3.24Å; R408-E959 WeakPolarHBondContact CB-OE2 3.49Å; R408-E959 VanDerWaalsContact CD-CD 3.45Å; R408-E959 WeakPolarHBondContact CD-OE2 3.39Å; F710-E959 HydrophobicContact CE1-CB 4.18Å; F710-E959 HydrophobicContact CE1-CG 3.89Å; F710-E959 HydrophobicContact CZ-CB 4.12Å; F710-E959 HydrophobicContact CZ-CG 4.2Å; L954-E959 CarbonylContact C-O 3.57Å; L954-E959 HydrophobicContact CB-CB 4.34Å; L954-E959 PolarHBondContact O-N 3.15Å; T955-E959 VanDerWaalsContact CA-O 3.29Å; T955-E959 WeakPolarHBondContact CA-O 3.25Å; T955-E959 PolarHBondContact N-O 2.63Å; E959-F961 HydrophobicContact CG-CD1 4.35Å; E959-F961 HydrophobicContact CG-CD2 4.45Å; E959-F961 HydrophobicContact CG-CE1 4.28Å; E959-F961 HydrophobicContact CG-CE2 4.36Å; E959-F961 HydrophobicContact CG-CG 4.48Å; E959-F961 HydrophobicContact CG-CZ 4.3Å; E959-F961 VanDerWaalsContact OE1-CA 3.32Å; E959-F961 WeakPolarHBondContact OE1-CA 3.29Å; E959-F961 PolarHBondContact OE1-N 3.27Å
960	Y	85.3	Confident	83.3	Confident	21 Å²	21	32.6 Å²	32.6	8%	0.082	18%	0.184	C	C	.	.			trans	-127.7	3.1	-177.6	-72.3	-92.4	0	0	0	112.7	H912 T955 L962 R1021 I1022	H912-Y960 AromaticContact CE1-CE1 3.86Å; H912-Y960 PolarHBondContact N-OH 3.21Å; H912-Y960 AromaticContact ND1-CE1 3.44Å; H912-Y960 WeakPolarHBondContact ND1-CE1 3.43Å; H912-Y960 AromaticContact ND1-CZ 3.56Å; H912-Y960 PolarHBondContact ND1-OH 3.41Å; T955-Y960 HydrophobicContact CG2-CD1 3.64Å; T955-Y960 HydrophobicContact CG2-CE1 3.43Å; T955-Y960 VanDerWaalsContact CG2-CE1 3.43Å; T955-Y960 HydrophobicContact CG2-CG 4.3Å; T955-Y960 PolarHBondContact O-OH 3.18Å; Y960-L962 VanDerWaalsContact C-N 3.29Å; Y960-L962 PolarHBondContact O-N 3.41Å; Y960-R1021 HydrophobicContact CD1-CB 4.09Å; Y960-R1021 HydrophobicContact CD1-CG 3.92Å; Y960-R1021 HydrophobicContact CD2-CB 3.84Å; Y960-R1021 HydrophobicContact CE1-CB 3.99Å; Y960-R1021 HydrophobicContact CE1-CG 3.65Å; Y960-R1021 HydrophobicContact CE2-CB 3.75Å; Y960-R1021 HydrophobicContact CE2-CG 4.32Å; Y960-R1021 VanDerWaalsContact CE2-O 3.23Å; Y960-R1021 WeakPolarHBondContact CE2-O 3.48Å; Y960-R1021 HydrophobicContact CG-CB 4.02Å; Y960-R1021 HydrophobicContact CG-CG 4.36Å; Y960-I1022 HydrophobicContact CD2-CG2 3.97Å
961	F	85.4	Confident	81.7	Confident	20 Å²	20	35.5 Å²	35.5	9%	0.088	21%	0.208	C	C	.	.			trans	52.7	47	-176.8	-57.2	-80.2	0	0	0	112.3	L951 L954 E959 Q999 M1001	L951-F961 HydrophobicContact CD1-CD2 3.92Å; L951-F961 HydrophobicContact CD1-CE2 3.78Å; L954-F961 HydrophobicContact CD1-CE2 3.68Å; L954-F961 HydrophobicContact CD1-CZ 3.66Å; E959-F961 HydrophobicContact CG-CD1 4.35Å; E959-F961 HydrophobicContact CG-CD2 4.45Å; E959-F961 HydrophobicContact CG-CE1 4.28Å; E959-F961 HydrophobicContact CG-CE2 4.36Å; E959-F961 HydrophobicContact CG-CG 4.48Å; E959-F961 HydrophobicContact CG-CZ 4.3Å; E959-F961 VanDerWaalsContact OE1-CA 3.32Å; E959-F961 WeakPolarHBondContact OE1-CA 3.29Å; E959-F961 PolarHBondContact OE1-N 3.27Å; F961-Q999 PolarHBondContact O-N 2.98Å; F961-M1001 HydrophobicContact CB-CE 3.47Å; F961-M1001 VanDerWaalsContact CB-CE 3.47Å; F961-M1001 HydrophobicContact CB-SD 3.8Å; F961-M1001 HydrophobicContact CD1-CE 3.32Å; F961-M1001 HydrophobicContact CD1-SD 4.28Å; F961-M1001 HydrophobicContact CD2-CE 3.66Å; F961-M1001 HydrophobicContact CD2-SD 3.46Å; F961-M1001 WeakPolarHBondContact CD2-SD 3.43Å; F961-M1001 HydrophobicContact CE1-CE 3.81Å; F961-M1001 HydrophobicContact CE2-CE 4.12Å; F961-M1001 HydrophobicContact CE2-SD 3.98Å; F961-M1001 HydrophobicContact CG-CE 3.2Å; F961-M1001 HydrophobicContact CG-SD 3.6Å; F961-M1001 HydrophobicContact CZ-CE 4.17Å
962	L	86.8	Confident	79.8	Confident	24 Å²	24	40 Å²	40	13%	0.126	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	136.7	176.2	-57.4	-177	0	0	0	109.6	Y960 M996 A997 R998 L1013 I1022	Y960-L962 VanDerWaalsContact C-N 3.29Å; Y960-L962 PolarHBondContact O-N 3.41Å; L962-M996 HydrophobicContact CB-SD 4.5Å; L962-A997 WeakPolarHBondContact CA-O 3.47Å; L962-R998 HydrophobicContact CD2-CB 4.19Å; L962-R998 HydrophobicContact CD2-CG 4.46Å; L962-L1013 HydrophobicContact CD1-CD1 4.05Å; L962-L1013 HydrophobicContact CD2-CD1 3.44Å; L962-L1013 VanDerWaalsContact CD2-CD1 3.44Å; L962-L1013 HydrophobicContact CG-CD1 4.41Å; L962-I1022 HydrophobicContact CD1-CD1 4.26Å; L962-I1022 HydrophobicContact CD1-CG1 4.49Å; L962-I1022 HydrophobicContact CD1-CG2 3.89Å
963	K	87.3	Confident	78.1	Confident	65 Å²	65	40.1 Å²	40.1	28%	0.283	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	138.7	176.6	-67.5	-170	159	168.7	0	110.7	E363 M996 A997 Q999	E363-K963 HydrophobicContact CG-CG 4.45Å; E363-K963 WeakPolarHBondContact OE1-CA 3.47Å; E363-K963 WeakPolarHBondContact OE1-CB 3.41Å; E363-K963 WeakPolarHBondContact OE2-CE 3.45Å; K963-M996 WeakPolarHBondContact O-CA 3.45Å; K963-A997 PolarHBondContact N-O 3.04Å; K963-A997 PolarHBondContact O-N 3Å; K963-Q999 VanDerWaalsContact NZ-CD 3.34Å
964	S	88.7	Confident	76.2	Confident	7 Å²	7	44.9 Å²	44.9	5%	0.049	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	113.6	175.2	65.2	0	0	0	0	110.2	L323 Q326 E363	L323-S964 WeakPolarHBondContact CD2-OG 3.35Å; Q326-S964 PolarHBondContact NE2-O 2.79Å; Q326-S964 VanDerWaalsContact NE2-O 3.13Å; E363-S964 PolarHBondContact OE1-N 2.72Å
965	K	87	Confident	75	Confident	62 Å²	62	47.1 Å²	47.1	27%	0.27	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	149.8	176.9	-65.5	-174.9	-178.1	178.8	0	110.3	L970 V995 A997 E1010	K965-L970 HydrophobicContact CB-CD1 4.1Å; K965-L970 HydrophobicContact CD-CD1 4.49Å; K965-L970 HydrophobicContact CD-CD2 4.29Å; K965-V995 PolarHBondContact N-O 3.16Å; K965-V995 PolarHBondContact O-N 3.25Å; K965-A997 HydrophobicContact CD-CB 4.1Å; K965-E1010 IonicContact NZ-OE1 3.95Å; K965-E1010 PolarHBondContact NZ-OE1 3.12Å; K965-E1010 VanDerWaalsContact NZ-OE1 3.14Å
966	M	85.3	Confident	74	Confident	43 Å²	43	50.5 Å²	50.5	21%	0.212	36%	0.358	C	S	.	.			trans	-73.7	141	174.4	-88.6	-63.3	176.4	0	0	111.4	P325 Q326 A329 S968 S969	P325-M966 HydrophobicContact CB-CE 3.42Å; P325-M966 VanDerWaalsContact CB-CE 3.42Å; P325-M966 HydrophobicContact CB-CG 4.42Å; P325-M966 WeakPolarHBondContact O-CE 3.33Å; Q326-M966 VanDerWaalsContact CA-CE 3.45Å; Q326-M966 HydrophobicContact CB-CE 4.35Å; Q326-M966 HydrophobicContact CG-CE 4.13Å; A329-M966 HydrophobicContact CB-CE 4.13Å; M966-S968 VanDerWaalsContact C-N 3.25Å; M966-S968 PolarHBondContact O-N 3.01Å; M966-S969 PolarHBondContact O-N 3.2Å; M966-S969 VanDerWaalsContact O-N 3.09Å; M966-S969 PolarHBondContact O-OG 2.96Å
967	P	75	Confident	73.7	Confident	45 Å²	45	50.4 Å²	50.4	29%	0.292	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-59.2	-35.5	-178.2	-20.9	32	0	0	0	113	S969 L970 A971 S992 V995	P967-S969 PolarHBondContact O-N 3.29Å; P967-L970 PolarHBondContact O-N 3.41Å; P967-L970 VanDerWaalsContact O-N 3.15Å; P967-A971 PolarHBondContact O-N 3.16Å; P967-S992 WeakPolarHBondContact CG-O 3.35Å; P967-V995 HydrophobicContact CB-CG2 4.27Å; P967-V995 HydrophobicContact CG-CG2 4.15Å
968	S	64.8	Low	73.5	Confident	104 Å²	104	54 Å²	54	73%	0.727	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-61.6	-26.6	178	50.7	0	0	0	0	114.1	M966 L970	M966-S968 VanDerWaalsContact C-N 3.25Å; M966-S968 PolarHBondContact O-N 3.01Å; S968-L970 VanDerWaalsContact C-N 3.32Å; S968-L970 PolarHBondContact O-N 3.34Å
969	S	60.2	Low	73.5	Confident	80 Å²	80	54.1 Å²	54.1	56%	0.559	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-77.6	-14.8	178.5	67	0	0	0	0	114.1	M966 P967	M966-S969 PolarHBondContact O-N 3.2Å; M966-S969 VanDerWaalsContact O-N 3.09Å; M966-S969 PolarHBondContact O-OG 2.96Å; P967-S969 PolarHBondContact O-N 3.29Å
970	L	59.2	Low	73.3	Confident	49 Å²	49	54.7 Å²	54.7	26%	0.257	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-15.5	-175	-66.1	164.7	0	0	0	112.9	K965 P967 S968 A972 L977 V995	K965-L970 HydrophobicContact CB-CD1 4.1Å; K965-L970 HydrophobicContact CD-CD1 4.49Å; K965-L970 HydrophobicContact CD-CD2 4.29Å; P967-L970 PolarHBondContact O-N 3.41Å; P967-L970 VanDerWaalsContact O-N 3.15Å; S968-L970 VanDerWaalsContact C-N 3.32Å; S968-L970 PolarHBondContact O-N 3.34Å; L970-A972 PolarHBondContact O-N 3.02Å; L970-L977 HydrophobicContact CB-CD1 3.62Å; L970-L977 HydrophobicContact CD1-CD1 4.49Å; L970-V995 HydrophobicContact CD1-CB 4.06Å; L970-V995 HydrophobicContact CD1-CG1 4.18Å; L970-V995 HydrophobicContact CD1-CG2 4.46Å
971	A	54.7	Low	73.1	Confident	61 Å²	61	55.3 Å²	55.3	50%	0.504	39%	0.388	S	S	.	.			trans	-91.6	52.1	-172.3	0	0	0	0	0	113.4	P967 G973	P967-A971 PolarHBondContact O-N 3.16Å; A971-G973 PolarHBondContact O-N 3.5Å
972	A	50.5	Low	72.3	Confident	112 Å²	112	59.8 Å²	59.8	93%	0.926	42%	0.422	S	S	*	.	S	Bend	trans	-75.1	-6.5	174.4	0	0	0	0	0	113.7	L970	L970-A972 PolarHBondContact O-N 3.02Å
973	G	51.6	Low	71.6	Confident	51 Å²	51	62.4 Å²	62.4	53%	0.526	43%	0.433	S	S	.	.	S	Bend	trans	-138.7	122.1	172	0	0	0	0	0	109.7	A971 G975	A971-G973 PolarHBondContact O-N 3.5Å; G973-G975 PolarHBondContact O-N 2.86Å
974	G	51.9	Low	71.3	Confident	100 Å²	100	60.1 Å²	60.1	100%	1.031	43%	0.425	S	S	*	.	S	Bend	trans	-66.9	42.6	-164.2	0	0	0	0	0	118.7
975	G	64.3	Low	71.1	Confident	47 Å²	47	63.9 Å²	63.9	49%	0.485	45%	0.449	S	S	.	.	S	Bend	trans	-122.2	162.7	172.6	0	0	0	0	0	113.4	G973 L977	G973-G975 PolarHBondContact O-N 2.86Å; G975-L977 PolarHBondContact O-N 2.88Å
976	P	69.3	Low	71	Confident	80 Å²	80	61.8 Å²	61.8	52%	0.519	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-65	126.3	175.3	26.6	-32.3	0	0	0	110.5	C987 P990	P976-C987 HydrophobicContact CB-CB 3.94Å; P976-P990 HydrophobicContact CB-CG 4.49Å
977	L	79.5	Confident	70.9	Confident	46 Å²	46	62.2 Å²	62.2	24%	0.241	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-69.5	124.1	-175.5	-68.3	166.9	0	0	0	110.5	L970 G975 C987 V988 P1012	L970-L977 HydrophobicContact CB-CD1 3.62Å; L970-L977 HydrophobicContact CD1-CD1 4.49Å; G975-L977 PolarHBondContact O-N 2.88Å; L977-C987 WeakPolarHBondContact O-CA 3.49Å; L977-C987 WeakPolarHBondContact O-CB 3.46Å; L977-V988 HydrophobicContact CB-CG2 4.42Å; L977-V988 PolarHBondContact O-N 2.99Å; L977-P1012 HydrophobicContact CB-CG 4.02Å; L977-P1012 HydrophobicContact CD1-CG 4.43Å
978	P	83.6	Confident	71.3	Confident	88 Å²	88	60.6 Å²	60.6	57%	0.571	44%	0.437	S	S	*	.	B	Isolated β-bridge	trans	-67.2	146.8	177.1	28.2	-33.9	0	0	0	110.8
979	C	84.8	Confident	72.1	Confident	12 Å²	12	57.2 Å²	57.2	8%	0.081	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-64.1	135.4	174	-174.3	0	0	0	0	110.4	I981 C984 N986 C1014	C979-I981 PolarHBondContact O-N 2.67Å; C979-C984 HydrophobicContact CB-CB 3.95Å; C979-N986 WeakPolarHBondContact CB-O 3.35Å; C979-N986 PolarHBondContact N-O 3.4Å; C979-C1014 HydrophobicContact CB-CB 4.08Å; C979-C1014 PolarHBondContact SG-N 3.36Å
980	S	83.9	Confident	72.7	Confident	32 Å²	32	58.6 Å²	58.6	22%	0.224	42%	0.419	C	S	.	.	S	Bend	trans	-70.3	0.4	-178.7	64.8	0	0	0	0	115.2	G1011 P1012 L1013	S980-G1011 PolarHBondContact OG-O 3.26Å; S980-P1012 WeakPolarHBondContact CB-O 3.23Å; S980-P1012 PolarHBondContact N-O 3.36Å; S980-P1012 PolarHBondContact OG-O 3.29Å; S980-L1013 VanDerWaalsContact OG-CD2 3.32Å; S980-L1013 WeakPolarHBondContact OG-CD2 3.5Å
981	I	81.1	Confident	73.4	Confident	34 Å²	34	59 Å²	59	17%	0.174	44%	0.435	C	S	.	.	S	Bend	trans	-88.3	123.5	178.2	-68.2	157.6	0	0	0	108.7	C979 E983 C984 L1013 C1017 R1021	C979-I981 PolarHBondContact O-N 2.67Å; I981-E983 PolarHBondContact O-N 2.85Å; I981-C984 HydrophobicContact CB-CB 4.03Å; I981-C984 HydrophobicContact CG2-CB 4.2Å; I981-C984 PolarHBondContact O-N 3.04Å; I981-L1013 HydrophobicContact CD1-CD2 3.57Å; I981-L1013 HydrophobicContact CG1-CD2 3.82Å; I981-C1017 HydrophobicContact CD1-CB 3.64Å; I981-C1017 WeakPolarHBondContact CD1-SG 3.26Å; I981-R1021 VanDerWaalsContact CD1-NH1 3.27Å
982	S	68.1	Low	74.7	Confident	114 Å²	114	56.3 Å²	56.3	80%	0.797	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-7.9	-170.3	48.4	0	0	0	0	116.7
983	E	72.9	Confident	76.2	Confident	78 Å²	78	51.1 Å²	51.1	36%	0.364	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.1	6	-176.9	-66.5	173	-157.5	0	0	112.7	I981 P985 P1040	I981-E983 PolarHBondContact O-N 2.85Å; E983-P985 WeakPolarHBondContact O-CD 3.48Å; E983-P1040 VanDerWaalsContact O-CD 3.29Å; E983-P1040 WeakPolarHBondContact O-CD 3.39Å
984	C	81.3	Confident	77.9	Confident	18 Å²	18	48.7 Å²	48.7	12%	0.122	35%	0.345	C	S	.	.			trans	-87.4	123.1	-178.6	-169.2	0	0	0	0	110.6	C979 I981 N986	C979-C984 HydrophobicContact CB-CB 3.95Å; I981-C984 HydrophobicContact CB-CB 4.03Å; I981-C984 HydrophobicContact CG2-CB 4.2Å; I981-C984 PolarHBondContact O-N 3.04Å; C984-N986 PolarHBondContact O-N 3.49Å
985	P	83.2	Confident	79.6	Confident	85 Å²	85	44.1 Å²	44.1	55%	0.552	30%	0.296	S	S	*	.			trans	-79.1	-2.3	178.3	33.1	-37.2	0	0	0	113.5	E983 A1037	E983-P985 WeakPolarHBondContact O-CD 3.48Å; P985-A1037 HydrophobicContact CG-CB 4.05Å
986	N	85.3	Confident	80.8	Confident	19 Å²	19	42.4 Å²	42.4	10%	0.102	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-94.8	147.2	-170.8	-59.9	-48.1	0	0	0	111.4	C979 C984 C1014 A1037	C979-N986 WeakPolarHBondContact CB-O 3.35Å; C979-N986 PolarHBondContact N-O 3.4Å; C984-N986 PolarHBondContact O-N 3.49Å; N986-C1014 HydrophobicContact CB-CB 3.88Å; N986-A1037 PolarHBondContact ND2-O 3.28Å; N986-A1037 WeakPolarHBondContact OD1-CB 3.46Å; N986-A1037 PolarHBondContact OD1-N 3.47Å
987	C	84.1	Confident	81.6	Confident	52 Å²	52	38.7 Å²	38.7	35%	0.351	25%	0.252	S	S	.	.	B	Isolated β-bridge	trans	-103.9	163.9	166.6	-60.4	0	0	0	0	110.5	P976 L977	P976-C987 HydrophobicContact CB-CB 3.94Å; L977-C987 WeakPolarHBondContact O-CA 3.49Å; L977-C987 WeakPolarHBondContact O-CB 3.46Å
988	V	83.6	Confident	81.8	Confident	10 Å²	10	40.6 Å²	40.6	6%	0.061	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-67.4	135.1	171.2	-179.6	0	0	0	0	109.7	L977 V995 P1012	L977-V988 HydrophobicContact CB-CG2 4.42Å; L977-V988 PolarHBondContact O-N 2.99Å; V988-V995 HydrophobicContact CG1-CG1 4.17Å; V988-V995 HydrophobicContact CG1-CG2 3.83Å; V988-V995 HydrophobicContact CG2-CG1 4.13Å; V988-P1012 HydrophobicContact CG2-CB 4.04Å
989	T	80.9	Confident	81.5	Confident	33 Å²	33	39.8 Å²	39.8	20%	0.202	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-67.4	128.8	-177.4	-61	0	0	0	0	111.7	G991 S992 E1015 M1036	T989-G991 PolarHBondContact O-N 2.84Å; T989-S992 PolarHBondContact O-N 2.84Å; T989-S992 PolarHBondContact O-OG 3.22Å; T989-E1015 PolarHBondContact N-OE1 2.91Å; T989-E1015 PolarHBondContact N-OE2 2.97Å; T989-M1036 WeakPolarHBondContact OG1-CE 3.43Å
990	P	72.4	Confident	81.1	Confident	110 Å²	110	43.6 Å²	43.6	71%	0.714	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	121.1	168.6	-21.4	33.1	0	0	0	110.4	P976	P976-P990 HydrophobicContact CB-CG 4.49Å
991	G	73.9	Confident	80.7	Confident	56 Å²	56	42.5 Å²	42.5	58%	0.577	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.6	10	-176.7	0	0	0	0	0	115.4	R334 T989	R334-G991 PolarHBondContact NH2-O 2.86Å; T989-G991 PolarHBondContact O-N 2.84Å
992	S	82.7	Confident	80.4	Confident	6 Å²	6	41.6 Å²	41.6	4%	0.042	25%	0.246	C	C	.	.			trans	-61.2	138.7	166.5	-70.8	0	0	0	0	111.3	P967 T989 F994 E1015 M1029	P967-S992 WeakPolarHBondContact CG-O 3.35Å; T989-S992 PolarHBondContact O-N 2.84Å; T989-S992 PolarHBondContact O-OG 3.22Å; S992-F994 PolarHBondContact O-N 3.09Å; S992-E1015 WeakPolarHBondContact CB-OE1 2.99Å; S992-E1015 PolarHBondContact OG-OE1 2.85Å; S992-M1029 WeakPolarHBondContact CA-O 3.47Å
993	A	81.7	Confident	80.8	Confident	3 Å²	3	36.2 Å²	36.2	3%	0.025	21%	0.209	C	C	.	.	S	Bend	trans	-60.3	-36.1	-176.5	0	0	0	0	0	112.2	A329 L333 M1029	A329-A993 HydrophobicContact CB-CB 4.06Å; A329-A993 WeakPolarHBondContact CB-O 3.29Å; L333-A993 HydrophobicContact CD1-CB 4.3Å; A993-M1029 PolarHBondContact N-O 3.06Å
994	F	88.3	Confident	80.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.202	C	C	.	.	S	Bend	trans	-155.2	167.9	171.1	61.9	-93.2	0	0	0	109.2	Q326 T330 L361 S992 M996 L1028 M1029	Q326-F994 HydrophobicContact CB-CB 4.33Å; Q326-F994 HydrophobicContact CB-CD1 4.3Å; Q326-F994 HydrophobicContact CB-CG 4.42Å; Q326-F994 HydrophobicContact CG-CB 3.98Å; Q326-F994 HydrophobicContact CG-CG 4.41Å; T330-F994 WeakPolarHBondContact OG1-CD1 3.45Å; T330-F994 VanDerWaalsContact OG1-CE1 3.26Å; T330-F994 WeakPolarHBondContact OG1-CE1 3.48Å; L361-F994 HydrophobicContact CD1-CD1 4.45Å; L361-F994 HydrophobicContact CD1-CE1 4.07Å; L361-F994 HydrophobicContact CD1-CZ 4.27Å; L361-F994 HydrophobicContact CD2-CE1 4.26Å; L361-F994 HydrophobicContact CD2-CE2 4.1Å; L361-F994 HydrophobicContact CD2-CZ 3.67Å; S992-F994 PolarHBondContact O-N 3.09Å; F994-M996 HydrophobicContact CD2-SD 4.34Å; F994-M996 HydrophobicContact CE2-CE 3.64Å; F994-M996 HydrophobicContact CE2-CG 3.96Å; F994-M996 HydrophobicContact CE2-SD 3.83Å; F994-M996 HydrophobicContact CZ-CE 4.24Å; F994-L1028 HydrophobicContact CE1-CB 3.89Å; F994-L1028 HydrophobicContact CZ-CB 3.97Å; F994-M1029 HydrophobicContact CD2-CG 4.02Å; F994-M1029 HydrophobicContact CE1-CG 4.22Å; F994-M1029 HydrophobicContact CE2-CG 3.45Å; F994-M1029 VanDerWaalsContact CE2-CG 3.45Å; F994-M1029 HydrophobicContact CE2-SD 4.2Å; F994-M1029 HydrophobicContact CZ-CG 3.57Å; F994-M1029 WeakPolarHBondContact O-CE 3.4Å
995	V	87.3	Confident	80.3	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	132.8	177.9	-174.7	0	0	0	0	109.7	K965 P967 L970 V988 P1012	K965-V995 PolarHBondContact N-O 3.16Å; K965-V995 PolarHBondContact O-N 3.25Å; P967-V995 HydrophobicContact CB-CG2 4.27Å; P967-V995 HydrophobicContact CG-CG2 4.15Å; L970-V995 HydrophobicContact CD1-CB 4.06Å; L970-V995 HydrophobicContact CD1-CG1 4.18Å; L970-V995 HydrophobicContact CD1-CG2 4.46Å; V988-V995 HydrophobicContact CG1-CG1 4.17Å; V988-V995 HydrophobicContact CG1-CG2 3.83Å; V988-V995 HydrophobicContact CG2-CG1 4.13Å; V995-P1012 HydrophobicContact CG1-CB 3.66Å
996	M	88.9	Confident	79.5	Confident	11 Å²	11	35.9 Å²	35.9	5%	0.054	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	122.7	169.1	-70.8	-60.7	-159.3	0	0	109.1	L361 L962 K963 F994 L1013 V1018 I1022 T1025 M1029	L361-M996 HydrophobicContact CD2-CE 3.78Å; L962-M996 HydrophobicContact CB-SD 4.5Å; K963-M996 WeakPolarHBondContact O-CA 3.45Å; F994-M996 HydrophobicContact CD2-SD 4.34Å; F994-M996 HydrophobicContact CE2-CE 3.64Å; F994-M996 HydrophobicContact CE2-CG 3.96Å; F994-M996 HydrophobicContact CE2-SD 3.83Å; F994-M996 HydrophobicContact CZ-CE 4.24Å; M996-L1013 PolarHBondContact O-N 3.09Å; M996-V1018 HydrophobicContact CB-CG1 4.48Å; M996-V1018 HydrophobicContact CB-CG2 3.7Å; M996-V1018 HydrophobicContact CG-CG1 4.04Å; M996-V1018 HydrophobicContact CG-CG2 4.11Å; M996-I1022 HydrophobicContact CE-CD1 3.93Å; M996-T1025 HydrophobicContact CE-CG2 4.03Å; M996-M1029 HydrophobicContact CB-CE 4.26Å; M996-M1029 HydrophobicContact CB-SD 4.32Å; M996-M1029 HydrophobicContact CG-CE 4.2Å; M996-M1029 HydrophobicContact CG-SD 3.74Å
997	A	86.5	Confident	78.8	Confident	2 Å²	2	38.6 Å²	38.6	2%	0.017	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	139.9	177.3	0	0	0	0	0	110.4	L962 K963 K965 G1011	L962-A997 WeakPolarHBondContact CA-O 3.47Å; K963-A997 PolarHBondContact N-O 3.04Å; K963-A997 PolarHBondContact O-N 3Å; K965-A997 HydrophobicContact CD-CB 4.1Å; A997-G1011 WeakPolarHBondContact CA-O 3.3Å
998	R	83.7	Confident	78	Confident	86 Å²	86	36.5 Å²	36.5	33%	0.325	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	132.8	171.7	-169.2	179.1	-172.8	-176.4	2	109.1	L962 E1010 G1011	L962-R998 HydrophobicContact CD2-CB 4.19Å; L962-R998 HydrophobicContact CD2-CG 4.46Å; R998-E1010 WeakPolarHBondContact O-CA 3.43Å; R998-G1011 PolarHBondContact N-O 3.09Å; R998-G1011 PolarHBondContact O-N 3.24Å
999	Q	77.6	Confident	77.2	Confident	71 Å²	71	41.2 Å²	41.2	33%	0.332	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-77.4	146.6	173.3	-167.2	174.5	-13.2	0	0	111	F961 K963 M1001 T1008	F961-Q999 PolarHBondContact O-N 2.98Å; K963-Q999 VanDerWaalsContact NZ-CD 3.34Å; Q999-M1001 PolarHBondContact O-N 3.15Å; Q999-T1008 PolarHBondContact O-OG1 3.5Å; Q999-T1008 VanDerWaalsContact O-OG1 3.09Å
1000	K	76.6	Confident	77.2	Confident	92 Å²	92	44.9 Å²	44.9	40%	0.4	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-63.9	124.5	165.8	-170.5	-176.5	175.7	-164.8	0	108.7	V1007 E1010	K1000-V1007 HydrophobicContact CG-CG1 4.15Å; K1000-E1010 HydrophobicContact CB-CB 4.14Å
1001	M	75.5	Confident	77.7	Confident	10 Å²	10	40.2 Å²	40.2	5%	0.049	22%	0.217	C	C	.	.			trans	-130.8	126.6	173.9	-67.1	-171.2	147.8	0	0	108.6	C736 F961 Q999 T1008	C736-M1001 HydrophobicContact CB-CB 4.39Å; F961-M1001 HydrophobicContact CB-CE 3.47Å; F961-M1001 VanDerWaalsContact CB-CE 3.47Å; F961-M1001 HydrophobicContact CB-SD 3.8Å; F961-M1001 HydrophobicContact CD1-CE 3.32Å; F961-M1001 HydrophobicContact CD1-SD 4.28Å; F961-M1001 HydrophobicContact CD2-CE 3.66Å; F961-M1001 HydrophobicContact CD2-SD 3.46Å; F961-M1001 WeakPolarHBondContact CD2-SD 3.43Å; F961-M1001 HydrophobicContact CE1-CE 3.81Å; F961-M1001 HydrophobicContact CE2-CE 4.12Å; F961-M1001 HydrophobicContact CE2-SD 3.98Å; F961-M1001 HydrophobicContact CG-CE 3.2Å; F961-M1001 HydrophobicContact CG-SD 3.6Å; F961-M1001 HydrophobicContact CZ-CE 4.17Å; Q999-M1001 PolarHBondContact O-N 3.15Å; M1001-T1008 HydrophobicContact CB-CG2 4.43Å; M1001-T1008 WeakPolarHBondContact CB-OG1 3.29Å; M1001-T1008 PolarHBondContact N-OG1 3.47Å; M1001-T1008 PolarHBondContact O-N 3.27Å; M1001-T1008 PolarHBondContact O-OG1 2.92Å
1002	Q	74.1	Confident	78.3	Confident	14 Å²	14	38.5 Å²	38.5	7%	0.065	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-91.6	103.2	171.3	-62.7	-170.9	41.6	0	0	108.7	C736 E741 L744 V1007	C736-Q1002 PolarHBondContact SG-O 3.23Å; E741-Q1002 HydrophobicContact CG-CB 4.27Å; E741-Q1002 HydrophobicContact CG-CG 4.13Å; E741-Q1002 WeakPolarHBondContact OE1-CG 3.32Å; E741-Q1002 PolarHBondContact OE1-NE2 3.49Å; L744-Q1002 HydrophobicContact CD2-CB 3.93Å; Q1002-V1007 HydrophobicContact CG-CG1 4.5Å; Q1002-V1007 HydrophobicContact CG-CG2 4.33Å
1003	C	77.4	Confident	78.5	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.014	20%	0.195	C	C	.	.			trans	-86.2	164	164.1	-56.1	0	0	0	0	108.8	I946 E1005 C1006	I946-C1003 VanDerWaalsContact O-CA 3.31Å; I946-C1003 WeakPolarHBondContact O-CA 3.43Å; I946-C1003 VanDerWaalsContact O-CB 3.3Å; I946-C1003 WeakPolarHBondContact O-CB 3.4Å; C1003-E1005 PolarHBondContact O-N 3.02Å; C1003-E1005 VanDerWaalsContact O-N 3.1Å; C1003-C1006 WeakPolarHBondContact CA-O 3.32Å; C1003-C1006 WeakPolarHBondContact CB-O 3.47Å; C1003-C1006 PolarHBondContact N-O 3.08Å; C1003-C1006 PolarHBondContact O-N 3.05Å
1004	T	73.3	Confident	78.8	Confident	36 Å²	36	38.2 Å²	38.2	22%	0.221	19%	0.194	C	C	.	.	S	Bend	trans	-50.9	-37.3	177.8	43.8	0	0	0	0	114.2	L744 I899 V900 V945 I946	L744-T1004 HydrophobicContact CD1-CG2 4.47Å; I899-T1004 HydrophobicContact CG2-CG2 3.53Å; V900-T1004 WeakPolarHBondContact O-CG2 3.42Å; V945-T1004 HydrophobicContact CG1-CG2 3.81Å; I946-T1004 PolarHBondContact O-N 3.47Å
1005	E	69.8	Low	78.7	Confident	108 Å²	108	38.2 Å²	38.2	51%	0.505	19%	0.194	S	C	.	.	S	Bend	trans	-110.8	-14.9	-175.5	-55	-179.1	136.5	0	0	114.7	D902 C1003	D902-E1005 HydrophobicContact CB-CG 4.42Å; D902-E1005 WeakPolarHBondContact CB-OE1 3.49Å; C1003-E1005 PolarHBondContact O-N 3.02Å; C1003-E1005 VanDerWaalsContact O-N 3.1Å
1006	C	66	Low	78.7	Confident	30 Å²	30	40 Å²	40	20%	0.203	20%	0.2	C	C	.	.			trans	-145.9	141.3	-172	67.5	0	0	0	0	112.6	C1003	C1003-C1006 WeakPolarHBondContact CA-O 3.32Å; C1003-C1006 WeakPolarHBondContact CB-O 3.47Å; C1003-C1006 PolarHBondContact N-O 3.08Å; C1003-C1006 PolarHBondContact O-N 3.05Å
1007	V	71.1	Confident	78.5	Confident	76 Å²	76	39.4 Å²	39.4	46%	0.461	20%	0.197	S	C	.	.	B	Isolated β-bridge	trans	-99	125.6	166.3	-176	0	0	0	0	107.3	K1000 Q1002	K1000-V1007 HydrophobicContact CG-CG1 4.15Å; Q1002-V1007 HydrophobicContact CG-CG1 4.5Å; Q1002-V1007 HydrophobicContact CG-CG2 4.33Å
1008	T	67.6	Low	78.5	Confident	7 Å²	7	39.3 Å²	39.3	4%	0.043	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-81.6	128.8	173.5	62.4	0	0	0	0	109.8	L951 Q999 M1001 E1010	L951-T1008 HydrophobicContact CD2-CG2 4.17Å; Q999-T1008 PolarHBondContact O-OG1 3.5Å; Q999-T1008 VanDerWaalsContact O-OG1 3.09Å; M1001-T1008 HydrophobicContact CB-CG2 4.43Å; M1001-T1008 WeakPolarHBondContact CB-OG1 3.29Å; M1001-T1008 PolarHBondContact N-OG1 3.47Å; M1001-T1008 PolarHBondContact O-N 3.27Å; M1001-T1008 PolarHBondContact O-OG1 2.92Å; T1008-E1010 PolarHBondContact O-N 3.34Å
1009	N	67	Low	78.7	Confident	109 Å²	109	37.6 Å²	37.6	58%	0.583	19%	0.19	S	C	*	.	P	Polyproline II helix	trans	-62.2	128.9	176	-64	-14	0	0	0	109.9
1010	E	80.1	Confident	79	Confident	111 Å²	111	35.5 Å²	35.5	52%	0.519	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-74.4	142.1	167.2	175	166.4	-162.2	0	0	109.4	K965 R998 K1000 T1008	K965-E1010 IonicContact NZ-OE1 3.95Å; K965-E1010 PolarHBondContact NZ-OE1 3.12Å; K965-E1010 VanDerWaalsContact NZ-OE1 3.14Å; R998-E1010 WeakPolarHBondContact O-CA 3.43Å; K1000-E1010 HydrophobicContact CB-CB 4.14Å; T1008-E1010 PolarHBondContact O-N 3.34Å
1011	G	82.2	Confident	79.3	Confident	11 Å²	11	32.9 Å²	32.9	11%	0.113	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.8	168.6	167.8	0	0	0	0	0	113.8	S980 A997 R998	S980-G1011 PolarHBondContact OG-O 3.26Å; A997-G1011 WeakPolarHBondContact CA-O 3.3Å; R998-G1011 PolarHBondContact N-O 3.09Å; R998-G1011 PolarHBondContact O-N 3.24Å
1012	P	86.2	Confident	79.6	Confident	20 Å²	20	33.1 Å²	33.1	13%	0.13	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	147.8	-177.7	29.9	-34.5	0	0	0	111.6	L977 S980 V988 V995	L977-P1012 HydrophobicContact CB-CG 4.02Å; L977-P1012 HydrophobicContact CD1-CG 4.43Å; S980-P1012 WeakPolarHBondContact CB-O 3.23Å; S980-P1012 PolarHBondContact N-O 3.36Å; S980-P1012 PolarHBondContact OG-O 3.29Å; V988-P1012 HydrophobicContact CG2-CB 4.04Å; V995-P1012 HydrophobicContact CG1-CB 3.66Å
1013	L	87.4	Confident	80.2	Confident	3 Å²	3	32.5 Å²	32.5	2%	0.016	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	137.6	174.4	-64	-178	0	0	0	110.3	L962 S980 I981 M996 C1017 V1018	L962-L1013 HydrophobicContact CD1-CD1 4.05Å; L962-L1013 HydrophobicContact CD2-CD1 3.44Å; L962-L1013 VanDerWaalsContact CD2-CD1 3.44Å; L962-L1013 HydrophobicContact CG-CD1 4.41Å; S980-L1013 VanDerWaalsContact OG-CD2 3.32Å; S980-L1013 WeakPolarHBondContact OG-CD2 3.5Å; I981-L1013 HydrophobicContact CD1-CD2 3.57Å; I981-L1013 HydrophobicContact CG1-CD2 3.82Å; M996-L1013 PolarHBondContact O-N 3.09Å; L1013-C1017 HydrophobicContact CB-CB 4.47Å; L1013-V1018 HydrophobicContact CB-CG2 3.86Å
1014	C	87.8	Confident	80.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.169	C	C	.	.			trans	-68.4	158.3	168.7	72.3	0	0	0	0	111.2	C979 N986 R1016 C1017 V1018 M1036	C979-C1014 HydrophobicContact CB-CB 4.08Å; C979-C1014 PolarHBondContact SG-N 3.36Å; N986-C1014 HydrophobicContact CB-CB 3.88Å; C1014-R1016 VanDerWaalsContact C-N 3.31Å; C1014-R1016 PolarHBondContact O-N 2.91Å; C1014-C1017 WeakPolarHBondContact O-CA 3.32Å; C1014-C1017 VanDerWaalsContact O-CB 3.3Å; C1014-C1017 WeakPolarHBondContact O-CB 3.43Å; C1014-C1017 PolarHBondContact O-N 2.79Å; C1014-C1017 VanDerWaalsContact SG-CB 3.57Å; C1014-C1017 PolarHBondContact SG-SG 3.48Å; C1014-V1018 WeakPolarHBondContact O-CG2 3.34Å; C1014-V1018 PolarHBondContact O-N 3.27Å; C1014-M1036 HydrophobicContact CB-SD 4.32Å
1015	E	87.7	Confident	81.1	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-67.7	-33.2	-169	-62.9	86	165.3	0	0	111.5	T989 S992 C1017 V1018 W1019 M1029 T1030 V1033 M1036	T989-E1015 PolarHBondContact N-OE1 2.91Å; T989-E1015 PolarHBondContact N-OE2 2.97Å; S992-E1015 WeakPolarHBondContact CB-OE1 2.99Å; S992-E1015 PolarHBondContact OG-OE1 2.85Å; E1015-C1017 VanDerWaalsContact C-N 3.35Å; E1015-C1017 PolarHBondContact O-N 2.65Å; E1015-V1018 PolarHBondContact O-N 2.64Å; E1015-W1019 WeakPolarHBondContact O-CB 3.48Å; E1015-W1019 PolarHBondContact O-N 3.23Å; E1015-M1029 HydrophobicContact CG-CB 3.98Å; E1015-M1029 HydrophobicContact CG-CE 3.77Å; E1015-M1029 HydrophobicContact CG-SD 4.11Å; E1015-T1030 HydrophobicContact CB-CG2 3.8Å; E1015-T1030 HydrophobicContact CG-CG2 3.54Å; E1015-V1033 HydrophobicContact CB-CG2 4.15Å; E1015-M1036 HydrophobicContact CB-CE 4.05Å; E1015-M1036 HydrophobicContact CB-SD 4.14Å; E1015-M1036 HydrophobicContact CG-CE 4.37Å; E1015-M1036 WeakPolarHBondContact OE2-CE 3.47Å
1016	R	85.9	Confident	81.8	Confident	40 Å²	40	26 Å²	26	15%	0.151	14%	0.136	C	C	.	.	H	α-helix	trans	-62.3	-39.8	170	-170.5	69.2	177.5	-177.7	-4.3	112.6	C1014 V1018 W1019 T1020 V1033 M1036 E1038	C1014-R1016 VanDerWaalsContact C-N 3.31Å; C1014-R1016 PolarHBondContact O-N 2.91Å; R1016-V1018 VanDerWaalsContact C-N 3.34Å; R1016-W1019 PolarHBondContact O-N 3.2Å; R1016-T1020 WeakPolarHBondContact O-CB 3.37Å; R1016-T1020 PolarHBondContact O-N 3.2Å; R1016-T1020 PolarHBondContact O-OG1 3.02Å; R1016-V1033 WeakPolarHBondContact CD-O 3.27Å; R1016-M1036 HydrophobicContact CB-CB 3.89Å; R1016-M1036 HydrophobicContact CB-SD 3.95Å; R1016-M1036 HydrophobicContact CG-CB 4.4Å; R1016-E1038 IonicContact NH2-OE1 3.47Å; R1016-E1038 PolarHBondContact NH2-OE1 2.81Å
1017	C	85.8	Confident	82.8	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-70	-33.2	176.8	-80.9	0	0	0	0	112.3	I981 L1013 C1014 E1015 R1021 I1039	I981-C1017 HydrophobicContact CD1-CB 3.64Å; I981-C1017 WeakPolarHBondContact CD1-SG 3.26Å; L1013-C1017 HydrophobicContact CB-CB 4.47Å; C1014-C1017 WeakPolarHBondContact O-CA 3.32Å; C1014-C1017 VanDerWaalsContact O-CB 3.3Å; C1014-C1017 WeakPolarHBondContact O-CB 3.43Å; C1014-C1017 PolarHBondContact O-N 2.79Å; C1014-C1017 VanDerWaalsContact SG-CB 3.57Å; C1014-C1017 PolarHBondContact SG-SG 3.48Å; E1015-C1017 VanDerWaalsContact C-N 3.35Å; E1015-C1017 PolarHBondContact O-N 2.65Å; C1017-R1021 WeakPolarHBondContact O-CG 3.34Å; C1017-R1021 PolarHBondContact O-N 3.23Å; C1017-R1021 PolarHBondContact O-NH1 3.48Å; C1017-I1039 HydrophobicContact CB-CD1 4.49Å; C1017-I1039 WeakPolarHBondContact SG-CD1 3.5Å
1018	V	86.9	Confident	83.5	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-68.1	-48.8	173.1	179	0	0	0	0	110	M996 L1013 C1014 E1015 R1016 T1020 R1021 I1022 A1026 M1029	M996-V1018 HydrophobicContact CB-CG1 4.48Å; M996-V1018 HydrophobicContact CB-CG2 3.7Å; M996-V1018 HydrophobicContact CG-CG1 4.04Å; M996-V1018 HydrophobicContact CG-CG2 4.11Å; L1013-V1018 HydrophobicContact CB-CG2 3.86Å; C1014-V1018 WeakPolarHBondContact O-CG2 3.34Å; C1014-V1018 PolarHBondContact O-N 3.27Å; E1015-V1018 PolarHBondContact O-N 2.64Å; R1016-V1018 VanDerWaalsContact C-N 3.34Å; V1018-T1020 VanDerWaalsContact C-N 3.32Å; V1018-T1020 PolarHBondContact O-N 2.56Å; V1018-R1021 PolarHBondContact O-N 3.46Å; V1018-I1022 HydrophobicContact CG1-CD1 3.39Å; V1018-I1022 HydrophobicContact CG1-CG1 3.41Å; V1018-I1022 VanDerWaalsContact CG1-CG1 3.41Å; V1018-I1022 WeakPolarHBondContact O-CG1 3.32Å; V1018-I1022 PolarHBondContact O-N 3.2Å; V1018-A1026 HydrophobicContact CB-CB 4.07Å; V1018-A1026 HydrophobicContact CG1-CB 3.83Å; V1018-M1029 HydrophobicContact CB-SD 4.2Å; V1018-M1029 HydrophobicContact CG1-SD 3.95Å; V1018-M1029 HydrophobicContact CG2-CE 4.4Å; V1018-M1029 HydrophobicContact CG2-SD 4Å
1019	W	86.6	Confident	84.4	Confident	49 Å²	49	20.7 Å²	20.7	19%	0.186	10%	0.103	C	C	.	.	H	α-helix	trans	-57.4	-44.1	177.5	170.9	-106	0	0	0	112.3	E290 E1015 R1016 R1021 G1023 P1024 A1026 F1027 V1033	E290-W1019 HydrophobicContact CG-CH2 3.98Å; E290-W1019 HydrophobicContact CG-CZ2 4.41Å; E1015-W1019 WeakPolarHBondContact O-CB 3.48Å; E1015-W1019 PolarHBondContact O-N 3.23Å; R1016-W1019 PolarHBondContact O-N 3.2Å; W1019-R1021 PolarHBondContact O-N 3Å; W1019-R1021 VanDerWaalsContact O-N 3.15Å; W1019-G1023 VanDerWaalsContact O-CA 3.25Å; W1019-G1023 WeakPolarHBondContact O-CA 3.5Å; W1019-G1023 PolarHBondContact O-N 2.96Å; W1019-P1024 HydrophobicContact CH2-CG 4.19Å; W1019-P1024 HydrophobicContact CZ3-CB 3.75Å; W1019-P1024 HydrophobicContact CZ3-CG 3.66Å; W1019-A1026 HydrophobicContact CB-CB 3.68Å; W1019-F1027 AromaticContact CD2-CE2 3.93Å; W1019-F1027 HydrophobicContact CD2-CE2 3.93Å; W1019-F1027 AromaticContact CE3-CD2 3.62Å; W1019-F1027 HydrophobicContact CE3-CD2 3.62Å; W1019-F1027 AromaticContact CE3-CE2 3.32Å; W1019-F1027 HydrophobicContact CE3-CE2 3.32Å; W1019-F1027 HydrophobicContact CH2-CD2 4.49Å; W1019-F1027 AromaticContact CH2-CE2 3.85Å; W1019-F1027 HydrophobicContact CH2-CE2 3.85Å; W1019-F1027 HydrophobicContact CZ2-CE2 4.36Å; W1019-F1027 AromaticContact CZ3-CD2 3.58Å; W1019-F1027 HydrophobicContact CZ3-CD2 3.58Å; W1019-F1027 AromaticContact CZ3-CE2 3.28Å; W1019-F1027 HydrophobicContact CZ3-CE2 3.28Å; W1019-V1033 HydrophobicContact CB-CG1 3.58Å; W1019-V1033 HydrophobicContact CG-CG1 4Å
1020	T	83.6	Confident	85.2	Confident	28 Å²	28	15.5 Å²	15.5	17%	0.172	8%	0.075	C	C	.	.	H	α-helix	trans	-62.5	-22.9	177.3	-54.9	0	0	0	0	112.6	K404 H912 R1016 V1018	K404-T1020 PolarHBondContact NZ-O 3.07Å; H912-T1020 HydrophobicContact CB-CG2 4.25Å; H912-T1020 VanDerWaalsContact CB-O 3.31Å; H912-T1020 WeakPolarHBondContact CB-O 3.38Å; R1016-T1020 WeakPolarHBondContact O-CB 3.37Å; R1016-T1020 PolarHBondContact O-N 3.2Å; R1016-T1020 PolarHBondContact O-OG1 3.02Å; V1018-T1020 VanDerWaalsContact C-N 3.32Å; V1018-T1020 PolarHBondContact O-N 2.56Å
1021	R	83.9	Confident	85.2	Confident	36 Å²	36	13.6 Å²	13.6	14%	0.136	7%	0.068	C	C	.	.	H	α-helix	trans	-102.9	-58.6	-176.1	-72.4	176	179	73.6	3.6	112.9	K404 Y960 I981 C1017 V1018 W1019	K404-R1021 WeakPolarHBondContact CE-O 3.31Å; Y960-R1021 HydrophobicContact CD1-CB 4.09Å; Y960-R1021 HydrophobicContact CD1-CG 3.92Å; Y960-R1021 HydrophobicContact CD2-CB 3.84Å; Y960-R1021 HydrophobicContact CE1-CB 3.99Å; Y960-R1021 HydrophobicContact CE1-CG 3.65Å; Y960-R1021 HydrophobicContact CE2-CB 3.75Å; Y960-R1021 HydrophobicContact CE2-CG 4.32Å; Y960-R1021 VanDerWaalsContact CE2-O 3.23Å; Y960-R1021 WeakPolarHBondContact CE2-O 3.48Å; Y960-R1021 HydrophobicContact CG-CB 4.02Å; Y960-R1021 HydrophobicContact CG-CG 4.36Å; I981-R1021 VanDerWaalsContact CD1-NH1 3.27Å; C1017-R1021 WeakPolarHBondContact O-CG 3.34Å; C1017-R1021 PolarHBondContact O-N 3.23Å; C1017-R1021 PolarHBondContact O-NH1 3.48Å; V1018-R1021 PolarHBondContact O-N 3.46Å; W1019-R1021 PolarHBondContact O-N 3Å; W1019-R1021 VanDerWaalsContact O-N 3.15Å
1022	I	82.3	Confident	85	Confident	16 Å²	16	16.9 Å²	16.9	8%	0.082	8%	0.083	C	C	.	.	H	α-helix	trans	-105.8	2.6	-174.1	64.7	167.7	0	0	0	113.6	Y960 L962 M996 V1018 T1025	Y960-I1022 HydrophobicContact CD2-CG2 3.97Å; L962-I1022 HydrophobicContact CD1-CD1 4.26Å; L962-I1022 HydrophobicContact CD1-CG1 4.49Å; L962-I1022 HydrophobicContact CD1-CG2 3.89Å; M996-I1022 HydrophobicContact CE-CD1 3.93Å; V1018-I1022 HydrophobicContact CG1-CD1 3.39Å; V1018-I1022 HydrophobicContact CG1-CG1 3.41Å; V1018-I1022 VanDerWaalsContact CG1-CG1 3.41Å; V1018-I1022 WeakPolarHBondContact O-CG1 3.32Å; V1018-I1022 PolarHBondContact O-N 3.2Å; I1022-T1025 HydrophobicContact CD1-CG2 3.89Å
1023	G	85.3	Confident	84.6	Confident	1 Å²	1	16 Å²	16	1%	0.01	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	73.3	-140.6	172.6	0	0	0	0	0	113.7	W1019 T1025 A1026	W1019-G1023 VanDerWaalsContact O-CA 3.25Å; W1019-G1023 WeakPolarHBondContact O-CA 3.5Å; W1019-G1023 PolarHBondContact O-N 2.96Å; G1023-T1025 PolarHBondContact O-N 3.48Å; G1023-A1026 WeakPolarHBondContact O-CB 3.48Å; G1023-A1026 PolarHBondContact O-N 3.32Å; G1023-A1026 VanDerWaalsContact O-N 3.09Å
1024	P	84.2	Confident	84.3	Confident	2 Å²	2	19.5 Å²	19.5	1%	0.013	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-64.1	-10.4	-168.3	-17.4	28.9	0	0	0	117.5	S289 I293 I403 K404 W1019 A1026 F1027	S289-P1024 WeakPolarHBondContact O-CB 3.45Å; S289-P1024 WeakPolarHBondContact O-CG 2.96Å; I293-P1024 HydrophobicContact CB-CB 4.48Å; I293-P1024 HydrophobicContact CG1-CB 3.9Å; I403-P1024 HydrophobicContact CG2-CG 4.08Å; K404-P1024 WeakPolarHBondContact O-CD 3.46Å; W1019-P1024 HydrophobicContact CH2-CG 4.19Å; W1019-P1024 HydrophobicContact CZ3-CB 3.75Å; W1019-P1024 HydrophobicContact CZ3-CG 3.66Å; P1024-A1026 PolarHBondContact O-N 3.45Å; P1024-A1026 VanDerWaalsContact O-N 3.17Å; P1024-F1027 PolarHBondContact O-N 2.9Å; P1024-F1027 VanDerWaalsContact O-N 3.08Å
1025	T	85.4	Confident	83.7	Confident	6 Å²	6	23.9 Å²	23.9	4%	0.037	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-57.6	-26.5	169	-50.1	0	0	0	0	112.2	V360 L361 M996 I1022 G1023 F1027 L1028	V360-T1025 HydrophobicContact CG1-CG2 4.17Å; L361-T1025 HydrophobicContact CD2-CG2 4.23Å; M996-T1025 HydrophobicContact CE-CG2 4.03Å; I1022-T1025 HydrophobicContact CD1-CG2 3.89Å; G1023-T1025 PolarHBondContact O-N 3.48Å; T1025-F1027 PolarHBondContact O-N 3.21Å; T1025-L1028 HydrophobicContact CG2-CD1 4.35Å; T1025-L1028 WeakPolarHBondContact O-CB 3.16Å; T1025-L1028 PolarHBondContact O-N 3.31Å
1026	A	85.7	Confident	83.4	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-59.2	-33.3	175.1	0	0	0	0	0	113.4	V1018 W1019 G1023 P1024 L1028 M1029 V1033	V1018-A1026 HydrophobicContact CB-CB 4.07Å; V1018-A1026 HydrophobicContact CG1-CB 3.83Å; W1019-A1026 HydrophobicContact CB-CB 3.68Å; G1023-A1026 WeakPolarHBondContact O-CB 3.48Å; G1023-A1026 PolarHBondContact O-N 3.32Å; G1023-A1026 VanDerWaalsContact O-N 3.09Å; P1024-A1026 PolarHBondContact O-N 3.45Å; P1024-A1026 VanDerWaalsContact O-N 3.17Å; A1026-L1028 PolarHBondContact O-N 3.03Å; A1026-M1029 VanDerWaalsContact O-CB 3.31Å; A1026-M1029 WeakPolarHBondContact O-CB 3.36Å; A1026-M1029 PolarHBondContact O-N 2.85Å; A1026-V1033 HydrophobicContact CB-CG1 4.29Å; A1026-V1033 HydrophobicContact CB-CG2 4.43Å
1027	F	85.9	Confident	82.9	Confident	3 Å²	3	25.4 Å²	25.4	1%	0.013	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-72.2	-5.6	177.1	-72.8	-83.6	0	0	0	112.7	E290 R294 W1019 P1024 T1025 M1029 T1030 V1033 L1034	E290-F1027 HydrophobicContact CB-CD2 4.01Å; E290-F1027 HydrophobicContact CB-CE1 4.2Å; E290-F1027 HydrophobicContact CB-CE2 3.52Å; E290-F1027 HydrophobicContact CB-CZ 3.62Å; E290-F1027 HydrophobicContact CG-CE2 3.66Å; E290-F1027 HydrophobicContact CG-CZ 3.62Å; E290-F1027 VanDerWaalsContact O-CD2 3.23Å; E290-F1027 WeakPolarHBondContact O-CD2 3.18Å; E290-F1027 WeakPolarHBondContact O-CG 3.46Å; R294-F1027 PolarHBondContact NE-O 3.23Å; R294-F1027 PolarHBondContact NH2-O 2.77Å; W1019-F1027 AromaticContact CD2-CE2 3.93Å; W1019-F1027 HydrophobicContact CD2-CE2 3.93Å; W1019-F1027 AromaticContact CE3-CD2 3.62Å; W1019-F1027 HydrophobicContact CE3-CD2 3.62Å; W1019-F1027 AromaticContact CE3-CE2 3.32Å; W1019-F1027 HydrophobicContact CE3-CE2 3.32Å; W1019-F1027 HydrophobicContact CH2-CD2 4.49Å; W1019-F1027 AromaticContact CH2-CE2 3.85Å; W1019-F1027 HydrophobicContact CH2-CE2 3.85Å; W1019-F1027 HydrophobicContact CZ2-CE2 4.36Å; W1019-F1027 AromaticContact CZ3-CD2 3.58Å; W1019-F1027 HydrophobicContact CZ3-CD2 3.58Å; W1019-F1027 AromaticContact CZ3-CE2 3.28Å; W1019-F1027 HydrophobicContact CZ3-CE2 3.28Å; P1024-F1027 PolarHBondContact O-N 2.9Å; P1024-F1027 VanDerWaalsContact O-N 3.08Å; T1025-F1027 PolarHBondContact O-N 3.21Å; F1027-M1029 VanDerWaalsContact C-N 3.26Å; F1027-T1030 WeakPolarHBondContact CA-O 3.36Å; F1027-V1033 HydrophobicContact CD1-CB 4.3Å; F1027-V1033 HydrophobicContact CD1-CG2 3.82Å; F1027-V1033 HydrophobicContact CE1-CB 3.86Å; F1027-V1033 HydrophobicContact CE1-CG2 3.91Å; F1027-V1033 HydrophobicContact CE2-CB 4.43Å; F1027-V1033 HydrophobicContact CE2-CG1 4.46Å; F1027-V1033 HydrophobicContact CG-CG2 4.18Å; F1027-V1033 HydrophobicContact CZ-CB 3.94Å; F1027-V1033 HydrophobicContact CZ-CG1 4.34Å; F1027-V1033 HydrophobicContact CZ-CG2 4.31Å; F1027-L1034 HydrophobicContact CZ-CD1 4.29Å; F1027-L1034 HydrophobicContact CZ-CD2 4.3Å; F1027-L1034 HydrophobicContact CZ-CG 3.98Å
1028	L	85.6	Confident	82.2	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-77.7	-16.4	167.6	-60.5	-175.5	0	0	0	112.6	I293 R294 T330 V360 F994 T1025 A1026	I293-L1028 HydrophobicContact CG2-CD1 3.78Å; I293-L1028 HydrophobicContact CG2-CD2 4.11Å; I293-L1028 HydrophobicContact CG2-CG 4.07Å; R294-L1028 HydrophobicContact CG-CD2 3.88Å; T330-L1028 HydrophobicContact CG2-CB 3.83Å; T330-L1028 HydrophobicContact CG2-CD2 3.76Å; T330-L1028 HydrophobicContact CG2-CG 4.25Å; T330-L1028 PolarHBondContact OG1-O 3Å; V360-L1028 HydrophobicContact CG1-CD1 3.95Å; F994-L1028 HydrophobicContact CE1-CB 3.89Å; F994-L1028 HydrophobicContact CZ-CB 3.97Å; T1025-L1028 HydrophobicContact CG2-CD1 4.35Å; T1025-L1028 WeakPolarHBondContact O-CB 3.16Å; T1025-L1028 PolarHBondContact O-N 3.31Å; A1026-L1028 PolarHBondContact O-N 3.03Å
1029	M	86.8	Confident	81.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-55.3	179.7	-56	169.6	68.1	0	0	111	R334 S992 A993 F994 M996 E1015 V1018 A1026 F1027	R334-M1029 PolarHBondContact NE-O 3.47Å; S992-M1029 WeakPolarHBondContact CA-O 3.47Å; A993-M1029 PolarHBondContact N-O 3.06Å; F994-M1029 HydrophobicContact CD2-CG 4.02Å; F994-M1029 HydrophobicContact CE1-CG 4.22Å; F994-M1029 HydrophobicContact CE2-CG 3.45Å; F994-M1029 VanDerWaalsContact CE2-CG 3.45Å; F994-M1029 HydrophobicContact CE2-SD 4.2Å; F994-M1029 HydrophobicContact CZ-CG 3.57Å; F994-M1029 WeakPolarHBondContact O-CE 3.4Å; M996-M1029 HydrophobicContact CB-CE 4.26Å; M996-M1029 HydrophobicContact CB-SD 4.32Å; M996-M1029 HydrophobicContact CG-CE 4.2Å; M996-M1029 HydrophobicContact CG-SD 3.74Å; E1015-M1029 HydrophobicContact CG-CB 3.98Å; E1015-M1029 HydrophobicContact CG-CE 3.77Å; E1015-M1029 HydrophobicContact CG-SD 4.11Å; V1018-M1029 HydrophobicContact CB-SD 4.2Å; V1018-M1029 HydrophobicContact CG1-SD 3.95Å; V1018-M1029 HydrophobicContact CG2-CE 4.4Å; V1018-M1029 HydrophobicContact CG2-SD 4Å; A1026-M1029 VanDerWaalsContact O-CB 3.31Å; A1026-M1029 WeakPolarHBondContact O-CB 3.36Å; A1026-M1029 PolarHBondContact O-N 2.85Å; F1027-M1029 VanDerWaalsContact C-N 3.26Å
1030	T	83.3	Confident	80.1	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.197	C	C	.	.			trans	-149.1	164.1	-177.9	-165.7	0	0	0	0	112.1	E1015 F1027 D1032 V1033	E1015-T1030 HydrophobicContact CB-CG2 3.8Å; E1015-T1030 HydrophobicContact CG-CG2 3.54Å; F1027-T1030 WeakPolarHBondContact CA-O 3.36Å; T1030-D1032 HydrophobicContact CG2-CB 4.35Å; T1030-D1032 PolarHBondContact OG1-N 3.38Å; T1030-V1033 HydrophobicContact CG2-CG2 3.87Å; T1030-V1033 WeakPolarHBondContact O-CG2 3.45Å
1031	D	80.1	Confident	78.6	Confident	70 Å²	70	37.6 Å²	37.6	37%	0.374	21%	0.208	S	C	.	.	S	Bend	trans	-85.2	-26.3	170.1	-67.1	-67.8	0	0	0	111.9	R294 R334 V1033	R294-D1031 IonicContact CZ-OD1 2.75Å; R294-D1031 IonicContact NH1-OD1 2.68Å; R294-D1031 PolarHBondContact NH1-OD1 3.38Å; R294-D1031 IonicContact NH2-OD1 3.72Å; R294-D1031 PolarHBondContact NH2-OD1 2.84Å; R294-D1031 IonicContact NH2-OD2 2.82Å; R334-D1031 WeakPolarHBondContact CD-OD2 3.37Å; R334-D1031 IonicContact CZ-OD2 3.82Å; R334-D1031 IonicContact NH1-OD2 2.81Å; R334-D1031 PolarHBondContact NH1-OD2 2.76Å; D1031-V1033 PolarHBondContact O-N 3.26Å
1032	D	77.8	Confident	76.8	Confident	81 Å²	81	42.8 Å²	42.8	43%	0.433	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	27.6	-174.6	-58.9	-48.7	0	0	0	114.1	T1030 L1034 S1035	T1030-D1032 HydrophobicContact CG2-CB 4.35Å; T1030-D1032 PolarHBondContact OG1-N 3.38Å; D1032-L1034 VanDerWaalsContact C-N 3.34Å; D1032-L1034 PolarHBondContact O-N 2.68Å; D1032-S1035 WeakPolarHBondContact CB-OG 3.43Å; D1032-S1035 PolarHBondContact O-OG 2.84Å
1033	V	79.4	Confident	74.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-36.8	-176.3	-177.3	0	0	0	0	111.7	E1015 R1016 W1019 A1026 F1027 T1030 D1031	E1015-V1033 HydrophobicContact CB-CG2 4.15Å; R1016-V1033 WeakPolarHBondContact CD-O 3.27Å; W1019-V1033 HydrophobicContact CB-CG1 3.58Å; W1019-V1033 HydrophobicContact CG-CG1 4Å; A1026-V1033 HydrophobicContact CB-CG1 4.29Å; A1026-V1033 HydrophobicContact CB-CG2 4.43Å; F1027-V1033 HydrophobicContact CD1-CB 4.3Å; F1027-V1033 HydrophobicContact CD1-CG2 3.82Å; F1027-V1033 HydrophobicContact CE1-CB 3.86Å; F1027-V1033 HydrophobicContact CE1-CG2 3.91Å; F1027-V1033 HydrophobicContact CE2-CB 4.43Å; F1027-V1033 HydrophobicContact CE2-CG1 4.46Å; F1027-V1033 HydrophobicContact CG-CG2 4.18Å; F1027-V1033 HydrophobicContact CZ-CB 3.94Å; F1027-V1033 HydrophobicContact CZ-CG1 4.34Å; F1027-V1033 HydrophobicContact CZ-CG2 4.31Å; T1030-V1033 HydrophobicContact CG2-CG2 3.87Å; T1030-V1033 WeakPolarHBondContact O-CG2 3.45Å; D1031-V1033 PolarHBondContact O-N 3.26Å
1034	L	79.6	Confident	72.7	Confident	78 Å²	78	54.2 Å²	54.2	41%	0.408	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-16.4	-175.6	-58.9	-178.4	0	0	0	113.6	E290 F1027 D1032 M1036	E290-L1034 WeakPolarHBondContact OE1-CD1 3.35Å; F1027-L1034 HydrophobicContact CZ-CD1 4.29Å; F1027-L1034 HydrophobicContact CZ-CD2 4.3Å; F1027-L1034 HydrophobicContact CZ-CG 3.98Å; D1032-L1034 VanDerWaalsContact C-N 3.34Å; D1032-L1034 PolarHBondContact O-N 2.68Å; L1034-M1036 VanDerWaalsContact C-N 3.3Å
1035	S	76.9	Confident	70.4	Confident	92 Å²	92	58.7 Å²	58.7	64%	0.643	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-12.4	177.1	57.2	0	0	0	0	113.2	D1032	D1032-S1035 WeakPolarHBondContact CB-OG 3.43Å; D1032-S1035 PolarHBondContact O-OG 2.84Å
1036	M	80	Confident	68	Low	21 Å²	21	61.4 Å²	61.4	10%	0.103	33%	0.334	C	S	.	.	S	Bend	trans	-71.8	148.8	175.2	-69.5	-177.9	177.7	0	0	112.9	T989 C1014 E1015 R1016 L1034	T989-M1036 WeakPolarHBondContact OG1-CE 3.43Å; C1014-M1036 HydrophobicContact CB-SD 4.32Å; E1015-M1036 HydrophobicContact CB-CE 4.05Å; E1015-M1036 HydrophobicContact CB-SD 4.14Å; E1015-M1036 HydrophobicContact CG-CE 4.37Å; E1015-M1036 WeakPolarHBondContact OE2-CE 3.47Å; R1016-M1036 HydrophobicContact CB-CB 3.89Å; R1016-M1036 HydrophobicContact CB-SD 3.95Å; R1016-M1036 HydrophobicContact CG-CB 4.4Å; L1034-M1036 VanDerWaalsContact C-N 3.3Å
1037	A	76.3	Confident	65.7	Low	50 Å²	50	68.6 Å²	68.6	41%	0.413	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-60.4	143.8	179.6	0	0	0	0	0	111.8	P985 N986	P985-A1037 HydrophobicContact CG-CB 4.05Å; N986-A1037 PolarHBondContact ND2-O 3.28Å; N986-A1037 WeakPolarHBondContact OD1-CB 3.46Å; N986-A1037 PolarHBondContact OD1-N 3.47Å
1038	E	71.3	Confident	63.2	Low	149 Å²	149	75 Å²	75	70%	0.696	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-64	144.6	172.7	-63.2	-158.8	144.5	0	0	110.8	R1016 P1040	R1016-E1038 IonicContact NH2-OE1 3.47Å; R1016-E1038 PolarHBondContact NH2-OE1 2.81Å; E1038-P1040 WeakPolarHBondContact O-CD 2.99Å
1039	I	71.1	Confident	60.5	Low	24 Å²	24	83.1 Å²	83.1	12%	0.123	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-77	122.6	-177.3	-55.7	158.8	0	0	0	107	C1017 Q1041	C1017-I1039 HydrophobicContact CB-CD1 4.49Å; C1017-I1039 WeakPolarHBondContact SG-CD1 3.5Å; I1039-Q1041 VanDerWaalsContact O-CG 3.32Å; I1039-Q1041 WeakPolarHBondContact O-CG 3.29Å; I1039-Q1041 PolarHBondContact O-N 3.18Å
1040	P	57.6	Low	57.8	Low	73 Å²	73	86.8 Å²	86.8	47%	0.474	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-55.3	123.8	167.9	-18	28.6	0	0	0	108.7	E983 E1038	E983-P1040 VanDerWaalsContact O-CD 3.29Å; E983-P1040 WeakPolarHBondContact O-CD 3.39Å; E1038-P1040 WeakPolarHBondContact O-CD 2.99Å
1041	Q	52.3	Low	55.3	Low	87 Å²	87	93.2 Å²	93.2	41%	0.407	49%	0.49	S	S	.	.			trans	-117.2	86.9	-172.5	-79	156.2	-0.4	0	0	109.1	I1039 L1043	I1039-Q1041 VanDerWaalsContact O-CG 3.32Å; I1039-Q1041 WeakPolarHBondContact O-CG 3.29Å; I1039-Q1041 PolarHBondContact O-N 3.18Å; Q1041-L1043 PolarHBondContact O-N 3.41Å
1042	Q	45.6	Very low	52.9	Low	146 Å²	146	95.8 Å²	95.8	68%	0.682	50%	0.498	S	S	*	.			trans	-72.5	110.3	160.9	-73.9	-167	-0.3	0	0	108	H1044	Q1042-H1044 PolarHBondContact O-N 3.47Å
1043	L	42.1	Very low	50.7	Low	102 Å²	102	96.9 Å²	96.9	53%	0.534	50%	0.504	S	S	.	.			trans	-60.7	91.9	158.4	-79.5	156.2	0	0	0	106.5	Q1041 V1045	Q1041-L1043 PolarHBondContact O-N 3.41Å; L1043-V1045 HydrophobicContact CB-CG2 4.15Å; L1043-V1045 PolarHBondContact O-N 2.94Å
1044	H	39.9	Very low	48.4	Very low	155 Å²	155	103 Å²	103	72%	0.718	53%	0.532	S	S	*	.			trans	-65.3	78.8	148.2	-87.7	-66.1	0	0	0	105.9	Q1042 P1046	Q1042-H1044 PolarHBondContact O-N 3.47Å; H1044-P1046 VanDerWaalsContact O-CD 3.26Å; H1044-P1046 WeakPolarHBondContact O-CD 3.42Å; H1044-P1046 VanDerWaalsContact O-N 3.1Å
1045	V	35.6	Very low	46	Very low	96 Å²	96	104.3 Å²	104.3	58%	0.582	54%	0.539	S	S	*	.			trans	-50.3	117.4	152.5	-176.6	0	0	0	0	103.1	L1043 I1047	L1043-V1045 HydrophobicContact CB-CG2 4.15Å; L1043-V1045 PolarHBondContact O-N 2.94Å; V1045-I1047 VanDerWaalsContact C-N 3.31Å; V1045-I1047 PolarHBondContact O-N 2.98Å
1046	P	35.6	Very low	43.7	Very low	62 Å²	62	107 Å²	107	40%	0.403	54%	0.54	S	S	.	.			trans	-57.7	108.5	170.5	21.5	-27.2	0	0	0	105.4	H1044 H1048	H1044-P1046 VanDerWaalsContact O-CD 3.26Å; H1044-P1046 WeakPolarHBondContact O-CD 3.42Å; H1044-P1046 VanDerWaalsContact O-N 3.1Å; P1046-H1048 PolarHBondContact O-N 3.19Å
1047	I	36.1	Very low	41.4	Very low	152 Å²	152	114.4 Å²	114.4	78%	0.779	57%	0.571	S	S	*	*			trans	-69.3	76.5	167.2	-57.3	174.5	0	0	0	105	V1045	V1045-I1047 VanDerWaalsContact C-N 3.31Å; V1045-I1047 PolarHBondContact O-N 2.98Å
1048	H	34.4	Very low	39.7	Very low	136 Å²	136	117.7 Å²	117.7	63%	0.63	58%	0.579	S	S	*	*			trans	-126.4	61.1	159.9	-71.8	-61.5	0	0	0	106.8	P1046 P1050 F1051	P1046-H1048 PolarHBondContact O-N 3.19Å; H1048-P1050 WeakPolarHBondContact O-CD 3.37Å; H1048-F1051 PolarHBondContact O-N 3.17Å
1049	H	29.2	Very low	38	Very low	171 Å²	171	116 Å²	116	79%	0.792	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	70.4	145.8	-90.9	-8.2	0	0	0	108.1
1050	P	29.6	Very low	36.2	Very low	78 Å²	78	121.1 Å²	121.1	51%	0.506	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn		-135.1	-6	115.1	17.2	3.7	0	0	0	115.4	H1048	H1048-P1050 WeakPolarHBondContact O-CD 3.37Å
1051	F	31.4	Very low	34.9	Very low	135 Å²	135	123.9 Å²	123.9	59%	0.592	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-88.7	-22.5	-171.9	-112.5	-84.8	0	0	0	114.8	H1048 L1053 E1054	H1048-F1051 PolarHBondContact O-N 3.17Å; F1051-L1053 PolarHBondContact O-N 2.87Å; F1051-E1054 PolarHBondContact O-N 3.24Å
1052	F	28.3	Very low	33.9	Very low	123 Å²	123	126.3 Å²	126.3	54%	0.539	62%	0.618	S	S	.	*	G	3₁₀ helix	trans	-73.9	-11	174.2	-102.9	-85.4	0	0	0	113.6
1053	L	31.7	Very low	33.1	Very low	105 Å²	105	124.9 Å²	124.9	55%	0.55	61%	0.614	S	S	.	*	G	3₁₀ helix	trans	-95.1	-13.1	174.2	-79.8	162.9	0	0	0	113.4	F1051 F1057	F1051-L1053 PolarHBondContact O-N 2.87Å; L1053-F1057 HydrophobicContact CD2-CD2 4.02Å; L1053-F1057 HydrophobicContact CD2-CE2 3.8Å
1054	E	32.5	Very low	32.4	Very low	129 Å²	129	126.6 Å²	126.6	60%	0.603	62%	0.619	S	S	*	*	S	Bend	trans	-91.8	-5.8	178	-76.9	-174.3	165.7	0	0	114.1	F1051	F1051-E1054 PolarHBondContact O-N 3.24Å
1055	L	27.8	Very low	31.9	Very low	105 Å²	105	124.4 Å²	124.4	55%	0.55	61%	0.612	S	S	.	*	S	Bend	trans	-102.1	2.8	170.6	-86.5	159.4	0	0	0	113.4
1056	F	30.2	Very low	31.5	Very low	149 Å²	149	126.8 Å²	126.8	65%	0.654	61%	0.614	S	S	*	*			trans	-132.1	16.8	175.2	-84.1	-72.6	0	0	0	114.6
1057	F	31.8	Very low	31.2	Very low	176 Å²	176	132.6 Å²	132.6	77%	0.772	63%	0.633	S	S	*	*			trans	-144.3	0	169.3	-72.7	-71.2	0	0	0	113.4	L1053	L1053-F1057 HydrophobicContact CD2-CD2 4.02Å; L1053-F1057 HydrophobicContact CD2-CE2 3.8Å

Retrieved 1,057 of 1,057 residues in 1525.4 ms (Link to these results)

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