A0A3Q0KMF4_SCHMA Loading...

Excision repair helicase ercc-6-related

AlphaFold DB , UniProt , Accession A0A3Q0KMF4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,408 aa.

						>A0A3Q0KMF4_SCHMA|A0A3Q0KMF4
MGTLDPYPSSSTSKSKKCIDNPMRFSINKDIIKKAENQDMNSIQRIVAYDHLEFETSVIEQAKNTFKRNNSLQASATRERLSALDDDIMSAQRELEKMELSLDTLLGQVSTEVSNSSLGNRKIRSLELEIETKMKLIDTLISRKSALLTKLSSLEKENFISDDNASKPDEDLLSVNIVKPLSADDFNSPVKHLSTKLYRVKRCENKAVELKKLSKYKHNDDADIHAFQERLRRQRRTELLEEQFAREHEVHSSNPSDGKLDGGFCVPGSIWSRLFDYQRKGVKWLWDLHQKGCGGIIGDEMGLGKTIQIIALLAGLHYSNIEDRSYRLYLSTRNLTSECQQEFLGLGPTLIVCPATVLNQWMSEFHSWWPPIRVAILHSTGSGYGKPNKLIQMITNNPGSVLLTTYSTLVTYRDMLTSRNWSYVILDEGHKIKNPEAEATLAVKHFSTPHRLILSGSPIQNNLRELWSLFDFVCPGRLGPLPEFMQQFSIPITQGGYAAASPLQVETAYQCACTLRDLLKPYLIRRLKADVQIQLPAKSEQVLFCRLTDYQQKLYREYLESQVCKDLLNGKGNIFPSLILLRNLCNHPDLATGGPRDSCFLNEEFESDKQGIENVCLSYSWSRFGCPRRSSKMLVVASLLKNWYDQGHKVLLFSQSRRMLTLLERLVQLMKFSYLRMDGTTPVSQRHELIRRFNYRSTSDSEKIDRTSDHLDIFLFLLTTRVGGLGVNLTSANRVLIYDPDWNPTTDLQARERAWRIGQSRDVVIYRLLTSGTIEEKIYHRQIFKQFLTNRILKNPRQQRFFKTNDLQELLTFEDESDIQIPETALYLKSEGMGHTLTNSLTENRFDILAKKQKDNPLQSKSSHMNTDISSGSDVEDDDEKEEDEGKKEKETEASVDDNFTNTPLNSDKKSKRTEQLRQLAKEISRRIAEECSNKDNPVESVTKQSNEITSNKHNLSRKRKSDIKGTRVDGKRIKLVAKQCRYDVGEGMDISLSRNQLAEPVKATSSNTEDDNFIQSVLVSSCSSSNYLSINKQDYSTVSSFKEKRSMVDQDTRDEASRVAKEALKNIQKFHKSNEIKCKESFQENKEKAKNRKSSKIKYTNHQDSYSLSSNKSLKFTQKMSVSSSPIFRQITQIVHHDKLLDEMTNPNHIDSSFDQLAANRLANKAIIALEEEVKRWQQCNFRSFSQTAEITQRRSVLYPFGQAKNRFLWNRNESTSCGYIQLLQMSSDFDCSTKKAYNENSANLHVRFSSELLLSLIRSRKILHHDHLHSSSSTESVDSMLNHSMQRLCAELIRTLGGSNTVTSEYLAVHFKSILNENNDCATVNIHNNANVVHRSITSRHFRSLLKQLAIRHRSKCDQSQLDLPSRGRLDDVWTLRGKFQSIASYLLVNLASAERLNQPSNTVIY
					

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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	34.5	Very low	32.2	Very low	251 Å²	251	131.2 Å²	131.2	100%	1.236	78%	0.776	S	S	*	*				0	122	0	-56.8	173.6	-177.4	0	0	106.6
2	G	34.5	Very low	32.2	Very low	70 Å²	70	132.3 Å²	132.3	72%	0.722	79%	0.786	S	S	*	*			cis	145.5	140.8	5.4	0	0	0	0	0	107.3
3	T	32.7	Very low	31.8	Very low	125 Å²	125	129.3 Å²	129.3	77%	0.767	78%	0.775	S	S	*	*			cis	-150.3	154.1	8.9	33.7	0	0	0	0	108.2
4	L	29.4	Very low	31.6	Very low	139 Å²	139	134.2 Å²	134.2	73%	0.728	78%	0.781	S	S	*	*				40	134	94.7	-44.1	170.4	0	0	0	113.1
5	D	29.6	Very low	31.5	Very low	125 Å²	125	132.5 Å²	132.5	67%	0.668	78%	0.78	S	S	*	*			cis	-173.5	-161.1	7.5	-120	-19.4	0	0	0	108.2
6	P	36.4	Very low	31.4	Very low	106 Å²	106	136.3 Å²	136.3	69%	0.688	78%	0.784	S	S	*	*			cis	-134.1	174.3	-30.6	30.8	-9.7	0	0	0	115.9
7	Y	32.6	Very low	31.1	Very low	194 Å²	194	140.2 Å²	140.2	76%	0.761	79%	0.789	S	S	*	*			trans	-9.9	157.3	140.3	-72.1	-74.7	0	0	0	121
8	P	34.4	Very low	30.8	Very low	121 Å²	121	139.4 Å²	139.4	79%	0.786	79%	0.793	S	S	*	*				-127.7	154.8	52.2	30.3	-11.2	0	0	0	116.3
9	S	28.7	Very low	30.8	Very low	92 Å²	92	138.7 Å²	138.7	64%	0.643	79%	0.785	S	S	*	*			cis	105.3	101.5	13.4	80.3	0	0	0	0	116.4
10	S	32.5	Very low	30.8	Very low	112 Å²	112	139.6 Å²	139.6	78%	0.783	79%	0.788	S	S	*	*			trans	-152.3	113.8	155.6	60	0	0	0	0	111.6
11	S	28.7	Very low	30.8	Very low	108 Å²	108	140.1 Å²	140.1	76%	0.755	79%	0.789	S	S	*	*			trans	-0.8	142.3	151.5	52.1	0	0	0	0	118.9
12	T	32.8	Very low	30.7	Very low	145 Å²	145	133.7 Å²	133.7	89%	0.89	77%	0.765	S	S	*	*				-133.5	-176.7	53.5	48.8	0	0	0	0	115.4
13	S	27.2	Very low	30.7	Very low	93 Å²	93	138 Å²	138	65%	0.65	77%	0.768	S	S	*	*			trans	-136.7	166.1	-154.5	66.4	0	0	0	0	115.4
14	K	29.1	Very low	30.6	Very low	198 Å²	198	143.7 Å²	143.7	86%	0.861	78%	0.776	S	S	*	*			trans	79.9	121.1	175	-49.4	159.1	-171.9	176.4	0	112.3
15	S	29.8	Very low	30.9	Very low	108 Å²	108	145.7 Å²	145.7	76%	0.755	78%	0.779	S	S	*	*			cis	-157.7	160.5	43.7	59.2	0	0	0	0	115.9
16	K	28.9	Very low	31.3	Very low	194 Å²	194	145.1 Å²	145.1	84%	0.843	79%	0.785	S	S	*	*			trans	24.3	109.3	153.4	-59.6	170.1	-176.7	175.3	0	118.4
17	K	26.1	Very low	31.4	Very low	203 Å²	203	146.5 Å²	146.5	88%	0.883	79%	0.785	S	S	*	*				42.8	101.4	85.2	-74.6	-170.5	174.4	-177.3	0	115.2
18	C	26.1	Very low	31.8	Very low	126 Å²	126	141.5 Å²	141.5	85%	0.851	77%	0.772	S	S	*	*			trans	175.8	173.8	138	-103	0	0	0	0	111.5
19	I	31.1	Very low	32.4	Very low	126 Å²	126	143.2 Å²	143.2	65%	0.646	77%	0.767	S	S	*	*			trans	76	64.8	175.6	-38.5	173.9	0	0	0	115.1
20	D	30.3	Very low	33.3	Very low	156 Å²	156	143.7 Å²	143.7	83%	0.834	76%	0.762	S	S	*	*			trans	-129.2	148.3	144.6	-93.2	-49.7	0	0	0	107.7
21	N	31.7	Very low	34	Very low	151 Å²	151	143.7 Å²	143.7	81%	0.807	75%	0.752	S	S	*	*			trans	60.7	88.9	-174.5	-62.2	-41.5	0	0	0	117.8
22	P	32.3	Very low	34.7	Very low	115 Å²	115	143.1 Å²	143.1	75%	0.747	74%	0.74	S	S	*	*			trans	-74	164.6	137.4	34.8	-31.6	0	0	0	110.5
23	M	33.4	Very low	35.2	Very low	160 Å²	160	142.2 Å²	142.2	79%	0.788	72%	0.724	S	S	*	*			trans	68.7	65.6	-179.5	-58.4	-64.3	-172.3	0	0	116.6	F25	M23-F25 HydrophobicContact SD-CE2 3.85Å; M23-F25 HydrophobicContact SD-CZ 4.1Å
24	R	32.4	Very low	36	Very low	245 Å²	245	146.1 Å²	146.1	93%	0.925	73%	0.729	S	S	*	*			trans	-130.3	103	149.3	-116.2	-174.2	-179.6	-172	0.4	109.8	S26	R24-S26 PolarHBondContact O-N 3.48Å
25	F	35.3	Very low	36.7	Very low	181 Å²	181	140.6 Å²	140.6	79%	0.794	72%	0.72	S	S	*	*			trans	-71.7	113.1	172.5	-65.6	-86.6	0	0	0	109.1	M23	M23-F25 HydrophobicContact SD-CE2 3.85Å; M23-F25 HydrophobicContact SD-CZ 4.1Å
26	S	36.8	Very low	37.1	Very low	114 Å²	114	142.1 Å²	142.1	80%	0.797	72%	0.715	S	S	*	*			trans	-110.3	86.5	176.5	-176.6	0	0	0	0	109.3	R24 N28	R24-S26 PolarHBondContact O-N 3.48Å; S26-N28 PolarHBondContact O-N 2.89Å
27	I	39.2	Very low	37.8	Very low	134 Å²	134	139.3 Å²	139.3	69%	0.687	71%	0.71	S	S	*	*			trans	-58	129.5	171.2	-60.6	173.6	0	0	0	108.2	K29 I32	I27-K29 PolarHBondContact O-N 3.35Å; I27-I32 HydrophobicContact CG2-CD1 4.21Å
28	N	41.2	Very low	38.3	Very low	90 Å²	90	137.8 Å²	137.8	48%	0.481	71%	0.706	S	S	.	*			trans	-73.5	98.8	-177.5	-171.5	3.6	0	0	0	110.5	S26 D30 I31	S26-N28 PolarHBondContact O-N 2.89Å; N28-D30 PolarHBondContact O-N 3.37Å; N28-D30 VanDerWaalsContact O-N 3.09Å; N28-D30 PolarHBondContact OD1-N 3.37Å; N28-I31 HydrophobicContact CB-CD1 4.04Å; N28-I31 HydrophobicContact CB-CG1 4.22Å; N28-I31 WeakPolarHBondContact O-CB 3.45Å; N28-I31 PolarHBondContact O-N 3.23Å; N28-I31 VanDerWaalsContact O-N 3.1Å
29	K	47.8	Very low	39	Very low	156 Å²	156	138.4 Å²	138.4	68%	0.678	70%	0.7	S	S	*	*	H	α-helix	trans	-60.2	-21.5	-174.5	-67.4	-169.1	174.8	-169.8	0	113.9	I27 I31 I32 K33	I27-K29 PolarHBondContact O-N 3.35Å; K29-I31 PolarHBondContact O-N 3.38Å; K29-I32 PolarHBondContact O-N 3.12Å; K29-K33 PolarHBondContact O-N 3.31Å; K29-K33 VanDerWaalsContact O-N 3.11Å
30	D	45.9	Very low	39.2	Very low	103 Å²	103	139.9 Å²	139.9	55%	0.551	71%	0.706	S	S	*	*	H	α-helix	trans	-74.7	-13.5	-179.7	-57.9	-26.1	0	0	0	112.9	N28 K34	N28-D30 PolarHBondContact O-N 3.37Å; N28-D30 VanDerWaalsContact O-N 3.09Å; N28-D30 PolarHBondContact OD1-N 3.37Å; D30-K34 WeakPolarHBondContact O-CG 3.32Å
31	I	47.7	Very low	39.6	Very low	112 Å²	112	140.5 Å²	140.5	57%	0.574	71%	0.71	S	S	*	*	H	α-helix	trans	-75.9	-43.7	169	-58	178.2	0	0	0	109.7	N28 K29 K34	N28-I31 HydrophobicContact CB-CD1 4.04Å; N28-I31 HydrophobicContact CB-CG1 4.22Å; N28-I31 WeakPolarHBondContact O-CB 3.45Å; N28-I31 PolarHBondContact O-N 3.23Å; N28-I31 VanDerWaalsContact O-N 3.1Å; K29-I31 PolarHBondContact O-N 3.38Å; I31-K34 PolarHBondContact O-N 3.1Å
32	I	43.4	Very low	40	Very low	96 Å²	96	136 Å²	136	49%	0.492	69%	0.69	S	S	.	*	H	α-helix	trans	-64.5	-46.9	-180	-58.4	173.5	0	0	0	110.2	I27 K29 K34 A35	I27-I32 HydrophobicContact CG2-CD1 4.21Å; K29-I32 PolarHBondContact O-N 3.12Å; I32-K34 PolarHBondContact O-N 3.5Å; I32-K34 VanDerWaalsContact O-N 3.07Å; I32-A35 PolarHBondContact O-N 2.66Å
33	K	43	Very low	40.2	Very low	126 Å²	126	135.2 Å²	135.2	55%	0.548	68%	0.679	S	S	.	*	H	α-helix	trans	-61.4	-16.4	178.8	-76.4	-175.3	167.4	-169.6	0	115.7	K29 N37	K29-K33 PolarHBondContact O-N 3.31Å; K29-K33 VanDerWaalsContact O-N 3.11Å; K33-N37 PolarHBondContact O-ND2 3.1Å
34	K	45.6	Very low	40.4	Very low	174 Å²	174	136.6 Å²	136.6	76%	0.757	68%	0.683	S	S	*	*	H	α-helix	trans	-83.3	-19.2	175.1	-77.9	-176.3	175.6	-171.9	0	113.2	D30 I31 I32	D30-K34 WeakPolarHBondContact O-CG 3.32Å; I31-K34 PolarHBondContact O-N 3.1Å; I32-K34 PolarHBondContact O-N 3.5Å; I32-K34 VanDerWaalsContact O-N 3.07Å
35	A	42.1	Very low	40.4	Very low	83 Å²	83	136 Å²	136	69%	0.686	68%	0.681	S	S	*	*	H	α-helix	trans	-85	-22.5	176.9	0	0	0	0	0	113.3	I32 N37	I32-A35 PolarHBondContact O-N 2.66Å; A35-N37 VanDerWaalsContact C-N 3.25Å; A35-N37 PolarHBondContact O-N 3.4Å
36	E	38.9	Very low	40.3	Very low	140 Å²	140	132.9 Å²	132.9	65%	0.654	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-3	-173.7	-64	175.6	131.2	0	0	114.8
37	N	43.2	Very low	40.1	Very low	135 Å²	135	133.5 Å²	133.5	72%	0.722	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.1	19.7	-164.6	-76.5	-58.6	0	0	0	115.7	K33 A35	K33-N37 PolarHBondContact O-ND2 3.1Å; A35-N37 VanDerWaalsContact C-N 3.25Å; A35-N37 PolarHBondContact O-N 3.4Å
38	Q	38.1	Very low	39.9	Very low	171 Å²	171	131.4 Å²	131.4	80%	0.799	67%	0.672	S	S	*	*	S	Bend	trans	-134.6	117.7	177.2	-69.1	-171	-38.9	0	0	113.6
39	D	39.2	Very low	39.6	Very low	138 Å²	138	136.3 Å²	136.3	74%	0.738	69%	0.686	S	S	*	*			trans	40.2	90.9	162.2	-61.5	-17.8	0	0	0	119.9	N41 S42	D39-N41 PolarHBondContact O-N 3.28Å; D39-S42 PolarHBondContact O-N 2.89Å; D39-S42 PolarHBondContact O-OG 3.41Å
40	M	36.5	Very low	39.2	Very low	157 Å²	157	134.3 Å²	134.3	77%	0.773	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-50.4	-15.3	172.2	-72.9	-76.6	-72.3	0	0	116.6	S42 I43	M40-S42 VanDerWaalsContact C-N 3.32Å; M40-I43 VanDerWaalsContact O-CD1 3.28Å; M40-I43 WeakPolarHBondContact O-CD1 3.47Å; M40-I43 WeakPolarHBondContact O-CG1 3.44Å; M40-I43 HydrophobicContact SD-CD1 4.37Å
41	N	38.8	Very low	39.3	Very low	170 Å²	170	135.8 Å²	135.8	91%	0.909	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-87.1	2.6	-178	-72.3	-23.8	0	0	0	113.9	D39	D39-N41 PolarHBondContact O-N 3.28Å
42	S	38.8	Very low	39.3	Very low	55 Å²	55	136.4 Å²	136.4	39%	0.385	69%	0.689	S	S	.	*	G	3₁₀ helix	trans	-94.4	-4.5	-178.4	60.5	0	0	0	0	114.8	D39 M40 Q44 R45	D39-S42 PolarHBondContact O-N 2.89Å; D39-S42 PolarHBondContact O-OG 3.41Å; M40-S42 VanDerWaalsContact C-N 3.32Å; S42-Q44 VanDerWaalsContact C-N 3.28Å; S42-Q44 PolarHBondContact O-N 2.94Å; S42-R45 PolarHBondContact O-N 2.73Å
43	I	38	Very low	39.6	Very low	100 Å²	100	137.5 Å²	137.5	51%	0.513	69%	0.692	S	S	.	*	G	3₁₀ helix	trans	-59	-28.8	-163.3	-66.3	172.3	0	0	0	114.3	M40 R45 I46	M40-I43 VanDerWaalsContact O-CD1 3.28Å; M40-I43 WeakPolarHBondContact O-CD1 3.47Å; M40-I43 WeakPolarHBondContact O-CG1 3.44Å; M40-I43 HydrophobicContact SD-CD1 4.37Å; I43-R45 PolarHBondContact O-N 3.48Å; I43-I46 PolarHBondContact O-N 2.96Å
44	Q	37	Very low	40.1	Very low	189 Å²	189	138.4 Å²	138.4	88%	0.883	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-71.3	-8	175	-75.4	-173.6	-16.7	0	0	114.9	S42	S42-Q44 VanDerWaalsContact C-N 3.28Å; S42-Q44 PolarHBondContact O-N 2.94Å
45	R	33.1	Very low	40.6	Very low	232 Å²	232	133.1 Å²	133.1	88%	0.875	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-101.1	-3.5	172.7	-70.4	-175.2	177.2	170.3	-0	113.9	S42 I43 V47	S42-R45 PolarHBondContact O-N 2.73Å; I43-R45 PolarHBondContact O-N 3.48Å; R45-V47 PolarHBondContact O-N 3.44Å
46	I	32.7	Very low	41.7	Very low	115 Å²	115	133.1 Å²	133.1	59%	0.59	67%	0.666	S	S	*	*			trans	-86	48.5	177.4	-42.6	179.9	0	0	0	109.8	I43	I43-I46 PolarHBondContact O-N 2.96Å
47	V	32.4	Very low	43	Very low	128 Å²	128	129.2 Å²	129.2	78%	0.776	65%	0.654	S	S	*	*	S	Bend	trans	-132.9	37.8	179.9	-163.2	0	0	0	0	109.7	R45	R45-V47 PolarHBondContact O-N 3.44Å
48	A	34.1	Very low	44.1	Very low	89 Å²	89	126.2 Å²	126.2	74%	0.736	64%	0.641	S	S	*	*			trans	-169	64.8	169.8	0	0	0	0	0	110.6
49	Y	34.7	Very low	45.5	Very low	193 Å²	193	122 Å²	122	76%	0.757	62%	0.623	S	S	*	*			trans	-99	116.7	139.9	-95.9	-71.6	0	0	0	105.1	H51	Y49-H51 PolarHBondContact O-N 3.43Å
50	D	40.3	Very low	47	Very low	114 Å²	114	121.1 Å²	121.1	61%	0.61	61%	0.614	S	S	*	*			trans	-61	134.1	178	-100.2	-33.7	0	0	0	109.1	L52 E53	D50-L52 PolarHBondContact O-N 3.32Å; D50-E53 HydrophobicContact CB-CG 4.44Å; D50-E53 PolarHBondContact O-N 2.89Å
51	H	46.9	Very low	48.6	Very low	135 Å²	135	119.5 Å²	119.5	63%	0.625	61%	0.605	S	S	*	*	H	α-helix	trans	-55.4	-30.8	179.8	-135.6	-94.6	0	0	0	110.6	Y49 E55	Y49-H51 PolarHBondContact O-N 3.43Å; H51-E55 IonicContact CE1-OE1 3.62Å; H51-E55 PolarHBondContact CE1-OE1 3.42Å; H51-E55 IonicContact CG-OE1 3.91Å; H51-E55 IonicContact ND1-OE1 3.44Å; H51-E55 PolarHBondContact ND1-OE1 2.97Å; H51-E55 VanDerWaalsContact O-CB 3.28Å; H51-E55 WeakPolarHBondContact O-CB 3.42Å; H51-E55 VanDerWaalsContact O-CG 3.3Å; H51-E55 WeakPolarHBondContact O-CG 3.4Å; H51-E55 PolarHBondContact O-N 3.4Å
52	L	48.3	Very low	50	Low	124 Å²	124	113.9 Å²	113.9	65%	0.649	58%	0.582	S	S	*	*	H	α-helix	trans	-64.2	-36.6	173.6	-73.8	89.2	0	0	0	114.4	D50 T56	D50-L52 PolarHBondContact O-N 3.32Å; L52-T56 VanDerWaalsContact O-CB 3.25Å; L52-T56 WeakPolarHBondContact O-CB 3.45Å; L52-T56 VanDerWaalsContact O-CG2 3.22Å; L52-T56 WeakPolarHBondContact O-CG2 3.3Å; L52-T56 PolarHBondContact O-N 3.15Å; L52-T56 PolarHBondContact O-OG1 2.9Å
53	E	51.2	Low	51.5	Low	119 Å²	119	117.4 Å²	117.4	56%	0.556	59%	0.59	S	S	*	*	H	α-helix	trans	-69.8	-42.1	-179.5	-72.5	-161	144.7	0	0	111.4	D50 T56 S57	D50-E53 HydrophobicContact CB-CG 4.44Å; D50-E53 PolarHBondContact O-N 2.89Å; E53-T56 WeakPolarHBondContact CA-OG1 3.36Å; E53-T56 PolarHBondContact O-OG1 3.22Å; E53-T56 VanDerWaalsContact O-OG1 3.13Å; E53-S57 WeakPolarHBondContact O-CB 3.37Å; E53-S57 PolarHBondContact O-N 3.17Å
54	F	53.5	Low	53.2	Low	145 Å²	145	116.6 Å²	116.6	64%	0.636	59%	0.587	S	S	*	*	H	α-helix	trans	-67.9	-45.1	174.9	-175.1	-101.7	0	0	0	111.4	S57 V58	F54-S57 PolarHBondContact O-N 2.99Å; F54-V58 HydrophobicContact CD1-CG2 4.32Å; F54-V58 HydrophobicContact CE1-CG2 3.96Å; F54-V58 HydrophobicContact CE2-CG2 4.33Å; F54-V58 HydrophobicContact CZ-CG2 3.96Å; F54-V58 WeakPolarHBondContact O-CB 3.46Å; F54-V58 WeakPolarHBondContact O-CG2 3.45Å; F54-V58 PolarHBondContact O-N 3.43Å
55	E	54.5	Low	54.9	Low	64 Å²	64	111.5 Å²	111.5	30%	0.299	57%	0.569	S	S	.	*	H	α-helix	trans	-63.8	-42.8	176.9	-77.2	-178.7	-157	0	0	112.4	H51 V58 I59	H51-E55 IonicContact CE1-OE1 3.62Å; H51-E55 PolarHBondContact CE1-OE1 3.42Å; H51-E55 IonicContact CG-OE1 3.91Å; H51-E55 IonicContact ND1-OE1 3.44Å; H51-E55 PolarHBondContact ND1-OE1 2.97Å; H51-E55 VanDerWaalsContact O-CB 3.28Å; H51-E55 WeakPolarHBondContact O-CB 3.42Å; H51-E55 VanDerWaalsContact O-CG 3.3Å; H51-E55 WeakPolarHBondContact O-CG 3.4Å; H51-E55 PolarHBondContact O-N 3.4Å; E55-V58 PolarHBondContact O-N 3.47Å; E55-I59 HydrophobicContact CB-CD1 4.4Å; E55-I59 VanDerWaalsContact O-CB 3.22Å; E55-I59 WeakPolarHBondContact O-CB 3.46Å; E55-I59 WeakPolarHBondContact O-CD1 3.44Å; E55-I59 WeakPolarHBondContact O-CG1 3.34Å; E55-I59 PolarHBondContact O-N 3.24Å
56	T	65.7	Low	56.8	Low	82 Å²	82	105 Å²	105	50%	0.503	55%	0.547	S	S	.	.	H	α-helix	trans	-64.6	-41.3	176.9	49.8	0	0	0	0	111.8	L52 E53 V58 I59 E60	L52-T56 VanDerWaalsContact O-CB 3.25Å; L52-T56 WeakPolarHBondContact O-CB 3.45Å; L52-T56 VanDerWaalsContact O-CG2 3.22Å; L52-T56 WeakPolarHBondContact O-CG2 3.3Å; L52-T56 PolarHBondContact O-N 3.15Å; L52-T56 PolarHBondContact O-OG1 2.9Å; E53-T56 WeakPolarHBondContact CA-OG1 3.36Å; E53-T56 PolarHBondContact O-OG1 3.22Å; E53-T56 VanDerWaalsContact O-OG1 3.13Å; T56-V58 PolarHBondContact O-N 3.01Å; T56-I59 PolarHBondContact O-N 3.22Å; T56-E60 VanDerWaalsContact O-CB 3.27Å; T56-E60 WeakPolarHBondContact O-CB 3.38Å; T56-E60 PolarHBondContact O-N 3.24Å
57	S	65.3	Low	58.8	Low	58 Å²	58	103.9 Å²	103.9	41%	0.406	54%	0.538	S	S	.	.	H	α-helix	trans	-62.7	-41.9	174.8	-165.6	0	0	0	0	112.3	E53 F54 E60 Q61	E53-S57 WeakPolarHBondContact O-CB 3.37Å; E53-S57 PolarHBondContact O-N 3.17Å; F54-S57 PolarHBondContact O-N 2.99Å; S57-E60 PolarHBondContact O-N 3.45Å; S57-Q61 WeakPolarHBondContact O-CG 3.32Å; S57-Q61 PolarHBondContact O-N 2.56Å
58	V	67.1	Low	60.9	Low	73 Å²	73	106.7 Å²	106.7	44%	0.442	54%	0.535	S	S	.	.	H	α-helix	trans	-68.1	-41	175.9	171.2	0	0	0	0	111.7	F54 E55 T56 E60 Q61 A62	F54-V58 HydrophobicContact CD1-CG2 4.32Å; F54-V58 HydrophobicContact CE1-CG2 3.96Å; F54-V58 HydrophobicContact CE2-CG2 4.33Å; F54-V58 HydrophobicContact CZ-CG2 3.96Å; F54-V58 WeakPolarHBondContact O-CB 3.46Å; F54-V58 WeakPolarHBondContact O-CG2 3.45Å; F54-V58 PolarHBondContact O-N 3.43Å; E55-V58 PolarHBondContact O-N 3.47Å; T56-V58 PolarHBondContact O-N 3.01Å; V58-E60 VanDerWaalsContact C-N 3.34Å; V58-Q61 PolarHBondContact O-N 3.15Å; V58-A62 WeakPolarHBondContact O-CB 3.43Å; V58-A62 PolarHBondContact O-N 2.88Å
59	I	68	Low	63	Low	83 Å²	83	106.5 Å²	106.5	43%	0.426	52%	0.522	S	S	.	.	H	α-helix	trans	-65.2	-37.9	175.1	-73.2	163.8	0	0	0	110.7	E55 T56 A62 K63	E55-I59 HydrophobicContact CB-CD1 4.4Å; E55-I59 VanDerWaalsContact O-CB 3.22Å; E55-I59 WeakPolarHBondContact O-CB 3.46Å; E55-I59 WeakPolarHBondContact O-CD1 3.44Å; E55-I59 WeakPolarHBondContact O-CG1 3.34Å; E55-I59 PolarHBondContact O-N 3.24Å; T56-I59 PolarHBondContact O-N 3.22Å; I59-A62 PolarHBondContact O-N 3Å; I59-K63 HydrophobicContact CG2-CD 4.08Å; I59-K63 HydrophobicContact CG2-CG 4.37Å; I59-K63 WeakPolarHBondContact O-CB 3.42Å; I59-K63 VanDerWaalsContact O-CG 3.25Å; I59-K63 WeakPolarHBondContact O-CG 3.21Å; I59-K63 PolarHBondContact O-N 3.15Å
60	E	70.9	Confident	65.1	Low	118 Å²	118	97.6 Å²	97.6	55%	0.551	49%	0.487	S	S	*	.	H	α-helix	trans	-70.6	-43.3	176.9	-178.1	167.9	-155.9	0	0	111.7	T56 S57 V58 A62 K63 N64	T56-E60 VanDerWaalsContact O-CB 3.27Å; T56-E60 WeakPolarHBondContact O-CB 3.38Å; T56-E60 PolarHBondContact O-N 3.24Å; S57-E60 PolarHBondContact O-N 3.45Å; V58-E60 VanDerWaalsContact C-N 3.34Å; E60-A62 VanDerWaalsContact C-N 3.29Å; E60-A62 PolarHBondContact O-N 2.82Å; E60-K63 PolarHBondContact O-N 2.84Å; E60-N64 WeakPolarHBondContact CG-ND2 3.46Å; E60-N64 VanDerWaalsContact O-CB 3.31Å; E60-N64 WeakPolarHBondContact O-CB 3.48Å; E60-N64 PolarHBondContact O-N 3.19Å; E60-N64 PolarHBondContact O-ND2 2.74Å
61	Q	69.1	Low	66.9	Low	123 Å²	123	95.1 Å²	95.1	58%	0.575	48%	0.479	S	S	*	.	H	α-helix	trans	-58.2	-43.2	169.9	-73.4	-173.4	26.7	0	0	111	S57 V58 N64 T65	S57-Q61 WeakPolarHBondContact O-CG 3.32Å; S57-Q61 PolarHBondContact O-N 2.56Å; V58-Q61 PolarHBondContact O-N 3.15Å; Q61-N64 PolarHBondContact O-N 3.32Å; Q61-T65 WeakPolarHBondContact O-CB 3.28Å; Q61-T65 PolarHBondContact O-N 3.47Å; Q61-T65 PolarHBondContact O-OG1 2.97Å
62	A	68.8	Low	68.6	Low	52 Å²	52	93.9 Å²	93.9	43%	0.43	48%	0.476	S	S	.	.	H	α-helix	trans	-63.2	-46.2	175.9	0	0	0	0	0	112.6	V58 I59 E60 N64 T65 F66	V58-A62 WeakPolarHBondContact O-CB 3.43Å; V58-A62 PolarHBondContact O-N 2.88Å; I59-A62 PolarHBondContact O-N 3Å; E60-A62 VanDerWaalsContact C-N 3.29Å; E60-A62 PolarHBondContact O-N 2.82Å; A62-N64 PolarHBondContact O-N 2.83Å; A62-T65 PolarHBondContact O-N 2.92Å; A62-F66 VanDerWaalsContact O-CB 3.25Å; A62-F66 WeakPolarHBondContact O-CB 3.39Å; A62-F66 PolarHBondContact O-N 3.22Å
63	K	70.6	Confident	70.2	Confident	129 Å²	129	92 Å²	92	56%	0.561	46%	0.464	S	S	*	.	H	α-helix	trans	-58.1	-46.4	174.6	-78.5	172	177.5	179.9	0	111.4	I59 E60 F66 K67	I59-K63 HydrophobicContact CG2-CD 4.08Å; I59-K63 HydrophobicContact CG2-CG 4.37Å; I59-K63 WeakPolarHBondContact O-CB 3.42Å; I59-K63 VanDerWaalsContact O-CG 3.25Å; I59-K63 WeakPolarHBondContact O-CG 3.21Å; I59-K63 PolarHBondContact O-N 3.15Å; E60-K63 PolarHBondContact O-N 2.84Å; K63-F66 PolarHBondContact O-N 3.01Å; K63-K67 WeakPolarHBondContact O-CB 3.22Å; K63-K67 WeakPolarHBondContact O-CG 3.44Å; K63-K67 PolarHBondContact O-N 3.14Å
64	N	73.7	Confident	71.8	Confident	83 Å²	83	86.4 Å²	86.4	44%	0.444	44%	0.438	S	S	.	.	H	α-helix	trans	-70.4	-39	-178.9	-74.6	-32.3	0	0	0	112.1	E60 Q61 A62 F66 R68	E60-N64 WeakPolarHBondContact CG-ND2 3.46Å; E60-N64 VanDerWaalsContact O-CB 3.31Å; E60-N64 WeakPolarHBondContact O-CB 3.48Å; E60-N64 PolarHBondContact O-N 3.19Å; E60-N64 PolarHBondContact O-ND2 2.74Å; Q61-N64 PolarHBondContact O-N 3.32Å; A62-N64 PolarHBondContact O-N 2.83Å; N64-F66 VanDerWaalsContact C-N 3.34Å; N64-R68 VanDerWaalsContact O-CB 3.27Å; N64-R68 WeakPolarHBondContact O-CB 3.21Å; N64-R68 PolarHBondContact O-N 2.86Å
65	T	72.3	Confident	73.3	Confident	82 Å²	82	83 Å²	83	50%	0.503	43%	0.432	S	S	.	.	H	α-helix	trans	-64.2	-38	170.3	-62	0	0	0	0	111.8	Q61 A62 R68 N69	Q61-T65 WeakPolarHBondContact O-CB 3.28Å; Q61-T65 PolarHBondContact O-N 3.47Å; Q61-T65 PolarHBondContact O-OG1 2.97Å; A62-T65 PolarHBondContact O-N 2.92Å; T65-R68 PolarHBondContact O-N 3.34Å; T65-N69 WeakPolarHBondContact O-CB 2.98Å; T65-N69 VanDerWaalsContact O-CG 3.31Å; T65-N69 PolarHBondContact O-N 3.48Å; T65-N69 PolarHBondContact O-ND2 2.81Å
66	F	73.4	Confident	74.8	Confident	96 Å²	96	81.3 Å²	81.3	42%	0.421	43%	0.43	S	S	.	.	H	α-helix	trans	-66.6	-52.1	176.2	-174.3	-98.8	0	0	0	111.9	A62 K63 N64 R68 N69 N70 E157	A62-F66 VanDerWaalsContact O-CB 3.25Å; A62-F66 WeakPolarHBondContact O-CB 3.39Å; A62-F66 PolarHBondContact O-N 3.22Å; K63-F66 PolarHBondContact O-N 3.01Å; N64-F66 VanDerWaalsContact C-N 3.34Å; F66-R68 PolarHBondContact O-N 3.29Å; F66-N69 PolarHBondContact O-N 2.91Å; F66-N69 VanDerWaalsContact O-N 3.1Å; F66-N70 WeakPolarHBondContact CE1-ND2 3.27Å; F66-N70 WeakPolarHBondContact CZ-ND2 3.38Å; F66-N70 PolarHBondContact O-N 2.88Å; F66-E157 HydrophobicContact CE1-CB 4.36Å; F66-E157 WeakPolarHBondContact CZ-OE2 3.31Å
67	K	75.1	Confident	75.8	Confident	91 Å²	91	77.8 Å²	77.8	40%	0.396	41%	0.408	S	S	.	.	H	α-helix	trans	-52.9	-41.9	173.2	-75.1	-177.8	176	-177.5	0	111.4	K63 S71	K63-K67 WeakPolarHBondContact O-CB 3.22Å; K63-K67 WeakPolarHBondContact O-CG 3.44Å; K63-K67 PolarHBondContact O-N 3.14Å; K67-S71 WeakPolarHBondContact O-CB 3.16Å; K67-S71 PolarHBondContact O-N 3.26Å; K67-S71 PolarHBondContact O-OG 3.31Å
68	R	75.9	Confident	76.9	Confident	188 Å²	188	81.1 Å²	81.1	71%	0.709	41%	0.412	S	S	*	.	H	α-helix	trans	-70.2	-36.3	178	-160.5	173.2	-163.7	151.5	3.8	113.7	N64 T65 F66 S71 L72	N64-R68 VanDerWaalsContact O-CB 3.27Å; N64-R68 WeakPolarHBondContact O-CB 3.21Å; N64-R68 PolarHBondContact O-N 2.86Å; T65-R68 PolarHBondContact O-N 3.34Å; F66-R68 PolarHBondContact O-N 3.29Å; R68-S71 PolarHBondContact O-OG 3.34Å; R68-S71 VanDerWaalsContact O-OG 3.13Å; R68-L72 WeakPolarHBondContact O-CB 3.49Å; R68-L72 WeakPolarHBondContact O-CD1 3.42Å; R68-L72 VanDerWaalsContact O-CG 3.27Å; R68-L72 WeakPolarHBondContact O-CG 3.49Å; R68-L72 PolarHBondContact O-N 3.48Å; R68-L72 VanDerWaalsContact O-N 3.16Å
69	N	77.5	Confident	78	Confident	85 Å²	85	84.2 Å²	84.2	46%	0.455	42%	0.421	S	S	.	.	H	α-helix	trans	-71.6	-38.4	174.3	-77.9	-32.9	0	0	0	112.1	T65 F66 Q73	T65-N69 WeakPolarHBondContact O-CB 2.98Å; T65-N69 VanDerWaalsContact O-CG 3.31Å; T65-N69 PolarHBondContact O-N 3.48Å; T65-N69 PolarHBondContact O-ND2 2.81Å; F66-N69 PolarHBondContact O-N 2.91Å; F66-N69 VanDerWaalsContact O-N 3.1Å; N69-Q73 WeakPolarHBondContact O-CB 3.44Å; N69-Q73 PolarHBondContact O-N 3.44Å
70	N	78.6	Confident	78.9	Confident	6 Å²	6	87 Å²	87	3%	0.032	43%	0.426	C	S	.	.	H	α-helix	trans	-71.8	-36.3	177.7	-85.9	13.1	0	0	0	112.3	F66 Q73 A74 L154 E157	F66-N70 WeakPolarHBondContact CE1-ND2 3.27Å; F66-N70 WeakPolarHBondContact CZ-ND2 3.38Å; F66-N70 PolarHBondContact O-N 2.88Å; N70-Q73 PolarHBondContact O-N 3.06Å; N70-A74 VanDerWaalsContact O-CB 3.25Å; N70-A74 WeakPolarHBondContact O-CB 3.25Å; N70-A74 PolarHBondContact O-N 2.95Å; N70-L154 HydrophobicContact CB-CD2 4.42Å; N70-E157 WeakPolarHBondContact ND2-CB 3.39Å; N70-E157 PolarHBondContact ND2-OE2 2.76Å
71	S	78.8	Confident	79.9	Confident	62 Å²	62	82.9 Å²	82.9	43%	0.434	41%	0.408	S	S	.	.	H	α-helix	trans	-67.8	-38.7	172.7	66.3	0	0	0	0	112.7	K67 R68 A74 S75	K67-S71 WeakPolarHBondContact O-CB 3.16Å; K67-S71 PolarHBondContact O-N 3.26Å; K67-S71 PolarHBondContact O-OG 3.31Å; R68-S71 PolarHBondContact O-OG 3.34Å; R68-S71 VanDerWaalsContact O-OG 3.13Å; S71-A74 PolarHBondContact O-N 3.07Å; S71-S75 WeakPolarHBondContact O-CB 3.47Å; S71-S75 PolarHBondContact O-N 2.79Å
72	L	82.8	Confident	80.8	Confident	109 Å²	109	80.1 Å²	80.1	57%	0.571	40%	0.402	S	S	*	.	H	α-helix	trans	-63	-44.6	171.4	-76.4	169.6	0	0	0	112.2	R68 S75 A76	R68-L72 WeakPolarHBondContact O-CB 3.49Å; R68-L72 WeakPolarHBondContact O-CD1 3.42Å; R68-L72 VanDerWaalsContact O-CG 3.27Å; R68-L72 WeakPolarHBondContact O-CG 3.49Å; R68-L72 PolarHBondContact O-N 3.48Å; R68-L72 VanDerWaalsContact O-N 3.16Å; L72-S75 PolarHBondContact O-N 3.12Å; L72-A76 WeakPolarHBondContact O-CB 3.42Å; L72-A76 PolarHBondContact O-N 3.43Å
73	Q	81.1	Confident	81.8	Confident	83 Å²	83	80.1 Å²	80.1	39%	0.388	40%	0.402	S	S	.	.	H	α-helix	trans	-64.3	-40.7	174.5	-79.7	-162.2	73.1	0	0	112.3	N69 N70 A76 T77 L154	N69-Q73 WeakPolarHBondContact O-CB 3.44Å; N69-Q73 PolarHBondContact O-N 3.44Å; N70-Q73 PolarHBondContact O-N 3.06Å; Q73-A76 PolarHBondContact O-N 3.45Å; Q73-T77 PolarHBondContact O-N 3.35Å; Q73-T77 PolarHBondContact O-OG1 3.45Å; Q73-T77 VanDerWaalsContact O-OG1 3.06Å; Q73-L154 HydrophobicContact CB-CD1 3.82Å; Q73-L154 HydrophobicContact CB-CD2 4.11Å
74	A	84.7	Confident	82.8	Confident	3 Å²	3	74.2 Å²	74.2	3%	0.025	38%	0.376	C	S	.	.	H	α-helix	trans	-61.7	-45.9	178	0	0	0	0	0	111.1	N70 S71 T77 R78	N70-A74 VanDerWaalsContact O-CB 3.25Å; N70-A74 WeakPolarHBondContact O-CB 3.25Å; N70-A74 PolarHBondContact O-N 2.95Å; S71-A74 PolarHBondContact O-N 3.07Å; A74-T77 WeakPolarHBondContact CA-OG1 3.18Å; A74-T77 PolarHBondContact O-N 2.99Å; A74-T77 PolarHBondContact O-OG1 3.08Å; A74-R78 WeakPolarHBondContact O-CG 3.32Å; A74-R78 PolarHBondContact O-N 3.02Å
75	S	85.4	Confident	83.6	Confident	72 Å²	72	72.5 Å²	72.5	50%	0.503	37%	0.367	S	S	.	.	H	α-helix	trans	-56.7	-52.2	173.8	-170.5	0	0	0	0	111.7	S71 L72 T77 R78 E79	S71-S75 WeakPolarHBondContact O-CB 3.47Å; S71-S75 PolarHBondContact O-N 2.79Å; L72-S75 PolarHBondContact O-N 3.12Å; S75-T77 PolarHBondContact O-N 3.04Å; S75-R78 PolarHBondContact O-N 3.13Å; S75-E79 PolarHBondContact O-N 3.05Å
76	A	86.8	Confident	84.5	Confident	30 Å²	30	73.8 Å²	73.8	25%	0.248	37%	0.371	C	S	.	.	H	α-helix	trans	-65	-23.2	178.1	0	0	0	0	0	113.8	L72 Q73 R80	L72-A76 WeakPolarHBondContact O-CB 3.42Å; L72-A76 PolarHBondContact O-N 3.43Å; Q73-A76 PolarHBondContact O-N 3.45Å; A76-R80 VanDerWaalsContact O-CD 3.26Å; A76-R80 WeakPolarHBondContact O-CD 3.46Å; A76-R80 WeakPolarHBondContact O-CG 3.45Å; A76-R80 PolarHBondContact O-N 2.79Å
77	T	86.4	Confident	85.4	Confident	7 Å²	7	73.4 Å²	73.4	4%	0.043	37%	0.373	C	S	.	.	H	α-helix	trans	-79.8	-29.6	170	46.8	0	0	0	0	113.5	Q73 A74 S75 L81 K150 L154	Q73-T77 PolarHBondContact O-N 3.35Å; Q73-T77 PolarHBondContact O-OG1 3.45Å; Q73-T77 VanDerWaalsContact O-OG1 3.06Å; A74-T77 WeakPolarHBondContact CA-OG1 3.18Å; A74-T77 PolarHBondContact O-N 2.99Å; A74-T77 PolarHBondContact O-OG1 3.08Å; S75-T77 PolarHBondContact O-N 3.04Å; T77-L81 PolarHBondContact O-N 3.48Å; T77-L81 VanDerWaalsContact O-N 3.11Å; T77-K150 HydrophobicContact CG2-CD 4.05Å; T77-K150 HydrophobicContact CG2-CG 4.32Å; T77-L154 HydrophobicContact CG2-CD1 4.29Å
78	R	88.8	Confident	86.2	Confident	129 Å²	129	69.7 Å²	69.7	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-71.7	-43.6	174.9	-69.1	178.3	-170	133.6	0.8	111.5	A74 S75 R80 L81 S82 L151 E155	A74-R78 WeakPolarHBondContact O-CG 3.32Å; A74-R78 PolarHBondContact O-N 3.02Å; S75-R78 PolarHBondContact O-N 3.13Å; R78-R80 VanDerWaalsContact C-N 3.28Å; R78-R80 PolarHBondContact O-N 2.81Å; R78-L81 WeakPolarHBondContact O-CA 3.39Å; R78-L81 VanDerWaalsContact O-CB 3.29Å; R78-L81 WeakPolarHBondContact O-CB 3.42Å; R78-L81 PolarHBondContact O-N 3.2Å; R78-S82 PolarHBondContact O-N 2.91Å; R78-L151 HydrophobicContact CG-CD1 3.54Å; R78-E155 IonicContact CZ-OE1 2.79Å; R78-E155 IonicContact NE-OE1 2.72Å; R78-E155 IonicContact NH2-OE1 3.73Å; R78-E155 PolarHBondContact NH2-OE1 3.34Å
79	E	88.8	Confident	86.9	Confident	138 Å²	138	65.7 Å²	65.7	65%	0.645	35%	0.349	S	S	*	.	H	α-helix	trans	-58.1	-39.3	173.2	-176	-176.8	-155.2	0	0	112.1	S75 L81 S82 A83	S75-E79 PolarHBondContact O-N 3.05Å; E79-L81 VanDerWaalsContact C-N 3.27Å; E79-L81 PolarHBondContact O-N 2.78Å; E79-S82 PolarHBondContact O-OG 3.43Å; E79-S82 VanDerWaalsContact O-OG 3.05Å; E79-A83 PolarHBondContact O-N 2.96Å
80	R	88.7	Confident	87.6	Confident	141 Å²	141	64.2 Å²	64.2	53%	0.532	35%	0.345	S	S	.	.	H	α-helix	trans	-73.1	-16	173	-70.8	172	-173.6	-163.6	-0.1	114	A76 R78 L84 L147	A76-R80 VanDerWaalsContact O-CD 3.26Å; A76-R80 WeakPolarHBondContact O-CD 3.46Å; A76-R80 WeakPolarHBondContact O-CG 3.45Å; A76-R80 PolarHBondContact O-N 2.79Å; R78-R80 VanDerWaalsContact C-N 3.28Å; R78-R80 PolarHBondContact O-N 2.81Å; R80-L84 WeakPolarHBondContact O-CB 3.31Å; R80-L147 HydrophobicContact CB-CD1 4.12Å
81	L	90.1	Very high	88.1	Confident	32 Å²	32	64.2 Å²	64.2	17%	0.168	35%	0.345	C	S	.	.	H	α-helix	trans	-84.1	-45.2	175.5	-154.8	85.4	0	0	0	110.4	T77 R78 E79 L84 D85 K144 L147 L148	T77-L81 PolarHBondContact O-N 3.48Å; T77-L81 VanDerWaalsContact O-N 3.11Å; R78-L81 WeakPolarHBondContact O-CA 3.39Å; R78-L81 VanDerWaalsContact O-CB 3.29Å; R78-L81 WeakPolarHBondContact O-CB 3.42Å; R78-L81 PolarHBondContact O-N 3.2Å; E79-L81 VanDerWaalsContact C-N 3.27Å; E79-L81 PolarHBondContact O-N 2.78Å; L81-L84 PolarHBondContact O-N 3.13Å; L81-D85 PolarHBondContact O-N 2.88Å; L81-K144 HydrophobicContact CD1-CG 4.14Å; L81-L147 HydrophobicContact CD1-CB 3.65Å; L81-L147 HydrophobicContact CD1-CD1 4.35Å; L81-L148 HydrophobicContact CD1-CD2 4.18Å; L81-L148 HydrophobicContact CD1-CG 4.08Å; L81-L148 HydrophobicContact CD2-CD2 3.74Å; L81-L148 HydrophobicContact CD2-CG 4.44Å
82	S	89.3	Confident	88.7	Confident	65 Å²	65	64.9 Å²	64.9	46%	0.455	34%	0.342	S	S	.	.	H	α-helix	trans	-62	-47.1	177.6	53.2	0	0	0	0	111.9	R78 E79 L84 D85 D86	R78-S82 PolarHBondContact O-N 2.91Å; E79-S82 PolarHBondContact O-OG 3.43Å; E79-S82 VanDerWaalsContact O-OG 3.05Å; S82-L84 PolarHBondContact O-N 3.19Å; S82-D85 PolarHBondContact O-N 3.46Å; S82-D86 PolarHBondContact O-N 2.8Å
83	A	90.2	Very high	89.1	Confident	51 Å²	51	65.9 Å²	65.9	42%	0.421	34%	0.338	S	S	.	.	H	α-helix	trans	-61	-31.4	176.7	0	0	0	0	0	113.1	E79 D87	E79-A83 PolarHBondContact O-N 2.96Å; A83-D87 PolarHBondContact O-N 2.93Å; A83-D87 VanDerWaalsContact O-N 3.12Å
84	L	90.9	Very high	89.5	Confident	5 Å²	5	66 Å²	66	3%	0.026	34%	0.339	C	S	.	.	H	α-helix	trans	-76.5	-30.5	176	-168	78.3	0	0	0	112.1	R80 L81 S82 D87 I88 L140 R143 K144 L147	R80-L84 WeakPolarHBondContact O-CB 3.31Å; L81-L84 PolarHBondContact O-N 3.13Å; S82-L84 PolarHBondContact O-N 3.19Å; L84-D87 WeakPolarHBondContact O-CB 3.49Å; L84-D87 PolarHBondContact O-N 2.78Å; L84-I88 HydrophobicContact CG-CD1 4.43Å; L84-I88 WeakPolarHBondContact O-CD1 3.18Å; L84-I88 VanDerWaalsContact O-CG1 3.24Å; L84-I88 WeakPolarHBondContact O-CG1 3.47Å; L84-I88 PolarHBondContact O-N 2.86Å; L84-L140 HydrophobicContact CD1-CD2 3.66Å; L84-R143 HydrophobicContact CD1-CB 4.37Å; L84-R143 HydrophobicContact CD1-CG 4.16Å; L84-R143 HydrophobicContact CD2-CB 4.02Å; L84-R143 HydrophobicContact CD2-CG 4.05Å; L84-K144 VanDerWaalsContact CD2-CA 3.5Å; L84-K144 HydrophobicContact CD2-CB 3.75Å; L84-K144 VanDerWaalsContact CD2-N 3.31Å; L84-L147 HydrophobicContact CD2-CD1 4.23Å
85	D	90.8	Very high	89.9	Confident	47 Å²	47	66.9 Å²	66.9	25%	0.251	34%	0.343	S	S	.	.	H	α-helix	trans	-72.7	-36.2	174.1	-76.2	-9.3	0	0	0	111.4	L81 S82 I88 M89 K144	L81-D85 PolarHBondContact O-N 2.88Å; S82-D85 PolarHBondContact O-N 3.46Å; D85-I88 PolarHBondContact O-N 3.4Å; D85-M89 WeakPolarHBondContact O-CB 3.41Å; D85-M89 VanDerWaalsContact O-CG 3.27Å; D85-M89 WeakPolarHBondContact O-CG 3.41Å; D85-M89 PolarHBondContact O-N 2.8Å; D85-K144 VanDerWaalsContact OD1-CD 3.23Å; D85-K144 WeakPolarHBondContact OD1-CD 3.21Å; D85-K144 WeakPolarHBondContact OD1-CE 3.24Å; D85-K144 IonicContact OD1-NZ 2.85Å; D85-K144 PolarHBondContact OD1-NZ 3.45Å; D85-K144 WeakPolarHBondContact OD2-CE 3.21Å; D85-K144 IonicContact OD2-NZ 2.72Å; D85-K144 PolarHBondContact OD2-NZ 2.8Å
86	D	91.2	Very high	90.2	Very high	109 Å²	109	68.7 Å²	68.7	58%	0.583	34%	0.343	S	S	*	.	H	α-helix	trans	-61.1	-45	168.7	-67.7	-42.1	0	0	0	111.7	S82 I88 M89 S90	S82-D86 PolarHBondContact O-N 2.8Å; D86-I88 PolarHBondContact O-N 3.09Å; D86-M89 PolarHBondContact O-N 3.05Å; D86-S90 WeakPolarHBondContact O-CB 3.2Å; D86-S90 PolarHBondContact O-N 3.19Å
87	D	91	Very high	90.4	Very high	88 Å²	88	74.1 Å²	74.1	47%	0.471	36%	0.361	S	S	.	.	H	α-helix	trans	-57.4	-46.7	173.7	-82.3	-21.1	0	0	0	111.6	A83 L84 S90 A91 L140	A83-D87 PolarHBondContact O-N 2.93Å; A83-D87 VanDerWaalsContact O-N 3.12Å; L84-D87 WeakPolarHBondContact O-CB 3.49Å; L84-D87 PolarHBondContact O-N 2.78Å; D87-S90 PolarHBondContact O-N 2.91Å; D87-A91 WeakPolarHBondContact O-CB 3.48Å; D87-A91 PolarHBondContact O-N 2.84Å; D87-L140 HydrophobicContact CB-CD1 4.17Å; D87-L140 HydrophobicContact CB-CD2 4.36Å
88	I	92.1	Very high	90.6	Very high	14 Å²	14	74.8 Å²	74.8	7%	0.072	36%	0.364	C	S	.	.	H	α-helix	trans	-63.4	-50.1	178.9	-71.6	164.7	0	0	0	110.6	L84 D85 D86 S90 A91 Q92 L140 I141 K144	L84-I88 HydrophobicContact CG-CD1 4.43Å; L84-I88 WeakPolarHBondContact O-CD1 3.18Å; L84-I88 VanDerWaalsContact O-CG1 3.24Å; L84-I88 WeakPolarHBondContact O-CG1 3.47Å; L84-I88 PolarHBondContact O-N 2.86Å; D85-I88 PolarHBondContact O-N 3.4Å; D86-I88 PolarHBondContact O-N 3.09Å; I88-S90 PolarHBondContact O-N 3.35Å; I88-A91 PolarHBondContact O-N 3.08Å; I88-Q92 HydrophobicContact CG2-CG 4.45Å; I88-Q92 WeakPolarHBondContact O-CG 3.43Å; I88-Q92 PolarHBondContact O-N 3.24Å; I88-L140 HydrophobicContact CD1-CB 4.03Å; I88-L140 HydrophobicContact CG1-CB 3.53Å; I88-L140 HydrophobicContact CG1-CD1 3.97Å; I88-L140 HydrophobicContact CG1-CG 4.36Å; I88-I141 HydrophobicContact CD1-CG1 4.4Å; I88-K144 HydrophobicContact CD1-CB 4.46Å; I88-K144 HydrophobicContact CD1-CD 4.32Å
89	M	91.1	Very high	90.6	Very high	104 Å²	104	72.7 Å²	72.7	51%	0.512	36%	0.36	S	S	.	.	H	α-helix	trans	-63.4	-29.3	178.7	-71.9	-62	-59.7	0	0	112.2	D85 D86 R93	D85-M89 WeakPolarHBondContact O-CB 3.41Å; D85-M89 VanDerWaalsContact O-CG 3.27Å; D85-M89 WeakPolarHBondContact O-CG 3.41Å; D85-M89 PolarHBondContact O-N 2.8Å; D86-M89 PolarHBondContact O-N 3.05Å; M89-R93 WeakPolarHBondContact O-CG 3.33Å; M89-R93 PolarHBondContact O-N 3.34Å; M89-R93 PolarHBondContact O-NE 2.97Å; M89-R93 PolarHBondContact O-NH2 2.99Å
90	S	91.4	Very high	90.7	Very high	53 Å²	53	71.7 Å²	71.7	37%	0.371	36%	0.358	S	S	.	.	H	α-helix	trans	-71.2	-48.9	172.4	-160.7	0	0	0	0	111.6	D86 D87 I88 Q92 R93 E94	D86-S90 WeakPolarHBondContact O-CB 3.2Å; D86-S90 PolarHBondContact O-N 3.19Å; D87-S90 PolarHBondContact O-N 2.91Å; I88-S90 PolarHBondContact O-N 3.35Å; S90-Q92 VanDerWaalsContact C-N 3.31Å; S90-Q92 PolarHBondContact O-N 2.92Å; S90-R93 PolarHBondContact O-N 3.05Å; S90-E94 PolarHBondContact O-N 3.11Å; S90-E94 VanDerWaalsContact O-N 3.08Å
91	A	90.6	Very high	90.7	Very high	6 Å²	6	67.4 Å²	67.4	5%	0.05	35%	0.35	C	S	.	.	H	α-helix	trans	-62.6	-35.7	179.1	0	0	0	0	0	112.9	D87 I88 E94 L95 L136 I137 L140	D87-A91 WeakPolarHBondContact O-CB 3.48Å; D87-A91 PolarHBondContact O-N 2.84Å; I88-A91 PolarHBondContact O-N 3.08Å; A91-E94 PolarHBondContact O-N 3.36Å; A91-L95 WeakPolarHBondContact O-CB 3.41Å; A91-L95 PolarHBondContact O-N 3.17Å; A91-L136 HydrophobicContact CB-CD2 3.92Å; A91-I137 HydrophobicContact CB-CD1 4.15Å; A91-I137 HydrophobicContact CB-CG1 3.72Å; A91-L140 HydrophobicContact CB-CD1 4.46Å
92	Q	91.6	Very high	90.6	Very high	76 Å²	76	67.3 Å²	67.3	36%	0.355	35%	0.349	S	S	.	.	H	α-helix	trans	-64.5	-48.1	173.8	-73	176.4	-60.5	0	0	111.9	I88 S90 E94 L95 E96 I137	I88-Q92 HydrophobicContact CG2-CG 4.45Å; I88-Q92 WeakPolarHBondContact O-CG 3.43Å; I88-Q92 PolarHBondContact O-N 3.24Å; S90-Q92 VanDerWaalsContact C-N 3.31Å; S90-Q92 PolarHBondContact O-N 2.92Å; Q92-E94 PolarHBondContact O-N 2.7Å; Q92-L95 WeakPolarHBondContact O-CB 3.36Å; Q92-L95 PolarHBondContact O-N 3.48Å; Q92-E96 WeakPolarHBondContact O-CG 3.27Å; Q92-E96 PolarHBondContact O-N 2.95Å; Q92-I137 HydrophobicContact CG-CD1 4.18Å
93	R	91.2	Very high	90.4	Very high	130 Å²	130	69.1 Å²	69.1	49%	0.491	35%	0.354	S	S	.	.	H	α-helix	trans	-65	-21.2	176.7	-76	175.7	-68.6	153.1	-0.7	114.2	M89 S90 K97	M89-R93 WeakPolarHBondContact O-CG 3.33Å; M89-R93 PolarHBondContact O-N 3.34Å; M89-R93 PolarHBondContact O-NE 2.97Å; M89-R93 PolarHBondContact O-NH2 2.99Å; S90-R93 PolarHBondContact O-N 3.05Å; R93-K97 WeakPolarHBondContact O-CD 3.3Å; R93-K97 WeakPolarHBondContact O-CE 3.43Å; R93-K97 VanDerWaalsContact O-CG 3.3Å; R93-K97 WeakPolarHBondContact O-CG 3.41Å
94	E	89.7	Confident	90.2	Very high	86 Å²	86	70.4 Å²	70.4	40%	0.402	36%	0.357	S	S	.	.	H	α-helix	trans	-77.8	-43.9	167.7	-71.1	-173.5	151.2	0	0	111.4	S90 A91 Q92 K97 M98 K133	S90-E94 PolarHBondContact O-N 3.11Å; S90-E94 VanDerWaalsContact O-N 3.08Å; A91-E94 PolarHBondContact O-N 3.36Å; Q92-E94 PolarHBondContact O-N 2.7Å; E94-K97 WeakPolarHBondContact O-CB 3.49Å; E94-K97 PolarHBondContact O-N 3.29Å; E94-K97 VanDerWaalsContact O-N 3.17Å; E94-M98 HydrophobicContact CB-CE 4.38Å; E94-M98 WeakPolarHBondContact O-CE 3.25Å; E94-M98 PolarHBondContact O-N 3.46Å; E94-M98 VanDerWaalsContact O-N 3.07Å; E94-K133 IonicContact OE2-NZ 3.41Å; E94-K133 PolarHBondContact OE2-NZ 3.31Å
95	L	92.1	Very high	89.8	Confident	22 Å²	22	71.6 Å²	71.6	12%	0.115	36%	0.363	C	S	.	.	H	α-helix	trans	-60.5	-46.1	179	-174.2	143.5	0	0	0	112	A91 Q92 K97 M98 E99 K133 M134 I137	A91-L95 WeakPolarHBondContact O-CB 3.41Å; A91-L95 PolarHBondContact O-N 3.17Å; Q92-L95 WeakPolarHBondContact O-CB 3.36Å; Q92-L95 PolarHBondContact O-N 3.48Å; L95-K97 PolarHBondContact O-N 3.12Å; L95-M98 HydrophobicContact CB-CE 4.4Å; L95-M98 PolarHBondContact O-N 2.93Å; L95-E99 VanDerWaalsContact CD2-CD 3.42Å; L95-E99 HydrophobicContact CD2-CG 4.11Å; L95-E99 WeakPolarHBondContact CD2-OE2 3.5Å; L95-E99 PolarHBondContact O-N 2.68Å; L95-K133 HydrophobicContact CD1-CB 4.43Å; L95-M134 HydrophobicContact CD1-CG 3.68Å; L95-I137 HydrophobicContact CB-CD1 4.34Å; L95-I137 HydrophobicContact CD1-CD1 3.89Å
96	E	91.2	Very high	89.2	Confident	109 Å²	109	72.9 Å²	72.9	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-54.1	-39	173.7	-70.5	167	170.7	0	0	112.4	Q92 L100	Q92-E96 WeakPolarHBondContact O-CG 3.27Å; Q92-E96 PolarHBondContact O-N 2.95Å; E96-L100 WeakPolarHBondContact O-CB 3.48Å; E96-L100 PolarHBondContact O-N 2.84Å
97	K	91.5	Very high	88.5	Confident	144 Å²	144	69.5 Å²	69.5	63%	0.626	36%	0.36	S	S	*	.	H	α-helix	trans	-70.9	-35.3	176.7	-69.1	170.6	-174.3	176.8	0	112.7	R93 E94 L95 S101	R93-K97 WeakPolarHBondContact O-CD 3.3Å; R93-K97 WeakPolarHBondContact O-CE 3.43Å; R93-K97 VanDerWaalsContact O-CG 3.3Å; R93-K97 WeakPolarHBondContact O-CG 3.41Å; E94-K97 WeakPolarHBondContact O-CB 3.49Å; E94-K97 PolarHBondContact O-N 3.29Å; E94-K97 VanDerWaalsContact O-N 3.17Å; L95-K97 PolarHBondContact O-N 3.12Å; K97-S101 WeakPolarHBondContact O-CB 3.42Å; K97-S101 PolarHBondContact O-N 3.19Å
98	M	89.7	Confident	87.5	Confident	22 Å²	22	70.4 Å²	70.4	11%	0.108	36%	0.362	C	S	.	.	H	α-helix	trans	-72	-36.4	175.5	-72.9	176.9	-67.5	0	0	111.5	E94 L95 S101 L102 L126 E129 I130 K133	E94-M98 HydrophobicContact CB-CE 4.38Å; E94-M98 WeakPolarHBondContact O-CE 3.25Å; E94-M98 PolarHBondContact O-N 3.46Å; E94-M98 VanDerWaalsContact O-N 3.07Å; L95-M98 HydrophobicContact CB-CE 4.4Å; L95-M98 PolarHBondContact O-N 2.93Å; M98-S101 PolarHBondContact O-N 2.73Å; M98-L102 WeakPolarHBondContact O-CB 3.42Å; M98-L102 PolarHBondContact O-N 2.84Å; M98-L126 HydrophobicContact CG-CD2 4.43Å; M98-E129 HydrophobicContact SD-CG 3.93Å; M98-I130 HydrophobicContact CB-CD1 4.09Å; M98-I130 HydrophobicContact CB-CG1 3.7Å; M98-K133 HydrophobicContact CE-CB 3.95Å; M98-K133 HydrophobicContact CE-CD 3.85Å; M98-K133 HydrophobicContact CE-CG 3.54Å; M98-K133 HydrophobicContact SD-CG 4.32Å
99	E	89.6	Confident	86.2	Confident	85 Å²	85	72.5 Å²	72.5	40%	0.397	38%	0.375	S	S	.	.	H	α-helix	trans	-65.3	-48.6	172.5	-70	-178.4	150.2	0	0	111.2	L95 S101 L102 D103 I130	L95-E99 VanDerWaalsContact CD2-CD 3.42Å; L95-E99 HydrophobicContact CD2-CG 4.11Å; L95-E99 WeakPolarHBondContact CD2-OE2 3.5Å; L95-E99 PolarHBondContact O-N 2.68Å; E99-S101 VanDerWaalsContact C-N 3.27Å; E99-S101 PolarHBondContact O-N 3.23Å; E99-L102 WeakPolarHBondContact O-CA 3.47Å; E99-L102 WeakPolarHBondContact O-CB 3.46Å; E99-L102 PolarHBondContact O-N 3.16Å; E99-D103 PolarHBondContact O-N 3.44Å; E99-I130 HydrophobicContact CG-CD1 4.36Å
100	L	90.2	Very high	84.6	Confident	116 Å²	116	72.4 Å²	72.4	61%	0.607	39%	0.385	S	S	*	.	H	α-helix	trans	-55.5	-39.9	171.3	-88.7	160	0	0	0	113	E96 T104	E96-L100 WeakPolarHBondContact O-CB 3.48Å; E96-L100 PolarHBondContact O-N 2.84Å; L100-T104 WeakPolarHBondContact O-CB 3.44Å; L100-T104 PolarHBondContact O-N 2.69Å; L100-T104 PolarHBondContact O-OG1 3.3Å
101	S	89.2	Confident	83	Confident	52 Å²	52	75.1 Å²	75.1	36%	0.364	40%	0.399	S	S	.	.	H	α-helix	trans	-71.2	-29.1	175.7	-173.1	0	0	0	0	113	K97 M98 E99 L105	K97-S101 WeakPolarHBondContact O-CB 3.42Å; K97-S101 PolarHBondContact O-N 3.19Å; M98-S101 PolarHBondContact O-N 2.73Å; E99-S101 VanDerWaalsContact C-N 3.27Å; E99-S101 PolarHBondContact O-N 3.23Å; S101-L105 WeakPolarHBondContact O-CD1 3.4Å; S101-L105 WeakPolarHBondContact O-CG 3.41Å; S101-L105 PolarHBondContact O-N 3.32Å
102	L	88.3	Confident	81.1	Confident	29 Å²	29	80.6 Å²	80.6	15%	0.152	42%	0.424	C	S	.	.	H	α-helix	trans	-73	-47.7	175	-178.8	63.4	0	0	0	110.2	M98 E99 T104 L105 L106 I123 L126 I130	M98-L102 WeakPolarHBondContact O-CB 3.42Å; M98-L102 PolarHBondContact O-N 2.84Å; E99-L102 WeakPolarHBondContact O-CA 3.47Å; E99-L102 WeakPolarHBondContact O-CB 3.46Å; E99-L102 PolarHBondContact O-N 3.16Å; L102-T104 VanDerWaalsContact C-N 3.31Å; L102-T104 PolarHBondContact O-N 3.33Å; L102-L105 PolarHBondContact O-N 2.73Å; L102-L105 VanDerWaalsContact O-N 3.09Å; L102-L106 HydrophobicContact CD1-CD1 4.41Å; L102-L106 HydrophobicContact CD1-CG 4.43Å; L102-L106 HydrophobicContact CG-CD1 3.99Å; L102-L106 HydrophobicContact CG-CG 4.43Å; L102-L106 WeakPolarHBondContact O-CG 3.42Å; L102-L106 PolarHBondContact O-N 3.45Å; L102-I123 HydrophobicContact CD1-CG2 4.09Å; L102-L126 HydrophobicContact CD1-CB 4.44Å; L102-I130 HydrophobicContact CB-CD1 4.32Å; L102-I130 HydrophobicContact CD2-CD1 3.9Å
103	D	85.4	Confident	78.8	Confident	104 Å²	104	84.2 Å²	84.2	56%	0.556	45%	0.451	S	S	*	.	H	α-helix	trans	-60.3	-40.8	176.7	-73.8	-18.4	0	0	0	111.7	E99 L105 L106 G107	E99-D103 PolarHBondContact O-N 3.44Å; D103-L105 VanDerWaalsContact C-N 3.32Å; D103-L105 PolarHBondContact O-N 3.49Å; D103-L106 PolarHBondContact O-N 2.79Å; D103-G107 PolarHBondContact O-N 3.08Å
104	T	85.1	Confident	76.6	Confident	78 Å²	78	82 Å²	82	48%	0.479	46%	0.455	S	S	.	.	H	α-helix	trans	-59.2	-42.2	173.8	-58.2	0	0	0	0	111.8	L100 L102 Q108	L100-T104 WeakPolarHBondContact O-CB 3.44Å; L100-T104 PolarHBondContact O-N 2.69Å; L100-T104 PolarHBondContact O-OG1 3.3Å; L102-T104 VanDerWaalsContact C-N 3.31Å; L102-T104 PolarHBondContact O-N 3.33Å; T104-Q108 WeakPolarHBondContact O-CG 3.43Å; T104-Q108 PolarHBondContact O-N 2.95Å; T104-Q108 VanDerWaalsContact O-N 3.11Å
105	L	83.4	Confident	74.5	Confident	30 Å²	30	85.8 Å²	85.8	16%	0.157	48%	0.478	C	S	.	.	H	α-helix	trans	-72.9	-35.7	177.6	-73.9	168.8	0	0	0	112.7	S101 L102 D103 Q108 V109 I123 L126	S101-L105 WeakPolarHBondContact O-CD1 3.4Å; S101-L105 WeakPolarHBondContact O-CG 3.41Å; S101-L105 PolarHBondContact O-N 3.32Å; L102-L105 PolarHBondContact O-N 2.73Å; L102-L105 VanDerWaalsContact O-N 3.09Å; D103-L105 VanDerWaalsContact C-N 3.32Å; D103-L105 PolarHBondContact O-N 3.49Å; L105-Q108 PolarHBondContact O-N 3.22Å; L105-V109 WeakPolarHBondContact O-CB 3.48Å; L105-V109 WeakPolarHBondContact O-CG2 3.34Å; L105-V109 PolarHBondContact O-N 3.4Å; L105-I123 HydrophobicContact CB-CG1 4.33Å; L105-L126 HydrophobicContact CD1-CD1 3.41Å; L105-L126 VanDerWaalsContact CD1-CD1 3.41Å
106	L	78.5	Confident	72.9	Confident	73 Å²	73	87 Å²	87	38%	0.382	49%	0.488	S	S	.	.	H	α-helix	trans	-66.5	-38.3	174.6	-70.5	171.2	0	0	0	111.2	L102 D103 S110 I123	L102-L106 HydrophobicContact CD1-CD1 4.41Å; L102-L106 HydrophobicContact CD1-CG 4.43Å; L102-L106 HydrophobicContact CG-CD1 3.99Å; L102-L106 HydrophobicContact CG-CG 4.43Å; L102-L106 WeakPolarHBondContact O-CG 3.42Å; L102-L106 PolarHBondContact O-N 3.45Å; D103-L106 PolarHBondContact O-N 2.79Å; L106-S110 WeakPolarHBondContact O-CB 3.44Å; L106-S110 PolarHBondContact O-N 2.99Å; L106-S110 PolarHBondContact O-OG 3.49Å; L106-I123 HydrophobicContact CD2-CD1 4.11Å
107	G	75.8	Confident	71.5	Confident	38 Å²	38	85.6 Å²	85.6	39%	0.392	49%	0.491	S	S	.	.	H	α-helix	trans	-60.1	-50.7	171.1	0	0	0	0	0	112.3	D103 V109 S110 T111	D103-G107 PolarHBondContact O-N 3.08Å; G107-V109 PolarHBondContact O-N 3.04Å; G107-S110 WeakPolarHBondContact O-CB 3.39Å; G107-S110 PolarHBondContact O-N 3.42Å; G107-T111 PolarHBondContact O-N 2.9Å
108	Q	70.4	Confident	70.1	Confident	107 Å²	107	84 Å²	84	50%	0.5	49%	0.488	S	S	.	.	H	α-helix	trans	-59.8	-42.2	177.4	-72.6	172.2	-2.8	0	0	112.9	T104 L105 S110 T111 E112	T104-Q108 WeakPolarHBondContact O-CG 3.43Å; T104-Q108 PolarHBondContact O-N 2.95Å; T104-Q108 VanDerWaalsContact O-N 3.11Å; L105-Q108 PolarHBondContact O-N 3.22Å; Q108-S110 PolarHBondContact O-N 3.07Å; Q108-T111 PolarHBondContact O-N 2.91Å; Q108-T111 PolarHBondContact O-OG1 3.5Å; Q108-E112 PolarHBondContact O-N 3.36Å
109	V	64.1	Low	69.2	Low	59 Å²	59	83.5 Å²	83.5	36%	0.358	49%	0.489	S	S	.	.	H	α-helix	trans	-71.4	-18	176.8	171.8	0	0	0	0	112.5	L105 G107 I123	L105-V109 WeakPolarHBondContact O-CB 3.48Å; L105-V109 WeakPolarHBondContact O-CG2 3.34Å; L105-V109 PolarHBondContact O-N 3.4Å; G107-V109 PolarHBondContact O-N 3.04Å; V109-I123 HydrophobicContact CB-CD1 4.5Å; V109-I123 HydrophobicContact CG2-CD1 4.02Å
110	S	57.1	Low	68.4	Low	102 Å²	102	82.9 Å²	82.9	71%	0.713	49%	0.489	S	S	*	.	H	α-helix	trans	-80.8	-20.1	173.8	-58.2	0	0	0	0	113.4	L106 G107 Q108	L106-S110 WeakPolarHBondContact O-CB 3.44Å; L106-S110 PolarHBondContact O-N 2.99Å; L106-S110 PolarHBondContact O-OG 3.49Å; G107-S110 WeakPolarHBondContact O-CB 3.39Å; G107-S110 PolarHBondContact O-N 3.42Å; Q108-S110 PolarHBondContact O-N 3.07Å
111	T	58.2	Low	67.8	Low	109 Å²	109	86 Å²	86	67%	0.669	49%	0.492	S	S	*	.	H	α-helix	trans	-96.4	-29.2	178.4	49.8	0	0	0	0	114.1	G107 Q108 V113	G107-T111 PolarHBondContact O-N 2.9Å; Q108-T111 PolarHBondContact O-N 2.91Å; Q108-T111 PolarHBondContact O-OG1 3.5Å; T111-V113 PolarHBondContact O-N 2.92Å
112	E	50	Low	67.5	Low	121 Å²	121	89.1 Å²	89.1	57%	0.565	50%	0.499	S	S	*	.			trans	-90.2	99	179.2	-70.1	-172.9	177.7	0	0	111.9	Q108 S114	Q108-E112 PolarHBondContact O-N 3.36Å; E112-S114 PolarHBondContact O-N 3Å
113	V	45	Very low	67.4	Low	152 Å²	152	88.5 Å²	88.5	92%	0.921	50%	0.496	S	S	*	.			trans	-74.6	40.6	-178.7	-161	0	0	0	0	112.8	T111	T111-V113 PolarHBondContact O-N 2.92Å
114	S	43.5	Very low	67.3	Low	83 Å²	83	91.8 Å²	91.8	58%	0.58	50%	0.5	S	S	*	.	S	Bend	trans	-141.1	137.9	177.8	75.9	0	0	0	0	112.2	E112 S116	E112-S114 PolarHBondContact O-N 3Å; S114-S116 PolarHBondContact O-N 2.94Å
115	N	47.1	Very low	67.5	Low	167 Å²	167	91.6 Å²	91.6	89%	0.893	50%	0.502	S	S	*	.			trans	-74	75.5	-165.3	-81.3	-72.2	0	0	0	114	S117	N115-S117 PolarHBondContact O-N 3.04Å
116	S	57.2	Low	67.8	Low	46 Å²	46	91.5 Å²	91.5	32%	0.322	50%	0.502	S	S	.	.			trans	-71.1	98	172.8	80.8	0	0	0	0	110.8	S114 L118 G119 N120	S114-S116 PolarHBondContact O-N 2.94Å; S116-L118 PolarHBondContact O-N 3.25Å; S116-G119 PolarHBondContact O-N 3.49Å; S116-N120 PolarHBondContact O-N 2.99Å
117	S	61.6	Low	68.2	Low	80 Å²	80	92.2 Å²	92.2	56%	0.559	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.2	177.1	72.5	0	0	0	0	113.3	N115 R121	N115-S117 PolarHBondContact O-N 3.04Å; S117-R121 WeakPolarHBondContact O-CG 3.42Å
118	L	63.6	Low	68.8	Low	111 Å²	111	95.6 Å²	95.6	58%	0.581	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-36.9	178.3	-156.4	140.4	0	0	0	112.2	S116 R121 K122	S116-L118 PolarHBondContact O-N 3.25Å; L118-R121 PolarHBondContact O-N 2.92Å; L118-K122 HydrophobicContact CD2-CD 4.46Å; L118-K122 PolarHBondContact O-N 3.47Å; L118-K122 VanDerWaalsContact O-N 3.08Å
119	G	69.7	Low	69.7	Low	12 Å²	12	94.9 Å²	94.9	12%	0.124	51%	0.508	C	S	.	.	H	α-helix	trans	-62.4	-47.7	172.3	0	0	0	0	0	111.6	S116 R121 K122 I123	S116-G119 PolarHBondContact O-N 3.49Å; G119-R121 PolarHBondContact O-N 3.12Å; G119-R121 VanDerWaalsContact O-N 3.14Å; G119-K122 PolarHBondContact O-N 3.1Å; G119-I123 PolarHBondContact O-N 3.42Å
120	N	72.8	Confident	71	Confident	72 Å²	72	92.7 Å²	92.7	39%	0.385	50%	0.495	S	S	.	.	H	α-helix	trans	-59.2	-23.9	174.2	-83.1	-79.4	0	0	0	114.3	S116 R124	S116-N120 PolarHBondContact O-N 2.99Å; N120-R124 WeakPolarHBondContact O-CG 3.38Å; N120-R124 PolarHBondContact O-N 2.94Å
121	R	78.6	Confident	72.6	Confident	182 Å²	182	92.7 Å²	92.7	69%	0.687	48%	0.483	S	S	*	.	H	α-helix	trans	-80.9	-40.4	172	-73.5	173.7	-170	-174.3	5.2	112.2	S117 L118 G119 R124 S125	S117-R121 WeakPolarHBondContact O-CG 3.42Å; L118-R121 PolarHBondContact O-N 2.92Å; G119-R121 PolarHBondContact O-N 3.12Å; G119-R121 VanDerWaalsContact O-N 3.14Å; R121-R124 PolarHBondContact O-N 3.17Å; R121-S125 PolarHBondContact O-N 2.93Å
122	K	82.4	Confident	74	Confident	116 Å²	116	90.9 Å²	90.9	50%	0.504	47%	0.472	S	S	.	.	H	α-helix	trans	-60.6	-48.1	174.7	-73	-177.7	174.5	-176.9	0	111.3	L118 G119 R124 S125 L126	L118-K122 HydrophobicContact CD2-CD 4.46Å; L118-K122 PolarHBondContact O-N 3.47Å; L118-K122 VanDerWaalsContact O-N 3.08Å; G119-K122 PolarHBondContact O-N 3.1Å; K122-R124 PolarHBondContact O-N 3.24Å; K122-S125 WeakPolarHBondContact O-CB 3.31Å; K122-S125 PolarHBondContact O-N 2.97Å; K122-S125 VanDerWaalsContact O-N 3.08Å; K122-L126 PolarHBondContact O-N 3.27Å
123	I	86.6	Confident	76	Confident	16 Å²	16	87.6 Å²	87.6	8%	0.082	46%	0.456	C	S	.	.	H	α-helix	trans	-53.7	-54	176	-71.6	167.3	0	0	0	110.5	L102 L105 L106 V109 G119 S125 L126 E127	L102-I123 HydrophobicContact CD1-CG2 4.09Å; L105-I123 HydrophobicContact CB-CG1 4.33Å; L106-I123 HydrophobicContact CD2-CD1 4.11Å; V109-I123 HydrophobicContact CB-CD1 4.5Å; V109-I123 HydrophobicContact CG2-CD1 4.02Å; G119-I123 PolarHBondContact O-N 3.42Å; I123-S125 PolarHBondContact O-N 3.46Å; I123-L126 PolarHBondContact O-N 3.41Å; I123-L126 VanDerWaalsContact O-N 3.12Å; I123-E127 HydrophobicContact CG2-CG 4.24Å; I123-E127 WeakPolarHBondContact O-CG 2.99Å; I123-E127 PolarHBondContact O-N 3.44Å
124	R	83.4	Confident	78.2	Confident	174 Å²	174	85.1 Å²	85.1	66%	0.657	44%	0.436	S	S	*	.	H	α-helix	trans	-63.5	-24.1	178.8	-72.1	178.5	-174.3	-174.4	4.8	114.9	N120 R121 K122 E127 L128	N120-R124 WeakPolarHBondContact O-CG 3.38Å; N120-R124 PolarHBondContact O-N 2.94Å; R121-R124 PolarHBondContact O-N 3.17Å; K122-R124 PolarHBondContact O-N 3.24Å; R124-E127 WeakPolarHBondContact CA-OE2 3.27Å; R124-E127 WeakPolarHBondContact CG-OE2 3.22Å; R124-L128 WeakPolarHBondContact O-CB 3.46Å; R124-L128 PolarHBondContact O-N 3.39Å
125	S	87.6	Confident	80.4	Confident	74 Å²	74	85.8 Å²	85.8	52%	0.517	43%	0.428	S	S	.	.	H	α-helix	trans	-72.5	-46.3	173.5	-159.9	0	0	0	0	110.6	R121 K122 I123 L128 E129	R121-S125 PolarHBondContact O-N 2.93Å; K122-S125 WeakPolarHBondContact O-CB 3.31Å; K122-S125 PolarHBondContact O-N 2.97Å; K122-S125 VanDerWaalsContact O-N 3.08Å; I123-S125 PolarHBondContact O-N 3.46Å; S125-L128 PolarHBondContact O-N 2.97Å; S125-E129 WeakPolarHBondContact O-CB 3.36Å; S125-E129 PolarHBondContact O-N 3.3Å
126	L	89.6	Confident	82.5	Confident	28 Å²	28	81.9 Å²	81.9	15%	0.147	41%	0.407	C	S	.	.	H	α-helix	trans	-68	-41.6	176.7	-80.5	162.9	0	0	0	112.5	M98 L102 L105 K122 I123 L128 E129 I130	M98-L126 HydrophobicContact CG-CD2 4.43Å; L102-L126 HydrophobicContact CD1-CB 4.44Å; L105-L126 HydrophobicContact CD1-CD1 3.41Å; L105-L126 VanDerWaalsContact CD1-CD1 3.41Å; K122-L126 PolarHBondContact O-N 3.27Å; I123-L126 PolarHBondContact O-N 3.41Å; I123-L126 VanDerWaalsContact O-N 3.12Å; L126-L128 PolarHBondContact O-N 3.32Å; L126-E129 PolarHBondContact O-N 3.44Å; L126-I130 WeakPolarHBondContact O-CB 3.45Å; L126-I130 VanDerWaalsContact O-CG1 3.27Å; L126-I130 WeakPolarHBondContact O-CG1 3.42Å; L126-I130 PolarHBondContact O-N 3.39Å
127	E	88.4	Confident	84.1	Confident	88 Å²	88	80.5 Å²	80.5	41%	0.411	40%	0.395	S	S	.	.	H	α-helix	trans	-51.8	-44.7	172.1	-75	-179.9	126.8	0	0	111.1	I123 R124 E131	I123-E127 HydrophobicContact CG2-CG 4.24Å; I123-E127 WeakPolarHBondContact O-CG 2.99Å; I123-E127 PolarHBondContact O-N 3.44Å; R124-E127 WeakPolarHBondContact CA-OE2 3.27Å; R124-E127 WeakPolarHBondContact CG-OE2 3.22Å; E127-E131 WeakPolarHBondContact O-CB 3.46Å; E127-E131 PolarHBondContact O-N 3.13Å
128	L	88.4	Confident	85.5	Confident	109 Å²	109	81.7 Å²	81.7	57%	0.571	40%	0.396	S	S	*	.	H	α-helix	trans	-75.6	-35.2	-178.5	-168.6	146.1	0	0	0	112.3	R124 S125 L126 E131 T132	R124-L128 WeakPolarHBondContact O-CB 3.46Å; R124-L128 PolarHBondContact O-N 3.39Å; S125-L128 PolarHBondContact O-N 2.97Å; L126-L128 PolarHBondContact O-N 3.32Å; L128-E131 PolarHBondContact O-N 3.48Å; L128-T132 WeakPolarHBondContact O-CG2 3.38Å; L128-T132 PolarHBondContact O-N 2.83Å
129	E	88.5	Confident	86.7	Confident	91 Å²	91	81 Å²	81	43%	0.425	40%	0.396	S	S	.	.	H	α-helix	trans	-66.4	-46.1	175.1	-166.1	162.3	-167.4	0	0	111.4	M98 S125 L126 E131 T132 K133	M98-E129 HydrophobicContact SD-CG 3.93Å; S125-E129 WeakPolarHBondContact O-CB 3.36Å; S125-E129 PolarHBondContact O-N 3.3Å; L126-E129 PolarHBondContact O-N 3.44Å; E129-E131 VanDerWaalsContact C-N 3.34Å; E129-E131 PolarHBondContact O-N 3.16Å; E129-T132 PolarHBondContact O-N 3.05Å; E129-T132 PolarHBondContact O-OG1 3.47Å; E129-K133 WeakPolarHBondContact O-CG 3.34Å; E129-K133 PolarHBondContact O-N 2.93Å
130	I	92.3	Very high	87.8	Confident	14 Å²	14	81.4 Å²	81.4	7%	0.072	40%	0.396	C	S	.	.	H	α-helix	trans	-55.8	-47.2	169.8	-66.8	163.8	0	0	0	110.3	M98 E99 L102 L126 T132 K133 M134	M98-I130 HydrophobicContact CB-CD1 4.09Å; M98-I130 HydrophobicContact CB-CG1 3.7Å; E99-I130 HydrophobicContact CG-CD1 4.36Å; L102-I130 HydrophobicContact CB-CD1 4.32Å; L102-I130 HydrophobicContact CD2-CD1 3.9Å; L126-I130 WeakPolarHBondContact O-CB 3.45Å; L126-I130 VanDerWaalsContact O-CG1 3.27Å; L126-I130 WeakPolarHBondContact O-CG1 3.42Å; L126-I130 PolarHBondContact O-N 3.39Å; I130-T132 PolarHBondContact O-N 3.49Å; I130-K133 PolarHBondContact O-N 2.89Å; I130-M134 HydrophobicContact CG2-CG 4.27Å; I130-M134 HydrophobicContact CG2-SD 4.27Å; I130-M134 WeakPolarHBondContact O-CG 3.46Å; I130-M134 PolarHBondContact O-N 3.35Å
131	E	89.3	Confident	88.6	Confident	101 Å²	101	82.1 Å²	82.1	47%	0.472	40%	0.398	S	S	.	.	H	α-helix	trans	-61.5	-27.7	178.1	-151.8	-148.8	156.7	0	0	112.8	E127 L128 E129 K135	E127-E131 WeakPolarHBondContact O-CB 3.46Å; E127-E131 PolarHBondContact O-N 3.13Å; L128-E131 PolarHBondContact O-N 3.48Å; E129-E131 VanDerWaalsContact C-N 3.34Å; E129-E131 PolarHBondContact O-N 3.16Å; E131-K135 WeakPolarHBondContact O-CD 3.42Å; E131-K135 VanDerWaalsContact O-CE 3.27Å; E131-K135 WeakPolarHBondContact O-CE 3.41Å; E131-K135 VanDerWaalsContact O-CG 3.25Å; E131-K135 WeakPolarHBondContact O-CG 3.34Å; E131-K135 WeakPolarHBondContact OE1-CE 3.45Å; E131-K135 IonicContact OE1-NZ 2.81Å; E131-K135 PolarHBondContact OE1-NZ 2.91Å; E131-K135 IonicContact OE2-NZ 2.66Å; E131-K135 PolarHBondContact OE2-NZ 3.36Å
132	T	89.2	Confident	89.2	Confident	72 Å²	72	77.2 Å²	77.2	44%	0.442	39%	0.392	S	S	.	.	H	α-helix	trans	-78.2	-36.1	172.2	59.3	0	0	0	0	113.4	L128 E129 I130 K135 L136	L128-T132 WeakPolarHBondContact O-CG2 3.38Å; L128-T132 PolarHBondContact O-N 2.83Å; E129-T132 PolarHBondContact O-N 3.05Å; E129-T132 PolarHBondContact O-OG1 3.47Å; I130-T132 PolarHBondContact O-N 3.49Å; T132-K135 PolarHBondContact O-N 3.02Å; T132-L136 PolarHBondContact O-N 2.94Å; T132-L136 VanDerWaalsContact O-N 3.12Å
133	K	90.7	Very high	89.5	Confident	51 Å²	51	79.1 Å²	79.1	22%	0.222	40%	0.396	C	S	.	.	H	α-helix	trans	-73	-37.5	179	-69.7	-94.4	-172.2	179	0	112	E94 L95 M98 E129 I130 K135 L136 I137	E94-K133 IonicContact OE2-NZ 3.41Å; E94-K133 PolarHBondContact OE2-NZ 3.31Å; L95-K133 HydrophobicContact CD1-CB 4.43Å; M98-K133 HydrophobicContact CE-CB 3.95Å; M98-K133 HydrophobicContact CE-CD 3.85Å; M98-K133 HydrophobicContact CE-CG 3.54Å; M98-K133 HydrophobicContact SD-CG 4.32Å; E129-K133 WeakPolarHBondContact O-CG 3.34Å; E129-K133 PolarHBondContact O-N 2.93Å; I130-K133 PolarHBondContact O-N 2.89Å; K133-K135 PolarHBondContact O-N 3.35Å; K133-L136 WeakPolarHBondContact O-CB 3.5Å; K133-L136 PolarHBondContact O-N 3.13Å; K133-I137 WeakPolarHBondContact O-CG1 3.26Å; K133-I137 PolarHBondContact O-N 3.01Å
134	M	91.8	Very high	89.7	Confident	101 Å²	101	81.4 Å²	81.4	50%	0.498	41%	0.405	S	S	.	.	H	α-helix	trans	-56	-47.7	169.1	-68.4	-177	86.7	0	0	111.7	L95 I130 L136 I137 D138	L95-M134 HydrophobicContact CD1-CG 3.68Å; I130-M134 HydrophobicContact CG2-CG 4.27Å; I130-M134 HydrophobicContact CG2-SD 4.27Å; I130-M134 WeakPolarHBondContact O-CG 3.46Å; I130-M134 PolarHBondContact O-N 3.35Å; M134-L136 VanDerWaalsContact C-N 3.27Å; M134-L136 PolarHBondContact O-N 3.3Å; M134-I137 PolarHBondContact O-N 3.21Å; M134-I137 VanDerWaalsContact O-N 3.13Å; M134-D138 PolarHBondContact O-N 3.17Å
135	K	90.3	Very high	90	Very high	96 Å²	96	76 Å²	76	42%	0.417	39%	0.394	S	S	.	.	H	α-helix	trans	-64	-31.1	178.3	-68.2	164	-167.6	153.3	0	113	E131 T132 K133 T139	E131-K135 WeakPolarHBondContact O-CD 3.42Å; E131-K135 VanDerWaalsContact O-CE 3.27Å; E131-K135 WeakPolarHBondContact O-CE 3.41Å; E131-K135 VanDerWaalsContact O-CG 3.25Å; E131-K135 WeakPolarHBondContact O-CG 3.34Å; E131-K135 WeakPolarHBondContact OE1-CE 3.45Å; E131-K135 IonicContact OE1-NZ 2.81Å; E131-K135 PolarHBondContact OE1-NZ 2.91Å; E131-K135 IonicContact OE2-NZ 2.66Å; E131-K135 PolarHBondContact OE2-NZ 3.36Å; T132-K135 PolarHBondContact O-N 3.02Å; K133-K135 PolarHBondContact O-N 3.35Å; K135-T139 WeakPolarHBondContact O-CB 3.32Å; K135-T139 PolarHBondContact O-N 3.21Å; K135-T139 VanDerWaalsContact O-N 3.11Å; K135-T139 PolarHBondContact O-OG1 2.96Å
136	L	90.6	Very high	90	Very high	85 Å²	85	75.2 Å²	75.2	45%	0.445	39%	0.392	S	S	.	.	H	α-helix	trans	-68.5	-44.8	173	-178.3	139	0	0	0	110.7	A91 T132 K133 M134 T139 L140	A91-L136 HydrophobicContact CB-CD2 3.92Å; T132-L136 PolarHBondContact O-N 2.94Å; T132-L136 VanDerWaalsContact O-N 3.12Å; K133-L136 WeakPolarHBondContact O-CB 3.5Å; K133-L136 PolarHBondContact O-N 3.13Å; M134-L136 VanDerWaalsContact C-N 3.27Å; M134-L136 PolarHBondContact O-N 3.3Å; L136-T139 WeakPolarHBondContact O-CB 3.27Å; L136-T139 PolarHBondContact O-N 3.01Å; L136-T139 VanDerWaalsContact O-N 3.17Å; L136-L140 HydrophobicContact CD2-CD1 3.72Å; L136-L140 HydrophobicContact CD2-CG 4.39Å; L136-L140 WeakPolarHBondContact O-CG 3.41Å; L136-L140 PolarHBondContact O-N 2.98Å
137	I	91.5	Very high	89.9	Confident	17 Å²	17	75.3 Å²	75.3	9%	0.087	39%	0.393	C	S	.	.	H	α-helix	trans	-61.4	-46.3	174.9	-67.8	165.8	0	0	0	111.2	A91 Q92 L95 K133 M134 T139 L140 I141	A91-I137 HydrophobicContact CB-CD1 4.15Å; A91-I137 HydrophobicContact CB-CG1 3.72Å; Q92-I137 HydrophobicContact CG-CD1 4.18Å; L95-I137 HydrophobicContact CB-CD1 4.34Å; L95-I137 HydrophobicContact CD1-CD1 3.89Å; K133-I137 WeakPolarHBondContact O-CG1 3.26Å; K133-I137 PolarHBondContact O-N 3.01Å; M134-I137 PolarHBondContact O-N 3.21Å; M134-I137 VanDerWaalsContact O-N 3.13Å; I137-T139 PolarHBondContact O-N 3.4Å; I137-L140 PolarHBondContact O-N 3.16Å; I137-L140 VanDerWaalsContact O-N 3.12Å; I137-I141 HydrophobicContact CG2-CD1 3.7Å; I137-I141 HydrophobicContact CG2-CG1 4.31Å; I137-I141 WeakPolarHBondContact O-CG1 3.47Å; I137-I141 PolarHBondContact O-N 3.46Å
138	D	89.4	Confident	90	Very high	106 Å²	106	74.8 Å²	74.8	57%	0.567	39%	0.392	S	S	*	.	H	α-helix	trans	-54.3	-41.5	173.2	-76.9	-27.4	0	0	0	112	M134 I141 S142	M134-D138 PolarHBondContact O-N 3.17Å; D138-I141 PolarHBondContact O-N 3.17Å; D138-S142 WeakPolarHBondContact O-CB 3.28Å; D138-S142 PolarHBondContact O-N 3.47Å
139	T	89.8	Confident	89.9	Confident	97 Å²	97	74.4 Å²	74.4	60%	0.595	40%	0.395	S	S	*	.	H	α-helix	trans	-68.2	-38.8	179.2	-57.8	0	0	0	0	111.8	K135 L136 I137 R143	K135-T139 WeakPolarHBondContact O-CB 3.32Å; K135-T139 PolarHBondContact O-N 3.21Å; K135-T139 VanDerWaalsContact O-N 3.11Å; K135-T139 PolarHBondContact O-OG1 2.96Å; L136-T139 WeakPolarHBondContact O-CB 3.27Å; L136-T139 PolarHBondContact O-N 3.01Å; L136-T139 VanDerWaalsContact O-N 3.17Å; I137-T139 PolarHBondContact O-N 3.4Å; T139-R143 WeakPolarHBondContact O-CB 3.4Å; T139-R143 PolarHBondContact O-N 3.35Å; T139-R143 VanDerWaalsContact O-N 3.1Å
140	L	91.6	Very high	89.8	Confident	20 Å²	20	74.2 Å²	74.2	11%	0.105	39%	0.392	C	S	.	.	H	α-helix	trans	-68.2	-44	174.4	-66	172.4	0	0	0	111.6	L84 D87 I88 A91 L136 I137 S142 R143 K144	L84-L140 HydrophobicContact CD1-CD2 3.66Å; D87-L140 HydrophobicContact CB-CD1 4.17Å; D87-L140 HydrophobicContact CB-CD2 4.36Å; I88-L140 HydrophobicContact CD1-CB 4.03Å; I88-L140 HydrophobicContact CG1-CB 3.53Å; I88-L140 HydrophobicContact CG1-CD1 3.97Å; I88-L140 HydrophobicContact CG1-CG 4.36Å; A91-L140 HydrophobicContact CB-CD1 4.46Å; L136-L140 HydrophobicContact CD2-CD1 3.72Å; L136-L140 HydrophobicContact CD2-CG 4.39Å; L136-L140 WeakPolarHBondContact O-CG 3.41Å; L136-L140 PolarHBondContact O-N 2.98Å; I137-L140 PolarHBondContact O-N 3.16Å; I137-L140 VanDerWaalsContact O-N 3.12Å; L140-S142 VanDerWaalsContact C-N 3.33Å; L140-S142 PolarHBondContact O-N 2.7Å; L140-R143 CarbonylContact O-C 3.54Å; L140-R143 WeakPolarHBondContact O-CA 3.36Å; L140-R143 WeakPolarHBondContact O-CB 3.38Å; L140-R143 PolarHBondContact O-N 3.17Å; L140-K144 PolarHBondContact O-N 2.97Å
141	I	91	Very high	89.6	Confident	86 Å²	86	74.8 Å²	74.8	44%	0.441	40%	0.395	S	S	.	.	H	α-helix	trans	-61.1	-42.3	175.7	-67.9	170.2	0	0	0	110.7	I88 I137 D138 R143 K144 S145	I88-I141 HydrophobicContact CD1-CG1 4.4Å; I137-I141 HydrophobicContact CG2-CD1 3.7Å; I137-I141 HydrophobicContact CG2-CG1 4.31Å; I137-I141 WeakPolarHBondContact O-CG1 3.47Å; I137-I141 PolarHBondContact O-N 3.46Å; D138-I141 PolarHBondContact O-N 3.17Å; I141-R143 PolarHBondContact O-N 2.98Å; I141-K144 WeakPolarHBondContact O-CB 3.4Å; I141-K144 PolarHBondContact O-N 3.32Å; I141-K144 VanDerWaalsContact O-N 3.17Å; I141-S145 PolarHBondContact O-N 3.21Å; I141-S145 PolarHBondContact O-OG 2.96Å
142	S	89.9	Confident	89.4	Confident	79 Å²	79	72.3 Å²	72.3	55%	0.552	39%	0.389	S	S	*	.	H	α-helix	trans	-65.3	-23.2	173.7	-173.4	0	0	0	0	113.3	D138 L140 S145	D138-S142 WeakPolarHBondContact O-CB 3.28Å; D138-S142 PolarHBondContact O-N 3.47Å; L140-S142 VanDerWaalsContact C-N 3.33Å; L140-S142 PolarHBondContact O-N 2.7Å; S142-S145 PolarHBondContact O-OG 3.29Å
143	R	89	Confident	89	Confident	157 Å²	157	71.4 Å²	71.4	59%	0.592	39%	0.386	S	S	*	.	H	α-helix	trans	-81.9	-34.2	173.2	-171.3	172	177.7	-174.5	-2.5	111.2	L84 T139 L140 I141 A146 L147	L84-R143 HydrophobicContact CD1-CB 4.37Å; L84-R143 HydrophobicContact CD1-CG 4.16Å; L84-R143 HydrophobicContact CD2-CB 4.02Å; L84-R143 HydrophobicContact CD2-CG 4.05Å; T139-R143 WeakPolarHBondContact O-CB 3.4Å; T139-R143 PolarHBondContact O-N 3.35Å; T139-R143 VanDerWaalsContact O-N 3.1Å; L140-R143 CarbonylContact O-C 3.54Å; L140-R143 WeakPolarHBondContact O-CA 3.36Å; L140-R143 WeakPolarHBondContact O-CB 3.38Å; L140-R143 PolarHBondContact O-N 3.17Å; I141-R143 PolarHBondContact O-N 2.98Å; R143-A146 PolarHBondContact O-N 3.09Å; R143-L147 WeakPolarHBondContact O-CG 3.32Å; R143-L147 PolarHBondContact O-N 2.99Å
144	K	91.4	Very high	88.5	Confident	64 Å²	64	69.3 Å²	69.3	28%	0.278	38%	0.377	S	S	.	.	H	α-helix	trans	-63.3	-49.1	174.8	-172	178.5	-174	158	0	111.1	L81 L84 D85 I88 L140 I141 A146 L147 L148	L81-K144 HydrophobicContact CD1-CG 4.14Å; L84-K144 VanDerWaalsContact CD2-CA 3.5Å; L84-K144 HydrophobicContact CD2-CB 3.75Å; L84-K144 VanDerWaalsContact CD2-N 3.31Å; D85-K144 VanDerWaalsContact OD1-CD 3.23Å; D85-K144 WeakPolarHBondContact OD1-CD 3.21Å; D85-K144 WeakPolarHBondContact OD1-CE 3.24Å; D85-K144 IonicContact OD1-NZ 2.85Å; D85-K144 PolarHBondContact OD1-NZ 3.45Å; D85-K144 WeakPolarHBondContact OD2-CE 3.21Å; D85-K144 IonicContact OD2-NZ 2.72Å; D85-K144 PolarHBondContact OD2-NZ 2.8Å; I88-K144 HydrophobicContact CD1-CB 4.46Å; I88-K144 HydrophobicContact CD1-CD 4.32Å; L140-K144 PolarHBondContact O-N 2.97Å; I141-K144 WeakPolarHBondContact O-CB 3.4Å; I141-K144 PolarHBondContact O-N 3.32Å; I141-K144 VanDerWaalsContact O-N 3.17Å; K144-A146 VanDerWaalsContact C-N 3.31Å; K144-A146 PolarHBondContact O-N 3.06Å; K144-L147 PolarHBondContact O-N 3.21Å; K144-L148 HydrophobicContact CG-CD1 4.14Å; K144-L148 HydrophobicContact CG-CG 4.47Å; K144-L148 WeakPolarHBondContact O-CG 3.38Å; K144-L148 PolarHBondContact O-N 2.88Å
145	S	89.1	Confident	87.8	Confident	60 Å²	60	67.8 Å²	67.8	42%	0.42	37%	0.368	S	S	.	.	H	α-helix	trans	-62.5	-36.7	178.4	61.7	0	0	0	0	112.6	I141 S142 T149	I141-S145 PolarHBondContact O-N 3.21Å; I141-S145 PolarHBondContact O-OG 2.96Å; S142-S145 PolarHBondContact O-OG 3.29Å; S145-T149 WeakPolarHBondContact O-CB 3.23Å; S145-T149 PolarHBondContact O-N 3.48Å; S145-T149 PolarHBondContact O-OG1 2.85Å
146	A	88.5	Confident	86.9	Confident	57 Å²	57	70.6 Å²	70.6	47%	0.471	38%	0.381	S	S	.	.	H	α-helix	trans	-65.1	-41.2	173.7	0	0	0	0	0	112.7	R143 K144 T149 K150	R143-A146 PolarHBondContact O-N 3.09Å; K144-A146 VanDerWaalsContact C-N 3.31Å; K144-A146 PolarHBondContact O-N 3.06Å; A146-T149 PolarHBondContact O-N 3.4Å; A146-K150 PolarHBondContact O-N 3.06Å
147	L	88.1	Confident	85.5	Confident	31 Å²	31	70.7 Å²	70.7	16%	0.162	38%	0.379	C	S	.	.	H	α-helix	trans	-69.6	-41.3	175.4	-73	177.9	0	0	0	112.6	R80 L81 L84 R143 K144 T149 K150 L151	R80-L147 HydrophobicContact CB-CD1 4.12Å; L81-L147 HydrophobicContact CD1-CB 3.65Å; L81-L147 HydrophobicContact CD1-CD1 4.35Å; L84-L147 HydrophobicContact CD2-CD1 4.23Å; R143-L147 WeakPolarHBondContact O-CG 3.32Å; R143-L147 PolarHBondContact O-N 2.99Å; K144-L147 PolarHBondContact O-N 3.21Å; L147-T149 VanDerWaalsContact C-N 3.31Å; L147-T149 PolarHBondContact O-N 3.12Å; L147-K150 PolarHBondContact O-N 3.02Å; L147-L151 WeakPolarHBondContact O-CB 3.42Å; L147-L151 PolarHBondContact O-N 3.39Å
148	L	89	Confident	83.9	Confident	77 Å²	77	72.5 Å²	72.5	40%	0.403	39%	0.389	S	S	.	.	H	α-helix	trans	-60.2	-40.3	172.7	-74	172.7	0	0	0	112	L81 K144 L151 S152	L81-L148 HydrophobicContact CD1-CD2 4.18Å; L81-L148 HydrophobicContact CD1-CG 4.08Å; L81-L148 HydrophobicContact CD2-CD2 3.74Å; L81-L148 HydrophobicContact CD2-CG 4.44Å; K144-L148 HydrophobicContact CG-CD1 4.14Å; K144-L148 HydrophobicContact CG-CG 4.47Å; K144-L148 WeakPolarHBondContact O-CG 3.38Å; K144-L148 PolarHBondContact O-N 2.88Å; L148-L151 WeakPolarHBondContact O-CB 3.43Å; L148-L151 PolarHBondContact O-N 2.89Å; L148-S152 PolarHBondContact O-N 3.47Å
149	T	86.1	Confident	81.9	Confident	101 Å²	101	76.3 Å²	76.3	62%	0.62	40%	0.401	S	S	*	.	H	α-helix	trans	-62.4	-43.8	174.5	-55.7	0	0	0	0	110.9	S145 A146 L147 S152 S153	S145-T149 WeakPolarHBondContact O-CB 3.23Å; S145-T149 PolarHBondContact O-N 3.48Å; S145-T149 PolarHBondContact O-OG1 2.85Å; A146-T149 PolarHBondContact O-N 3.4Å; L147-T149 VanDerWaalsContact C-N 3.31Å; L147-T149 PolarHBondContact O-N 3.12Å; T149-S152 PolarHBondContact O-N 3.11Å; T149-S153 PolarHBondContact O-N 3.2Å; T149-S153 VanDerWaalsContact O-N 3.14Å; T149-S153 PolarHBondContact O-OG 3.06Å
150	K	87	Confident	79.8	Confident	87 Å²	87	77.7 Å²	77.7	38%	0.378	40%	0.403	S	S	.	.	H	α-helix	trans	-64.7	-40.8	175.6	-178.3	170.8	175.5	175.8	0	112.3	T77 A146 L147 S153 L154	T77-K150 HydrophobicContact CG2-CD 4.05Å; T77-K150 HydrophobicContact CG2-CG 4.32Å; A146-K150 PolarHBondContact O-N 3.06Å; L147-K150 PolarHBondContact O-N 3.02Å; K150-S153 WeakPolarHBondContact CA-OG 3.32Å; K150-S153 PolarHBondContact O-N 3.49Å; K150-S153 PolarHBondContact O-OG 3.11Å; K150-L154 HydrophobicContact CG-CD1 4.18Å; K150-L154 WeakPolarHBondContact O-CG 3.4Å; K150-L154 PolarHBondContact O-N 3.04Å; K150-L154 VanDerWaalsContact O-N 3.07Å
151	L	87.7	Confident	77.2	Confident	25 Å²	25	80 Å²	80	13%	0.131	42%	0.421	C	S	.	.	H	α-helix	trans	-57.4	-50.7	175.2	-171.1	92.1	0	0	0	110.3	R78 L147 L148 S153 L154 E155	R78-L151 HydrophobicContact CG-CD1 3.54Å; L147-L151 WeakPolarHBondContact O-CB 3.42Å; L147-L151 PolarHBondContact O-N 3.39Å; L148-L151 WeakPolarHBondContact O-CB 3.43Å; L148-L151 PolarHBondContact O-N 2.89Å; L151-S153 VanDerWaalsContact C-N 3.31Å; L151-S153 PolarHBondContact O-N 3.44Å; L151-L154 PolarHBondContact O-N 2.89Å; L151-E155 WeakPolarHBondContact CD2-OE1 3.43Å; L151-E155 HydrophobicContact CG-CG 4.43Å; L151-E155 WeakPolarHBondContact O-CG 3.36Å; L151-E155 PolarHBondContact O-N 3.26Å
152	S	84.9	Confident	74.6	Confident	49 Å²	49	81.9 Å²	81.9	34%	0.343	43%	0.432	S	S	.	.	H	α-helix	trans	-60.1	-36.3	179.2	-170.1	0	0	0	0	113.1	L148 T149 K156	L148-S152 PolarHBondContact O-N 3.47Å; T149-S152 PolarHBondContact O-N 3.11Å; S152-K156 WeakPolarHBondContact O-CB 3.43Å; S152-K156 VanDerWaalsContact O-CG 3.26Å; S152-K156 WeakPolarHBondContact O-CG 3.31Å; S152-K156 PolarHBondContact O-N 2.8Å
153	S	81.7	Confident	72.1	Confident	53 Å²	53	84.8 Å²	84.8	37%	0.371	44%	0.441	S	S	.	.	H	α-helix	trans	-65.6	-44.1	171.8	45.2	0	0	0	0	112.9	T149 K150 L151 E155 K156 E157	T149-S153 PolarHBondContact O-N 3.2Å; T149-S153 VanDerWaalsContact O-N 3.14Å; T149-S153 PolarHBondContact O-OG 3.06Å; K150-S153 WeakPolarHBondContact CA-OG 3.32Å; K150-S153 PolarHBondContact O-N 3.49Å; K150-S153 PolarHBondContact O-OG 3.11Å; L151-S153 VanDerWaalsContact C-N 3.31Å; L151-S153 PolarHBondContact O-N 3.44Å; S153-E155 VanDerWaalsContact C-N 3.32Å; S153-E155 PolarHBondContact O-N 3.13Å; S153-K156 PolarHBondContact O-N 3.05Å; S153-E157 WeakPolarHBondContact O-CG 3.49Å; S153-E157 PolarHBondContact O-N 3Å
154	L	80.2	Confident	69.4	Low	7 Å²	7	84.3 Å²	84.3	4%	0.037	45%	0.451	C	S	.	.	H	α-helix	trans	-66.7	-33.5	178.8	-70.5	169.9	0	0	0	112.3	N70 Q73 T77 K150 L151 N158	N70-L154 HydrophobicContact CB-CD2 4.42Å; Q73-L154 HydrophobicContact CB-CD1 3.82Å; Q73-L154 HydrophobicContact CB-CD2 4.11Å; T77-L154 HydrophobicContact CG2-CD1 4.29Å; K150-L154 HydrophobicContact CG-CD1 4.18Å; K150-L154 WeakPolarHBondContact O-CG 3.4Å; K150-L154 PolarHBondContact O-N 3.04Å; K150-L154 VanDerWaalsContact O-N 3.07Å; L151-L154 PolarHBondContact O-N 2.89Å; L154-N158 PolarHBondContact O-N 3.19Å; L154-N158 PolarHBondContact O-ND2 3.2Å
155	E	76.4	Confident	66.5	Low	69 Å²	69	85.9 Å²	85.9	32%	0.322	48%	0.475	S	S	.	.	H	α-helix	trans	-73.9	-40.5	177	-71.6	170.9	162.8	0	0	111.6	R78 L151 S153 E157 N158 F159	R78-E155 IonicContact CZ-OE1 2.79Å; R78-E155 IonicContact NE-OE1 2.72Å; R78-E155 IonicContact NH2-OE1 3.73Å; R78-E155 PolarHBondContact NH2-OE1 3.34Å; L151-E155 WeakPolarHBondContact CD2-OE1 3.43Å; L151-E155 HydrophobicContact CG-CG 4.43Å; L151-E155 WeakPolarHBondContact O-CG 3.36Å; L151-E155 PolarHBondContact O-N 3.26Å; S153-E155 VanDerWaalsContact C-N 3.32Å; S153-E155 PolarHBondContact O-N 3.13Å; E155-E157 VanDerWaalsContact C-N 3.34Å; E155-E157 PolarHBondContact O-N 3.2Å; E155-N158 PolarHBondContact O-N 3.16Å; E155-N158 VanDerWaalsContact O-N 3.15Å; E155-F159 PolarHBondContact O-N 2.92Å
156	K	71.7	Confident	63.9	Low	155 Å²	155	88 Å²	88	67%	0.674	49%	0.49	S	S	*	.	H	α-helix	trans	-63.2	-37.2	172.8	-75.1	174.3	-179.9	-178.3	0	112.8	S152 S153 N158 F159	S152-K156 WeakPolarHBondContact O-CB 3.43Å; S152-K156 VanDerWaalsContact O-CG 3.26Å; S152-K156 WeakPolarHBondContact O-CG 3.31Å; S152-K156 PolarHBondContact O-N 2.8Å; S153-K156 PolarHBondContact O-N 3.05Å; K156-N158 PolarHBondContact O-N 3.12Å; K156-F159 PolarHBondContact O-N 3.12Å; K156-F159 VanDerWaalsContact O-N 3.16Å
157	E	61.9	Low	61.2	Low	88 Å²	88	93.7 Å²	93.7	41%	0.411	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-16	175.1	-75.4	175.6	-164.5	0	0	114	F66 N70 S153 E155	F66-E157 HydrophobicContact CE1-CB 4.36Å; F66-E157 WeakPolarHBondContact CZ-OE2 3.31Å; N70-E157 WeakPolarHBondContact ND2-CB 3.39Å; N70-E157 PolarHBondContact ND2-OE2 2.76Å; S153-E157 WeakPolarHBondContact O-CG 3.49Å; S153-E157 PolarHBondContact O-N 3Å; E155-E157 VanDerWaalsContact C-N 3.34Å; E155-E157 PolarHBondContact O-N 3.2Å
158	N	57.3	Low	58.3	Low	54 Å²	54	97.8 Å²	97.8	29%	0.289	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-23.3	171.2	-73.5	-61.8	0	0	0	112.7	L154 E155 K156 I160	L154-N158 PolarHBondContact O-N 3.19Å; L154-N158 PolarHBondContact O-ND2 3.2Å; E155-N158 PolarHBondContact O-N 3.16Å; E155-N158 VanDerWaalsContact O-N 3.15Å; K156-N158 PolarHBondContact O-N 3.12Å; N158-I160 VanDerWaalsContact C-N 3.31Å; N158-I160 PolarHBondContact O-N 3.03Å
159	F	48.4	Very low	55.5	Low	186 Å²	186	101 Å²	101	82%	0.816	55%	0.55	S	S	*	*			trans	-88.5	61.5	175.2	-93.2	-86.4	0	0	0	112.1	E155 K156	E155-F159 PolarHBondContact O-N 2.92Å; K156-F159 PolarHBondContact O-N 3.12Å; K156-F159 VanDerWaalsContact O-N 3.16Å
160	I	45	Very low	52.9	Low	126 Å²	126	105.2 Å²	105.2	65%	0.646	56%	0.563	S	S	*	*			trans	-95.6	103.7	157	-60.4	178.8	0	0	0	105.9	N158	N158-I160 VanDerWaalsContact C-N 3.31Å; N158-I160 PolarHBondContact O-N 3.03Å
161	S	36.6	Very low	50.2	Low	69 Å²	69	107.4 Å²	107.4	48%	0.483	58%	0.578	S	S	.	*			trans	-72.4	139.8	-177.4	50.1	0	0	0	0	112.1	D163	S161-D163 PolarHBondContact O-N 3.29Å
162	D	37.5	Very low	47.5	Very low	126 Å²	126	114.3 Å²	114.3	67%	0.674	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-77.7	-4.4	-172.9	-61.8	-67.3	0	0	0	113.7	N164 A165	D162-N164 VanDerWaalsContact C-N 3.25Å; D162-N164 PolarHBondContact O-N 3.2Å; D162-N164 VanDerWaalsContact O-N 3.09Å; D162-A165 PolarHBondContact O-N 3.49Å
163	D	35.6	Very low	44.8	Very low	140 Å²	140	118 Å²	118	75%	0.749	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-69.7	-4.5	-171.5	-57.3	-62	0	0	0	116.5	S161	S161-D163 PolarHBondContact O-N 3.29Å
164	N	33.5	Very low	42.2	Very low	147 Å²	147	119.1 Å²	119.1	79%	0.786	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-95.4	14.1	178.4	-75.5	-57.9	0	0	0	113.9	D162 S166	D162-N164 VanDerWaalsContact C-N 3.25Å; D162-N164 PolarHBondContact O-N 3.2Å; D162-N164 VanDerWaalsContact O-N 3.09Å; N164-S166 VanDerWaalsContact C-N 3.25Å; N164-S166 PolarHBondContact O-N 3.07Å; N164-S166 VanDerWaalsContact O-N 3.16Å
165	A	31.1	Very low	39.7	Very low	96 Å²	96	124.9 Å²	124.9	79%	0.793	67%	0.673	S	S	*	*			trans	-78.6	13.8	-172.7	0	0	0	0	0	116.1	D162	D162-A165 PolarHBondContact O-N 3.49Å
166	S	33	Very low	37.4	Very low	104 Å²	104	127.7 Å²	127.7	73%	0.727	69%	0.69	S	S	*	*	S	Bend	trans	-120.9	35.7	-164.9	57.3	0	0	0	0	115.7	N164	N164-S166 VanDerWaalsContact C-N 3.25Å; N164-S166 PolarHBondContact O-N 3.07Å; N164-S166 VanDerWaalsContact O-N 3.16Å
167	K	32.4	Very low	35.3	Very low	178 Å²	178	127.4 Å²	127.4	77%	0.774	69%	0.694	S	S	*	*			trans	-157.5	126.5	161	-108.2	151.9	-170.7	167.5	0	112	D169	K167-D169 PolarHBondContact O-N 3.11Å
168	P	28	Very low	33.7	Very low	117 Å²	117	129.3 Å²	129.3	76%	0.76	71%	0.712	S	S	*	*			trans	-86	100.3	171.6	32.8	-30.2	0	0	0	110.4	E170	P168-E170 PolarHBondContact O-N 2.63Å; P168-E170 VanDerWaalsContact O-N 3.15Å
169	D	29.9	Very low	32.3	Very low	144 Å²	144	134.7 Å²	134.7	77%	0.77	73%	0.733	S	S	*	*			trans	-80.8	87.7	168.9	-78.3	-14	0	0	0	109.6	K167 D171	K167-D169 PolarHBondContact O-N 3.11Å; D169-D171 VanDerWaalsContact C-N 3.27Å; D169-D171 PolarHBondContact O-N 3.17Å
170	E	30.6	Very low	31.2	Very low	190 Å²	190	131.9 Å²	131.9	89%	0.888	73%	0.733	S	S	*	*			trans	-66.4	72.9	173.6	-66.8	-171.5	141.6	0	0	112.6	P168	P168-E170 PolarHBondContact O-N 2.63Å; P168-E170 VanDerWaalsContact O-N 3.15Å
171	D	30.8	Very low	30.4	Very low	132 Å²	132	133.7 Å²	133.7	71%	0.706	74%	0.743	S	S	*	*			trans	-144	14.8	-178.6	-127.6	-15.3	0	0	0	114.4	D169	D169-D171 VanDerWaalsContact C-N 3.27Å; D169-D171 PolarHBondContact O-N 3.17Å
172	L	31.1	Very low	30.1	Very low	170 Å²	170	135.7 Å²	135.7	89%	0.89	76%	0.757	S	S	*	*	S	Bend	trans	-130.9	23.3	-172	-76.7	177.1	0	0	0	116.4
173	L	28.4	Very low	29.8	Very low	127 Å²	127	133.3 Å²	133.3	67%	0.665	76%	0.755	S	S	*	*			trans	-154	40.9	170.6	-115.1	172.1	0	0	0	115.8
174	S	27.3	Very low	29.6	Very low	77 Å²	77	133.6 Å²	133.6	54%	0.538	76%	0.757	S	S	.	*			trans	-110.6	93.9	174.7	57.7	0	0	0	0	113.6	N176	S174-N176 PolarHBondContact O-N 3.36Å
175	V	27.8	Very low	29.7	Very low	128 Å²	128	134.6 Å²	134.6	78%	0.776	76%	0.762	S	S	*	*			trans	-76.8	75.8	168	-176.1	0	0	0	0	108.8	I177	V175-I177 PolarHBondContact O-N 2.78Å
176	N	27.4	Very low	29.6	Very low	128 Å²	128	138.3 Å²	138.3	68%	0.684	76%	0.761	S	S	*	*			trans	-71.1	91.2	-176.2	-83.5	-36.5	0	0	0	112.1	S174 V178	S174-N176 PolarHBondContact O-N 3.36Å; N176-V178 HydrophobicContact CB-CG2 4.25Å; N176-V178 PolarHBondContact O-N 2.99Å
177	I	27.4	Very low	29.4	Very low	148 Å²	148	140.5 Å²	140.5	76%	0.759	76%	0.764	S	S	*	*			trans	-70.6	83	164.1	-56.4	175.3	0	0	0	107.9	V175 K179	V175-I177 PolarHBondContact O-N 2.78Å; I177-K179 PolarHBondContact O-N 3.04Å
178	V	29.3	Very low	29.5	Very low	129 Å²	129	137 Å²	137	78%	0.782	76%	0.762	S	S	*	*			trans	-72.2	98.3	177.3	-177.3	0	0	0	0	109.4	N176	N176-V178 HydrophobicContact CB-CG2 4.25Å; N176-V178 PolarHBondContact O-N 2.99Å
179	K	26.5	Very low	29.6	Very low	167 Å²	167	137.8 Å²	137.8	73%	0.726	77%	0.767	S	S	*	*			trans	-64.8	141.6	158.9	-71	-179.3	178	177.6	0	108.9	I177 L181	I177-K179 PolarHBondContact O-N 3.04Å; K179-L181 PolarHBondContact O-N 3.44Å
180	P	27.2	Very low	29.6	Very low	127 Å²	127	136.5 Å²	136.5	83%	0.825	76%	0.764	S	S	*	*			trans	-68.3	132.8	167.5	30.2	-33	0	0	0	109.4
181	L	28	Very low	29.7	Very low	163 Å²	163	135.4 Å²	135.4	85%	0.853	76%	0.757	S	S	*	*			trans	-126.4	157.7	167.2	-89.9	160	0	0	0	108.7	K179	K179-L181 PolarHBondContact O-N 3.44Å
182	S	28.9	Very low	29.9	Very low	111 Å²	111	137.5 Å²	137.5	78%	0.776	76%	0.762	S	S	*	*			trans	-72	172.2	-163	49.9	0	0	0	0	114.3
183	A	31.1	Very low	30	Very low	76 Å²	76	136.5 Å²	136.5	63%	0.628	76%	0.757	S	S	*	*			trans	-67.6	-172.2	164.7	0	0	0	0	0	111.6
184	D	31.1	Very low	30.3	Very low	147 Å²	147	133.2 Å²	133.2	79%	0.786	74%	0.744	S	S	*	*			trans	77.5	85.9	170.9	-47.8	-30.8	0	0	0	115.8
185	D	36	Very low	30.7	Very low	168 Å²	168	133.3 Å²	133.3	90%	0.898	74%	0.742	S	S	*	*				-157.5	158.5	116.8	-127.2	-30.6	0	0	0	112.8
186	F	29.4	Very low	31	Very low	173 Å²	173	134.7 Å²	134.7	76%	0.759	74%	0.737	S	S	*	*			trans	-120.2	168.5	-165.5	-104.2	-99	0	0	0	115.1
187	N	29.9	Very low	31.4	Very low	150 Å²	150	134.4 Å²	134.4	80%	0.802	74%	0.735	S	S	*	*			trans	71.9	95.4	158.2	-58.7	-33.6	0	0	0	120.7
188	S	33.1	Very low	31.9	Very low	105 Å²	105	136.1 Å²	136.1	73%	0.734	73%	0.733	S	S	*	*			trans	-162.9	117.6	142.2	-173.6	0	0	0	0	112.4	V190	S188-V190 PolarHBondContact O-N 3.42Å
189	P	31.2	Very low	32.6	Very low	134 Å²	134	136.9 Å²	136.9	87%	0.87	72%	0.722	S	S	*	*			trans	-92.9	48.1	-170.3	37.6	-37.2	0	0	0	114.6
190	V	30	Very low	33.6	Very low	116 Å²	116	132.7 Å²	132.7	70%	0.703	71%	0.711	S	S	*	*			trans	-131	82.6	-179.6	-170.6	0	0	0	0	112.1	S188	S188-V190 PolarHBondContact O-N 3.42Å
191	K	32.6	Very low	34.5	Very low	167 Å²	167	133 Å²	133	73%	0.726	70%	0.699	S	S	*	*			trans	178.6	78.6	160.9	-96.1	151.1	-176.9	174	0	111.8	S194 T195	K191-S194 WeakPolarHBondContact CG-OG 3.26Å; K191-T195 PolarHBondContact O-OG1 3.05Å
192	H	34.7	Very low	35.5	Very low	176 Å²	176	132.4 Å²	132.4	82%	0.815	69%	0.685	S	S	*	*	S	Bend	trans	-104.6	-19.5	172.4	-110.4	-65.7	0	0	0	114.9
193	L	32.3	Very low	36.6	Very low	149 Å²	149	128.3 Å²	128.3	78%	0.78	66%	0.657	S	S	*	*	S	Bend	trans	-89.8	-41.9	178.7	-79.8	155.4	0	0	0	112.9	T195 K196	L193-T195 PolarHBondContact O-N 3.27Å; L193-K196 PolarHBondContact O-N 3.16Å
194	S	35	Very low	37.8	Very low	59 Å²	59	129.9 Å²	129.9	41%	0.413	65%	0.651	S	S	.	*	H	α-helix	trans	-59.4	-36.7	179.1	63.2	0	0	0	0	112.2	K191 K196 L197 Y198	K191-S194 WeakPolarHBondContact CG-OG 3.26Å; S194-K196 VanDerWaalsContact C-N 3.28Å; S194-K196 PolarHBondContact O-N 3Å; S194-L197 PolarHBondContact O-N 3.04Å; S194-Y198 WeakPolarHBondContact O-CB 3.31Å; S194-Y198 PolarHBondContact O-N 3.32Å
195	T	35.2	Very low	39	Very low	79 Å²	79	128.3 Å²	128.3	49%	0.485	64%	0.642	S	S	.	*	H	α-helix	trans	-65.4	-30	-175	-31.5	0	0	0	0	112.2	K191 L193 R199	K191-T195 PolarHBondContact O-OG1 3.05Å; L193-T195 PolarHBondContact O-N 3.27Å; T195-R199 WeakPolarHBondContact O-CB 3.41Å; T195-R199 PolarHBondContact O-N 2.59Å
196	K	35	Very low	40.1	Very low	157 Å²	157	121 Å²	121	68%	0.683	60%	0.603	S	S	*	*	H	α-helix	trans	-69.9	-47.8	171.9	-74.9	-172.3	174.4	-177.5	0	111.5	L193 S194 Y198 R199 V200	L193-K196 PolarHBondContact O-N 3.16Å; S194-K196 VanDerWaalsContact C-N 3.28Å; S194-K196 PolarHBondContact O-N 3Å; K196-Y198 VanDerWaalsContact C-N 3.32Å; K196-Y198 PolarHBondContact O-N 2.95Å; K196-R199 PolarHBondContact O-N 3.18Å; K196-V200 WeakPolarHBondContact O-CG2 3.43Å; K196-V200 PolarHBondContact O-N 3.09Å
197	L	36.6	Very low	41.4	Very low	121 Å²	121	114.3 Å²	114.3	63%	0.634	58%	0.579	S	S	*	*	H	α-helix	trans	-61	-40.4	174.9	-91.5	78.4	0	0	0	112.1	S194 V200 K201	S194-L197 PolarHBondContact O-N 3.04Å; L197-V200 PolarHBondContact O-N 3.42Å; L197-K201 PolarHBondContact O-N 2.89Å
198	Y	36.4	Very low	42.9	Very low	184 Å²	184	110.3 Å²	110.3	72%	0.722	56%	0.56	S	S	*	*	H	α-helix	trans	-65.5	-38	179.2	-138.3	-87.9	0	0	0	112	S194 K196 R202	S194-Y198 WeakPolarHBondContact O-CB 3.31Å; S194-Y198 PolarHBondContact O-N 3.32Å; K196-Y198 VanDerWaalsContact C-N 3.32Å; K196-Y198 PolarHBondContact O-N 2.95Å; Y198-R202 WeakPolarHBondContact O-CB 3.35Å; Y198-R202 PolarHBondContact O-N 3.25Å; Y198-R202 VanDerWaalsContact O-N 3.11Å
199	R	43.7	Very low	44.2	Very low	145 Å²	145	107.9 Å²	107.9	55%	0.547	54%	0.537	S	S	.	.	H	α-helix	trans	-67.8	-41.3	174.6	-168.1	167.5	176.3	170.8	-5.9	111.7	T195 K196 R202 C203 E247	T195-R199 WeakPolarHBondContact O-CB 3.41Å; T195-R199 PolarHBondContact O-N 2.59Å; K196-R199 PolarHBondContact O-N 3.18Å; R199-R202 PolarHBondContact O-N 3.49Å; R199-C203 PolarHBondContact O-N 2.98Å; R199-C203 VanDerWaalsContact O-N 3.1Å; R199-C203 PolarHBondContact O-SG 2.7Å; R199-E247 PolarHBondContact NH2-O 3.43Å
200	V	48.4	Very low	45.6	Very low	80 Å²	80	103 Å²	103	49%	0.485	50%	0.504	S	S	.	.	H	α-helix	trans	-61.1	-53.9	175	172.5	0	0	0	0	111.4	K196 L197 R202 C203 E204	K196-V200 WeakPolarHBondContact O-CG2 3.43Å; K196-V200 PolarHBondContact O-N 3.09Å; L197-V200 PolarHBondContact O-N 3.42Å; V200-R202 PolarHBondContact O-N 3.39Å; V200-C203 WeakPolarHBondContact O-CB 3.3Å; V200-C203 PolarHBondContact O-N 2.9Å; V200-E204 HydrophobicContact CG1-CG 4.35Å; V200-E204 WeakPolarHBondContact O-CG 3.47Å; V200-E204 PolarHBondContact O-N 3.19Å
201	K	45.1	Very low	47	Very low	134 Å²	134	104.1 Å²	104.1	58%	0.583	50%	0.499	S	S	*	.	H	α-helix	trans	-57.6	-34.6	178.1	-75.1	-169.7	172	-167.8	0	113.1	L197 E204 N205	L197-K201 PolarHBondContact O-N 2.89Å; K201-E204 PolarHBondContact O-N 2.92Å; K201-N205 WeakPolarHBondContact O-CB 3.13Å; K201-N205 PolarHBondContact O-N 2.86Å
202	R	50	Low	48.2	Very low	149 Å²	149	102.7 Å²	102.7	56%	0.562	49%	0.493	S	S	*	.	H	α-helix	trans	-67	-41.4	175.9	-168.1	173.7	-172.8	157.3	0.7	112.2	Y198 R199 V200 K206	Y198-R202 WeakPolarHBondContact O-CB 3.35Å; Y198-R202 PolarHBondContact O-N 3.25Å; Y198-R202 VanDerWaalsContact O-N 3.11Å; R199-R202 PolarHBondContact O-N 3.49Å; V200-R202 PolarHBondContact O-N 3.39Å; R202-K206 WeakPolarHBondContact O-CG 3.32Å; R202-K206 PolarHBondContact O-N 2.94Å; R202-K206 VanDerWaalsContact O-N 3.14Å
203	C	51.9	Low	49.3	Very low	26 Å²	26	95.9 Å²	95.9	18%	0.176	46%	0.462	C	S	.	.	H	α-helix	trans	-65.8	-42.3	173.4	-67.6	0	0	0	0	111.9	R199 V200 K206 A207	R199-C203 PolarHBondContact O-N 2.98Å; R199-C203 VanDerWaalsContact O-N 3.1Å; R199-C203 PolarHBondContact O-SG 2.7Å; V200-C203 WeakPolarHBondContact O-CB 3.3Å; V200-C203 PolarHBondContact O-N 2.9Å; C203-K206 PolarHBondContact O-N 2.78Å; C203-A207 WeakPolarHBondContact O-CB 3.35Å; C203-A207 PolarHBondContact O-N 2.81Å
204	E	55.7	Low	50.3	Low	109 Å²	109	93.1 Å²	93.1	51%	0.509	46%	0.455	S	S	.	.	H	α-helix	trans	-59.9	-48.6	176.1	-70	173.6	150.1	0	0	111.7	V200 K201 K206 A207 V208	V200-E204 HydrophobicContact CG1-CG 4.35Å; V200-E204 WeakPolarHBondContact O-CG 3.47Å; V200-E204 PolarHBondContact O-N 3.19Å; K201-E204 PolarHBondContact O-N 2.92Å; E204-K206 PolarHBondContact O-N 3.33Å; E204-A207 PolarHBondContact O-N 3.08Å; E204-V208 WeakPolarHBondContact O-CG2 3.38Å; E204-V208 PolarHBondContact O-N 3.04Å
205	N	57	Low	51	Low	113 Å²	113	98.7 Å²	98.7	60%	0.604	47%	0.472	S	S	*	.	H	α-helix	trans	-61.2	-42	178.2	-78.2	-6.1	0	0	0	112.2	K201 V208 E209	K201-N205 WeakPolarHBondContact O-CB 3.13Å; K201-N205 PolarHBondContact O-N 2.86Å; N205-V208 PolarHBondContact O-N 2.87Å; N205-E209 WeakPolarHBondContact O-CB 3.25Å; N205-E209 PolarHBondContact O-N 3.22Å
206	K	58.1	Low	51.9	Low	15 Å²	15	101.1 Å²	101.1	7%	0.065	47%	0.473	C	S	.	.	H	α-helix	trans	-63.3	-42.6	173.3	-73.3	-176.7	-175.5	-171.6	0	112.5	R202 C203 E204 V208 E209 L210 L240 E247	R202-K206 WeakPolarHBondContact O-CG 3.32Å; R202-K206 PolarHBondContact O-N 2.94Å; R202-K206 VanDerWaalsContact O-N 3.14Å; C203-K206 PolarHBondContact O-N 2.78Å; E204-K206 PolarHBondContact O-N 3.33Å; K206-V208 VanDerWaalsContact C-N 3.32Å; K206-V208 PolarHBondContact O-N 3.23Å; K206-E209 PolarHBondContact O-N 3.05Å; K206-L210 WeakPolarHBondContact O-CG 3.36Å; K206-L210 PolarHBondContact O-N 2.73Å; K206-L240 HydrophobicContact CG-CD2 4.34Å; K206-E247 WeakPolarHBondContact CE-OE2 3.34Å; K206-E247 IonicContact NZ-OE1 2.69Å; K206-E247 PolarHBondContact NZ-OE1 3.38Å; K206-E247 IonicContact NZ-OE2 3.56Å; K206-E247 PolarHBondContact NZ-OE2 3.42Å
207	A	58.3	Low	52.9	Low	32 Å²	32	102.3 Å²	102.3	26%	0.264	48%	0.478	S	S	.	.	H	α-helix	trans	-65.3	-36.4	177.1	0	0	0	0	0	111.9	C203 E204 K211	C203-A207 WeakPolarHBondContact O-CB 3.35Å; C203-A207 PolarHBondContact O-N 2.81Å; E204-A207 PolarHBondContact O-N 3.08Å; A207-K211 WeakPolarHBondContact O-CB 3.33Å; A207-K211 VanDerWaalsContact O-CG 3.28Å; A207-K211 WeakPolarHBondContact O-CG 3.4Å; A207-K211 PolarHBondContact O-N 3.33Å
208	V	60.9	Low	54	Low	66 Å²	66	102.2 Å²	102.2	40%	0.4	47%	0.474	S	S	.	.	H	α-helix	trans	-66.8	-38.6	171.1	169.1	0	0	0	0	111.3	E204 N205 K206 K211 K212	E204-V208 WeakPolarHBondContact O-CG2 3.38Å; E204-V208 PolarHBondContact O-N 3.04Å; N205-V208 PolarHBondContact O-N 2.87Å; K206-V208 VanDerWaalsContact C-N 3.32Å; K206-V208 PolarHBondContact O-N 3.23Å; V208-K211 CarbonylContact O-C 3.53Å; V208-K211 PolarHBondContact O-N 3.38Å; V208-K212 HydrophobicContact CG1-CD 4.14Å; V208-K212 WeakPolarHBondContact O-CB 3.41Å; V208-K212 VanDerWaalsContact O-CG 3.3Å; V208-K212 WeakPolarHBondContact O-CG 3.32Å; V208-K212 PolarHBondContact O-N 3.45Å
209	E	60.9	Low	55.3	Low	54 Å²	54	98.9 Å²	98.9	25%	0.252	47%	0.469	S	S	.	.	H	α-helix	trans	-65.5	-45.1	175.5	-164.7	-178.3	156.3	0	0	112	N205 K206 K211 K212 L213 R236 L240	N205-E209 WeakPolarHBondContact O-CB 3.25Å; N205-E209 PolarHBondContact O-N 3.22Å; K206-E209 PolarHBondContact O-N 3.05Å; E209-K211 VanDerWaalsContact C-N 3.35Å; E209-K211 PolarHBondContact O-N 3.03Å; E209-K212 CarbonylContact O-C 3.52Å; E209-K212 WeakPolarHBondContact O-CA 3.44Å; E209-K212 WeakPolarHBondContact O-CB 3.26Å; E209-K212 PolarHBondContact O-N 3.38Å; E209-L213 HydrophobicContact CG-CD1 4.09Å; E209-L213 WeakPolarHBondContact O-CG 3.44Å; E209-L213 PolarHBondContact O-N 3.14Å; E209-R236 IonicContact OE1-CZ 3.65Å; E209-R236 IonicContact OE1-NE 3.13Å; E209-R236 PolarHBondContact OE1-NE 2.82Å; E209-R236 IonicContact OE1-NH2 3.28Å; E209-R236 PolarHBondContact OE1-NH2 2.93Å; E209-L240 HydrophobicContact CG-CD1 4.28Å
210	L	60.6	Low	56.6	Low	33 Å²	33	92.6 Å²	92.6	17%	0.173	45%	0.446	C	S	.	.	H	α-helix	trans	-60.7	-40.7	172.1	-70.9	168.1	0	0	0	111.9	K206 K212 L213 S214 T237 L240 E241	K206-L210 WeakPolarHBondContact O-CG 3.36Å; K206-L210 PolarHBondContact O-N 2.73Å; L210-K212 VanDerWaalsContact C-N 3.27Å; L210-K212 PolarHBondContact O-N 2.95Å; L210-L213 PolarHBondContact O-N 3.46Å; L210-S214 WeakPolarHBondContact O-CB 3.43Å; L210-S214 PolarHBondContact O-N 3.02Å; L210-S214 PolarHBondContact O-OG 3.11Å; L210-T237 HydrophobicContact CD2-CG2 4.28Å; L210-L240 HydrophobicContact CD2-CB 3.84Å; L210-L240 HydrophobicContact CD2-CD1 4.19Å; L210-L240 HydrophobicContact CG-CB 4.35Å; L210-E241 HydrophobicContact CD2-CG 4.3Å
211	K	58.5	Low	58.1	Low	138 Å²	138	88.9 Å²	88.9	60%	0.6	42%	0.424	S	S	*	.	H	α-helix	trans	-67.5	-20	171.6	-76.4	176.6	177.9	-179.1	0	113.7	A207 V208 E209 S214 K215	A207-K211 WeakPolarHBondContact O-CB 3.33Å; A207-K211 VanDerWaalsContact O-CG 3.28Å; A207-K211 WeakPolarHBondContact O-CG 3.4Å; A207-K211 PolarHBondContact O-N 3.33Å; V208-K211 CarbonylContact O-C 3.53Å; V208-K211 PolarHBondContact O-N 3.38Å; E209-K211 VanDerWaalsContact C-N 3.35Å; E209-K211 PolarHBondContact O-N 3.03Å; K211-S214 WeakPolarHBondContact CA-OG 3.5Å; K211-K215 WeakPolarHBondContact O-CD 3.33Å; K211-K215 WeakPolarHBondContact O-CG 3.48Å
212	K	57.6	Low	59.5	Low	138 Å²	138	82.9 Å²	82.9	60%	0.6	40%	0.399	S	S	*	.	H	α-helix	trans	-84.7	-44.2	171.8	-76.2	168.9	178.7	176.3	0	111	V208 E209 L210 S214 K215 Y216	V208-K212 HydrophobicContact CG1-CD 4.14Å; V208-K212 WeakPolarHBondContact O-CB 3.41Å; V208-K212 VanDerWaalsContact O-CG 3.3Å; V208-K212 WeakPolarHBondContact O-CG 3.32Å; V208-K212 PolarHBondContact O-N 3.45Å; E209-K212 CarbonylContact O-C 3.52Å; E209-K212 WeakPolarHBondContact O-CA 3.44Å; E209-K212 WeakPolarHBondContact O-CB 3.26Å; E209-K212 PolarHBondContact O-N 3.38Å; L210-K212 VanDerWaalsContact C-N 3.27Å; L210-K212 PolarHBondContact O-N 2.95Å; K212-S214 PolarHBondContact O-N 3.44Å; K212-K215 PolarHBondContact O-N 3.1Å; K212-Y216 WeakPolarHBondContact O-CD2 3.49Å
213	L	57.7	Low	60.8	Low	32 Å²	32	79.6 Å²	79.6	17%	0.168	39%	0.393	C	S	.	.	H	α-helix	trans	-65.2	-35.8	178.8	-70.8	165.5	0	0	0	112.4	E209 L210 K215 Y216 R236 T237 L240	E209-L213 HydrophobicContact CG-CD1 4.09Å; E209-L213 WeakPolarHBondContact O-CG 3.44Å; E209-L213 PolarHBondContact O-N 3.14Å; L210-L213 PolarHBondContact O-N 3.46Å; L213-K215 VanDerWaalsContact C-N 3.31Å; L213-K215 PolarHBondContact O-N 3.41Å; L213-Y216 WeakPolarHBondContact O-CD2 3.4Å; L213-R236 HydrophobicContact CD1-CG 4.34Å; L213-T237 HydrophobicContact CB-CG2 3.78Å; L213-T237 HydrophobicContact CD1-CG2 3.74Å; L213-T237 HydrophobicContact CG-CG2 4.31Å; L213-L240 HydrophobicContact CD1-CD1 3.75Å
214	S	54	Low	62	Low	91 Å²	91	81.7 Å²	81.7	64%	0.636	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-12.5	175.4	52.7	0	0	0	0	115.1	L210 K211 K212	L210-S214 WeakPolarHBondContact O-CB 3.43Å; L210-S214 PolarHBondContact O-N 3.02Å; L210-S214 PolarHBondContact O-OG 3.11Å; K211-S214 WeakPolarHBondContact CA-OG 3.5Å; K212-S214 PolarHBondContact O-N 3.44Å
215	K	50.2	Low	63	Low	177 Å²	177	81.4 Å²	81.4	77%	0.77	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-3	179.6	-82	180	178.5	-174.3	0	114.7	K211 K212 L213	K211-K215 WeakPolarHBondContact O-CD 3.33Å; K211-K215 WeakPolarHBondContact O-CG 3.48Å; K212-K215 PolarHBondContact O-N 3.1Å; L213-K215 VanDerWaalsContact C-N 3.31Å; L213-K215 PolarHBondContact O-N 3.41Å
216	Y	54.2	Low	64	Low	130 Å²	130	77.7 Å²	77.7	51%	0.51	39%	0.385	S	S	.	.	S	Bend	trans	-69.6	141.2	179.5	-80.7	-94	0	0	0	112.2	K212 L213	K212-Y216 WeakPolarHBondContact O-CD2 3.49Å; L213-Y216 WeakPolarHBondContact O-CD2 3.4Å
217	K	54.9	Low	65	Low	181 Å²	181	78.5 Å²	78.5	79%	0.787	39%	0.389	S	S	*	.			trans	-68.2	132.6	175.5	-67.2	176.4	-178.8	171.9	0	110.1	N219	K217-N219 PolarHBondContact O-N 3Å
218	H	59.5	Low	66.1	Low	119 Å²	119	81 Å²	81	55%	0.551	40%	0.395	S	S	*	.			trans	-68.7	97.2	168.9	-66.8	-83.1	0	0	0	109.9	M362 H366	H218-M362 HydrophobicContact CB-SD 4.35Å; H218-H366 AromaticContact CE1-CE1 3.79Å; H218-H366 AromaticContact CG-CE1 3.4Å; H218-H366 VanDerWaalsContact CG-CE1 3.4Å; H218-H366 AromaticContact ND1-CE1 2.75Å; H218-H366 PolarHBondContact ND1-CE1 2.69Å; H218-H366 AromaticContact ND1-ND1 3.57Å
219	N	63.7	Low	67	Low	114 Å²	114	81.3 Å²	81.3	61%	0.61	39%	0.392	S	S	*	.			trans	-87.9	165.7	165.7	-63.2	-8.9	0	0	0	109.6	K217 H366	K217-N219 PolarHBondContact O-N 3Å; N219-H366 PolarHBondContact O-NE2 2.73Å
220	D	71.4	Confident	68	Low	13 Å²	13	80.5 Å²	80.5	7%	0.07	39%	0.387	C	S	.	.			trans	-88.1	147.1	-179.8	61.9	-41.5	0	0	0	113.9	A222 M362 G381 S382	D220-A222 PolarHBondContact O-N 2.81Å; D220-A222 WeakPolarHBondContact OD2-CB 3.36Å; D220-M362 HydrophobicContact CB-CE 3.45Å; D220-M362 VanDerWaalsContact CB-CE 3.45Å; D220-G381 VanDerWaalsContact OD2-CA 3.25Å; D220-G381 WeakPolarHBondContact OD2-CA 3.38Å; D220-S382 VanDerWaalsContact CG-N 3.33Å; D220-S382 VanDerWaalsContact CG-OG 3.28Å; D220-S382 VanDerWaalsContact OD1-CB 3.24Å; D220-S382 WeakPolarHBondContact OD1-CB 3.36Å; D220-S382 PolarHBondContact OD1-N 3.18Å; D220-S382 PolarHBondContact OD1-OG 3.38Å; D220-S382 PolarHBondContact OD2-N 3.09Å; D220-S382 PolarHBondContact OD2-OG 3Å
221	D	79.5	Confident	68.9	Low	2 Å²	2	80.7 Å²	80.7	1%	0.011	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	26.4	-178.2	-57	-44.9	0	0	0	113.5	D223 F227 R230 R373 V374	D221-D223 VanDerWaalsContact C-N 3.33Å; D221-D223 CarbonylContact C-O 3.55Å; D221-D223 PolarHBondContact O-N 3.07Å; D221-F227 HydrophobicContact CB-CB 4.02Å; D221-F227 HydrophobicContact CB-CD2 4Å; D221-F227 HydrophobicContact CB-CG 4.34Å; D221-R230 IonicContact OD1-CZ 2.75Å; D221-R230 IonicContact OD1-NE 2.78Å; D221-R230 PolarHBondContact OD1-NE 3.07Å; D221-R230 IonicContact OD1-NH2 3.24Å; D221-R230 IonicContact OD2-CZ 3.85Å; D221-R230 IonicContact OD2-NE 3.43Å; D221-R230 PolarHBondContact OD2-NE 3.33Å; D221-R230 IonicContact OD2-NH2 3.05Å; D221-R230 PolarHBondContact OD2-NH2 3.13Å; D221-R373 HydrophobicContact CB-CG 3.72Å; D221-R373 PolarHBondContact O-NE 3.4Å; D221-R373 PolarHBondContact O-NH2 2.83Å; D221-V374 VanDerWaalsContact CB-O 3.31Å; D221-V374 WeakPolarHBondContact CB-O 3.43Å; D221-V374 PolarHBondContact N-O 3.22Å; D221-V374 PolarHBondContact OD2-N 3.32Å
222	A	74.3	Confident	70	Confident	8 Å²	8	81.1 Å²	81.1	7%	0.066	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-39.3	-179.2	0	0	0	0	0	111.5	D220 R373 A375 L390	D220-A222 PolarHBondContact O-N 2.81Å; D220-A222 WeakPolarHBondContact OD2-CB 3.36Å; A222-R373 PolarHBondContact O-NH2 2.85Å; A222-A375 HydrophobicContact CB-CB 4.47Å; A222-L390 HydrophobicContact CB-CD1 3.71Å
223	D	77.5	Confident	71.1	Confident	81 Å²	81	78.3 Å²	78.3	43%	0.433	37%	0.371	S	S	.	.	S	Bend	trans	-84.4	137.3	165.2	179.4	22.9	0	0	0	110.9	D221 H225 A226 F227	D221-D223 VanDerWaalsContact C-N 3.33Å; D221-D223 CarbonylContact C-O 3.55Å; D221-D223 PolarHBondContact O-N 3.07Å; D223-H225 PolarHBondContact OD1-N 3.39Å; D223-H225 VanDerWaalsContact OD1-N 3.12Å; D223-H225 WeakPolarHBondContact OD2-CB 3.43Å; D223-A226 HydrophobicContact CB-CB 4.14Å; D223-F227 PolarHBondContact O-N 2.79Å
224	I	76.8	Confident	72	Confident	69 Å²	69	78 Å²	78	35%	0.354	37%	0.368	S	S	.	.	H	α-helix	trans	-72.7	-29	178.2	-163.8	167.9	0	0	0	111.9	F227 Q228	I224-F227 PolarHBondContact O-N 2.76Å; I224-Q228 WeakPolarHBondContact O-CG 3.5Å; I224-Q228 PolarHBondContact O-N 2.8Å
225	H	78.1	Confident	73.2	Confident	104 Å²	104	80.8 Å²	80.8	48%	0.481	37%	0.365	S	S	.	.	H	α-helix	trans	-69.3	-44.9	175	-174.3	-90.9	0	0	0	111	D223 F227 Q228 E229	D223-H225 PolarHBondContact OD1-N 3.39Å; D223-H225 VanDerWaalsContact OD1-N 3.12Å; D223-H225 WeakPolarHBondContact OD2-CB 3.43Å; H225-F227 VanDerWaalsContact C-N 3.31Å; H225-F227 PolarHBondContact O-N 3.2Å; H225-Q228 PolarHBondContact O-N 3.01Å; H225-E229 WeakPolarHBondContact O-CB 3.36Å; H225-E229 PolarHBondContact O-N 3.01Å
226	A	76.8	Confident	74.6	Confident	34 Å²	34	79.1 Å²	79.1	28%	0.281	35%	0.354	S	S	.	.	H	α-helix	trans	-57.4	-41.5	173.3	0	0	0	0	0	112.7	D223 E229 R230	D223-A226 HydrophobicContact CB-CB 4.14Å; A226-E229 PolarHBondContact O-N 2.91Å; A226-R230 WeakPolarHBondContact O-CB 3.35Å; A226-R230 PolarHBondContact O-N 3.18Å
227	F	79.5	Confident	75.6	Confident	33 Å²	33	74.4 Å²	74.4	15%	0.145	34%	0.339	C	S	.	.	H	α-helix	trans	-62.2	-48.1	174	176.1	-117.2	0	0	0	112.8	D221 D223 I224 H225 E229 R230 L231 P371 R373	D221-F227 HydrophobicContact CB-CB 4.02Å; D221-F227 HydrophobicContact CB-CD2 4Å; D221-F227 HydrophobicContact CB-CG 4.34Å; D223-F227 PolarHBondContact O-N 2.79Å; I224-F227 PolarHBondContact O-N 2.76Å; H225-F227 VanDerWaalsContact C-N 3.31Å; H225-F227 PolarHBondContact O-N 3.2Å; F227-E229 VanDerWaalsContact C-N 3.29Å; F227-E229 PolarHBondContact O-N 3.17Å; F227-R230 PolarHBondContact O-N 3.08Å; F227-L231 PolarHBondContact O-N 3.31Å; F227-P371 WeakPolarHBondContact CZ-O 3.46Å; F227-R373 HydrophobicContact CD1-CG 4.22Å; F227-R373 HydrophobicContact CD2-CB 4.09Å; F227-R373 HydrophobicContact CD2-CG 3.86Å; F227-R373 HydrophobicContact CE1-CB 4.23Å; F227-R373 HydrophobicContact CE1-CG 4.4Å; F227-R373 HydrophobicContact CE2-CB 3.74Å; F227-R373 HydrophobicContact CE2-CG 4.05Å; F227-R373 HydrophobicContact CG-CB 4.48Å; F227-R373 HydrophobicContact CG-CG 3.95Å; F227-R373 HydrophobicContact CZ-CB 3.81Å; F227-R373 HydrophobicContact CZ-CG 4.31Å
228	Q	81.2	Confident	76.7	Confident	84 Å²	84	69.7 Å²	69.7	39%	0.393	32%	0.319	S	S	.	.	H	α-helix	trans	-61.2	-38.4	176	-73.7	179.5	9.5	0	0	111.9	I224 H225 L231 R232	I224-Q228 WeakPolarHBondContact O-CG 3.5Å; I224-Q228 PolarHBondContact O-N 2.8Å; H225-Q228 PolarHBondContact O-N 3.01Å; Q228-L231 PolarHBondContact O-N 3.37Å; Q228-R232 WeakPolarHBondContact O-CB 3.47Å; Q228-R232 VanDerWaalsContact O-CG 3.29Å; Q228-R232 WeakPolarHBondContact O-CG 3.32Å; Q228-R232 PolarHBondContact O-N 2.91Å
229	E	80	Confident	77.6	Confident	73 Å²	73	68.4 Å²	68.4	34%	0.341	32%	0.316	S	S	.	.	H	α-helix	trans	-67.6	-42.2	176.2	-155.5	-165.2	174.1	0	0	111.7	H225 A226 F227 L231 R232 R233	H225-E229 WeakPolarHBondContact O-CB 3.36Å; H225-E229 PolarHBondContact O-N 3.01Å; A226-E229 PolarHBondContact O-N 2.91Å; F227-E229 VanDerWaalsContact C-N 3.29Å; F227-E229 PolarHBondContact O-N 3.17Å; E229-L231 VanDerWaalsContact C-N 3.35Å; E229-L231 PolarHBondContact O-N 3.16Å; E229-R232 PolarHBondContact O-N 3.07Å; E229-R233 VanDerWaalsContact CD-CZ 3.46Å; E229-R233 VanDerWaalsContact O-CG 3.3Å; E229-R233 WeakPolarHBondContact O-CG 3.42Å; E229-R233 PolarHBondContact O-N 3.18Å; E229-R233 IonicContact OE1-CZ 3.66Å; E229-R233 IonicContact OE1-NE 3.63Å; E229-R233 PolarHBondContact OE1-NE 3.46Å; E229-R233 IonicContact OE1-NH2 2.8Å; E229-R233 PolarHBondContact OE1-NH2 3.42Å; E229-R233 IonicContact OE2-CZ 2.83Å; E229-R233 IonicContact OE2-NH2 3.12Å; E229-R233 PolarHBondContact OE2-NH2 3.13Å
230	R	81.6	Confident	78.1	Confident	37 Å²	37	63.8 Å²	63.8	14%	0.14	29%	0.291	C	S	.	.	H	α-helix	trans	-57.4	-47.1	172.5	-175.1	174.3	67.1	75	-15.4	111.2	D221 A226 F227 R232 R233 Q234 P370 I372	D221-R230 IonicContact OD1-CZ 2.75Å; D221-R230 IonicContact OD1-NE 2.78Å; D221-R230 PolarHBondContact OD1-NE 3.07Å; D221-R230 IonicContact OD1-NH2 3.24Å; D221-R230 IonicContact OD2-CZ 3.85Å; D221-R230 IonicContact OD2-NE 3.43Å; D221-R230 PolarHBondContact OD2-NE 3.33Å; D221-R230 IonicContact OD2-NH2 3.05Å; D221-R230 PolarHBondContact OD2-NH2 3.13Å; A226-R230 WeakPolarHBondContact O-CB 3.35Å; A226-R230 PolarHBondContact O-N 3.18Å; F227-R230 PolarHBondContact O-N 3.08Å; R230-R232 PolarHBondContact O-N 3.14Å; R230-R233 PolarHBondContact O-N 3.22Å; R230-Q234 WeakPolarHBondContact O-CB 3.47Å; R230-Q234 PolarHBondContact O-N 3.07Å; R230-P370 PolarHBondContact NH1-O 3.38Å; R230-P370 PolarHBondContact NH2-O 3.04Å; R230-I372 PolarHBondContact NH2-O 2.98Å
231	L	80.4	Confident	78.2	Confident	36 Å²	36	68.8 Å²	68.8	19%	0.188	31%	0.314	C	S	.	.	H	α-helix	trans	-65.1	-37	179	-168.5	67.3	0	0	0	112.4	F227 Q228 E229 R235	F227-L231 PolarHBondContact O-N 3.31Å; Q228-L231 PolarHBondContact O-N 3.37Å; E229-L231 VanDerWaalsContact C-N 3.35Å; E229-L231 PolarHBondContact O-N 3.16Å; L231-R235 WeakPolarHBondContact O-CG 3.31Å; L231-R235 PolarHBondContact O-N 3.44Å
232	R	81.8	Confident	77.9	Confident	148 Å²	148	73.3 Å²	73.3	56%	0.558	34%	0.335	S	S	*	.	H	α-helix	trans	-65.3	-44.8	172.4	-74	170.1	-177	150	3.3	112	Q228 E229 R230 R235 R236	Q228-R232 WeakPolarHBondContact O-CB 3.47Å; Q228-R232 VanDerWaalsContact O-CG 3.29Å; Q228-R232 WeakPolarHBondContact O-CG 3.32Å; Q228-R232 PolarHBondContact O-N 2.91Å; E229-R232 PolarHBondContact O-N 3.07Å; R230-R232 PolarHBondContact O-N 3.14Å; R232-R235 PolarHBondContact O-N 3.24Å; R232-R236 PolarHBondContact O-N 3.36Å
233	R	79.8	Confident	77.9	Confident	79 Å²	79	76.4 Å²	76.4	30%	0.298	35%	0.348	S	S	.	.	H	α-helix	trans	-62.7	-41.7	176.4	-70.4	171.8	-172.7	165.4	0.3	111.6	E229 R230 R236 T237	E229-R233 VanDerWaalsContact CD-CZ 3.46Å; E229-R233 VanDerWaalsContact O-CG 3.3Å; E229-R233 WeakPolarHBondContact O-CG 3.42Å; E229-R233 PolarHBondContact O-N 3.18Å; E229-R233 IonicContact OE1-CZ 3.66Å; E229-R233 IonicContact OE1-NE 3.63Å; E229-R233 PolarHBondContact OE1-NE 3.46Å; E229-R233 IonicContact OE1-NH2 2.8Å; E229-R233 PolarHBondContact OE1-NH2 3.42Å; E229-R233 IonicContact OE2-CZ 2.83Å; E229-R233 IonicContact OE2-NH2 3.12Å; E229-R233 PolarHBondContact OE2-NH2 3.13Å; R230-R233 PolarHBondContact O-N 3.22Å; R233-R236 WeakPolarHBondContact O-CB 3.49Å; R233-R236 PolarHBondContact O-N 3.34Å; R233-T237 PolarHBondContact O-N 3.27Å; R233-T237 PolarHBondContact O-OG1 2.88Å
234	Q	75.9	Confident	77.6	Confident	24 Å²	24	75.8 Å²	75.8	11%	0.112	34%	0.342	C	S	.	.	H	α-helix	trans	-62.5	-49.2	175.9	179.9	-156.7	-24.6	0	0	111.9	R230 R236 T237 E238 P370	R230-Q234 WeakPolarHBondContact O-CB 3.47Å; R230-Q234 PolarHBondContact O-N 3.07Å; Q234-R236 PolarHBondContact O-N 2.96Å; Q234-T237 WeakPolarHBondContact CA-OG1 3.28Å; Q234-T237 PolarHBondContact O-N 3.45Å; Q234-T237 PolarHBondContact O-OG1 2.84Å; Q234-E238 HydrophobicContact CG-CG 4.4Å; Q234-E238 PolarHBondContact NE2-OE1 3.1Å; Q234-E238 WeakPolarHBondContact O-CG 3.48Å; Q234-E238 PolarHBondContact O-N 3.21Å; Q234-P370 VanDerWaalsContact CD-CB 3.42Å; Q234-P370 HydrophobicContact CG-CB 4.33Å
235	R	79.6	Confident	77.2	Confident	151 Å²	151	73.6 Å²	73.6	57%	0.57	33%	0.334	S	S	*	.	H	α-helix	trans	-59.2	-33.5	175.5	-71.8	176	-175.2	-173.8	1.1	111.9	L231 R232 E238 L239	L231-R235 WeakPolarHBondContact O-CG 3.31Å; L231-R235 PolarHBondContact O-N 3.44Å; R232-R235 PolarHBondContact O-N 3.24Å; R235-E238 WeakPolarHBondContact CA-OE2 3.34Å; R235-L239 VanDerWaalsContact O-CB 3.31Å; R235-L239 WeakPolarHBondContact O-CB 3.37Å; R235-L239 WeakPolarHBondContact O-CD1 3.43Å; R235-L239 WeakPolarHBondContact O-CG 3.35Å; R235-L239 PolarHBondContact O-N 3.31Å
236	R	79.6	Confident	76.7	Confident	141 Å²	141	76 Å²	76	53%	0.532	34%	0.339	S	S	.	.	H	α-helix	trans	-67	-42	172.3	-174.5	179.3	-178.6	141.7	0.8	112.2	E209 L213 R232 R233 Q234 L240	E209-R236 IonicContact OE1-CZ 3.65Å; E209-R236 IonicContact OE1-NE 3.13Å; E209-R236 PolarHBondContact OE1-NE 2.82Å; E209-R236 IonicContact OE1-NH2 3.28Å; E209-R236 PolarHBondContact OE1-NH2 2.93Å; L213-R236 HydrophobicContact CD1-CG 4.34Å; R232-R236 PolarHBondContact O-N 3.36Å; R233-R236 WeakPolarHBondContact O-CB 3.49Å; R233-R236 PolarHBondContact O-N 3.34Å; Q234-R236 PolarHBondContact O-N 2.96Å; R236-L240 HydrophobicContact CG-CD1 4.15Å; R236-L240 WeakPolarHBondContact O-CB 3.41Å; R236-L240 WeakPolarHBondContact O-CD1 3.32Å; R236-L240 WeakPolarHBondContact O-CG 3.43Å; R236-L240 PolarHBondContact O-N 2.98Å
237	T	76.2	Confident	76.1	Confident	31 Å²	31	76.8 Å²	76.8	19%	0.19	34%	0.337	C	S	.	.	H	α-helix	trans	-67.1	-42.2	174.4	49.1	0	0	0	0	112	L210 L213 R233 Q234 L240 E241	L210-T237 HydrophobicContact CD2-CG2 4.28Å; L213-T237 HydrophobicContact CB-CG2 3.78Å; L213-T237 HydrophobicContact CD1-CG2 3.74Å; L213-T237 HydrophobicContact CG-CG2 4.31Å; R233-T237 PolarHBondContact O-N 3.27Å; R233-T237 PolarHBondContact O-OG1 2.88Å; Q234-T237 WeakPolarHBondContact CA-OG1 3.28Å; Q234-T237 PolarHBondContact O-N 3.45Å; Q234-T237 PolarHBondContact O-OG1 2.84Å; T237-L240 PolarHBondContact O-N 3.15Å; T237-E241 WeakPolarHBondContact O-CB 3.39Å; T237-E241 WeakPolarHBondContact O-CG 3.45Å; T237-E241 PolarHBondContact O-N 3.22Å
238	E	76.7	Confident	75.3	Confident	82 Å²	82	79.8 Å²	79.8	38%	0.383	35%	0.351	S	S	.	.	H	α-helix	trans	-60.3	-47.6	176.5	-70.1	164.9	159.9	0	0	111.2	Q234 R235 L240 E241 E242	Q234-E238 HydrophobicContact CG-CG 4.4Å; Q234-E238 PolarHBondContact NE2-OE1 3.1Å; Q234-E238 WeakPolarHBondContact O-CG 3.48Å; Q234-E238 PolarHBondContact O-N 3.21Å; R235-E238 WeakPolarHBondContact CA-OE2 3.34Å; E238-L240 VanDerWaalsContact C-N 3.32Å; E238-L240 PolarHBondContact O-N 3.18Å; E238-E241 PolarHBondContact O-N 2.85Å; E238-E242 WeakPolarHBondContact O-CG 3.35Å; E238-E242 PolarHBondContact O-N 3.34Å
239	L	78.9	Confident	74	Confident	93 Å²	93	83.3 Å²	83.3	49%	0.487	37%	0.368	S	S	.	.	H	α-helix	trans	-64.8	-32.2	175.4	-72.8	168.8	0	0	0	113.4	R235 Q243	R235-L239 VanDerWaalsContact O-CB 3.31Å; R235-L239 WeakPolarHBondContact O-CB 3.37Å; R235-L239 WeakPolarHBondContact O-CD1 3.43Å; R235-L239 WeakPolarHBondContact O-CG 3.35Å; R235-L239 PolarHBondContact O-N 3.31Å; L239-Q243 WeakPolarHBondContact O-CB 3.25Å; L239-Q243 WeakPolarHBondContact O-CG 3.37Å; L239-Q243 PolarHBondContact O-N 3.24Å; L239-Q243 VanDerWaalsContact O-N 3.12Å
240	L	75.4	Confident	72.7	Confident	16 Å²	16	84.4 Å²	84.4	8%	0.084	38%	0.379	C	S	.	.	H	α-helix	trans	-72.4	-40.6	174	-77.1	169	0	0	0	111.6	K206 E209 L210 L213 R236 T237 E238 Q243 F244	K206-L240 HydrophobicContact CG-CD2 4.34Å; E209-L240 HydrophobicContact CG-CD1 4.28Å; L210-L240 HydrophobicContact CD2-CB 3.84Å; L210-L240 HydrophobicContact CD2-CD1 4.19Å; L210-L240 HydrophobicContact CG-CB 4.35Å; L213-L240 HydrophobicContact CD1-CD1 3.75Å; R236-L240 HydrophobicContact CG-CD1 4.15Å; R236-L240 WeakPolarHBondContact O-CB 3.41Å; R236-L240 WeakPolarHBondContact O-CD1 3.32Å; R236-L240 WeakPolarHBondContact O-CG 3.43Å; R236-L240 PolarHBondContact O-N 2.98Å; T237-L240 PolarHBondContact O-N 3.15Å; E238-L240 VanDerWaalsContact C-N 3.32Å; E238-L240 PolarHBondContact O-N 3.18Å; L240-Q243 PolarHBondContact O-N 3.4Å; L240-F244 VanDerWaalsContact O-CB 3.31Å; L240-F244 WeakPolarHBondContact O-CB 3.29Å; L240-F244 PolarHBondContact O-N 3.05Å
241	E	72.9	Confident	71	Confident	118 Å²	118	91.1 Å²	91.1	55%	0.551	41%	0.411	S	S	*	.	H	α-helix	trans	-65.8	-42.9	175.7	-74.8	174	-163.8	0	0	111.4	L210 T237 E238 Q243 F244 A245	L210-E241 HydrophobicContact CD2-CG 4.3Å; T237-E241 WeakPolarHBondContact O-CB 3.39Å; T237-E241 WeakPolarHBondContact O-CG 3.45Å; T237-E241 PolarHBondContact O-N 3.22Å; E238-E241 PolarHBondContact O-N 2.85Å; E241-Q243 VanDerWaalsContact C-N 3.35Å; E241-Q243 PolarHBondContact O-N 3.45Å; E241-F244 PolarHBondContact O-N 3.45Å; E241-A245 WeakPolarHBondContact O-CB 3.3Å; E241-A245 PolarHBondContact O-N 2.97Å
242	E	73.3	Confident	69.5	Low	97 Å²	97	93.2 Å²	93.2	45%	0.453	43%	0.429	S	S	.	.	H	α-helix	trans	-61.2	-40.3	172.1	-77.8	-174.7	-164.6	0	0	112.9	E238 R246	E238-E242 WeakPolarHBondContact O-CG 3.35Å; E238-E242 PolarHBondContact O-N 3.34Å; E242-R246 WeakPolarHBondContact O-CB 3.48Å; E242-R246 VanDerWaalsContact O-CG 3.29Å; E242-R246 WeakPolarHBondContact O-CG 3.44Å; E242-R246 PolarHBondContact O-N 2.74Å; E242-R246 VanDerWaalsContact O-N 3.08Å; E242-R246 PolarHBondContact O-NE 2.93Å; E242-R246 VanDerWaalsContact O-NE 3.11Å; E242-R246 IonicContact OE2-CZ 3.42Å; E242-R246 IonicContact OE2-NH2 3.98Å; E242-R246 PolarHBondContact OE2-NH2 3.22Å
243	Q	73.5	Confident	68.2	Low	73 Å²	73	91.1 Å²	91.1	34%	0.341	44%	0.437	S	S	.	.	H	α-helix	trans	-66.7	-40.9	175.5	-78.7	175.9	38.8	0	0	111.1	L239 L240 E241 R246 E247	L239-Q243 WeakPolarHBondContact O-CB 3.25Å; L239-Q243 WeakPolarHBondContact O-CG 3.37Å; L239-Q243 PolarHBondContact O-N 3.24Å; L239-Q243 VanDerWaalsContact O-N 3.12Å; L240-Q243 PolarHBondContact O-N 3.4Å; E241-Q243 VanDerWaalsContact C-N 3.35Å; E241-Q243 PolarHBondContact O-N 3.45Å; Q243-R246 PolarHBondContact O-N 3.49Å; Q243-E247 WeakPolarHBondContact O-CB 3.46Å; Q243-E247 WeakPolarHBondContact O-CG 3.3Å; Q243-E247 PolarHBondContact O-N 2.79Å
244	F	70.6	Confident	67.3	Low	69 Å²	69	94.4 Å²	94.4	30%	0.303	46%	0.461	S	S	.	.	H	α-helix	trans	-66.2	-43.8	179.4	-163.9	-96.9	0	0	0	111.2	L240 E241 R246 E247 H248	L240-F244 VanDerWaalsContact O-CB 3.31Å; L240-F244 WeakPolarHBondContact O-CB 3.29Å; L240-F244 PolarHBondContact O-N 3.05Å; E241-F244 PolarHBondContact O-N 3.45Å; F244-R246 PolarHBondContact O-N 2.79Å; F244-E247 PolarHBondContact O-N 2.95Å; F244-H248 AromaticContact CD1-CD2 3.79Å; F244-H248 AromaticContact CE1-CD2 3.57Å; F244-H248 AromaticContact CE1-NE2 3.76Å; F244-H248 AromaticContact CE2-CD2 3.89Å; F244-H248 AromaticContact CE2-NE2 3.61Å; F244-H248 AromaticContact CZ-CD2 3.62Å; F244-H248 AromaticContact CZ-NE2 3.33Å; F244-H248 VanDerWaalsContact CZ-NE2 3.33Å; F244-H248 WeakPolarHBondContact CZ-NE2 3.48Å; F244-H248 WeakPolarHBondContact O-CB 3.37Å; F244-H248 PolarHBondContact O-CD2 3.16Å; F244-H248 PolarHBondContact O-N 2.73Å
245	A	69.6	Low	66.8	Low	22 Å²	22	96 Å²	96	18%	0.182	47%	0.473	C	S	.	.	H	α-helix	trans	-59.2	-44.3	173.3	0	0	0	0	0	112	E241 H248 E249 V250	E241-A245 WeakPolarHBondContact O-CB 3.3Å; E241-A245 PolarHBondContact O-N 2.97Å; A245-H248 PolarHBondContact O-N 3.32Å; A245-E249 PolarHBondContact O-N 3.48Å; A245-V250 PolarHBondContact O-N 3.08Å; A245-V250 VanDerWaalsContact O-N 3.15Å
246	R	67.9	Low	66.4	Low	155 Å²	155	93.8 Å²	93.8	59%	0.585	48%	0.481	S	S	*	.	H	α-helix	trans	-63.5	-39.6	174.5	-77.4	-179.6	-92.8	176.6	-14.9	113.2	E242 Q243 F244 H248	E242-R246 WeakPolarHBondContact O-CB 3.48Å; E242-R246 VanDerWaalsContact O-CG 3.29Å; E242-R246 WeakPolarHBondContact O-CG 3.44Å; E242-R246 PolarHBondContact O-N 2.74Å; E242-R246 VanDerWaalsContact O-N 3.08Å; E242-R246 PolarHBondContact O-NE 2.93Å; E242-R246 VanDerWaalsContact O-NE 3.11Å; E242-R246 IonicContact OE2-CZ 3.42Å; E242-R246 IonicContact OE2-NH2 3.98Å; E242-R246 PolarHBondContact OE2-NH2 3.22Å; Q243-R246 PolarHBondContact O-N 3.49Å; F244-R246 PolarHBondContact O-N 2.79Å; R246-H248 VanDerWaalsContact C-N 3.31Å; R246-H248 PolarHBondContact O-N 3.01Å
247	E	64.3	Low	66.5	Low	51 Å²	51	90 Å²	90	24%	0.238	47%	0.471	C	S	.	.	H	α-helix	trans	-73.3	-21	179.7	-78.3	169.7	162.2	0	0	113.8	R199 K206 Q243 F244	R199-E247 PolarHBondContact NH2-O 3.43Å; K206-E247 WeakPolarHBondContact CE-OE2 3.34Å; K206-E247 IonicContact NZ-OE1 2.69Å; K206-E247 PolarHBondContact NZ-OE1 3.38Å; K206-E247 IonicContact NZ-OE2 3.56Å; K206-E247 PolarHBondContact NZ-OE2 3.42Å; Q243-E247 WeakPolarHBondContact O-CB 3.46Å; Q243-E247 WeakPolarHBondContact O-CG 3.3Å; Q243-E247 PolarHBondContact O-N 2.79Å; F244-E247 PolarHBondContact O-N 2.95Å
248	H	61.9	Low	66.5	Low	96 Å²	96	88.6 Å²	88.6	44%	0.444	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	8.5	178.7	-80.8	-81.8	0	0	0	114.6	F244 A245 R246 V250	F244-H248 AromaticContact CD1-CD2 3.79Å; F244-H248 AromaticContact CE1-CD2 3.57Å; F244-H248 AromaticContact CE1-NE2 3.76Å; F244-H248 AromaticContact CE2-CD2 3.89Å; F244-H248 AromaticContact CE2-NE2 3.61Å; F244-H248 AromaticContact CZ-CD2 3.62Å; F244-H248 AromaticContact CZ-NE2 3.33Å; F244-H248 VanDerWaalsContact CZ-NE2 3.33Å; F244-H248 WeakPolarHBondContact CZ-NE2 3.48Å; F244-H248 WeakPolarHBondContact O-CB 3.37Å; F244-H248 PolarHBondContact O-CD2 3.16Å; F244-H248 PolarHBondContact O-N 2.73Å; A245-H248 PolarHBondContact O-N 3.32Å; R246-H248 VanDerWaalsContact C-N 3.31Å; R246-H248 PolarHBondContact O-N 3.01Å; H248-V250 HydrophobicContact CB-CG2 4.18Å; H248-V250 PolarHBondContact O-N 2.8Å
249	E	53.4	Low	66.7	Low	158 Å²	158	92.3 Å²	92.3	74%	0.738	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	18.5	179.2	-65.7	174.1	-167.6	0	0	114.8	A245 H251	A245-E249 PolarHBondContact O-N 3.48Å; E249-H251 PolarHBondContact O-N 3.31Å; E249-H251 VanDerWaalsContact O-N 3.13Å
250	V	53.3	Low	66.7	Low	95 Å²	95	89.3 Å²	89.3	58%	0.576	46%	0.462	S	S	*	.			trans	-74.2	107.1	174.5	-179.3	0	0	0	0	108.1	A245 H248 S252	A245-V250 PolarHBondContact O-N 3.08Å; A245-V250 VanDerWaalsContact O-N 3.15Å; H248-V250 HydrophobicContact CB-CG2 4.18Å; H248-V250 PolarHBondContact O-N 2.8Å; V250-S252 PolarHBondContact O-N 2.98Å
251	H	46.1	Very low	66.6	Low	178 Å²	178	93.5 Å²	93.5	82%	0.824	49%	0.485	S	S	*	.			trans	-58.3	98.3	175.8	-68.3	-30.9	0	0	0	111	E249 S253	E249-H251 PolarHBondContact O-N 3.31Å; E249-H251 VanDerWaalsContact O-N 3.13Å; H251-S253 PolarHBondContact O-N 3.41Å
252	S	49.6	Very low	66.4	Low	80 Å²	80	90.8 Å²	90.8	56%	0.559	49%	0.488	S	S	*	.			trans	-73.3	73.9	171.3	60.7	0	0	0	0	109.7	V250 N254	V250-S252 PolarHBondContact O-N 2.98Å; S252-N254 PolarHBondContact O-N 2.77Å
253	S	54.5	Low	66.4	Low	104 Å²	104	88.6 Å²	88.6	73%	0.727	49%	0.492	S	S	*	.			trans	-63.4	100.6	166.5	45.2	0	0	0	0	108.1	H251 P255	H251-S253 PolarHBondContact O-N 3.41Å; S253-P255 VanDerWaalsContact O-CD 3.28Å; S253-P255 WeakPolarHBondContact O-CD 3.02Å
254	N	59.7	Low	67	Low	149 Å²	149	85.1 Å²	85.1	80%	0.797	48%	0.475	S	S	*	.			trans	-54.4	114.8	177.5	-80.2	-14.6	0	0	0	108.4	S252 S256	S252-N254 PolarHBondContact O-N 2.77Å; N254-S256 PolarHBondContact O-N 3.33Å
255	P	65.5	Low	67.7	Low	58 Å²	58	83.1 Å²	83.1	38%	0.377	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-62.1	137.9	-174.6	23.9	-33.8	0	0	0	109.5	S253 G268	S253-P255 VanDerWaalsContact O-CD 3.28Å; S253-P255 WeakPolarHBondContact O-CD 3.02Å; P255-G268 VanDerWaalsContact CG-C 3.41Å; P255-G268 WeakPolarHBondContact CG-O 3.46Å; P255-G268 WeakPolarHBondContact O-CA 3.32Å
256	S	72	Confident	68.6	Low	103 Å²	103	82.1 Å²	82.1	72%	0.72	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-65	137.4	-177.7	45.6	0	0	0	0	111.9	N254 G268	N254-S256 PolarHBondContact O-N 3.33Å; S256-G268 WeakPolarHBondContact O-CA 2.99Å
257	D	80.4	Confident	69.4	Low	61 Å²	61	75 Å²	75	33%	0.326	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-63.3	138.7	178.3	-66.9	-39	0	0	0	111.8	K259 V266 P267 G268 Y318	D257-K259 PolarHBondContact O-N 3.4Å; D257-V266 WeakPolarHBondContact CA-O 3.21Å; D257-P267 WeakPolarHBondContact OD1-CA 3.43Å; D257-G268 PolarHBondContact OD1-N 2.67Å; D257-Y318 PolarHBondContact OD2-OH 2.97Å
258	G	77.7	Confident	70.3	Confident	2 Å²	2	72.6 Å²	72.6	2%	0.021	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	86	174.9	0	0	0	0	0	111.2	V266 W271	G258-V266 PolarHBondContact N-O 3.31Å; G258-V266 PolarHBondContact O-N 3.21Å; G258-W271 VanDerWaalsContact CA-CD1 3.49Å
259	K	80.1	Confident	71.3	Confident	161 Å²	161	70.8 Å²	70.8	70%	0.7	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	128.1	175	-57.1	-169	177.7	-178.6	0	110.7	D257	D257-K259 PolarHBondContact O-N 3.4Å
260	L	79.2	Confident	72.9	Confident	29 Å²	29	63.3 Å²	63.3	15%	0.152	39%	0.388	C	S	.	.			trans	-120.1	162	173.2	-63.5	-175.8	0	0	0	111.2	G262 G263 F264 W271 K283	L260-G262 PolarHBondContact O-N 3.35Å; L260-G263 PolarHBondContact O-N 3.28Å; L260-F264 HydrophobicContact CB-CB 4.48Å; L260-F264 HydrophobicContact CB-CD1 4.2Å; L260-F264 HydrophobicContact CD1-CD1 3.91Å; L260-F264 HydrophobicContact CD1-CE1 4.21Å; L260-F264 HydrophobicContact CG-CD1 4.29Å; L260-F264 PolarHBondContact N-O 3.23Å; L260-W271 HydrophobicContact CD1-CH2 4.47Å; L260-W271 HydrophobicContact CD2-CH2 4.2Å; L260-K283 HydrophobicContact CD1-CB 3.89Å; L260-K283 HydrophobicContact CD1-CG 4.25Å; L260-K283 HydrophobicContact CD2-CD 4.27Å
261	D	73.4	Confident	74.6	Confident	105 Å²	105	61 Å²	61	56%	0.561	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	133.5	-175.9	-45	-70	0	0	0	111.6	K283 W286 Q290	D261-K283 IonicContact OD2-NZ 2.63Å; D261-K283 PolarHBondContact OD2-NZ 3.18Å; D261-W286 PolarHBondContact O-NE1 3.41Å; D261-Q290 PolarHBondContact O-NE2 3.33Å
262	G	68	Low	76.6	Confident	60 Å²	60	55.3 Å²	55.3	62%	0.619	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.8	21.7	-175	0	0	0	0	0	115	L260 F264	L260-G262 PolarHBondContact O-N 3.35Å; G262-F264 PolarHBondContact O-N 2.73Å
263	G	74.9	Confident	78.4	Confident	52 Å²	52	59.2 Å²	59.2	54%	0.536	35%	0.351	S	S	.	.	S	Bend	trans	86.6	-1.5	168.7	0	0	0	0	0	115.7	L260 C265	L260-G263 PolarHBondContact O-N 3.28Å; G263-C265 PolarHBondContact O-N 3.41Å
264	F	85.1	Confident	80.1	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.317	C	S	.	.			trans	-72.9	115.2	-179.2	-179.8	-94.4	0	0	0	111.2	L260 G262 V266 V282 W286 L312 L316 I321	L260-F264 HydrophobicContact CB-CB 4.48Å; L260-F264 HydrophobicContact CB-CD1 4.2Å; L260-F264 HydrophobicContact CD1-CD1 3.91Å; L260-F264 HydrophobicContact CD1-CE1 4.21Å; L260-F264 HydrophobicContact CG-CD1 4.29Å; L260-F264 PolarHBondContact N-O 3.23Å; G262-F264 PolarHBondContact O-N 2.73Å; F264-V266 HydrophobicContact CD1-CG2 4.1Å; F264-V266 HydrophobicContact CE1-CG2 3.32Å; F264-V266 HydrophobicContact CZ-CG2 3.91Å; F264-V282 HydrophobicContact CE1-CG1 4Å; F264-V282 HydrophobicContact CZ-CG1 4.38Å; F264-W286 HydrophobicContact CB-CD2 3.72Å; F264-W286 VanDerWaalsContact CB-CE2 3.43Å; F264-W286 HydrophobicContact CB-CE3 4.09Å; F264-W286 HydrophobicContact CB-CG 4.29Å; F264-W286 HydrophobicContact CB-CH2 4.01Å; F264-W286 HydrophobicContact CB-CZ2 3.61Å; F264-W286 HydrophobicContact CB-CZ3 4.22Å; F264-W286 HydrophobicContact CD1-CD2 4.36Å; F264-W286 HydrophobicContact CD1-CG 4.31Å; F264-W286 AromaticContact CD2-CD2 3.93Å; F264-W286 HydrophobicContact CD2-CD2 3.93Å; F264-W286 AromaticContact CD2-CE3 3.54Å; F264-W286 HydrophobicContact CD2-CE3 3.54Å; F264-W286 HydrophobicContact CD2-CH2 4.35Å; F264-W286 AromaticContact CD2-CZ3 3.77Å; F264-W286 HydrophobicContact CD2-CZ3 3.77Å; F264-W286 HydrophobicContact CE2-CE3 4.11Å; F264-W286 AromaticContact CG-CD2 3.76Å; F264-W286 HydrophobicContact CG-CD2 3.76Å; F264-W286 AromaticContact CG-CE3 3.89Å; F264-W286 HydrophobicContact CG-CE3 3.89Å; F264-W286 HydrophobicContact CG-CG 4.18Å; F264-W286 HydrophobicContact CG-CZ2 4.45Å; F264-W286 HydrophobicContact CG-CZ3 4.29Å; F264-L312 HydrophobicContact CE2-CD1 4.37Å; F264-L312 HydrophobicContact CZ-CD1 4.14Å; F264-L316 HydrophobicContact CD2-CD2 4.18Å; F264-L316 HydrophobicContact CE2-CD2 4.01Å; F264-L316 HydrophobicContact CE2-CG 4.05Å; F264-I321 HydrophobicContact CB-CD1 4.07Å
265	C	85.8	Confident	81.5	Confident	27 Å²	27	51.9 Å²	51.9	18%	0.182	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	122.2	-180	-64.5	0	0	0	0	109.7	G263 G315 Y318	G263-C265 PolarHBondContact O-N 3.41Å; C265-G315 WeakPolarHBondContact O-CA 3.36Å; C265-Y318 HydrophobicContact CB-CD1 4.12Å; C265-Y318 HydrophobicContact CB-CE1 4.27Å
266	V	87.5	Confident	82.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129.5	169.5	-174.8	0	0	0	0	109.1	D257 G258 F264 G268 I270 W271 V282	D257-V266 WeakPolarHBondContact CA-O 3.21Å; G258-V266 PolarHBondContact N-O 3.31Å; G258-V266 PolarHBondContact O-N 3.21Å; F264-V266 HydrophobicContact CD1-CG2 4.1Å; F264-V266 HydrophobicContact CE1-CG2 3.32Å; F264-V266 HydrophobicContact CZ-CG2 3.91Å; V266-G268 PolarHBondContact O-N 2.76Å; V266-I270 HydrophobicContact CG1-CB 4.25Å; V266-I270 HydrophobicContact CG1-CG2 4.36Å; V266-W271 HydrophobicContact CB-CB 4.42Å; V266-W271 HydrophobicContact CB-CE3 3.86Å; V266-W271 HydrophobicContact CG1-CB 4.26Å; V266-W271 HydrophobicContact CG1-CE3 4.11Å; V266-W271 HydrophobicContact CG2-CE3 3.94Å; V266-W271 HydrophobicContact CG2-CZ3 4.14Å; V266-V282 HydrophobicContact CG2-CG1 4.28Å
267	P	86.1	Confident	83.6	Confident	5 Å²	5	50 Å²	50	3%	0.032	28%	0.277	C	S	.	.			trans	-50	130.3	175.4	-29	34.2	0	0	0	112.9	D257 S269 I270 W271 Y318 W369	D257-P267 WeakPolarHBondContact OD1-CA 3.43Å; P267-S269 PolarHBondContact O-N 3.21Å; P267-S269 VanDerWaalsContact O-N 3.11Å; P267-I270 PolarHBondContact O-N 3.48Å; P267-W271 PolarHBondContact O-N 2.85Å; P267-Y318 HydrophobicContact CG-CD1 3.95Å; P267-Y318 HydrophobicContact CG-CD2 3.98Å; P267-Y318 HydrophobicContact CG-CG 3.65Å; P267-W369 HydrophobicContact CB-CE3 4.44Å; P267-W369 HydrophobicContact CB-CH2 4.07Å; P267-W369 HydrophobicContact CB-CZ3 3.73Å; P267-W369 HydrophobicContact CG-CE3 4.14Å; P267-W369 HydrophobicContact CG-CH2 3.51Å; P267-W369 HydrophobicContact CG-CZ2 4.09Å; P267-W369 HydrophobicContact CG-CZ3 3.54Å
268	G	82.2	Confident	84.1	Confident	2 Å²	2	47.4 Å²	47.4	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-56.5	-30.1	-177.2	0	0	0	0	0	113.9	P255 S256 D257 V266 I270 W271 S272	P255-G268 VanDerWaalsContact CG-C 3.41Å; P255-G268 WeakPolarHBondContact CG-O 3.46Å; P255-G268 WeakPolarHBondContact O-CA 3.32Å; S256-G268 WeakPolarHBondContact O-CA 2.99Å; D257-G268 PolarHBondContact OD1-N 2.67Å; V266-G268 PolarHBondContact O-N 2.76Å; G268-I270 PolarHBondContact O-N 3.03Å; G268-W271 PolarHBondContact O-N 2.94Å; G268-S272 VanDerWaalsContact O-CB 3.25Å; G268-S272 WeakPolarHBondContact O-CB 3.35Å; G268-S272 PolarHBondContact O-N 3.17Å; G268-S272 PolarHBondContact O-OG 3.28Å
269	S	82.2	Confident	84.8	Confident	58 Å²	58	50.4 Å²	50.4	41%	0.406	27%	0.273	S	S	.	.	H	α-helix	trans	-61.1	-29.4	174.9	56.6	0	0	0	0	113.6	P267 R273	P267-S269 PolarHBondContact O-N 3.21Å; P267-S269 VanDerWaalsContact O-N 3.11Å; S269-R273 VanDerWaalsContact O-CD 3.25Å; S269-R273 WeakPolarHBondContact O-CD 3.5Å; S269-R273 WeakPolarHBondContact O-CG 3.29Å; S269-R273 PolarHBondContact O-NE 2.74Å
270	I	88.3	Confident	85.4	Confident	1 Å²	1	50 Å²	50	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-90.1	-49.7	171.1	-57.2	174.5	0	0	0	109.4	V266 P267 G268 S272 R273 L274 A311 A314 W368 W369	V266-I270 HydrophobicContact CG1-CB 4.25Å; V266-I270 HydrophobicContact CG1-CG2 4.36Å; P267-I270 PolarHBondContact O-N 3.48Å; G268-I270 PolarHBondContact O-N 3.03Å; I270-S272 VanDerWaalsContact C-N 3.32Å; I270-S272 PolarHBondContact O-N 3.22Å; I270-R273 WeakPolarHBondContact O-CA 3.41Å; I270-R273 PolarHBondContact O-N 3.15Å; I270-L274 HydrophobicContact CG2-CD1 4.43Å; I270-L274 HydrophobicContact CG2-CD2 4.37Å; I270-L274 HydrophobicContact CG2-CG 4.22Å; I270-L274 PolarHBondContact O-N 2.83Å; I270-L274 VanDerWaalsContact O-N 3.11Å; I270-A311 HydrophobicContact CG2-CB 3.95Å; I270-A314 HydrophobicContact CD1-CB 3.57Å; I270-W368 WeakPolarHBondContact CD1-O 3.42Å; I270-W368 WeakPolarHBondContact CG1-O 3.4Å; I270-W369 HydrophobicContact CD1-CB 4.03Å; I270-W369 HydrophobicContact CD1-CD2 4.25Å; I270-W369 HydrophobicContact CD1-CE3 3.85Å; I270-W369 HydrophobicContact CD1-CG 4.36Å
271	W	88.9	Confident	86	Confident	46 Å²	46	48.7 Å²	48.7	17%	0.174	27%	0.265	C	S	.	.	H	α-helix	trans	-60.5	-37.5	-171	-171.4	-106.7	0	0	0	113.6	G258 L260 V266 P267 G268 R273 L274 R279 V282	G258-W271 VanDerWaalsContact CA-CD1 3.49Å; L260-W271 HydrophobicContact CD1-CH2 4.47Å; L260-W271 HydrophobicContact CD2-CH2 4.2Å; V266-W271 HydrophobicContact CB-CB 4.42Å; V266-W271 HydrophobicContact CB-CE3 3.86Å; V266-W271 HydrophobicContact CG1-CB 4.26Å; V266-W271 HydrophobicContact CG1-CE3 4.11Å; V266-W271 HydrophobicContact CG2-CE3 3.94Å; V266-W271 HydrophobicContact CG2-CZ3 4.14Å; P267-W271 PolarHBondContact O-N 2.85Å; G268-W271 PolarHBondContact O-N 2.94Å; W271-R273 VanDerWaalsContact C-N 3.32Å; W271-R273 PolarHBondContact O-N 3.08Å; W271-L274 HydrophobicContact CE3-CD1 3.88Å; W271-L274 HydrophobicContact CZ3-CD1 4.29Å; W271-L274 PolarHBondContact O-N 3.31Å; W271-R279 HydrophobicContact CD2-CG 4.24Å; W271-R279 HydrophobicContact CE3-CG 4.26Å; W271-R279 HydrophobicContact CH2-CB 3.69Å; W271-R279 HydrophobicContact CH2-CG 3.93Å; W271-R279 HydrophobicContact CZ2-CB 3.93Å; W271-R279 HydrophobicContact CZ2-CG 3.89Å; W271-R279 HydrophobicContact CZ3-CB 4.15Å; W271-R279 HydrophobicContact CZ3-CG 4.11Å; W271-R279 PolarHBondContact O-NE 3.42Å; W271-R279 PolarHBondContact O-NH2 2.96Å; W271-V282 HydrophobicContact CZ3-CB 4.45Å; W271-V282 HydrophobicContact CZ3-CG1 4.35Å
272	S	87	Confident	86.9	Confident	59 Å²	59	43.7 Å²	43.7	41%	0.413	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-36.4	173.2	55.4	0	0	0	0	113	G268 I270 R279	G268-S272 VanDerWaalsContact O-CB 3.25Å; G268-S272 WeakPolarHBondContact O-CB 3.35Å; G268-S272 PolarHBondContact O-N 3.17Å; G268-S272 PolarHBondContact O-OG 3.28Å; I270-S272 VanDerWaalsContact C-N 3.32Å; I270-S272 PolarHBondContact O-N 3.22Å; S272-R279 PolarHBondContact O-NH2 3.2Å; S272-R279 VanDerWaalsContact O-NH2 3.15Å
273	R	88.3	Confident	88.1	Confident	161 Å²	161	44.4 Å²	44.4	61%	0.608	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-14.4	-178.5	-61.2	179.7	-178.8	177.2	1.1	114	S269 I270 W271 W368	S269-R273 VanDerWaalsContact O-CD 3.25Å; S269-R273 WeakPolarHBondContact O-CD 3.5Å; S269-R273 WeakPolarHBondContact O-CG 3.29Å; S269-R273 PolarHBondContact O-NE 2.74Å; I270-R273 WeakPolarHBondContact O-CA 3.41Å; I270-R273 PolarHBondContact O-N 3.15Å; W271-R273 VanDerWaalsContact C-N 3.32Å; W271-R273 PolarHBondContact O-N 3.08Å; R273-W368 HydrophobicContact CB-CH2 4.31Å; R273-W368 HydrophobicContact CB-CZ3 3.81Å; R273-W368 HydrophobicContact CG-CZ3 4.42Å
274	L	90	Very high	89	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.016	21%	0.206	C	C	.	.	S	Bend	trans	-74.1	134.6	174.2	-67	-179.5	0	0	0	111.6	I270 W271 Q278 R279 V282 I307 A311	I270-L274 HydrophobicContact CG2-CD1 4.43Å; I270-L274 HydrophobicContact CG2-CD2 4.37Å; I270-L274 HydrophobicContact CG2-CG 4.22Å; I270-L274 PolarHBondContact O-N 2.83Å; I270-L274 VanDerWaalsContact O-N 3.11Å; W271-L274 HydrophobicContact CE3-CD1 3.88Å; W271-L274 HydrophobicContact CZ3-CD1 4.29Å; W271-L274 PolarHBondContact O-N 3.31Å; L274-Q278 HydrophobicContact CB-CB 4.3Å; L274-Q278 HydrophobicContact CD2-CB 4.2Å; L274-R279 HydrophobicContact CB-CG 3.84Å; L274-R279 HydrophobicContact CD1-CG 4.4Å; L274-R279 PolarHBondContact O-NE 2.66Å; L274-R279 PolarHBondContact O-NH2 3.1Å; L274-V282 HydrophobicContact CD1-CG2 4.18Å; L274-I307 HydrophobicContact CD2-CD1 3.69Å; L274-I307 HydrophobicContact CD2-CG1 3.77Å; L274-A311 HydrophobicContact CD1-CB 3.93Å; L274-A311 HydrophobicContact CD2-CB 4.38Å
275	F	89.2	Confident	89.4	Confident	96 Å²	96	44 Å²	44	42%	0.421	21%	0.207	S	C	.	.			trans	-66.7	155.2	167.1	-64.2	-80.6	0	0	0	111.5	Y277 Q278 R279 I757	F275-Y277 VanDerWaalsContact C-N 3.28Å; F275-Y277 HydrophobicContact CB-CD1 3.45Å; F275-Y277 VanDerWaalsContact CB-CD1 3.45Å; F275-Y277 HydrophobicContact CB-CE1 3.2Å; F275-Y277 HydrophobicContact CB-CG 4.49Å; F275-Y277 HydrophobicContact CD1-CE1 4.33Å; F275-Y277 AromaticContact CD2-CE1 3.82Å; F275-Y277 HydrophobicContact CD2-CE1 3.82Å; F275-Y277 HydrophobicContact CG-CD1 4.27Å; F275-Y277 AromaticContact CG-CE1 3.56Å; F275-Y277 HydrophobicContact CG-CE1 3.56Å; F275-Y277 PolarHBondContact O-N 3.4Å; F275-Q278 HydrophobicContact CB-CG 4.29Å; F275-Q278 CarbonylContact O-C 3.6Å; F275-Q278 WeakPolarHBondContact O-CA 3.32Å; F275-Q278 WeakPolarHBondContact O-CB 3.33Å; F275-Q278 PolarHBondContact O-N 3.3Å; F275-R279 PolarHBondContact O-N 2.94Å; F275-I757 HydrophobicContact CE2-CD1 4.39Å
276	D	89.6	Confident	89.7	Confident	100 Å²	100	43.1 Å²	43.1	54%	0.535	20%	0.2	S	C	.	.	H	α-helix	trans	-62.3	-31	-175.4	-63.1	-53.5	0	0	0	114.7	R279 K280	D276-R279 PolarHBondContact O-N 3.01Å; D276-R279 IonicContact OD1-CZ 3.24Å; D276-R279 IonicContact OD1-NH1 3.71Å; D276-R279 PolarHBondContact OD1-NH1 3.06Å; D276-K280 VanDerWaalsContact O-CG 3.31Å; D276-K280 WeakPolarHBondContact O-CG 3.41Å; D276-K280 PolarHBondContact O-N 3.08Å
277	Y	91.3	Very high	89.9	Confident	23 Å²	23	45.3 Å²	45.3	9%	0.09	21%	0.211	C	C	.	.	H	α-helix	trans	-67.2	-37.9	170.7	72.7	-84.8	0	0	0	111.3	F275 K280 G281 L303 R526 V531 I533	F275-Y277 VanDerWaalsContact C-N 3.28Å; F275-Y277 HydrophobicContact CB-CD1 3.45Å; F275-Y277 VanDerWaalsContact CB-CD1 3.45Å; F275-Y277 HydrophobicContact CB-CE1 3.2Å; F275-Y277 HydrophobicContact CB-CG 4.49Å; F275-Y277 HydrophobicContact CD1-CE1 4.33Å; F275-Y277 AromaticContact CD2-CE1 3.82Å; F275-Y277 HydrophobicContact CD2-CE1 3.82Å; F275-Y277 HydrophobicContact CG-CD1 4.27Å; F275-Y277 AromaticContact CG-CE1 3.56Å; F275-Y277 HydrophobicContact CG-CE1 3.56Å; F275-Y277 PolarHBondContact O-N 3.4Å; Y277-K280 PolarHBondContact O-N 3.45Å; Y277-G281 PolarHBondContact O-N 3.25Å; Y277-L303 HydrophobicContact CE2-CB 3.95Å; Y277-L303 HydrophobicContact CE2-CD2 4.22Å; Y277-L303 VanDerWaalsContact CE2-O 3.29Å; Y277-L303 WeakPolarHBondContact CE2-O 3.16Å; Y277-L303 PolarHBondContact OH-O 3.12Å; Y277-R526 PolarHBondContact O-NH1 2.84Å; Y277-V531 HydrophobicContact CD1-CB 4.49Å; Y277-V531 HydrophobicContact CD1-CG1 3.12Å; Y277-V531 HydrophobicContact CD2-CG1 4.16Å; Y277-V531 HydrophobicContact CD2-CG2 4.42Å; Y277-V531 HydrophobicContact CE1-CG1 3.32Å; Y277-V531 HydrophobicContact CE2-CG1 4.32Å; Y277-V531 HydrophobicContact CG-CG1 3.58Å; Y277-V531 HydrophobicContact CG-CG2 4.23Å; Y277-I533 HydrophobicContact CE1-CD1 4.15Å
278	Q	92.4	Very high	90.1	Very high	6 Å²	6	45.4 Å²	45.4	3%	0.028	21%	0.211	C	C	.	.	H	α-helix	trans	-67.4	-40.7	175.6	-62	176	-20.9	0	0	110.8	L274 F275 K280 G281 V282 L303 Q308	L274-Q278 HydrophobicContact CB-CB 4.3Å; L274-Q278 HydrophobicContact CD2-CB 4.2Å; F275-Q278 HydrophobicContact CB-CG 4.29Å; F275-Q278 CarbonylContact O-C 3.6Å; F275-Q278 WeakPolarHBondContact O-CA 3.32Å; F275-Q278 WeakPolarHBondContact O-CB 3.33Å; F275-Q278 PolarHBondContact O-N 3.3Å; Q278-K280 PolarHBondContact O-N 3.41Å; Q278-G281 CarbonylContact O-C 3.18Å; Q278-G281 WeakPolarHBondContact O-CA 3.4Å; Q278-G281 PolarHBondContact O-N 3.42Å; Q278-V282 WeakPolarHBondContact O-CG2 3.18Å; Q278-V282 PolarHBondContact O-N 2.91Å; Q278-L303 PolarHBondContact NE2-O 3.02Å; Q278-Q308 HydrophobicContact CB-CG 3.86Å; Q278-Q308 HydrophobicContact CG-CG 3.99Å
279	R	91.7	Very high	90.5	Very high	64 Å²	64	45.8 Å²	45.8	24%	0.242	21%	0.213	C	C	.	.	H	α-helix	trans	-56.3	-48.1	171.2	-64.8	177.4	-179.1	143.3	0.7	111.9	W271 S272 L274 F275 D276 G281 V282 K283	W271-R279 HydrophobicContact CD2-CG 4.24Å; W271-R279 HydrophobicContact CE3-CG 4.26Å; W271-R279 HydrophobicContact CH2-CB 3.69Å; W271-R279 HydrophobicContact CH2-CG 3.93Å; W271-R279 HydrophobicContact CZ2-CB 3.93Å; W271-R279 HydrophobicContact CZ2-CG 3.89Å; W271-R279 HydrophobicContact CZ3-CB 4.15Å; W271-R279 HydrophobicContact CZ3-CG 4.11Å; W271-R279 PolarHBondContact O-NE 3.42Å; W271-R279 PolarHBondContact O-NH2 2.96Å; S272-R279 PolarHBondContact O-NH2 3.2Å; S272-R279 VanDerWaalsContact O-NH2 3.15Å; L274-R279 HydrophobicContact CB-CG 3.84Å; L274-R279 HydrophobicContact CD1-CG 4.4Å; L274-R279 PolarHBondContact O-NE 2.66Å; L274-R279 PolarHBondContact O-NH2 3.1Å; F275-R279 PolarHBondContact O-N 2.94Å; D276-R279 PolarHBondContact O-N 3.01Å; D276-R279 IonicContact OD1-CZ 3.24Å; D276-R279 IonicContact OD1-NH1 3.71Å; D276-R279 PolarHBondContact OD1-NH1 3.06Å; R279-G281 VanDerWaalsContact C-N 3.28Å; R279-G281 PolarHBondContact O-N 3.07Å; R279-V282 PolarHBondContact O-N 3.06Å; R279-K283 PolarHBondContact O-N 3.18Å
280	K	91.6	Very high	90.7	Very high	154 Å²	154	47.6 Å²	47.6	67%	0.67	22%	0.215	S	C	*	.	H	α-helix	trans	-60.5	-34.6	173	-71.1	170	-177.2	176.2	0	112.6	D276 Y277 Q278 W284	D276-K280 VanDerWaalsContact O-CG 3.31Å; D276-K280 WeakPolarHBondContact O-CG 3.41Å; D276-K280 PolarHBondContact O-N 3.08Å; Y277-K280 PolarHBondContact O-N 3.45Å; Q278-K280 PolarHBondContact O-N 3.41Å; K280-W284 PolarHBondContact O-N 2.94Å; K280-W284 VanDerWaalsContact O-N 3.07Å
281	G	92.6	Very high	90.6	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-70.3	-41.7	175.9	0	0	0	0	0	113.3	Y277 Q278 R279 W284 L285	Y277-G281 PolarHBondContact O-N 3.25Å; Q278-G281 CarbonylContact O-C 3.18Å; Q278-G281 WeakPolarHBondContact O-CA 3.4Å; Q278-G281 PolarHBondContact O-N 3.42Å; R279-G281 VanDerWaalsContact C-N 3.28Å; R279-G281 PolarHBondContact O-N 3.07Å; G281-W284 PolarHBondContact O-N 3.31Å; G281-L285 WeakPolarHBondContact O-CG 3.23Å; G281-L285 PolarHBondContact O-N 3.21Å
282	V	93	Very high	90.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.3	-41.4	173.7	174.4	0	0	0	0	110.7	F264 V266 W271 L274 Q278 R279 L285 W286 Q308 A311	F264-V282 HydrophobicContact CE1-CG1 4Å; F264-V282 HydrophobicContact CZ-CG1 4.38Å; V266-V282 HydrophobicContact CG2-CG1 4.28Å; W271-V282 HydrophobicContact CZ3-CB 4.45Å; W271-V282 HydrophobicContact CZ3-CG1 4.35Å; L274-V282 HydrophobicContact CD1-CG2 4.18Å; Q278-V282 WeakPolarHBondContact O-CG2 3.18Å; Q278-V282 PolarHBondContact O-N 2.91Å; R279-V282 PolarHBondContact O-N 3.06Å; V282-L285 PolarHBondContact O-N 3.28Å; V282-W286 PolarHBondContact O-N 3.42Å; V282-Q308 HydrophobicContact CG2-CB 4.44Å; V282-A311 HydrophobicContact CG2-CB 3.81Å
283	K	92.7	Very high	90.2	Very high	74 Å²	74	51.6 Å²	51.6	32%	0.322	24%	0.236	S	C	.	.	H	α-helix	trans	-60	-47.2	172.1	-177.9	164	-178.7	163.4	0	112.1	L260 D261 R279 L285 W286 D287	L260-K283 HydrophobicContact CD1-CB 3.89Å; L260-K283 HydrophobicContact CD1-CG 4.25Å; L260-K283 HydrophobicContact CD2-CD 4.27Å; D261-K283 IonicContact OD2-NZ 2.63Å; D261-K283 PolarHBondContact OD2-NZ 3.18Å; R279-K283 PolarHBondContact O-N 3.18Å; K283-L285 VanDerWaalsContact C-N 3.3Å; K283-L285 PolarHBondContact O-N 2.82Å; K283-W286 WeakPolarHBondContact O-CB 3.28Å; K283-W286 PolarHBondContact O-N 3.25Å; K283-W286 VanDerWaalsContact O-N 3.11Å; K283-D287 PolarHBondContact O-N 3.47Å
284	W	93.3	Very high	90.3	Very high	42 Å²	42	44 Å²	44	16%	0.159	21%	0.208	C	C	.	.	H	α-helix	trans	-61.1	-36.3	177.1	178.9	75.5	0	0	0	113.2	K280 G281 D287 L288 I297 P521 I524	K280-W284 PolarHBondContact O-N 2.94Å; K280-W284 VanDerWaalsContact O-N 3.07Å; G281-W284 PolarHBondContact O-N 3.31Å; W284-D287 WeakPolarHBondContact O-CB 3.5Å; W284-D287 PolarHBondContact O-N 2.84Å; W284-L288 HydrophobicContact CD2-CD1 4.14Å; W284-L288 HydrophobicContact CE3-CD1 3.98Å; W284-L288 HydrophobicContact CH2-CD1 3.67Å; W284-L288 HydrophobicContact CZ2-CD1 3.8Å; W284-L288 HydrophobicContact CZ3-CD1 3.74Å; W284-L288 WeakPolarHBondContact O-CG 3.41Å; W284-L288 PolarHBondContact O-N 3.17Å; W284-I297 HydrophobicContact CZ3-CG1 4.39Å; W284-P521 PolarHBondContact NE1-O 3.45Å; W284-I524 HydrophobicContact CB-CD1 4.49Å; W284-I524 HydrophobicContact CD2-CB 4.07Å; W284-I524 HydrophobicContact CD2-CD1 4.36Å; W284-I524 HydrophobicContact CD2-CG2 4.25Å; W284-I524 HydrophobicContact CE3-CB 3.94Å; W284-I524 HydrophobicContact CE3-CD1 4.45Å; W284-I524 HydrophobicContact CE3-CG2 3.59Å; W284-I524 HydrophobicContact CG-CD1 4.41Å; W284-I524 HydrophobicContact CH2-CB 3.96Å; W284-I524 HydrophobicContact CH2-CG2 3.77Å; W284-I524 HydrophobicContact CZ2-CB 4.09Å; W284-I524 HydrophobicContact CZ2-CG2 4.4Å; W284-I524 HydrophobicContact CZ3-CB 3.9Å; W284-I524 HydrophobicContact CZ3-CG2 3.34Å
285	L	93.5	Very high	90.5	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-67.4	-36.6	173.9	-71.3	167.5	0	0	0	112.8	G281 V282 K283 L288 H289 I297 Q308 I309 L312 L452	G281-L285 WeakPolarHBondContact O-CG 3.23Å; G281-L285 PolarHBondContact O-N 3.21Å; V282-L285 PolarHBondContact O-N 3.28Å; K283-L285 VanDerWaalsContact C-N 3.3Å; K283-L285 PolarHBondContact O-N 2.82Å; L285-L288 PolarHBondContact O-N 2.91Å; L285-H289 PolarHBondContact O-N 3.08Å; L285-I297 HydrophobicContact CD1-CD1 3.81Å; L285-I297 HydrophobicContact CD2-CD1 3.9Å; L285-I297 HydrophobicContact CD2-CG1 4.14Å; L285-I297 HydrophobicContact CG-CD1 4.29Å; L285-Q308 HydrophobicContact CD1-CB 4.38Å; L285-I309 HydrophobicContact CD1-CD1 4.12Å; L285-L312 HydrophobicContact CB-CD1 3.97Å; L285-L312 HydrophobicContact CB-CD2 4.01Å; L285-L312 HydrophobicContact CB-CG 4.49Å; L285-L312 HydrophobicContact CD1-CD2 4.41Å; L285-L452 HydrophobicContact CD2-CD1 4.05Å; L285-L452 HydrophobicContact CD2-CD2 3.99Å
286	W	91.8	Very high	90.7	Very high	9 Å²	9	39.3 Å²	39.3	3%	0.034	19%	0.187	C	C	.	.	H	α-helix	trans	-66.6	-42.2	172.4	174.2	-117.9	0	0	0	111.5	D261 F264 V282 K283 L288 H289 Q290 L316 I321	D261-W286 PolarHBondContact O-NE1 3.41Å; F264-W286 HydrophobicContact CB-CD2 3.72Å; F264-W286 VanDerWaalsContact CB-CE2 3.43Å; F264-W286 HydrophobicContact CB-CE3 4.09Å; F264-W286 HydrophobicContact CB-CG 4.29Å; F264-W286 HydrophobicContact CB-CH2 4.01Å; F264-W286 HydrophobicContact CB-CZ2 3.61Å; F264-W286 HydrophobicContact CB-CZ3 4.22Å; F264-W286 HydrophobicContact CD1-CD2 4.36Å; F264-W286 HydrophobicContact CD1-CG 4.31Å; F264-W286 AromaticContact CD2-CD2 3.93Å; F264-W286 HydrophobicContact CD2-CD2 3.93Å; F264-W286 AromaticContact CD2-CE3 3.54Å; F264-W286 HydrophobicContact CD2-CE3 3.54Å; F264-W286 HydrophobicContact CD2-CH2 4.35Å; F264-W286 AromaticContact CD2-CZ3 3.77Å; F264-W286 HydrophobicContact CD2-CZ3 3.77Å; F264-W286 HydrophobicContact CE2-CE3 4.11Å; F264-W286 AromaticContact CG-CD2 3.76Å; F264-W286 HydrophobicContact CG-CD2 3.76Å; F264-W286 AromaticContact CG-CE3 3.89Å; F264-W286 HydrophobicContact CG-CE3 3.89Å; F264-W286 HydrophobicContact CG-CG 4.18Å; F264-W286 HydrophobicContact CG-CZ2 4.45Å; F264-W286 HydrophobicContact CG-CZ3 4.29Å; V282-W286 PolarHBondContact O-N 3.42Å; K283-W286 WeakPolarHBondContact O-CB 3.28Å; K283-W286 PolarHBondContact O-N 3.25Å; K283-W286 VanDerWaalsContact O-N 3.11Å; W286-L288 PolarHBondContact O-N 3.28Å; W286-L288 VanDerWaalsContact O-N 3.16Å; W286-H289 HydrophobicContact CE3-CB 4.21Å; W286-H289 AromaticContact CE3-CD2 3.84Å; W286-H289 AromaticContact CZ3-CD2 3.32Å; W286-H289 WeakPolarHBondContact CZ3-CD2 3.33Å; W286-H289 AromaticContact CZ3-NE2 3.97Å; W286-H289 PolarHBondContact O-N 2.87Å; W286-H289 VanDerWaalsContact O-N 3.11Å; W286-Q290 HydrophobicContact CD2-CG 4.22Å; W286-Q290 VanDerWaalsContact CE2-NE2 3.27Å; W286-Q290 HydrophobicContact CH2-CG 4.28Å; W286-Q290 HydrophobicContact CZ2-CG 3.85Å; W286-Q290 VanDerWaalsContact CZ2-NE2 3.33Å; W286-Q290 PolarHBondContact O-N 3.47Å; W286-L316 HydrophobicContact CE3-CD2 4.39Å; W286-L316 HydrophobicContact CZ3-CD2 3.91Å; W286-I321 HydrophobicContact CH2-CD1 3.67Å; W286-I321 HydrophobicContact CH2-CG2 4.37Å; W286-I321 HydrophobicContact CZ2-CD1 4.24Å; W286-I321 HydrophobicContact CZ3-CD1 4.34Å
287	D	91.5	Very high	90.9	Very high	46 Å²	46	34.6 Å²	34.6	25%	0.246	16%	0.162	C	C	.	.	H	α-helix	trans	-59.4	-25.5	173.8	-60	-24.2	0	0	0	112.6	K283 W284 K291	K283-D287 PolarHBondContact O-N 3.47Å; W284-D287 WeakPolarHBondContact O-CB 3.5Å; W284-D287 PolarHBondContact O-N 2.84Å; D287-K291 WeakPolarHBondContact O-CD 3.49Å; D287-K291 VanDerWaalsContact O-CG 3.28Å; D287-K291 WeakPolarHBondContact O-CG 3.31Å; D287-K291 PolarHBondContact O-NZ 3.27Å
288	L	91.5	Very high	90.8	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.031	16%	0.157	C	C	.	.	H	α-helix	trans	-82	-42.7	173.4	-68.7	172.5	0	0	0	112.1	W284 L285 W286 Q290 K291 G292 C293 Y522	W284-L288 HydrophobicContact CD2-CD1 4.14Å; W284-L288 HydrophobicContact CE3-CD1 3.98Å; W284-L288 HydrophobicContact CH2-CD1 3.67Å; W284-L288 HydrophobicContact CZ2-CD1 3.8Å; W284-L288 HydrophobicContact CZ3-CD1 3.74Å; W284-L288 WeakPolarHBondContact O-CG 3.41Å; W284-L288 PolarHBondContact O-N 3.17Å; L285-L288 PolarHBondContact O-N 2.91Å; W286-L288 PolarHBondContact O-N 3.28Å; W286-L288 VanDerWaalsContact O-N 3.16Å; L288-Q290 VanDerWaalsContact C-N 3.35Å; L288-Q290 PolarHBondContact O-N 3.15Å; L288-K291 CarbonylContact O-C 3.59Å; L288-K291 PolarHBondContact O-N 2.9Å; L288-G292 PolarHBondContact O-N 2.97Å; L288-G292 VanDerWaalsContact O-N 3.15Å; L288-C293 VanDerWaalsContact CD2-SG 3.6Å; L288-C293 PolarHBondContact O-N 3.11Å; L288-Y522 HydrophobicContact CD2-CD1 4.36Å
289	H	89.5	Confident	90.7	Very high	11 Å²	11	33.2 Å²	33.2	5%	0.051	16%	0.156	C	C	.	.	H	α-helix	trans	-57.4	-46.3	175.4	177.4	90	0	0	0	111.6	L285 W286 K291 G292 D323 Y423 H450	L285-H289 PolarHBondContact O-N 3.08Å; W286-H289 HydrophobicContact CE3-CB 4.21Å; W286-H289 AromaticContact CE3-CD2 3.84Å; W286-H289 AromaticContact CZ3-CD2 3.32Å; W286-H289 WeakPolarHBondContact CZ3-CD2 3.33Å; W286-H289 AromaticContact CZ3-NE2 3.97Å; W286-H289 PolarHBondContact O-N 2.87Å; W286-H289 VanDerWaalsContact O-N 3.11Å; H289-K291 PolarHBondContact O-N 3.31Å; H289-G292 PolarHBondContact O-N 3.07Å; H289-D323 IonicContact CE1-OD1 2.9Å; H289-D323 IonicContact CE1-OD2 3.87Å; H289-Y423 AromaticContact ND1-CE2 3.82Å; H289-Y423 AromaticContact ND1-CZ 3.7Å; H289-Y423 PolarHBondContact ND1-OH 3.26Å; H289-H450 AromaticContact CE1-CE1 3.66Å; H289-H450 AromaticContact CE1-NE2 3.34Å; H289-H450 PolarHBondContact CE1-NE2 2.8Å; H289-H450 VanDerWaalsContact CE1-NE2 3.34Å; H289-H450 AromaticContact CG-CE1 3.79Å; H289-H450 AromaticContact ND1-CD2 3.77Å; H289-H450 AromaticContact ND1-CE1 3.21Å; H289-H450 PolarHBondContact ND1-CE1 2.72Å; H289-H450 AromaticContact ND1-CG 3.99Å; H289-H450 AromaticContact ND1-ND1 3.68Å; H289-H450 AromaticContact ND1-NE2 3.27Å; H289-H450 PolarHBondContact ND1-NE2 3.15Å; H289-H450 PolarHBondContact O-CE1 3.15Å
290	Q	86.6	Confident	90.5	Very high	96 Å²	96	32.2 Å²	32.2	45%	0.449	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.1	175.5	-72.8	-172.9	-16.9	0	0	113.5	D261 W286 L288	D261-Q290 PolarHBondContact O-NE2 3.33Å; W286-Q290 HydrophobicContact CD2-CG 4.22Å; W286-Q290 VanDerWaalsContact CE2-NE2 3.27Å; W286-Q290 HydrophobicContact CH2-CG 4.28Å; W286-Q290 HydrophobicContact CZ2-CG 3.85Å; W286-Q290 VanDerWaalsContact CZ2-NE2 3.33Å; W286-Q290 PolarHBondContact O-N 3.47Å; L288-Q290 VanDerWaalsContact C-N 3.35Å; L288-Q290 PolarHBondContact O-N 3.15Å
291	K	85.6	Confident	90.2	Very high	140 Å²	140	25.5 Å²	25.5	61%	0.609	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-1.7	178.5	-65.9	179.5	-169.8	89.5	0	113.2	D287 L288 H289 C293	D287-K291 WeakPolarHBondContact O-CD 3.49Å; D287-K291 VanDerWaalsContact O-CG 3.28Å; D287-K291 WeakPolarHBondContact O-CG 3.31Å; D287-K291 PolarHBondContact O-NZ 3.27Å; L288-K291 CarbonylContact O-C 3.59Å; L288-K291 PolarHBondContact O-N 2.9Å; H289-K291 PolarHBondContact O-N 3.31Å; K291-C293 PolarHBondContact O-N 3.33Å
292	G	83.6	Confident	89.6	Confident	26 Å²	26	26.3 Å²	26.3	27%	0.268	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	33.2	-176.2	0	0	0	0	0	113.5	L288 H289 S325	L288-G292 PolarHBondContact O-N 2.97Å; L288-G292 VanDerWaalsContact O-N 3.15Å; H289-G292 PolarHBondContact O-N 3.07Å; G292-S325 WeakPolarHBondContact CA-OG 3.27Å
293	C	85.4	Confident	89.3	Confident	24 Å²	24	26.3 Å²	26.3	16%	0.162	13%	0.134	C	C	.	.			trans	-127.6	156.2	-173.6	70	0	0	0	0	113.2	L288 K291 Y522	L288-C293 VanDerWaalsContact CD2-SG 3.6Å; L288-C293 PolarHBondContact O-N 3.11Å; K291-C293 PolarHBondContact O-N 3.33Å; C293-Y522 HydrophobicContact CB-CE1 4.39Å
294	G	90.2	Very high	89	Confident	1 Å²	1	23.5 Å²	23.5	1%	0.01	13%	0.126	C	C	.	.			trans	-79.2	169.6	-179.9	0	0	0	0	0	114.2	R451	G294-R451 CarbonylContact C-O 3.14Å; G294-R451 WeakPolarHBondContact CA-O 3.34Å
295	G	93.1	Very high	88.9	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	163.3	172.4	0	0	0	0	0	114.5	R451 L452 I453 Y522	G295-R451 PolarHBondContact N-O 2.84Å; G295-R451 VanDerWaalsContact N-O 3.08Å; G295-L452 WeakPolarHBondContact O-CA 3.45Å; G295-I453 PolarHBondContact O-N 3.23Å; G295-Y522 CarbonylContact C-O 3.52Å; G295-Y522 WeakPolarHBondContact CA-O 3.33Å
296	I	94.1	Very high	88.8	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	119.1	177.1	-51	-173.3	0	0	0	109.6	G298 I453 L469 F470 V473 Y522 L523 I524	I296-G298 PolarHBondContact O-N 2.64Å; I296-I453 CarbonylContact C-O 3.59Å; I296-I453 WeakPolarHBondContact CA-O 3.44Å; I296-I453 HydrophobicContact CG1-CB 4.18Å; I296-I453 HydrophobicContact CG2-CB 4.25Å; I296-I453 HydrophobicContact CG2-CG2 4.21Å; I296-L469 HydrophobicContact CD1-CB 4.08Å; I296-F470 HydrophobicContact CD1-CD2 3.79Å; I296-F470 HydrophobicContact CD1-CE2 3.44Å; I296-F470 VanDerWaalsContact CD1-CE2 3.44Å; I296-F470 HydrophobicContact CD1-CG 4.47Å; I296-F470 HydrophobicContact CD1-CZ 3.86Å; I296-V473 HydrophobicContact CD1-CG2 4.3Å; I296-V473 HydrophobicContact CG1-CG2 3.87Å; I296-Y522 PolarHBondContact N-O 2.77Å; I296-L523 HydrophobicContact CB-CD1 3.77Å; I296-L523 HydrophobicContact CG2-CD1 3.7Å; I296-I524 PolarHBondContact O-N 2.9Å
297	I	94.2	Very high	88.9	Confident	1 Å²	1	24 Å²	24	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	92.8	166	-43.8	-174	0	0	0	108.3	W284 L285 D299 K305 I309 I453 L454 S455 I524	W284-I297 HydrophobicContact CZ3-CG1 4.39Å; L285-I297 HydrophobicContact CD1-CD1 3.81Å; L285-I297 HydrophobicContact CD2-CD1 3.9Å; L285-I297 HydrophobicContact CD2-CG1 4.14Å; L285-I297 HydrophobicContact CG-CD1 4.29Å; I297-D299 VanDerWaalsContact C-N 3.32Å; I297-D299 HydrophobicContact CG2-CB 4.16Å; I297-D299 WeakPolarHBondContact CG2-OD2 3.42Å; I297-K305 HydrophobicContact CB-CD 4.17Å; I297-K305 HydrophobicContact CB-CG 4.47Å; I297-K305 HydrophobicContact CG2-CD 3.85Å; I297-K305 HydrophobicContact CG2-CG 3.79Å; I297-K305 WeakPolarHBondContact O-CD 3.24Å; I297-I309 HydrophobicContact CD1-CD1 3.93Å; I297-I309 HydrophobicContact CD1-CG1 4.33Å; I297-I453 PolarHBondContact N-O 3.43Å; I297-L454 HydrophobicContact CB-CD2 3.93Å; I297-L454 HydrophobicContact CD1-CD2 3.56Å; I297-L454 HydrophobicContact CG1-CD2 3.8Å; I297-S455 PolarHBondContact O-N 3.24Å; I297-I524 HydrophobicContact CB-CG2 4.42Å; I297-I524 HydrophobicContact CG2-CG2 4.06Å
298	G	89.7	Confident	89	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.12	C	C	.	.			trans	-88	12	179.7	0	0	0	0	0	115	I296 S455 I524 R525	I296-G298 PolarHBondContact O-N 2.64Å; G298-S455 CarbonylContact C-O 3.59Å; G298-S455 WeakPolarHBondContact CA-O 3.41Å; G298-I524 VanDerWaalsContact CA-O 3.29Å; G298-I524 WeakPolarHBondContact CA-O 3.43Å; G298-I524 PolarHBondContact N-O 3.01Å; G298-R525 WeakPolarHBondContact O-CG 3.36Å
299	D	90	Very high	89.1	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.119	C	C	.	.	P	Polyproline II helix	trans	-48.1	150.2	177.6	-75.6	-20.3	0	0	0	113	I297 L303 K305 Q308 G456 R526	I297-D299 VanDerWaalsContact C-N 3.32Å; I297-D299 HydrophobicContact CG2-CB 4.16Å; I297-D299 WeakPolarHBondContact CG2-OD2 3.42Å; D299-L303 HydrophobicContact CB-CB 4.37Å; D299-L303 HydrophobicContact CB-CD1 4.17Å; D299-K305 HydrophobicContact CB-CD 4.09Å; D299-K305 HydrophobicContact CB-CG 4Å; D299-K305 PolarHBondContact O-NZ 3.26Å; D299-Q308 PolarHBondContact OD2-NE2 3.12Å; D299-Q308 VanDerWaalsContact OD2-NE2 3.08Å; D299-G456 WeakPolarHBondContact O-CA 3.31Å; D299-R526 VanDerWaalsContact CG-NH2 3.33Å; D299-R526 IonicContact OD1-CZ 2.73Å; D299-R526 PolarHBondContact OD1-N 3.04Å; D299-R526 IonicContact OD1-NE 3.91Å; D299-R526 PolarHBondContact OD1-NE 3.06Å; D299-R526 IonicContact OD1-NH2 2.85Å; D299-R526 PolarHBondContact OD1-NH2 3.38Å; D299-R526 IonicContact OD2-CZ 2.65Å; D299-R526 IonicContact OD2-NE 3.41Å; D299-R526 IonicContact OD2-NH2 2.89Å; D299-R526 PolarHBondContact OD2-NH2 3.19Å
300	E	86.6	Confident	89.4	Confident	43 Å²	43	21.1 Å²	21.1	20%	0.201	12%	0.116	C	C	.	.	P	Polyproline II helix	trans	-58.1	160.4	171.5	-167.1	166.2	178.2	0	0	113	L303 K305 R526 L527 K528	E300-L303 HydrophobicContact CB-CD1 3.93Å; E300-L303 HydrophobicContact CB-CG 4.31Å; E300-K305 PolarHBondContact O-NZ 3.03Å; E300-K305 VanDerWaalsContact O-NZ 3.08Å; E300-R526 PolarHBondContact N-O 3.17Å; E300-L527 WeakPolarHBondContact OE2-CA 3.39Å; E300-L527 WeakPolarHBondContact OE2-CB 3.2Å; E300-K528 HydrophobicContact CG-CD 4.48Å; E300-K528 HydrophobicContact CG-CG 4.34Å; E300-K528 PolarHBondContact OE2-N 3.25Å
301	M	85.8	Confident	89.7	Confident	14 Å²	14	16.5 Å²	16.5	7%	0.069	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	139.8	179.1	-63.9	179.8	64.2	0	0	110.6	K528 Q749 E752	M301-K528 WeakPolarHBondContact O-CE 3.45Å; M301-Q749 HydrophobicContact CE-CB 3.98Å; M301-Q749 HydrophobicContact CE-CG 3.83Å; M301-Q749 HydrophobicContact SD-CB 4.2Å; M301-Q749 HydrophobicContact SD-CG 3.67Å; M301-E752 HydrophobicContact CB-CB 3.89Å; M301-E752 HydrophobicContact CB-CG 4.17Å; M301-E752 HydrophobicContact CE-CB 4.16Å; M301-E752 HydrophobicContact SD-CB 4.12Å; M301-E752 HydrophobicContact SD-CG 4.31Å
302	G	80.3	Confident	90	Very high	17 Å²	17	9.9 Å²	9.9	18%	0.175	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.4	-20.6	-177	0	0	0	0	0	115.6	G304 I757	G302-G304 PolarHBondContact O-N 2.9Å; G302-I757 WeakPolarHBondContact O-CD1 3Å
303	L	86.6	Confident	90.4	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.005	5%	0.053	C	C	.	.	S	Bend	trans	-68.3	9.1	179.2	-66.3	-174.9	0	0	0	115.7	Y277 Q278 D299 E300 R526 K528 V531 I533	Y277-L303 HydrophobicContact CE2-CB 3.95Å; Y277-L303 HydrophobicContact CE2-CD2 4.22Å; Y277-L303 VanDerWaalsContact CE2-O 3.29Å; Y277-L303 WeakPolarHBondContact CE2-O 3.16Å; Y277-L303 PolarHBondContact OH-O 3.12Å; Q278-L303 PolarHBondContact NE2-O 3.02Å; D299-L303 HydrophobicContact CB-CB 4.37Å; D299-L303 HydrophobicContact CB-CD1 4.17Å; E300-L303 HydrophobicContact CB-CD1 3.93Å; E300-L303 HydrophobicContact CB-CG 4.31Å; L303-R526 HydrophobicContact CD1-CB 4.22Å; L303-R526 WeakPolarHBondContact CD1-O 3.41Å; L303-K528 HydrophobicContact CD2-CG 4.02Å; L303-K528 HydrophobicContact CG-CG 4.45Å; L303-V531 HydrophobicContact CD1-CG2 4.47Å; L303-V531 HydrophobicContact CD2-CG1 4.45Å; L303-I533 HydrophobicContact CD2-CD1 3.51Å
304	G	86.1	Confident	90.7	Very high	15 Å²	15	7.5 Å²	7.5	16%	0.155	5%	0.046	C	C	.	.			trans	63	74.1	-180	0	0	0	0	0	113.7	G302 I307 Q308	G302-G304 PolarHBondContact O-N 2.9Å; G304-I307 WeakPolarHBondContact O-CG2 3.25Å; G304-Q308 WeakPolarHBondContact O-CG 3.4Å; G304-Q308 PolarHBondContact O-NE2 3.16Å
305	K	91.2	Very high	90.6	Very high	26 Å²	26	7.4 Å²	7.4	11%	0.113	5%	0.045	C	C	.	.	H	α-helix	trans	-76.6	-40.3	169.8	-73.4	-174.2	-80.9	-75.3	0	112.1	I297 D299 E300 I307 Q308 I309 L454	I297-K305 HydrophobicContact CB-CD 4.17Å; I297-K305 HydrophobicContact CB-CG 4.47Å; I297-K305 HydrophobicContact CG2-CD 3.85Å; I297-K305 HydrophobicContact CG2-CG 3.79Å; I297-K305 WeakPolarHBondContact O-CD 3.24Å; D299-K305 HydrophobicContact CB-CD 4.09Å; D299-K305 HydrophobicContact CB-CG 4Å; D299-K305 PolarHBondContact O-NZ 3.26Å; E300-K305 PolarHBondContact O-NZ 3.03Å; E300-K305 VanDerWaalsContact O-NZ 3.08Å; K305-I307 PolarHBondContact O-N 3.37Å; K305-Q308 PolarHBondContact O-N 3.42Å; K305-I309 PolarHBondContact O-N 3.18Å; K305-L454 HydrophobicContact CD-CB 4.35Å
306	T	92.3	Very high	90.4	Very high	23 Å²	23	7.8 Å²	7.8	14%	0.141	5%	0.047	C	C	.	.	H	α-helix	trans	-54.5	-50.1	177.5	-47.1	0	0	0	0	112.1	Q308 I309 I310 W361 E364	T306-Q308 PolarHBondContact O-N 3.13Å; T306-I309 PolarHBondContact O-N 3.39Å; T306-I309 VanDerWaalsContact O-N 3.15Å; T306-I310 HydrophobicContact CG2-CD1 3.97Å; T306-I310 WeakPolarHBondContact O-CG1 3.46Å; T306-I310 PolarHBondContact O-N 3.34Å; T306-W361 HydrophobicContact CG2-CD2 3.95Å; T306-W361 HydrophobicContact CG2-CE3 3.74Å; T306-W361 HydrophobicContact CG2-CH2 3.95Å; T306-W361 HydrophobicContact CG2-CZ2 4.12Å; T306-W361 HydrophobicContact CG2-CZ3 3.75Å; T306-E364 HydrophobicContact CG2-CB 4.31Å; T306-E364 HydrophobicContact CG2-CG 4.43Å
307	I	92.6	Very high	90	Very high	15 Å²	15	10.2 Å²	10.2	8%	0.077	6%	0.058	C	C	.	.	H	α-helix	trans	-65	-33.7	-179.9	-167.3	-179.7	0	0	0	113.2	L274 G304 K305 I309 I310 A311 W368	L274-I307 HydrophobicContact CD2-CD1 3.69Å; L274-I307 HydrophobicContact CD2-CG1 3.77Å; G304-I307 WeakPolarHBondContact O-CG2 3.25Å; K305-I307 PolarHBondContact O-N 3.37Å; I307-I309 VanDerWaalsContact C-N 3.32Å; I307-I309 PolarHBondContact O-N 2.85Å; I307-I310 PolarHBondContact O-N 2.82Å; I307-A311 VanDerWaalsContact O-CB 3.28Å; I307-A311 WeakPolarHBondContact O-CB 3.46Å; I307-A311 PolarHBondContact O-N 3.28Å; I307-W368 HydrophobicContact CD1-CD2 3.91Å; I307-W368 HydrophobicContact CD1-CE3 3.89Å; I307-W368 HydrophobicContact CD1-CH2 3.47Å; I307-W368 VanDerWaalsContact CD1-CH2 3.47Å; I307-W368 HydrophobicContact CD1-CZ2 3.48Å; I307-W368 VanDerWaalsContact CD1-CZ2 3.48Å; I307-W368 HydrophobicContact CD1-CZ3 3.67Å; I307-W368 HydrophobicContact CG1-CD2 4.09Å; I307-W368 HydrophobicContact CG1-CE3 4.34Å; I307-W368 HydrophobicContact CG1-CZ2 4.37Å
308	Q	93.7	Very high	89.6	Confident	1 Å²	1	15.1 Å²	15.1	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-64.5	-37.2	173.9	-70.6	174.1	81.3	0	0	111.6	Q278 V282 L285 D299 G304 K305 T306 L312	Q278-Q308 HydrophobicContact CB-CG 3.86Å; Q278-Q308 HydrophobicContact CG-CG 3.99Å; V282-Q308 HydrophobicContact CG2-CB 4.44Å; L285-Q308 HydrophobicContact CD1-CB 4.38Å; D299-Q308 PolarHBondContact OD2-NE2 3.12Å; D299-Q308 VanDerWaalsContact OD2-NE2 3.08Å; G304-Q308 WeakPolarHBondContact O-CG 3.4Å; G304-Q308 PolarHBondContact O-NE2 3.16Å; K305-Q308 PolarHBondContact O-N 3.42Å; T306-Q308 PolarHBondContact O-N 3.13Å; Q308-L312 PolarHBondContact O-N 3Å; Q308-L312 VanDerWaalsContact O-N 3.14Å
309	I	94.7	Very high	89.3	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-71.1	-43.6	173.2	-66.9	-57	0	0	0	111.8	L285 I297 K305 T306 I307 A311 L312 L313 W361 I425 L452 L454	L285-I309 HydrophobicContact CD1-CD1 4.12Å; I297-I309 HydrophobicContact CD1-CD1 3.93Å; I297-I309 HydrophobicContact CD1-CG1 4.33Å; K305-I309 PolarHBondContact O-N 3.18Å; T306-I309 PolarHBondContact O-N 3.39Å; T306-I309 VanDerWaalsContact O-N 3.15Å; I307-I309 VanDerWaalsContact C-N 3.32Å; I307-I309 PolarHBondContact O-N 2.85Å; I309-A311 VanDerWaalsContact C-N 3.31Å; I309-A311 PolarHBondContact O-N 3.11Å; I309-L312 WeakPolarHBondContact O-CB 3.2Å; I309-L312 PolarHBondContact O-N 2.97Å; I309-L313 HydrophobicContact CG2-CD1 3.78Å; I309-L313 HydrophobicContact CG2-CG 4.31Å; I309-L313 WeakPolarHBondContact O-CG 3.3Å; I309-L313 PolarHBondContact O-N 2.85Å; I309-W361 HydrophobicContact CB-CH2 4.4Å; I309-W361 HydrophobicContact CG2-CH2 4.28Å; I309-W361 HydrophobicContact CG2-CZ3 4.21Å; I309-I425 HydrophobicContact CG2-CD1 3.55Å; I309-I425 HydrophobicContact CG2-CG2 4.49Å; I309-L452 HydrophobicContact CD1-CD1 3.62Å; I309-L454 HydrophobicContact CD1-CD2 4.05Å; I309-L454 HydrophobicContact CG1-CD1 4.05Å; I309-L454 HydrophobicContact CG1-CD2 3.76Å; I309-L454 HydrophobicContact CG1-CG 4.48Å
310	I	94.2	Very high	88.5	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.4	-41.2	177.5	-62.4	168.7	0	0	0	110.4	T306 I307 L312 L313 A314 E364 F365 W368 W369	T306-I310 HydrophobicContact CG2-CD1 3.97Å; T306-I310 WeakPolarHBondContact O-CG1 3.46Å; T306-I310 PolarHBondContact O-N 3.34Å; I307-I310 PolarHBondContact O-N 2.82Å; I310-L312 PolarHBondContact O-N 3.2Å; I310-L313 PolarHBondContact O-N 3.15Å; I310-A314 WeakPolarHBondContact O-CB 3.4Å; I310-A314 PolarHBondContact O-N 3.35Å; I310-E364 HydrophobicContact CD1-CB 3.73Å; I310-F365 HydrophobicContact CB-CE1 4.39Å; I310-F365 HydrophobicContact CD1-CD1 4.34Å; I310-F365 HydrophobicContact CD1-CG 4.39Å; I310-F365 HydrophobicContact CG1-CD1 3.92Å; I310-F365 HydrophobicContact CG1-CE1 3.75Å; I310-F365 HydrophobicContact CG1-CG 4.38Å; I310-F365 HydrophobicContact CG1-CZ 4.08Å; I310-F365 HydrophobicContact CG2-CD1 4.07Å; I310-F365 HydrophobicContact CG2-CE1 4.25Å; I310-W368 HydrophobicContact CG2-CB 3.81Å; I310-W369 HydrophobicContact CG2-CB 4.21Å
311	A	93.3	Very high	87.9	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64	-37.2	175.8	0	0	0	0	0	113.1	I270 L274 V282 I307 I309 G315	I270-A311 HydrophobicContact CG2-CB 3.95Å; L274-A311 HydrophobicContact CD1-CB 3.93Å; L274-A311 HydrophobicContact CD2-CB 4.38Å; V282-A311 HydrophobicContact CG2-CB 3.81Å; I307-A311 VanDerWaalsContact O-CB 3.28Å; I307-A311 WeakPolarHBondContact O-CB 3.46Å; I307-A311 PolarHBondContact O-N 3.28Å; I309-A311 VanDerWaalsContact C-N 3.31Å; I309-A311 PolarHBondContact O-N 3.11Å; A311-G315 PolarHBondContact O-N 2.89Å
312	L	92.5	Very high	87	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62	-52.9	172.2	-178.3	72.5	0	0	0	111.2	F264 L285 Q308 I309 I310 A314 G315 L316 Y423 L452	F264-L312 HydrophobicContact CE2-CD1 4.37Å; F264-L312 HydrophobicContact CZ-CD1 4.14Å; L285-L312 HydrophobicContact CB-CD1 3.97Å; L285-L312 HydrophobicContact CB-CD2 4.01Å; L285-L312 HydrophobicContact CB-CG 4.49Å; L285-L312 HydrophobicContact CD1-CD2 4.41Å; Q308-L312 PolarHBondContact O-N 3Å; Q308-L312 VanDerWaalsContact O-N 3.14Å; I309-L312 WeakPolarHBondContact O-CB 3.2Å; I309-L312 PolarHBondContact O-N 2.97Å; I310-L312 PolarHBondContact O-N 3.2Å; L312-A314 PolarHBondContact O-N 3Å; L312-G315 PolarHBondContact O-N 3.38Å; L312-L316 WeakPolarHBondContact O-CG 3.42Å; L312-L316 PolarHBondContact O-N 3.09Å; L312-Y423 HydrophobicContact CD2-CE1 4.11Å; L312-L452 HydrophobicContact CD2-CD1 4.05Å
313	L	92.3	Very high	86.4	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.1	-39.2	-178.1	-64.6	171.2	0	0	0	112	I309 I310 L316 H317 L346 T349 I351 F365 I372 I425	I309-L313 HydrophobicContact CG2-CD1 3.78Å; I309-L313 HydrophobicContact CG2-CG 4.31Å; I309-L313 WeakPolarHBondContact O-CG 3.3Å; I309-L313 PolarHBondContact O-N 2.85Å; I310-L313 PolarHBondContact O-N 3.15Å; L313-L316 PolarHBondContact O-N 3.36Å; L313-H317 VanDerWaalsContact O-CB 3.32Å; L313-H317 WeakPolarHBondContact O-CB 3.16Å; L313-H317 PolarHBondContact O-N 3.13Å; L313-L346 HydrophobicContact CB-CD2 4.11Å; L313-L346 HydrophobicContact CD2-CD1 3.67Å; L313-L346 HydrophobicContact CD2-CD2 4.2Å; L313-T349 HydrophobicContact CD1-CG2 4.34Å; L313-T349 HydrophobicContact CD2-CG2 4.12Å; L313-I351 HydrophobicContact CD1-CD1 4.31Å; L313-F365 HydrophobicContact CD1-CE1 4.01Å; L313-F365 HydrophobicContact CD1-CZ 3.85Å; L313-I372 HydrophobicContact CB-CD1 4.17Å; L313-I425 HydrophobicContact CD1-CD1 4.29Å
314	A	91	Very high	85.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.3	-41.6	174	0	0	0	0	0	111.8	I270 I310 L312 H317 Y318 W369	I270-A314 HydrophobicContact CD1-CB 3.57Å; I310-A314 WeakPolarHBondContact O-CB 3.4Å; I310-A314 PolarHBondContact O-N 3.35Å; L312-A314 PolarHBondContact O-N 3Å; A314-H317 PolarHBondContact O-N 2.94Å; A314-Y318 WeakPolarHBondContact O-CB 3.49Å; A314-Y318 PolarHBondContact O-N 3.46Å; A314-W369 HydrophobicContact CB-CB 3.76Å; A314-W369 HydrophobicContact CB-CD2 3.88Å; A314-W369 HydrophobicContact CB-CG 3.46Å; A314-W369 VanDerWaalsContact CB-CG 3.46Å
315	G	89	Confident	84.5	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.3	-43.3	174.2	0	0	0	0	0	112.8	C265 A311 L312 H317 Y318 S319	C265-G315 WeakPolarHBondContact O-CA 3.36Å; A311-G315 PolarHBondContact O-N 2.89Å; L312-G315 PolarHBondContact O-N 3.38Å; G315-H317 VanDerWaalsContact C-N 3.34Å; G315-H317 PolarHBondContact O-N 3.3Å; G315-Y318 PolarHBondContact O-N 3.36Å; G315-S319 WeakPolarHBondContact O-CB 3.26Å; G315-S319 PolarHBondContact O-N 2.94Å; G315-S319 PolarHBondContact O-OG 2.89Å
316	L	88.2	Confident	83.4	Confident	8 Å²	8	34.2 Å²	34.2	4%	0.042	16%	0.159	C	C	.	.	H	α-helix	trans	-63	-39.3	174.5	-69.5	176.8	0	0	0	112.3	F264 W286 L312 L313 N320 L346 Y423	F264-L316 HydrophobicContact CD2-CD2 4.18Å; F264-L316 HydrophobicContact CE2-CD2 4.01Å; F264-L316 HydrophobicContact CE2-CG 4.05Å; W286-L316 HydrophobicContact CE3-CD2 4.39Å; W286-L316 HydrophobicContact CZ3-CD2 3.91Å; L312-L316 WeakPolarHBondContact O-CG 3.42Å; L312-L316 PolarHBondContact O-N 3.09Å; L313-L316 PolarHBondContact O-N 3.36Å; L316-N320 PolarHBondContact O-N 2.92Å; L316-L346 HydrophobicContact CB-CB 4.29Å; L316-L346 HydrophobicContact CB-CD1 4.22Å; L316-L346 HydrophobicContact CD1-CD1 4.08Å; L316-Y423 HydrophobicContact CD1-CE2 3.59Å
317	H	86.7	Confident	82.2	Confident	51 Å²	51	38.5 Å²	38.5	24%	0.236	17%	0.173	C	C	.	.	H	α-helix	trans	-72.3	-30.4	176.5	-175	-54.5	0	0	0	112.8	L313 A314 G315 N320 L346 W369 I372	L313-H317 VanDerWaalsContact O-CB 3.32Å; L313-H317 WeakPolarHBondContact O-CB 3.16Å; L313-H317 PolarHBondContact O-N 3.13Å; A314-H317 PolarHBondContact O-N 2.94Å; G315-H317 VanDerWaalsContact C-N 3.34Å; G315-H317 PolarHBondContact O-N 3.3Å; H317-N320 PolarHBondContact O-OD1 3.36Å; H317-L346 HydrophobicContact CB-CB 4.08Å; H317-L346 HydrophobicContact CB-CD2 4.35Å; H317-W369 AromaticContact CG-NE1 3.98Å; H317-W369 AromaticContact ND1-NE1 3.98Å; H317-I372 HydrophobicContact CB-CD1 4.36Å; H317-I372 HydrophobicContact CB-CG1 4.43Å; H317-I372 VanDerWaalsContact CD2-CG1 3.43Å; H317-I372 WeakPolarHBondContact CD2-CG1 3.32Å
318	Y	85.3	Confident	80.7	Confident	104 Å²	104	43.2 Å²	43.2	41%	0.408	20%	0.197	S	C	.	.	H	α-helix	trans	-84.9	-39.6	-178.3	-177.5	-109.3	0	0	0	112.5	D257 C265 P267 A314 G315 W369	D257-Y318 PolarHBondContact OD2-OH 2.97Å; C265-Y318 HydrophobicContact CB-CD1 4.12Å; C265-Y318 HydrophobicContact CB-CE1 4.27Å; P267-Y318 HydrophobicContact CG-CD1 3.95Å; P267-Y318 HydrophobicContact CG-CD2 3.98Å; P267-Y318 HydrophobicContact CG-CG 3.65Å; A314-Y318 WeakPolarHBondContact O-CB 3.49Å; A314-Y318 PolarHBondContact O-N 3.46Å; G315-Y318 PolarHBondContact O-N 3.36Å; Y318-W369 HydrophobicContact CD2-CH2 4.15Å; Y318-W369 HydrophobicContact CD2-CZ2 4.28Å
319	S	82.1	Confident	79.3	Confident	27 Å²	27	44.5 Å²	44.5	19%	0.189	20%	0.203	C	C	.	.	H	α-helix	trans	-80.3	-11.9	-177.8	58.7	0	0	0	0	114.8	G315 I321	G315-S319 WeakPolarHBondContact O-CB 3.26Å; G315-S319 PolarHBondContact O-N 2.94Å; G315-S319 PolarHBondContact O-OG 2.89Å; S319-I321 PolarHBondContact O-N 2.92Å; S319-I321 VanDerWaalsContact O-N 3.15Å; S319-I321 WeakPolarHBondContact OG-CD1 3.32Å; S319-I321 WeakPolarHBondContact OG-CG1 3.21Å
320	N	74.7	Confident	78	Confident	85 Å²	85	46.3 Å²	46.3	46%	0.455	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	33.2	178.8	-71.3	-28.5	0	0	0	114.3	L316 H317 L344	L316-N320 PolarHBondContact O-N 2.92Å; H317-N320 PolarHBondContact O-OD1 3.36Å; N320-L344 HydrophobicContact CB-CD2 4.14Å; N320-L344 HydrophobicContact CB-CG 4.12Å; N320-L344 WeakPolarHBondContact O-CG 3.2Å
321	I	73.1	Confident	76.3	Confident	38 Å²	38	49.5 Å²	49.5	20%	0.195	24%	0.235	C	C	.	.			trans	-71.6	137.6	-179.1	-65.4	171.6	0	0	0	110.8	F264 W286 S319 D323 G345	F264-I321 HydrophobicContact CB-CD1 4.07Å; W286-I321 HydrophobicContact CH2-CD1 3.67Å; W286-I321 HydrophobicContact CH2-CG2 4.37Å; W286-I321 HydrophobicContact CZ2-CD1 4.24Å; W286-I321 HydrophobicContact CZ3-CD1 4.34Å; S319-I321 PolarHBondContact O-N 2.92Å; S319-I321 VanDerWaalsContact O-N 3.15Å; S319-I321 WeakPolarHBondContact OG-CD1 3.32Å; S319-I321 WeakPolarHBondContact OG-CG1 3.21Å; I321-D323 PolarHBondContact O-N 3.19Å; I321-G345 WeakPolarHBondContact O-CA 3.48Å; I321-G345 PolarHBondContact O-N 2.87Å
322	E	67.1	Low	74.7	Confident	101 Å²	101	54.5 Å²	54.5	47%	0.472	27%	0.265	S	S	.	.			trans	-66.9	117.3	167.3	-70.4	179.1	-161.3	0	0	111.1	R324 R327 L344	E322-R324 VanDerWaalsContact C-N 3.3Å; E322-R324 PolarHBondContact O-N 2.59Å; E322-R327 IonicContact OE2-CZ 2.84Å; E322-R327 IonicContact OE2-NH1 3.35Å; E322-R327 PolarHBondContact OE2-NH1 3.35Å; E322-R327 IonicContact OE2-NH2 2.7Å; E322-R327 PolarHBondContact OE2-NH2 3.2Å; E322-L344 HydrophobicContact CG-CD1 4.08Å
323	D	67.1	Low	73.1	Confident	16 Å²	16	59.8 Å²	59.8	9%	0.086	29%	0.285	C	S	.	.			trans	-71.1	85.8	169.9	-175.7	-10.3	0	0	0	110	H289 I321 S325 Y326 R327 S422 H450	H289-D323 IonicContact CE1-OD1 2.9Å; H289-D323 IonicContact CE1-OD2 3.87Å; I321-D323 PolarHBondContact O-N 3.19Å; D323-S325 PolarHBondContact O-N 2.91Å; D323-S325 VanDerWaalsContact O-N 3.17Å; D323-S325 WeakPolarHBondContact OD1-CB 3.31Å; D323-S325 PolarHBondContact OD1-N 3.19Å; D323-Y326 WeakPolarHBondContact O-CA 3.27Å; D323-Y326 WeakPolarHBondContact O-CB 3.32Å; D323-Y326 PolarHBondContact O-N 3.25Å; D323-Y326 PolarHBondContact OD1-N 3.01Å; D323-Y326 WeakPolarHBondContact OD2-CB 3.39Å; D323-R327 PolarHBondContact O-N 2.89Å; D323-S422 PolarHBondContact OD2-OG 3.2Å; D323-H450 VanDerWaalsContact CG-NE2 3.31Å; D323-H450 IonicContact OD1-CE1 3.7Å; D323-H450 IonicContact OD1-NE2 3.46Å; D323-H450 PolarHBondContact OD1-NE2 2.89Å; D323-H450 VanDerWaalsContact OD1-NE2 3.07Å; D323-H450 IonicContact OD2-CD2 2.74Å; D323-H450 PolarHBondContact OD2-CD2 3.33Å; D323-H450 VanDerWaalsContact OD2-CD2 3.24Å; D323-H450 IonicContact OD2-NE2 3.17Å; D323-H450 PolarHBondContact OD2-NE2 3.2Å
324	R	68.1	Low	71	Confident	199 Å²	199	67 Å²	67	75%	0.751	32%	0.323	S	S	*	.	H	α-helix	trans	-54.9	-31.7	178	-175.8	178.2	179.6	177.6	1.2	112.4	E322 L328	E322-R324 VanDerWaalsContact C-N 3.3Å; E322-R324 PolarHBondContact O-N 2.59Å; R324-L328 WeakPolarHBondContact O-CB 3.49Å; R324-L328 PolarHBondContact O-N 2.92Å
325	S	65.9	Low	69.1	Low	30 Å²	30	70.7 Å²	70.7	21%	0.21	34%	0.343	C	S	.	.	H	α-helix	trans	-70.4	-40.1	177.1	-58.3	0	0	0	0	111.1	G292 D323 Y329	G292-S325 WeakPolarHBondContact CA-OG 3.27Å; D323-S325 PolarHBondContact O-N 2.91Å; D323-S325 VanDerWaalsContact O-N 3.17Å; D323-S325 WeakPolarHBondContact OD1-CB 3.31Å; D323-S325 PolarHBondContact OD1-N 3.19Å; S325-Y329 VanDerWaalsContact O-CB 3.31Å; S325-Y329 WeakPolarHBondContact O-CB 3.28Å; S325-Y329 PolarHBondContact O-N 2.94Å
326	Y	67.6	Low	66.8	Low	21 Å²	21	75.1 Å²	75.1	8%	0.082	37%	0.37	C	S	.	.	H	α-helix	trans	-68.4	-40.2	172.2	-176	-107.3	0	0	0	112.7	D323 L328 Y329 L330 F343 N420 P449	D323-Y326 WeakPolarHBondContact O-CA 3.27Å; D323-Y326 WeakPolarHBondContact O-CB 3.32Å; D323-Y326 PolarHBondContact O-N 3.25Å; D323-Y326 PolarHBondContact OD1-N 3.01Å; D323-Y326 WeakPolarHBondContact OD2-CB 3.39Å; Y326-L328 PolarHBondContact O-N 3.11Å; Y326-Y329 HydrophobicContact CD2-CD1 4.19Å; Y326-Y329 HydrophobicContact CE2-CD1 4.38Å; Y326-Y329 WeakPolarHBondContact O-CB 3.22Å; Y326-Y329 PolarHBondContact O-N 3.21Å; Y326-L330 HydrophobicContact CD1-CD1 4.03Å; Y326-L330 HydrophobicContact CD1-CG 4.37Å; Y326-L330 HydrophobicContact CE1-CD1 3.57Å; Y326-L330 HydrophobicContact CE1-CD2 4.45Å; Y326-L330 HydrophobicContact CE1-CG 4.05Å; Y326-L330 HydrophobicContact CE2-CD2 4.41Å; Y326-L330 HydrophobicContact CE2-CG 4.47Å; Y326-L330 WeakPolarHBondContact O-CG 3.37Å; Y326-L330 PolarHBondContact O-N 3.14Å; Y326-F343 HydrophobicContact CE1-CD2 4.18Å; Y326-N420 HydrophobicContact CE2-CB 4.33Å; Y326-P449 HydrophobicContact CD2-CG 4.31Å
327	R	66.1	Low	64.7	Low	113 Å²	113	79.2 Å²	79.2	43%	0.426	40%	0.399	S	S	.	.	H	α-helix	trans	-60.8	-44.8	173.5	-176	165.6	65.2	-150.8	-11.3	111.8	E322 D323 L330 S331 E342	E322-R327 IonicContact OE2-CZ 2.84Å; E322-R327 IonicContact OE2-NH1 3.35Å; E322-R327 PolarHBondContact OE2-NH1 3.35Å; E322-R327 IonicContact OE2-NH2 2.7Å; E322-R327 PolarHBondContact OE2-NH2 3.2Å; D323-R327 PolarHBondContact O-N 2.89Å; R327-L330 PolarHBondContact O-N 2.76Å; R327-S331 PolarHBondContact O-N 2.85Å; R327-S331 VanDerWaalsContact O-N 3.09Å; R327-E342 IonicContact NH1-OE1 2.92Å
328	L	61.9	Low	62.7	Low	113 Å²	113	85.6 Å²	85.6	59%	0.592	43%	0.429	S	S	*	.	H	α-helix	trans	-61.8	-45.4	174.7	-175.1	64.5	0	0	0	111	R324 Y326 L330 S331 T332	R324-L328 WeakPolarHBondContact O-CB 3.49Å; R324-L328 PolarHBondContact O-N 2.92Å; Y326-L328 PolarHBondContact O-N 3.11Å; L328-L330 PolarHBondContact O-N 2.85Å; L328-S331 PolarHBondContact O-N 2.82Å; L328-S331 PolarHBondContact O-OG 3.39Å; L328-T332 PolarHBondContact O-N 3.42Å; L328-T332 PolarHBondContact O-OG1 3.1Å
329	Y	65.2	Low	60.6	Low	29 Å²	29	84.6 Å²	84.6	11%	0.114	44%	0.436	C	S	.	.	H	α-helix	trans	-57.9	-44.1	176.4	171.7	-118.9	0	0	0	113	S325 Y326 T332 R333 S447	S325-Y329 VanDerWaalsContact O-CB 3.31Å; S325-Y329 WeakPolarHBondContact O-CB 3.28Å; S325-Y329 PolarHBondContact O-N 2.94Å; Y326-Y329 HydrophobicContact CD2-CD1 4.19Å; Y326-Y329 HydrophobicContact CE2-CD1 4.38Å; Y326-Y329 WeakPolarHBondContact O-CB 3.22Å; Y326-Y329 PolarHBondContact O-N 3.21Å; Y329-T332 PolarHBondContact O-N 3.36Å; Y329-R333 HydrophobicContact CE2-CG 4.05Å; Y329-R333 PolarHBondContact O-N 3.37Å; Y329-R333 WeakPolarHBondContact OH-CD 3.42Å; Y329-R333 VanDerWaalsContact OH-CZ 3.31Å; Y329-R333 PolarHBondContact OH-NE 2.94Å; Y329-R333 PolarHBondContact OH-NH1 3.05Å; Y329-S447 WeakPolarHBondContact CE2-OG 3.3Å; Y329-S447 VanDerWaalsContact CZ-O 3.28Å; Y329-S447 WeakPolarHBondContact OH-CB 3.47Å; Y329-S447 PolarHBondContact OH-O 2.75Å
330	L	65.6	Low	58.8	Low	37 Å²	37	89.4 Å²	89.4	19%	0.194	46%	0.456	C	S	.	.	H	α-helix	trans	-60.7	-46	175	-71.9	179.4	0	0	0	111.6	Y326 R327 L328 T332 R333 N420	Y326-L330 HydrophobicContact CD1-CD1 4.03Å; Y326-L330 HydrophobicContact CD1-CG 4.37Å; Y326-L330 HydrophobicContact CE1-CD1 3.57Å; Y326-L330 HydrophobicContact CE1-CD2 4.45Å; Y326-L330 HydrophobicContact CE1-CG 4.05Å; Y326-L330 HydrophobicContact CE2-CD2 4.41Å; Y326-L330 HydrophobicContact CE2-CG 4.47Å; Y326-L330 WeakPolarHBondContact O-CG 3.37Å; Y326-L330 PolarHBondContact O-N 3.14Å; R327-L330 PolarHBondContact O-N 2.76Å; L328-L330 PolarHBondContact O-N 2.85Å; L330-T332 VanDerWaalsContact C-N 3.32Å; L330-T332 PolarHBondContact O-N 3.3Å; L330-R333 PolarHBondContact O-N 3.37Å; L330-N420 HydrophobicContact CD2-CB 4.14Å; L330-N420 VanDerWaalsContact CD2-ND2 3.32Å; L330-N420 WeakPolarHBondContact CD2-ND2 3.44Å
331	S	59	Low	57.6	Low	68 Å²	68	90.7 Å²	90.7	48%	0.476	46%	0.459	S	S	.	.	H	α-helix	trans	-61.8	-37.7	178.5	72.4	0	0	0	0	112.7	R327 L328 R333 N334	R327-S331 PolarHBondContact O-N 2.85Å; R327-S331 VanDerWaalsContact O-N 3.09Å; L328-S331 PolarHBondContact O-N 2.82Å; L328-S331 PolarHBondContact O-OG 3.39Å; S331-R333 PolarHBondContact O-N 3.21Å; S331-N334 PolarHBondContact O-N 3.18Å
332	T	59.8	Low	56.6	Low	104 Å²	104	96.2 Å²	96.2	64%	0.638	48%	0.484	S	S	*	.	H	α-helix	trans	-66.1	-18.2	178.3	-52.5	0	0	0	0	113.4	L328 Y329 L330	L328-T332 PolarHBondContact O-N 3.42Å; L328-T332 PolarHBondContact O-OG1 3.1Å; Y329-T332 PolarHBondContact O-N 3.36Å; L330-T332 VanDerWaalsContact C-N 3.32Å; L330-T332 PolarHBondContact O-N 3.3Å
333	R	59.3	Low	56.1	Low	111 Å²	111	93.1 Å²	93.1	42%	0.419	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	0.1	178.7	-64.4	-164.2	103.7	177.5	3.7	114.6	Y329 L330 S331 L335 N420	Y329-R333 HydrophobicContact CE2-CG 4.05Å; Y329-R333 PolarHBondContact O-N 3.37Å; Y329-R333 WeakPolarHBondContact OH-CD 3.42Å; Y329-R333 VanDerWaalsContact OH-CZ 3.31Å; Y329-R333 PolarHBondContact OH-NE 2.94Å; Y329-R333 PolarHBondContact OH-NH1 3.05Å; L330-R333 PolarHBondContact O-N 3.37Å; S331-R333 PolarHBondContact O-N 3.21Å; R333-L335 HydrophobicContact CB-CD1 3.93Å; R333-L335 HydrophobicContact CB-CG 4.05Å; R333-L335 PolarHBondContact O-N 3.31Å; R333-L335 VanDerWaalsContact O-N 3.13Å; R333-N420 PolarHBondContact NH1-OD1 3.2Å
334	N	48.5	Very low	55.7	Low	151 Å²	151	97.4 Å²	97.4	81%	0.807	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	34.8	-175.9	-69.6	-10.1	0	0	0	113.6	S331	S331-N334 PolarHBondContact O-N 3.18Å
335	L	50.9	Low	55.8	Low	78 Å²	78	88.3 Å²	88.3	41%	0.408	46%	0.459	S	S	.	.			trans	-76	135.5	174.8	-74.3	163.7	0	0	0	109.6	R333 N420	R333-L335 HydrophobicContact CB-CD1 3.93Å; R333-L335 HydrophobicContact CB-CG 4.05Å; R333-L335 PolarHBondContact O-N 3.31Å; R333-L335 VanDerWaalsContact O-N 3.13Å; L335-N420 WeakPolarHBondContact CD1-ND2 3.35Å
336	T	40.3	Very low	56.4	Low	94 Å²	94	87.1 Å²	87.1	58%	0.577	45%	0.451	S	S	*	.			trans	-63.9	154.3	-176.6	46.9	0	0	0	0	112.5	E338 C339	T336-E338 PolarHBondContact O-N 3.07Å; T336-C339 PolarHBondContact O-N 3.4Å
337	S	45.2	Very low	57	Low	93 Å²	93	86.3 Å²	86.3	65%	0.65	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-52.9	-30.5	-171.3	-35	0	0	0	0	114.2	C339 Q340	S337-C339 PolarHBondContact O-N 3.49Å; S337-C339 VanDerWaalsContact O-N 3.16Å; S337-Q340 VanDerWaalsContact O-CB 3.32Å; S337-Q340 WeakPolarHBondContact O-CB 3.26Å; S337-Q340 PolarHBondContact O-N 2.84Å
338	E	44.1	Very low	58.1	Low	185 Å²	185	80.9 Å²	80.9	86%	0.864	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-62.1	-20.3	179.1	-57.7	177.2	137.6	0	0	113.9	T336	T336-E338 PolarHBondContact O-N 3.07Å
339	C	41.5	Very low	59.5	Low	83 Å²	83	75.5 Å²	75.5	56%	0.561	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-91.9	2.4	176.6	-69.2	0	0	0	0	113.9	T336 S337 Q341	T336-C339 PolarHBondContact O-N 3.4Å; S337-C339 PolarHBondContact O-N 3.49Å; S337-C339 VanDerWaalsContact O-N 3.16Å; C339-Q341 VanDerWaalsContact C-N 3.33Å; C339-Q341 PolarHBondContact O-N 3.5Å
340	Q	44.1	Very low	60.9	Low	129 Å²	129	74.1 Å²	74.1	60%	0.603	40%	0.395	S	S	*	.			trans	-83.8	69.3	-177.1	-64.1	179.3	-18.8	0	0	112.1	S337 E342	S337-Q340 VanDerWaalsContact O-CB 3.32Å; S337-Q340 WeakPolarHBondContact O-CB 3.26Å; S337-Q340 PolarHBondContact O-N 2.84Å; Q340-E342 PolarHBondContact O-N 3.32Å
341	Q	48.4	Very low	62.3	Low	112 Å²	112	72.4 Å²	72.4	52%	0.523	39%	0.386	S	S	.	.			trans	-77.6	101.4	158.4	-74.8	-169.5	-26.9	0	0	109	C339 F343	C339-Q341 VanDerWaalsContact C-N 3.33Å; C339-Q341 PolarHBondContact O-N 3.5Å; Q341-F343 HydrophobicContact CB-CD1 4.41Å; Q341-F343 HydrophobicContact CB-CE1 3.78Å; Q341-F343 HydrophobicContact CB-CE2 4.38Å; Q341-F343 HydrophobicContact CB-CZ 3.77Å; Q341-F343 PolarHBondContact O-N 3.06Å; Q341-F343 VanDerWaalsContact O-N 3.08Å
342	E	52.1	Low	64	Low	153 Å²	153	69.1 Å²	69.1	72%	0.715	36%	0.363	S	S	*	.			trans	-69.6	99.7	171.5	-63.4	-163	120.2	0	0	109.4	R327 Q340 L344	R327-E342 IonicContact NH1-OE1 2.92Å; Q340-E342 PolarHBondContact O-N 3.32Å; E342-L344 PolarHBondContact O-N 3.24Å
343	F	57.2	Low	65.5	Low	37 Å²	37	64.2 Å²	64.2	16%	0.162	33%	0.333	C	S	.	.			trans	-80.2	107.4	177	-59.9	-56.3	0	0	0	110.2	Y326 Q341 G345 P398	Y326-F343 HydrophobicContact CE1-CD2 4.18Å; Q341-F343 HydrophobicContact CB-CD1 4.41Å; Q341-F343 HydrophobicContact CB-CE1 3.78Å; Q341-F343 HydrophobicContact CB-CE2 4.38Å; Q341-F343 HydrophobicContact CB-CZ 3.77Å; Q341-F343 PolarHBondContact O-N 3.06Å; Q341-F343 VanDerWaalsContact O-N 3.08Å; F343-G345 PolarHBondContact O-N 3.46Å; F343-P398 HydrophobicContact CB-CB 4.34Å; F343-P398 HydrophobicContact CD1-CB 3.8Å; F343-P398 HydrophobicContact CD1-CG 4.05Å; F343-P398 HydrophobicContact CG-CB 4.31Å
344	L	58.2	Low	66.9	Low	106 Å²	106	59.6 Å²	59.6	56%	0.555	32%	0.317	S	S	*	.			trans	-71.4	120.3	168.8	-158	74.6	0	0	0	109	N320 E322 E342	N320-L344 HydrophobicContact CB-CD2 4.14Å; N320-L344 HydrophobicContact CB-CG 4.12Å; N320-L344 WeakPolarHBondContact O-CG 3.2Å; E322-L344 HydrophobicContact CG-CD1 4.08Å; E342-L344 PolarHBondContact O-N 3.24Å
345	G	70.1	Confident	68.5	Low	7 Å²	7	53.8 Å²	53.8	7%	0.072	29%	0.29	C	S	.	.	S	Bend	trans	84	-142.9	-175.4	0	0	0	0	0	114.8	I321 F343 G347	I321-G345 WeakPolarHBondContact O-CA 3.48Å; I321-G345 PolarHBondContact O-N 2.87Å; F343-G345 PolarHBondContact O-N 3.46Å; G345-G347 PolarHBondContact O-N 2.92Å
346	L	79.8	Confident	69.8	Low	5 Å²	5	51 Å²	51	3%	0.026	28%	0.277	C	S	.	.			trans	-70.7	110.9	-168.5	-179.9	62	0	0	0	113.1	L313 L316 H317 I372 G399	L313-L346 HydrophobicContact CB-CD2 4.11Å; L313-L346 HydrophobicContact CD2-CD1 3.67Å; L313-L346 HydrophobicContact CD2-CD2 4.2Å; L316-L346 HydrophobicContact CB-CB 4.29Å; L316-L346 HydrophobicContact CB-CD1 4.22Å; L316-L346 HydrophobicContact CD1-CD1 4.08Å; H317-L346 HydrophobicContact CB-CB 4.08Å; H317-L346 HydrophobicContact CB-CD2 4.35Å; L346-I372 HydrophobicContact CD2-CD1 3.8Å; L346-I372 HydrophobicContact CD2-CG1 4.4Å; L346-G399 PolarHBondContact O-N 3.49Å
347	G	80.6	Confident	71.8	Confident	4 Å²	4	47.2 Å²	47.2	4%	0.041	25%	0.253	C	S	.	.			trans	-69.5	167.6	170.5	0	0	0	0	0	114.3	G345 T349	G345-G347 PolarHBondContact O-N 2.92Å; G347-T349 PolarHBondContact O-N 2.9Å; G347-T349 PolarHBondContact O-OG1 3.19Å; G347-T349 VanDerWaalsContact O-OG1 3.06Å
348	P	87.5	Confident	73.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.			trans	-58.8	128.2	-176.5	23.6	-33.6	0	0	0	111.5	W421 S422	P348-W421 HydrophobicContact CB-CE3 4.1Å; P348-W421 HydrophobicContact CB-CZ3 4.31Å; P348-S422 PolarHBondContact O-N 2.92Å
349	T	92.3	Very high	75.6	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	129.1	-168.8	-68.7	0	0	0	0	111.7	L313 G347 I351 S400 V401 L402 I425	L313-T349 HydrophobicContact CD1-CG2 4.34Å; L313-T349 HydrophobicContact CD2-CG2 4.12Å; G347-T349 PolarHBondContact O-N 2.9Å; G347-T349 PolarHBondContact O-OG1 3.19Å; G347-T349 VanDerWaalsContact O-OG1 3.06Å; T349-I351 HydrophobicContact CG2-CD1 4.46Å; T349-I351 HydrophobicContact CG2-CG1 4.07Å; T349-S400 PolarHBondContact N-O 3.07Å; T349-S400 VanDerWaalsContact N-O 3.12Å; T349-V401 HydrophobicContact CG2-CG2 4.31Å; T349-V401 WeakPolarHBondContact O-CA 3.26Å; T349-L402 PolarHBondContact O-N 3.05Å; T349-I425 HydrophobicContact CG2-CD1 4.41Å
350	L	94	Very high	77.6	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	123.4	177.5	-175.9	64.4	0	0	0	110.7	V352 L402 T404 W421 Y423 V424 I425 F446	L350-V352 HydrophobicContact CD2-CG2 4.49Å; L350-V352 HydrophobicContact CG-CG2 4.28Å; L350-L402 HydrophobicContact CD1-CB 4.08Å; L350-L402 HydrophobicContact CD1-CD2 3.95Å; L350-L402 HydrophobicContact CD1-CG 4.02Å; L350-T404 HydrophobicContact CD1-CG2 3.87Å; L350-W421 HydrophobicContact CB-CD2 3.98Å; L350-W421 HydrophobicContact CB-CE3 3.75Å; L350-W421 HydrophobicContact CB-CZ3 4.1Å; L350-W421 HydrophobicContact CD1-CH2 4.37Å; L350-Y423 PolarHBondContact N-O 2.76Å; L350-V424 HydrophobicContact CB-CG2 4.27Å; L350-V424 HydrophobicContact CD2-CG2 4.37Å; L350-V424 WeakPolarHBondContact O-CA 3.31Å; L350-I425 PolarHBondContact O-N 3.01Å; L350-F446 HydrophobicContact CD2-CD1 4.42Å; L350-F446 HydrophobicContact CD2-CE1 3.8Å; L350-F446 HydrophobicContact CD2-CZ 4.01Å
351	I	95.6	Very high	79.8	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	121.6	176.1	-52	-174.4	0	0	0	109.3	L313 T349 W361 F365 V401 L402 L403 T404 I425	L313-I351 HydrophobicContact CD1-CD1 4.31Å; T349-I351 HydrophobicContact CG2-CD1 4.46Å; T349-I351 HydrophobicContact CG2-CG1 4.07Å; I351-W361 HydrophobicContact CD1-CE3 4.23Å; I351-W361 HydrophobicContact CD1-CZ3 3.98Å; I351-W361 HydrophobicContact CG2-CD2 4.38Å; I351-W361 HydrophobicContact CG2-CE3 4.34Å; I351-W361 HydrophobicContact CG2-CH2 4.33Å; I351-W361 HydrophobicContact CG2-CZ2 4.39Å; I351-W361 HydrophobicContact CG2-CZ3 4.3Å; I351-F365 HydrophobicContact CD1-CE2 3.79Å; I351-F365 HydrophobicContact CD1-CZ 3.68Å; I351-V401 HydrophobicContact CD1-CG1 3.63Å; I351-V401 HydrophobicContact CG1-CG1 3.95Å; I351-L402 PolarHBondContact N-O 2.91Å; I351-L403 HydrophobicContact CB-CD2 3.91Å; I351-L403 HydrophobicContact CD1-CD2 4.22Å; I351-L403 HydrophobicContact CG1-CD2 4.44Å; I351-L403 HydrophobicContact CG2-CD2 4.32Å; I351-T404 PolarHBondContact O-N 3.01Å; I351-I425 WeakPolarHBondContact CA-O 3.47Å; I351-I425 HydrophobicContact CD1-CD1 4.49Å; I351-I425 HydrophobicContact CG1-CB 4.22Å; I351-I425 HydrophobicContact CG1-CD1 4.45Å; I351-I425 HydrophobicContact CG2-CB 4.46Å
352	V	94.6	Very high	81.7	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	110.3	-177.6	-169.6	0	0	0	0	108.7	L350 T404 Y406 L409 I425 L426 D427	L350-V352 HydrophobicContact CD2-CG2 4.49Å; L350-V352 HydrophobicContact CG-CG2 4.28Å; V352-T404 WeakPolarHBondContact CA-O 3.39Å; V352-T404 HydrophobicContact CG2-CG2 4.17Å; V352-Y406 HydrophobicContact CG1-CD1 3.68Å; V352-Y406 HydrophobicContact CG1-CD2 4.01Å; V352-Y406 HydrophobicContact CG1-CE1 3.83Å; V352-Y406 HydrophobicContact CG1-CE2 4.15Å; V352-Y406 HydrophobicContact CG1-CG 3.78Å; V352-L409 HydrophobicContact CG1-CD1 4.16Å; V352-L409 HydrophobicContact CG2-CD1 3.57Å; V352-I425 PolarHBondContact N-O 2.9Å; V352-L426 HydrophobicContact CB-CD2 3.81Å; V352-L426 HydrophobicContact CG2-CD2 3.83Å; V352-D427 PolarHBondContact O-N 3.07Å
353	C	92.1	Very high	83.2	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	167.3	-177.7	72	0	0	0	0	112.7	T404 T405 D427	C353-T404 PolarHBondContact N-O 3.34Å; C353-T405 WeakPolarHBondContact O-CA 3.17Å; C353-D427 HydrophobicContact CB-CB 3.66Å
354	P	87.5	Confident	84.8	Confident	14 Å²	14	19 Å²	19	9%	0.091	11%	0.111	C	C	.	.			trans	-64.5	141.9	172.8	-17.4	30.9	0	0	0	111	T356 V357 E428	P354-T356 PolarHBondContact O-N 3.47Å; P354-V357 HydrophobicContact CB-CG2 4.14Å; P354-V357 HydrophobicContact CG-CG2 4.16Å; P354-V357 PolarHBondContact O-N 3.18Å; P354-E428 HydrophobicContact CG-CB 4.02Å; P354-E428 HydrophobicContact CG-CG 4.21Å
355	A	82.6	Confident	86.3	Confident	29 Å²	29	14 Å²	14	24%	0.24	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-20.4	-175.2	0	0	0	0	0	115.2	T405	A355-T405 HydrophobicContact CB-CG2 3.84Å
356	T	77.5	Confident	87.2	Confident	21 Å²	21	14.6 Å²	14.6	13%	0.129	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-23.2	174.3	39	0	0	0	0	114.7	P354 L725	P354-T356 PolarHBondContact O-N 3.47Å; T356-L725 WeakPolarHBondContact CB-O 3.29Å; T356-L725 HydrophobicContact CG2-CB 3.96Å; T356-L725 HydrophobicContact CG2-CD1 3.88Å; T356-L725 HydrophobicContact CG2-CG 4.38Å; T356-L725 WeakPolarHBondContact OG1-CB 3.31Å; T356-L725 PolarHBondContact OG1-O 3.24Å
357	V	83.3	Confident	87.5	Confident	13 Å²	13	18 Å²	18	8%	0.079	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-12.3	-175.9	-154.8	0	0	0	0	111.6	P354 N359 Q360 W361	P354-V357 HydrophobicContact CB-CG2 4.14Å; P354-V357 HydrophobicContact CG-CG2 4.16Å; P354-V357 PolarHBondContact O-N 3.18Å; V357-N359 VanDerWaalsContact C-N 3.33Å; V357-N359 PolarHBondContact O-N 2.64Å; V357-Q360 HydrophobicContact CG1-CB 4.16Å; V357-Q360 CarbonylContact O-C 3.44Å; V357-Q360 WeakPolarHBondContact O-CA 3.23Å; V357-Q360 WeakPolarHBondContact O-CB 3.47Å; V357-Q360 PolarHBondContact O-N 2.85Å; V357-W361 PolarHBondContact O-N 3.3Å
358	L	86	Confident	87.8	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-45.9	-52.6	177.7	-76.1	171.8	0	0	0	113.1	Q360 W361 M362 I376 H378 L403 T405	L358-Q360 VanDerWaalsContact C-N 3.32Å; L358-Q360 PolarHBondContact O-N 2.91Å; L358-W361 PolarHBondContact O-N 3.44Å; L358-M362 PolarHBondContact O-N 3.28Å; L358-I376 HydrophobicContact CB-CD1 4.17Å; L358-I376 HydrophobicContact CD1-CG2 4.33Å; L358-H378 HydrophobicContact CD1-CB 3.71Å; L358-L403 HydrophobicContact CD2-CB 3.89Å; L358-T405 HydrophobicContact CD1-CG2 3.71Å; L358-T405 HydrophobicContact CD2-CG2 4.36Å; L358-T405 HydrophobicContact CG-CG2 4.24Å
359	N	82	Confident	87.9	Confident	55 Å²	55	22.2 Å²	22.2	29%	0.294	12%	0.124	S	C	.	.	H	α-helix	trans	-68.8	-31.8	-178	-63.2	11.6	0	0	0	111.9	V357 S363	V357-N359 VanDerWaalsContact C-N 3.33Å; V357-N359 PolarHBondContact O-N 2.64Å; N359-S363 VanDerWaalsContact O-CB 3.3Å; N359-S363 WeakPolarHBondContact O-CB 3.42Å; N359-S363 PolarHBondContact O-N 2.85Å
360	Q	84.5	Confident	87.5	Confident	40 Å²	40	23.3 Å²	23.3	19%	0.187	13%	0.132	C	C	.	.	H	α-helix	trans	-68.4	-48	172.5	178.5	170.1	8	0	0	110.5	V357 L358 M362 S363 E364	V357-Q360 HydrophobicContact CG1-CB 4.16Å; V357-Q360 CarbonylContact O-C 3.44Å; V357-Q360 WeakPolarHBondContact O-CA 3.23Å; V357-Q360 WeakPolarHBondContact O-CB 3.47Å; V357-Q360 PolarHBondContact O-N 2.85Å; L358-Q360 VanDerWaalsContact C-N 3.32Å; L358-Q360 PolarHBondContact O-N 2.91Å; Q360-M362 VanDerWaalsContact C-N 3.3Å; Q360-M362 PolarHBondContact O-N 2.89Å; Q360-S363 PolarHBondContact O-N 2.78Å; Q360-S363 VanDerWaalsContact O-N 3.09Å; Q360-E364 HydrophobicContact CG-CG 3.79Å; Q360-E364 PolarHBondContact NE2-OE1 3.26Å; Q360-E364 WeakPolarHBondContact O-CB 3.33Å; Q360-E364 WeakPolarHBondContact O-CG 3.47Å; Q360-E364 PolarHBondContact O-N 3.31Å
361	W	90.1	Very high	87.1	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-53.8	-47	176	-87.7	96.8	0	0	0	111.5	T306 I309 I351 V357 L358 E364 F365 L403 D427 L454	T306-W361 HydrophobicContact CG2-CD2 3.95Å; T306-W361 HydrophobicContact CG2-CE3 3.74Å; T306-W361 HydrophobicContact CG2-CH2 3.95Å; T306-W361 HydrophobicContact CG2-CZ2 4.12Å; T306-W361 HydrophobicContact CG2-CZ3 3.75Å; I309-W361 HydrophobicContact CB-CH2 4.4Å; I309-W361 HydrophobicContact CG2-CH2 4.28Å; I309-W361 HydrophobicContact CG2-CZ3 4.21Å; I351-W361 HydrophobicContact CD1-CE3 4.23Å; I351-W361 HydrophobicContact CD1-CZ3 3.98Å; I351-W361 HydrophobicContact CG2-CD2 4.38Å; I351-W361 HydrophobicContact CG2-CE3 4.34Å; I351-W361 HydrophobicContact CG2-CH2 4.33Å; I351-W361 HydrophobicContact CG2-CZ2 4.39Å; I351-W361 HydrophobicContact CG2-CZ3 4.3Å; V357-W361 PolarHBondContact O-N 3.3Å; L358-W361 PolarHBondContact O-N 3.44Å; W361-E364 PolarHBondContact O-N 3.02Å; W361-F365 HydrophobicContact CE3-CD2 4.44Å; W361-F365 AromaticContact CE3-CE2 3.76Å; W361-F365 HydrophobicContact CE3-CE2 3.76Å; W361-F365 HydrophobicContact CE3-CZ 4.42Å; W361-F365 HydrophobicContact CZ3-CE2 4.24Å; W361-F365 HydrophobicContact CZ3-CZ 4.47Å; W361-F365 WeakPolarHBondContact O-CD2 3.46Å; W361-F365 PolarHBondContact O-N 2.92Å; W361-L403 HydrophobicContact CB-CD1 3.88Å; W361-L403 HydrophobicContact CB-CD2 4.19Å; W361-D427 HydrophobicContact CZ2-CB 3.95Å; W361-D427 PolarHBondContact NE1-OD2 3.12Å; W361-L454 HydrophobicContact CH2-CD1 3.71Å; W361-L454 HydrophobicContact CZ2-CD1 3.67Å
362	M	87.7	Confident	86.6	Confident	12 Å²	12	25.1 Å²	25.1	6%	0.059	14%	0.143	C	C	.	.	H	α-helix	trans	-57.9	-52.4	172.2	175.8	-164.2	-74	0	0	112.3	H218 D220 L358 Q360 E364 F365 H366 I376 L403	H218-M362 HydrophobicContact CB-SD 4.35Å; D220-M362 HydrophobicContact CB-CE 3.45Å; D220-M362 VanDerWaalsContact CB-CE 3.45Å; L358-M362 PolarHBondContact O-N 3.28Å; Q360-M362 VanDerWaalsContact C-N 3.3Å; Q360-M362 PolarHBondContact O-N 2.89Å; M362-E364 PolarHBondContact O-N 3.29Å; M362-F365 PolarHBondContact O-N 2.71Å; M362-H366 VanDerWaalsContact CG-CE1 3.49Å; M362-H366 WeakPolarHBondContact CG-CE1 3.39Å; M362-H366 WeakPolarHBondContact CG-NE2 3.47Å; M362-H366 WeakPolarHBondContact O-CB 3.2Å; M362-H366 PolarHBondContact O-N 3.31Å; M362-H366 PolarHBondContact SD-NE2 2.89Å; M362-H366 VanDerWaalsContact SD-NE2 3.43Å; M362-I376 HydrophobicContact CE-CD1 3.45Å; M362-I376 VanDerWaalsContact CE-CD1 3.45Å; M362-I376 HydrophobicContact CE-CG1 3.9Å; M362-L403 HydrophobicContact CB-CD1 4.14Å
363	S	85.2	Confident	86.3	Confident	52 Å²	52	25.7 Å²	25.7	36%	0.364	15%	0.145	S	C	.	.	H	α-helix	trans	-61.6	-33.5	-177.4	-170.8	0	0	0	0	112.6	N359 Q360 S367	N359-S363 VanDerWaalsContact O-CB 3.3Å; N359-S363 WeakPolarHBondContact O-CB 3.42Å; N359-S363 PolarHBondContact O-N 2.85Å; Q360-S363 PolarHBondContact O-N 2.78Å; Q360-S363 VanDerWaalsContact O-N 3.09Å; S363-S367 VanDerWaalsContact O-CB 3.24Å; S363-S367 WeakPolarHBondContact O-CB 3.4Å; S363-S367 PolarHBondContact O-N 3.26Å; S363-S367 VanDerWaalsContact O-N 3.16Å
364	E	89.6	Confident	86.2	Confident	40 Å²	40	25.7 Å²	25.7	19%	0.187	15%	0.145	C	C	.	.	H	α-helix	trans	-73	-45.4	176.8	-59	-102.4	-161.8	0	0	109.7	T306 I310 Q360 W361 M362 H366 S367 W368	T306-E364 HydrophobicContact CG2-CB 4.31Å; T306-E364 HydrophobicContact CG2-CG 4.43Å; I310-E364 HydrophobicContact CD1-CB 3.73Å; Q360-E364 HydrophobicContact CG-CG 3.79Å; Q360-E364 PolarHBondContact NE2-OE1 3.26Å; Q360-E364 WeakPolarHBondContact O-CB 3.33Å; Q360-E364 WeakPolarHBondContact O-CG 3.47Å; Q360-E364 PolarHBondContact O-N 3.31Å; W361-E364 PolarHBondContact O-N 3.02Å; M362-E364 PolarHBondContact O-N 3.29Å; E364-H366 PolarHBondContact O-N 3.13Å; E364-S367 PolarHBondContact O-N 2.87Å; E364-W368 WeakPolarHBondContact O-CB 3.32Å; E364-W368 PolarHBondContact O-N 3.39Å; E364-W368 PolarHBondContact OE2-NE1 3.27Å
365	F	90.7	Very high	86.3	Confident	1 Å²	1	25.1 Å²	25.1	0%	0.004	14%	0.142	C	C	.	.	H	α-helix	trans	-57.8	-47.9	172.1	-84.1	-68.2	0	0	0	112.1	I310 L313 I351 W361 M362 S367 W368 W369 I372 V374 V401 L403	I310-F365 HydrophobicContact CB-CE1 4.39Å; I310-F365 HydrophobicContact CD1-CD1 4.34Å; I310-F365 HydrophobicContact CD1-CG 4.39Å; I310-F365 HydrophobicContact CG1-CD1 3.92Å; I310-F365 HydrophobicContact CG1-CE1 3.75Å; I310-F365 HydrophobicContact CG1-CG 4.38Å; I310-F365 HydrophobicContact CG1-CZ 4.08Å; I310-F365 HydrophobicContact CG2-CD1 4.07Å; I310-F365 HydrophobicContact CG2-CE1 4.25Å; L313-F365 HydrophobicContact CD1-CE1 4.01Å; L313-F365 HydrophobicContact CD1-CZ 3.85Å; I351-F365 HydrophobicContact CD1-CE2 3.79Å; I351-F365 HydrophobicContact CD1-CZ 3.68Å; W361-F365 HydrophobicContact CE3-CD2 4.44Å; W361-F365 AromaticContact CE3-CE2 3.76Å; W361-F365 HydrophobicContact CE3-CE2 3.76Å; W361-F365 HydrophobicContact CE3-CZ 4.42Å; W361-F365 HydrophobicContact CZ3-CE2 4.24Å; W361-F365 HydrophobicContact CZ3-CZ 4.47Å; W361-F365 WeakPolarHBondContact O-CD2 3.46Å; W361-F365 PolarHBondContact O-N 2.92Å; M362-F365 PolarHBondContact O-N 2.71Å; F365-S367 PolarHBondContact O-N 2.82Å; F365-S367 VanDerWaalsContact O-N 3.12Å; F365-W368 PolarHBondContact O-N 3.3Å; F365-W369 CarbonylContact O-C 3.47Å; F365-W369 PolarHBondContact O-N 3.08Å; F365-I372 HydrophobicContact CD1-CG2 4.37Å; F365-V374 HydrophobicContact CB-CG2 3.68Å; F365-V374 HydrophobicContact CD1-CG2 4.37Å; F365-V374 HydrophobicContact CD2-CG1 4.27Å; F365-V374 HydrophobicContact CD2-CG2 4.03Å; F365-V374 HydrophobicContact CG-CG2 3.81Å; F365-V401 HydrophobicContact CE1-CG2 4.43Å; F365-V401 HydrophobicContact CE2-CG1 3.99Å; F365-V401 HydrophobicContact CZ-CG1 4.03Å; F365-V401 HydrophobicContact CZ-CG2 4.28Å; F365-L403 HydrophobicContact CE2-CD2 4.18Å
366	H	87.9	Confident	86.6	Confident	21 Å²	21	23.9 Å²	23.9	10%	0.097	13%	0.131	C	C	.	.	H	α-helix	trans	-64.5	-8.6	176	-71.2	175	0	0	0	114.3	H218 N219 M362 E364	H218-H366 AromaticContact CE1-CE1 3.79Å; H218-H366 AromaticContact CG-CE1 3.4Å; H218-H366 VanDerWaalsContact CG-CE1 3.4Å; H218-H366 AromaticContact ND1-CE1 2.75Å; H218-H366 PolarHBondContact ND1-CE1 2.69Å; H218-H366 AromaticContact ND1-ND1 3.57Å; N219-H366 PolarHBondContact O-NE2 2.73Å; M362-H366 VanDerWaalsContact CG-CE1 3.49Å; M362-H366 WeakPolarHBondContact CG-CE1 3.39Å; M362-H366 WeakPolarHBondContact CG-NE2 3.47Å; M362-H366 WeakPolarHBondContact O-CB 3.2Å; M362-H366 PolarHBondContact O-N 3.31Å; M362-H366 PolarHBondContact SD-NE2 2.89Å; M362-H366 VanDerWaalsContact SD-NE2 3.43Å; E364-H366 PolarHBondContact O-N 3.13Å
367	S	85.4	Confident	87.1	Confident	76 Å²	76	22.9 Å²	22.9	53%	0.531	13%	0.125	S	C	.	.	H	α-helix	trans	-113.8	-24.3	178.2	-174.6	0	0	0	0	114.1	S363 E364 F365	S363-S367 VanDerWaalsContact O-CB 3.24Å; S363-S367 WeakPolarHBondContact O-CB 3.4Å; S363-S367 PolarHBondContact O-N 3.26Å; S363-S367 VanDerWaalsContact O-N 3.16Å; E364-S367 PolarHBondContact O-N 2.87Å; F365-S367 PolarHBondContact O-N 2.82Å; F365-S367 VanDerWaalsContact O-N 3.12Å
368	W	88.2	Confident	87.2	Confident	58 Å²	58	23.6 Å²	23.6	22%	0.22	13%	0.127	C	C	.	.	H	α-helix	trans	-105.4	-42.3	-175.5	-72.3	111	0	0	0	113.2	I270 R273 I307 I310 E364 F365	I270-W368 WeakPolarHBondContact CD1-O 3.42Å; I270-W368 WeakPolarHBondContact CG1-O 3.4Å; R273-W368 HydrophobicContact CB-CH2 4.31Å; R273-W368 HydrophobicContact CB-CZ3 3.81Å; R273-W368 HydrophobicContact CG-CZ3 4.42Å; I307-W368 HydrophobicContact CD1-CD2 3.91Å; I307-W368 HydrophobicContact CD1-CE3 3.89Å; I307-W368 HydrophobicContact CD1-CH2 3.47Å; I307-W368 VanDerWaalsContact CD1-CH2 3.47Å; I307-W368 HydrophobicContact CD1-CZ2 3.48Å; I307-W368 VanDerWaalsContact CD1-CZ2 3.48Å; I307-W368 HydrophobicContact CD1-CZ3 3.67Å; I307-W368 HydrophobicContact CG1-CD2 4.09Å; I307-W368 HydrophobicContact CG1-CE3 4.34Å; I307-W368 HydrophobicContact CG1-CZ2 4.37Å; I310-W368 HydrophobicContact CG2-CB 3.81Å; E364-W368 WeakPolarHBondContact O-CB 3.32Å; E364-W368 PolarHBondContact O-N 3.39Å; E364-W368 PolarHBondContact OE2-NE1 3.27Å; F365-W368 PolarHBondContact O-N 3.3Å
369	W	88.5	Confident	86.7	Confident	35 Å²	35	27.4 Å²	27.4	13%	0.133	15%	0.154	C	C	.	.			trans	-144.9	75.8	173.6	-166.5	-114.3	0	0	0	111.4	P267 I270 I310 A314 H317 Y318 F365 P371 I372	P267-W369 HydrophobicContact CB-CE3 4.44Å; P267-W369 HydrophobicContact CB-CH2 4.07Å; P267-W369 HydrophobicContact CB-CZ3 3.73Å; P267-W369 HydrophobicContact CG-CE3 4.14Å; P267-W369 HydrophobicContact CG-CH2 3.51Å; P267-W369 HydrophobicContact CG-CZ2 4.09Å; P267-W369 HydrophobicContact CG-CZ3 3.54Å; I270-W369 HydrophobicContact CD1-CB 4.03Å; I270-W369 HydrophobicContact CD1-CD2 4.25Å; I270-W369 HydrophobicContact CD1-CE3 3.85Å; I270-W369 HydrophobicContact CD1-CG 4.36Å; I310-W369 HydrophobicContact CG2-CB 4.21Å; A314-W369 HydrophobicContact CB-CB 3.76Å; A314-W369 HydrophobicContact CB-CD2 3.88Å; A314-W369 HydrophobicContact CB-CG 3.46Å; A314-W369 VanDerWaalsContact CB-CG 3.46Å; H317-W369 AromaticContact CG-NE1 3.98Å; H317-W369 AromaticContact ND1-NE1 3.98Å; Y318-W369 HydrophobicContact CD2-CH2 4.15Å; Y318-W369 HydrophobicContact CD2-CZ2 4.28Å; F365-W369 CarbonylContact O-C 3.47Å; F365-W369 PolarHBondContact O-N 3.08Å; W369-P371 VanDerWaalsContact C-N 3.34Å; W369-P371 HydrophobicContact CD2-CG 4.34Å; W369-P371 HydrophobicContact CZ2-CG 4.11Å; W369-I372 PolarHBondContact O-N 2.81Å
370	P	84.7	Confident	86.2	Confident	23 Å²	23	27.9 Å²	27.9	15%	0.149	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-26	-176.5	-24.9	34.6	0	0	0	117.3	R230 Q234 I372	R230-P370 PolarHBondContact NH1-O 3.38Å; R230-P370 PolarHBondContact NH2-O 3.04Å; Q234-P370 VanDerWaalsContact CD-CB 3.42Å; Q234-P370 HydrophobicContact CG-CB 4.33Å; P370-I372 PolarHBondContact O-N 2.9Å
371	P	84.7	Confident	85.5	Confident	37 Å²	37	26.4 Å²	26.4	24%	0.24	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.9	179.3	-28.4	37.1	0	0	0	115.3	F227 W369	F227-P371 WeakPolarHBondContact CZ-O 3.46Å; W369-P371 VanDerWaalsContact C-N 3.34Å; W369-P371 HydrophobicContact CD2-CG 4.34Å; W369-P371 HydrophobicContact CZ2-CG 4.11Å
372	I	87	Confident	84.5	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	18%	0.183	C	C	.	.	S	Bend	trans	-66.9	138.1	173.1	-81.7	172.9	0	0	0	109.9	R230 L313 H317 L346 F365 W369 P370 V374 V401	R230-I372 PolarHBondContact NH2-O 2.98Å; L313-I372 HydrophobicContact CB-CD1 4.17Å; H317-I372 HydrophobicContact CB-CD1 4.36Å; H317-I372 HydrophobicContact CB-CG1 4.43Å; H317-I372 VanDerWaalsContact CD2-CG1 3.43Å; H317-I372 WeakPolarHBondContact CD2-CG1 3.32Å; L346-I372 HydrophobicContact CD2-CD1 3.8Å; L346-I372 HydrophobicContact CD2-CG1 4.4Å; F365-I372 HydrophobicContact CD1-CG2 4.37Å; W369-I372 PolarHBondContact O-N 2.81Å; P370-I372 PolarHBondContact O-N 2.9Å; I372-V374 HydrophobicContact CG2-CG2 3.84Å; I372-V401 HydrophobicContact CG2-CB 4.16Å; I372-V401 HydrophobicContact CG2-CG2 3.59Å
373	R	87.8	Confident	83.3	Confident	12 Å²	12	30.7 Å²	30.7	5%	0.045	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	121.3	176.4	-172.4	-180	175.6	-158.5	-4.9	110.6	D221 A222 F227 G399 V401	D221-R373 HydrophobicContact CB-CG 3.72Å; D221-R373 PolarHBondContact O-NE 3.4Å; D221-R373 PolarHBondContact O-NH2 2.83Å; A222-R373 PolarHBondContact O-NH2 2.85Å; F227-R373 HydrophobicContact CD1-CG 4.22Å; F227-R373 HydrophobicContact CD2-CB 4.09Å; F227-R373 HydrophobicContact CD2-CG 3.86Å; F227-R373 HydrophobicContact CE1-CB 4.23Å; F227-R373 HydrophobicContact CE1-CG 4.4Å; F227-R373 HydrophobicContact CE2-CB 3.74Å; F227-R373 HydrophobicContact CE2-CG 4.05Å; F227-R373 HydrophobicContact CG-CB 4.48Å; F227-R373 HydrophobicContact CG-CG 3.95Å; F227-R373 HydrophobicContact CZ-CB 3.81Å; F227-R373 HydrophobicContact CZ-CG 4.31Å; R373-G399 PolarHBondContact N-O 3.3Å; R373-V401 PolarHBondContact O-N 3.3Å
374	V	89.6	Confident	82.6	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	115.9	-173.9	-172.9	0	0	0	0	112.3	D221 F365 I372 V401 L403	D221-V374 VanDerWaalsContact CB-O 3.31Å; D221-V374 WeakPolarHBondContact CB-O 3.43Å; D221-V374 PolarHBondContact N-O 3.22Å; D221-V374 PolarHBondContact OD2-N 3.32Å; F365-V374 HydrophobicContact CB-CG2 3.68Å; F365-V374 HydrophobicContact CD1-CG2 4.37Å; F365-V374 HydrophobicContact CD2-CG1 4.27Å; F365-V374 HydrophobicContact CD2-CG2 4.03Å; F365-V374 HydrophobicContact CG-CG2 3.81Å; I372-V374 HydrophobicContact CG2-CG2 3.84Å; V374-V401 HydrophobicContact CG2-CB 4.48Å; V374-L403 HydrophobicContact CG1-CD1 3.59Å; V374-L403 HydrophobicContact CG1-CD2 4.4Å; V374-L403 HydrophobicContact CG1-CG 3.74Å
375	A	89.7	Confident	81.8	Confident	2 Å²	2	33.7 Å²	33.7	2%	0.017	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	147.6	179.5	0	0	0	0	0	112.5	A222 L390 I394 V401 L402 L403	A222-A375 HydrophobicContact CB-CB 4.47Å; A375-L390 HydrophobicContact CB-CD1 4.04Å; A375-I394 HydrophobicContact CB-CD1 3.76Å; A375-I394 HydrophobicContact CB-CG1 4.49Å; A375-V401 PolarHBondContact N-O 3.01Å; A375-V401 VanDerWaalsContact N-O 3.14Å; A375-L402 WeakPolarHBondContact O-CD1 3.2Å; A375-L403 PolarHBondContact O-N 2.85Å
376	I	89.4	Confident	81.2	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	119.1	177.9	-72.6	-179.4	0	0	0	110.8	L358 M362 H378 L403	L358-I376 HydrophobicContact CB-CD1 4.17Å; L358-I376 HydrophobicContact CD1-CG2 4.33Å; M362-I376 HydrophobicContact CE-CD1 3.45Å; M362-I376 VanDerWaalsContact CE-CD1 3.45Å; M362-I376 HydrophobicContact CE-CG1 3.9Å; I376-H378 HydrophobicContact CG2-CB 3.63Å; I376-H378 PolarHBondContact O-N 3.35Å; I376-L403 HydrophobicContact CG1-CB 4.15Å; I376-L403 HydrophobicContact CG1-CD1 4.21Å
377	L	88.1	Confident	80.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	80.1	163.7	-176.6	69.2	0	0	0	109	P387 L390 I391 L402 L403 T404 T408 Y412 L416	L377-P387 HydrophobicContact CD1-CB 3.7Å; L377-L390 HydrophobicContact CD1-CD2 4.42Å; L377-I391 HydrophobicContact CD2-CD1 4.13Å; L377-I391 HydrophobicContact CD2-CG1 4.32Å; L377-L402 HydrophobicContact CB-CD1 3.57Å; L377-L402 HydrophobicContact CB-CD2 4.29Å; L377-L402 HydrophobicContact CB-CG 4.21Å; L377-L402 HydrophobicContact CD2-CD2 4.19Å; L377-L403 PolarHBondContact N-O 3.37Å; L377-T404 PolarHBondContact O-OG1 2.73Å; L377-T408 HydrophobicContact CD2-CG2 4.35Å; L377-T408 HydrophobicContact CG-CG2 3.95Å; L377-T408 WeakPolarHBondContact O-CG2 3.37Å; L377-Y412 HydrophobicContact CD1-CD2 4.28Å; L377-Y412 HydrophobicContact CD1-CE2 4.29Å; L377-Y412 HydrophobicContact CD2-CD2 4.17Å; L377-Y412 HydrophobicContact CG-CD2 4.34Å; L377-L416 HydrophobicContact CD2-CD1 4.3Å; L377-L416 HydrophobicContact CD2-CD2 4.1Å
378	H	84.2	Confident	80.6	Confident	28 Å²	28	41.2 Å²	41.2	13%	0.13	24%	0.241	C	C	.	.	S	Bend	trans	-163.4	162.7	173.7	-178.6	-106.5	0	0	0	108.2	L358 I376 T380 G381 Y384 T405	L358-H378 HydrophobicContact CD1-CB 3.71Å; I376-H378 HydrophobicContact CG2-CB 3.63Å; I376-H378 PolarHBondContact O-N 3.35Å; H378-T380 PolarHBondContact ND1-OG1 3.25Å; H378-T380 PolarHBondContact O-N 3.14Å; H378-G381 PolarHBondContact O-N 3.1Å; H378-Y384 WeakPolarHBondContact O-CB 3.41Å; H378-Y384 WeakPolarHBondContact O-CD2 3.32Å; H378-T405 HydrophobicContact CB-CG2 4.32Å
379	S	75.8	Confident	80.3	Confident	81 Å²	81	44.8 Å²	44.8	57%	0.566	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-1.3	-177.8	58.1	0	0	0	0	115.6
380	T	70.8	Confident	80.1	Confident	65 Å²	65	43.4 Å²	43.4	40%	0.399	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-7.4	174.6	50.6	0	0	0	0	114	H378	H378-T380 PolarHBondContact ND1-OG1 3.25Å; H378-T380 PolarHBondContact O-N 3.14Å
381	G	69.6	Low	80	Confident	8 Å²	8	42.5 Å²	42.5	8%	0.082	25%	0.247	C	C	.	.	S	Bend	trans	-95.8	143.4	174.9	0	0	0	0	0	112.1	D220 H378 G383 Y384	D220-G381 VanDerWaalsContact OD2-CA 3.25Å; D220-G381 WeakPolarHBondContact OD2-CA 3.38Å; H378-G381 PolarHBondContact O-N 3.1Å; G381-G383 PolarHBondContact O-N 3.27Å; G381-Y384 WeakPolarHBondContact O-CB 3.34Å; G381-Y384 PolarHBondContact O-N 2.95Å
382	S	69	Low	79.9	Confident	87 Å²	87	44.9 Å²	44.9	61%	0.608	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-62.3	-30	-179.6	59.9	0	0	0	0	112.8	D220 Y384	D220-S382 VanDerWaalsContact CG-N 3.33Å; D220-S382 VanDerWaalsContact CG-OG 3.28Å; D220-S382 VanDerWaalsContact OD1-CB 3.24Å; D220-S382 WeakPolarHBondContact OD1-CB 3.36Å; D220-S382 PolarHBondContact OD1-N 3.18Å; D220-S382 PolarHBondContact OD1-OG 3.38Å; D220-S382 PolarHBondContact OD2-N 3.09Å; D220-S382 PolarHBondContact OD2-OG 3Å; S382-Y384 PolarHBondContact O-N 2.97Å
383	G	64.2	Low	79.6	Confident	15 Å²	15	48.2 Å²	48.2	16%	0.155	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-70.3	-9.6	177.1	0	0	0	0	0	115.7	G381 G385 K386	G381-G383 PolarHBondContact O-N 3.27Å; G383-G385 PolarHBondContact O-N 3.35Å; G383-G385 VanDerWaalsContact O-N 3.11Å; G383-K386 PolarHBondContact O-N 2.95Å; G383-K386 VanDerWaalsContact O-N 3.13Å
384	Y	70.2	Confident	79.4	Confident	85 Å²	85	47.7 Å²	47.7	33%	0.333	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-61.1	-25.5	-171	-169.8	-102.3	0	0	0	114.4	H378 G381 S382 K386 P387 Y412	H378-Y384 WeakPolarHBondContact O-CB 3.41Å; H378-Y384 WeakPolarHBondContact O-CD2 3.32Å; G381-Y384 WeakPolarHBondContact O-CB 3.34Å; G381-Y384 PolarHBondContact O-N 2.95Å; S382-Y384 PolarHBondContact O-N 2.97Å; Y384-K386 PolarHBondContact O-N 3.36Å; Y384-P387 WeakPolarHBondContact O-CD 3.49Å; Y384-Y412 HydrophobicContact CE2-CE2 4.1Å; Y384-Y412 PolarHBondContact OH-OH 2.91Å
385	G	71.6	Confident	78.9	Confident	71 Å²	71	48.4 Å²	48.4	73%	0.732	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-67.6	-15.6	178.2	0	0	0	0	0	115	G383	G383-G385 PolarHBondContact O-N 3.35Å; G383-G385 VanDerWaalsContact O-N 3.11Å
386	K	78.9	Confident	78.4	Confident	152 Å²	152	52.7 Å²	52.7	66%	0.661	30%	0.296	S	S	*	.	S	Bend	trans	-142	62.4	-178.6	-63.9	178.7	-175.2	165.6	0	110.9	G383 Y384 N388 K389 L390	G383-K386 PolarHBondContact O-N 2.95Å; G383-K386 VanDerWaalsContact O-N 3.13Å; Y384-K386 PolarHBondContact O-N 3.36Å; K386-N388 VanDerWaalsContact C-N 3.32Å; K386-N388 PolarHBondContact O-N 3.29Å; K386-K389 HydrophobicContact CB-CB 4.38Å; K386-K389 PolarHBondContact O-N 3.19Å; K386-K389 VanDerWaalsContact O-N 3.08Å; K386-L390 PolarHBondContact O-N 3.47Å; K386-L390 VanDerWaalsContact O-N 3.13Å
387	P	79.5	Confident	77.7	Confident	17 Å²	17	55.4 Å²	55.4	11%	0.11	31%	0.311	C	S	.	.	H	α-helix	trans	-62	-36.4	-165.8	25.1	-33.2	0	0	0	113	L377 Y384 K389 L390 I391 Y412	L377-P387 HydrophobicContact CD1-CB 3.7Å; Y384-P387 WeakPolarHBondContact O-CD 3.49Å; P387-K389 VanDerWaalsContact C-N 3.33Å; P387-K389 PolarHBondContact O-N 3.11Å; P387-L390 WeakPolarHBondContact O-CB 3.21Å; P387-L390 PolarHBondContact O-N 2.83Å; P387-I391 WeakPolarHBondContact O-CG1 3.4Å; P387-I391 PolarHBondContact O-N 3.43Å; P387-Y412 HydrophobicContact CB-CE2 4.37Å; P387-Y412 HydrophobicContact CG-CE1 4.42Å
388	N	81.7	Confident	77	Confident	86 Å²	86	58.6 Å²	58.6	46%	0.46	33%	0.332	S	S	.	.	H	α-helix	trans	-61.4	-41.5	178.4	-54.2	33.8	0	0	0	111.6	K386 Q392 M415	K386-N388 VanDerWaalsContact C-N 3.32Å; K386-N388 PolarHBondContact O-N 3.29Å; N388-Q392 WeakPolarHBondContact O-CB 3.34Å; N388-Q392 VanDerWaalsContact O-CG 3.26Å; N388-Q392 WeakPolarHBondContact O-CG 3.42Å; N388-Q392 PolarHBondContact O-N 3.2Å; N388-Q392 VanDerWaalsContact O-N 3.07Å; N388-M415 VanDerWaalsContact CG-SD 3.51Å; N388-M415 PolarHBondContact ND2-SD 2.73Å; N388-M415 VanDerWaalsContact ND2-SD 3.37Å; N388-M415 WeakPolarHBondContact OD1-CE 3.39Å; N388-M415 PolarHBondContact OD1-SD 2.73Å; N388-M415 VanDerWaalsContact OD1-SD 3.37Å
389	K	82.2	Confident	76.6	Confident	134 Å²	134	57.5 Å²	57.5	58%	0.583	33%	0.328	S	S	*	.	H	α-helix	trans	-69.1	-40.2	176.5	-63.8	-157.3	178	-156.5	0	110.9	K386 P387 Q392 M393	K386-K389 HydrophobicContact CB-CB 4.38Å; K386-K389 PolarHBondContact O-N 3.19Å; K386-K389 VanDerWaalsContact O-N 3.08Å; P387-K389 VanDerWaalsContact C-N 3.33Å; P387-K389 PolarHBondContact O-N 3.11Å; K389-Q392 PolarHBondContact O-N 2.97Å; K389-M393 VanDerWaalsContact O-CB 3.32Å; K389-M393 WeakPolarHBondContact O-CB 3.38Å; K389-M393 WeakPolarHBondContact O-CG 3.33Å; K389-M393 PolarHBondContact O-N 2.81Å
390	L	83.3	Confident	77.1	Confident	6 Å²	6	53.7 Å²	53.7	3%	0.031	30%	0.301	C	S	.	.	H	α-helix	trans	-59.7	-48.7	175.8	-175.1	64.3	0	0	0	111.5	A222 A375 L377 K386 P387 Q392 M393 I394	A222-L390 HydrophobicContact CB-CD1 3.71Å; A375-L390 HydrophobicContact CB-CD1 4.04Å; L377-L390 HydrophobicContact CD1-CD2 4.42Å; K386-L390 PolarHBondContact O-N 3.47Å; K386-L390 VanDerWaalsContact O-N 3.13Å; P387-L390 WeakPolarHBondContact O-CB 3.21Å; P387-L390 PolarHBondContact O-N 2.83Å; L390-Q392 PolarHBondContact O-N 3.25Å; L390-M393 PolarHBondContact O-N 3.04Å; L390-I394 HydrophobicContact CD1-CD1 4.13Å; L390-I394 HydrophobicContact CG-CD1 3.97Å; L390-I394 WeakPolarHBondContact O-CD1 3.44Å; L390-I394 VanDerWaalsContact O-CG1 3.25Å; L390-I394 WeakPolarHBondContact O-CG1 3.44Å; L390-I394 PolarHBondContact O-N 3.45Å
391	I	82.7	Confident	78.1	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-60.1	-47.8	178.2	-66.8	162.8	0	0	0	110.5	L377 P387 M393 I394 T395 L402 M415 L416 R419 W421	L377-I391 HydrophobicContact CD2-CD1 4.13Å; L377-I391 HydrophobicContact CD2-CG1 4.32Å; P387-I391 WeakPolarHBondContact O-CG1 3.4Å; P387-I391 PolarHBondContact O-N 3.43Å; I391-M393 PolarHBondContact O-N 2.93Å; I391-I394 PolarHBondContact O-N 3.29Å; I391-T395 PolarHBondContact O-N 3.41Å; I391-T395 PolarHBondContact O-OG1 3.01Å; I391-L402 HydrophobicContact CG1-CD2 4.38Å; I391-M415 HydrophobicContact CD1-CB 4.48Å; I391-M415 HydrophobicContact CD1-CE 4.41Å; I391-L416 HydrophobicContact CD1-CD2 3.75Å; I391-L416 HydrophobicContact CD1-CG 4.3Å; I391-L416 HydrophobicContact CG1-CD2 3.98Å; I391-L416 HydrophobicContact CG2-CD2 4.42Å; I391-R419 HydrophobicContact CG2-CG 4.03Å; I391-W421 HydrophobicContact CG2-CZ2 4.49Å
392	Q	82	Confident	79.2	Confident	86 Å²	86	50.2 Å²	50.2	40%	0.402	28%	0.278	S	S	.	.	H	α-helix	trans	-59.9	-46	176.2	-72.9	168.9	-16.2	0	0	112.5	N388 K389 L390 I394 T395 N396	N388-Q392 WeakPolarHBondContact O-CB 3.34Å; N388-Q392 VanDerWaalsContact O-CG 3.26Å; N388-Q392 WeakPolarHBondContact O-CG 3.42Å; N388-Q392 PolarHBondContact O-N 3.2Å; N388-Q392 VanDerWaalsContact O-N 3.07Å; K389-Q392 PolarHBondContact O-N 2.97Å; L390-Q392 PolarHBondContact O-N 3.25Å; Q392-I394 PolarHBondContact O-N 2.97Å; Q392-T395 PolarHBondContact O-N 3.5Å; Q392-N396 VanDerWaalsContact O-CB 3.31Å; Q392-N396 WeakPolarHBondContact O-CB 3.3Å; Q392-N396 PolarHBondContact O-N 3.45Å; Q392-N396 PolarHBondContact O-OD1 2.91Å
393	M	81.8	Confident	80.4	Confident	71 Å²	71	46 Å²	46	35%	0.35	25%	0.249	S	C	.	.	H	α-helix	trans	-64.3	-21.9	178	-74	174.7	73.8	0	0	113.3	K389 L390 I391 N397	K389-M393 VanDerWaalsContact O-CB 3.32Å; K389-M393 WeakPolarHBondContact O-CB 3.38Å; K389-M393 WeakPolarHBondContact O-CG 3.33Å; K389-M393 PolarHBondContact O-N 2.81Å; L390-M393 PolarHBondContact O-N 3.04Å; I391-M393 PolarHBondContact O-N 2.93Å; M393-N397 PolarHBondContact O-ND2 3.34Å
394	I	82.9	Confident	81.7	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-85.8	-55.3	174.6	-67	166.8	0	0	0	109.8	A375 L390 I391 Q392 N396 N397 S400 L402 W421	A375-I394 HydrophobicContact CB-CD1 3.76Å; A375-I394 HydrophobicContact CB-CG1 4.49Å; L390-I394 HydrophobicContact CD1-CD1 4.13Å; L390-I394 HydrophobicContact CG-CD1 3.97Å; L390-I394 WeakPolarHBondContact O-CD1 3.44Å; L390-I394 VanDerWaalsContact O-CG1 3.25Å; L390-I394 WeakPolarHBondContact O-CG1 3.44Å; L390-I394 PolarHBondContact O-N 3.45Å; I391-I394 PolarHBondContact O-N 3.29Å; Q392-I394 PolarHBondContact O-N 2.97Å; I394-N396 PolarHBondContact O-N 3.38Å; I394-N396 VanDerWaalsContact O-N 3.08Å; I394-N397 PolarHBondContact O-N 2.94Å; I394-N397 VanDerWaalsContact O-O 3.07Å; I394-S400 WeakPolarHBondContact CG2-OG 3.49Å; I394-S400 PolarHBondContact O-OG 3.48Å; I394-L402 HydrophobicContact CD1-CB 3.98Å; I394-L402 HydrophobicContact CD1-CD1 3.51Å; I394-L402 HydrophobicContact CD1-CD2 4.27Å; I394-L402 HydrophobicContact CD1-CG 4.11Å; I394-L402 HydrophobicContact CG2-CB 4.24Å; I394-W421 HydrophobicContact CG2-CH2 4.34Å; I394-W421 HydrophobicContact CG2-CZ3 4.2Å
395	T	79.9	Confident	82.8	Confident	15 Å²	15	41.4 Å²	41.4	9%	0.092	23%	0.227	C	C	.	.	H	α-helix	trans	-56	-32.4	-178.5	-53.3	0	0	0	0	112.9	I391 Q392 R419	I391-T395 PolarHBondContact O-N 3.41Å; I391-T395 PolarHBondContact O-OG1 3.01Å; Q392-T395 PolarHBondContact O-N 3.5Å; T395-R419 HydrophobicContact CG2-CB 4.16Å; T395-R419 HydrophobicContact CG2-CG 4.45Å
396	N	77.9	Confident	83.7	Confident	91 Å²	91	39.1 Å²	39.1	49%	0.487	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-2.4	179.2	-63.9	20.4	0	0	0	114.4	Q392 I394	Q392-N396 VanDerWaalsContact O-CB 3.31Å; Q392-N396 WeakPolarHBondContact O-CB 3.3Å; Q392-N396 PolarHBondContact O-N 3.45Å; Q392-N396 PolarHBondContact O-OD1 2.91Å; I394-N396 PolarHBondContact O-N 3.38Å; I394-N396 VanDerWaalsContact O-N 3.08Å
397	N	75	Confident	84.3	Confident	59 Å²	59	35.6 Å²	35.6	32%	0.316	19%	0.191	S	C	.	.	S	Bend	trans	-117.5	120.4	178.1	-82.6	-76.5	0	0	0	110.5	M393 I394 S400	M393-N397 PolarHBondContact O-ND2 3.34Å; I394-N397 PolarHBondContact O-N 2.94Å; I394-N397 VanDerWaalsContact O-O 3.07Å; N397-S400 WeakPolarHBondContact O-CB 3.13Å; N397-S400 PolarHBondContact O-OG 2.83Å
398	P	72.9	Confident	84.8	Confident	67 Å²	67	35.3 Å²	35.3	44%	0.435	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	160.5	169	27.7	-33.3	0	0	0	111.1	F343 S400	F343-P398 HydrophobicContact CB-CB 4.34Å; F343-P398 HydrophobicContact CD1-CB 3.8Å; F343-P398 HydrophobicContact CD1-CG 4.05Å; F343-P398 HydrophobicContact CG-CB 4.31Å; P398-S400 PolarHBondContact O-N 3.28Å
399	G	76.2	Confident	85.2	Confident	5 Å²	5	31.2 Å²	31.2	5%	0.052	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	15.1	-178.9	0	0	0	0	0	115	L346 R373	L346-G399 PolarHBondContact O-N 3.49Å; R373-G399 PolarHBondContact N-O 3.3Å
400	S	86.5	Confident	85.7	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.007	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	140	-174.1	69.9	0	0	0	0	113.7	T349 I394 N397 P398	T349-S400 PolarHBondContact N-O 3.07Å; T349-S400 VanDerWaalsContact N-O 3.12Å; I394-S400 WeakPolarHBondContact CG2-OG 3.49Å; I394-S400 PolarHBondContact O-OG 3.48Å; N397-S400 WeakPolarHBondContact O-CB 3.13Å; N397-S400 PolarHBondContact O-OG 2.83Å; P398-S400 PolarHBondContact O-N 3.28Å
401	V	92	Very high	86	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	123.8	-179.4	175.5	0	0	0	0	110.2	T349 I351 F365 I372 R373 V374 A375 L403	T349-V401 HydrophobicContact CG2-CG2 4.31Å; T349-V401 WeakPolarHBondContact O-CA 3.26Å; I351-V401 HydrophobicContact CD1-CG1 3.63Å; I351-V401 HydrophobicContact CG1-CG1 3.95Å; F365-V401 HydrophobicContact CE1-CG2 4.43Å; F365-V401 HydrophobicContact CE2-CG1 3.99Å; F365-V401 HydrophobicContact CZ-CG1 4.03Å; F365-V401 HydrophobicContact CZ-CG2 4.28Å; I372-V401 HydrophobicContact CG2-CB 4.16Å; I372-V401 HydrophobicContact CG2-CG2 3.59Å; R373-V401 PolarHBondContact O-N 3.3Å; V374-V401 HydrophobicContact CG2-CB 4.48Å; A375-V401 PolarHBondContact N-O 3.01Å; A375-V401 VanDerWaalsContact N-O 3.14Å; V401-L403 HydrophobicContact CG1-CD2 3.98Å
402	L	92.7	Very high	86.3	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	116.7	171.3	-176.3	54.3	0	0	0	111	T349 L350 I351 A375 L377 I391 I394 L416 W421	T349-L402 PolarHBondContact O-N 3.05Å; L350-L402 HydrophobicContact CD1-CB 4.08Å; L350-L402 HydrophobicContact CD1-CD2 3.95Å; L350-L402 HydrophobicContact CD1-CG 4.02Å; I351-L402 PolarHBondContact N-O 2.91Å; A375-L402 WeakPolarHBondContact O-CD1 3.2Å; L377-L402 HydrophobicContact CB-CD1 3.57Å; L377-L402 HydrophobicContact CB-CD2 4.29Å; L377-L402 HydrophobicContact CB-CG 4.21Å; L377-L402 HydrophobicContact CD2-CD2 4.19Å; I391-L402 HydrophobicContact CG1-CD2 4.38Å; I394-L402 HydrophobicContact CD1-CB 3.98Å; I394-L402 HydrophobicContact CD1-CD1 3.51Å; I394-L402 HydrophobicContact CD1-CD2 4.27Å; I394-L402 HydrophobicContact CD1-CG 4.11Å; I394-L402 HydrophobicContact CG2-CB 4.24Å; L402-L416 HydrophobicContact CD2-CD2 4.08Å; L402-W421 HydrophobicContact CB-CH2 4.09Å; L402-W421 HydrophobicContact CB-CZ3 4.16Å; L402-W421 HydrophobicContact CD2-CH2 3.69Å; L402-W421 HydrophobicContact CD2-CZ2 4.33Å
403	L	93.6	Very high	86.6	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	126.3	169.5	-55.1	-175.7	0	0	0	109.4	I351 L358 W361 M362 F365 V374 A375 I376 L377 V401	I351-L403 HydrophobicContact CB-CD2 3.91Å; I351-L403 HydrophobicContact CD1-CD2 4.22Å; I351-L403 HydrophobicContact CG1-CD2 4.44Å; I351-L403 HydrophobicContact CG2-CD2 4.32Å; L358-L403 HydrophobicContact CD2-CB 3.89Å; W361-L403 HydrophobicContact CB-CD1 3.88Å; W361-L403 HydrophobicContact CB-CD2 4.19Å; M362-L403 HydrophobicContact CB-CD1 4.14Å; F365-L403 HydrophobicContact CE2-CD2 4.18Å; V374-L403 HydrophobicContact CG1-CD1 3.59Å; V374-L403 HydrophobicContact CG1-CD2 4.4Å; V374-L403 HydrophobicContact CG1-CG 3.74Å; A375-L403 PolarHBondContact O-N 2.85Å; I376-L403 HydrophobicContact CG1-CB 4.15Å; I376-L403 HydrophobicContact CG1-CD1 4.21Å; L377-L403 PolarHBondContact N-O 3.37Å; V401-L403 HydrophobicContact CG1-CD2 3.98Å
404	T	92.7	Very high	86.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	175.4	174.4	-160.2	0	0	0	0	112.4	L350 I351 V352 C353 L377 T408 L409	L350-T404 HydrophobicContact CD1-CG2 3.87Å; I351-T404 PolarHBondContact O-N 3.01Å; V352-T404 WeakPolarHBondContact CA-O 3.39Å; V352-T404 HydrophobicContact CG2-CG2 4.17Å; C353-T404 PolarHBondContact N-O 3.34Å; L377-T404 PolarHBondContact O-OG1 2.73Å; T404-T408 WeakPolarHBondContact OG1-CB 3.44Å; T404-L409 HydrophobicContact CG2-CB 4.44Å
405	T	92.4	Very high	86.9	Confident	2 Å²	2	39 Å²	39	1%	0.012	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	152.4	179.7	79.8	0	0	0	0	111.6	C353 A355 L358 H378 S407 T408 L409	C353-T405 WeakPolarHBondContact O-CA 3.17Å; A355-T405 HydrophobicContact CB-CG2 3.84Å; L358-T405 HydrophobicContact CD1-CG2 3.71Å; L358-T405 HydrophobicContact CD2-CG2 4.36Å; L358-T405 HydrophobicContact CG-CG2 4.24Å; H378-T405 HydrophobicContact CB-CG2 4.32Å; T405-S407 PolarHBondContact O-N 3.27Å; T405-S407 VanDerWaalsContact O-N 3.15Å; T405-S407 PolarHBondContact OG1-N 3.15Å; T405-S407 PolarHBondContact OG1-OG 2.92Å; T405-T408 PolarHBondContact O-N 2.97Å; T405-T408 WeakPolarHBondContact OG1-CB 3.26Å; T405-T408 PolarHBondContact OG1-N 3.37Å; T405-T408 PolarHBondContact OG1-OG1 2.98Å; T405-L409 WeakPolarHBondContact O-CB 3.21Å; T405-L409 PolarHBondContact O-N 3.25Å
406	Y	91.8	Very high	87.3	Confident	23 Å²	23	38.2 Å²	38.2	9%	0.09	21%	0.205	C	C	.	.	H	α-helix	trans	-51.3	-36.9	173.4	-68.8	-82.6	0	0	0	113.2	V352 V410 D427 K431 I432	V352-Y406 HydrophobicContact CG1-CD1 3.68Å; V352-Y406 HydrophobicContact CG1-CD2 4.01Å; V352-Y406 HydrophobicContact CG1-CE1 3.83Å; V352-Y406 HydrophobicContact CG1-CE2 4.15Å; V352-Y406 HydrophobicContact CG1-CG 3.78Å; Y406-V410 WeakPolarHBondContact O-CG2 3.24Å; Y406-V410 PolarHBondContact O-N 3.43Å; Y406-D427 WeakPolarHBondContact CE2-O 3.48Å; Y406-D427 PolarHBondContact OH-O 3.22Å; Y406-K431 HydrophobicContact CD1-CB 4.43Å; Y406-K431 HydrophobicContact CD2-CB 4.31Å; Y406-K431 HydrophobicContact CD2-CG 4.08Å; Y406-K431 HydrophobicContact CE1-CB 4.17Å; Y406-K431 HydrophobicContact CE2-CB 4.04Å; Y406-K431 HydrophobicContact CE2-CG 3.79Å; Y406-K431 HydrophobicContact CG-CB 4.49Å; Y406-I432 HydrophobicContact CD1-CG2 4.25Å; Y406-I432 HydrophobicContact CE1-CG2 3.83Å
407	S	90.2	Very high	87.6	Confident	79 Å²	79	35.9 Å²	35.9	55%	0.552	19%	0.194	S	C	*	.	H	α-helix	trans	-67.8	-46.4	174.3	26.3	0	0	0	0	112.8	T405 L409 V410 T411	T405-S407 PolarHBondContact O-N 3.27Å; T405-S407 VanDerWaalsContact O-N 3.15Å; T405-S407 PolarHBondContact OG1-N 3.15Å; T405-S407 PolarHBondContact OG1-OG 2.92Å; S407-L409 VanDerWaalsContact C-N 3.33Å; S407-L409 PolarHBondContact O-N 2.98Å; S407-V410 PolarHBondContact O-N 2.83Å; S407-T411 PolarHBondContact O-N 2.86Å; S407-T411 PolarHBondContact O-OG1 3.24Å
408	T	90.1	Very high	88	Confident	10 Å²	10	36.5 Å²	36.5	6%	0.061	20%	0.203	C	C	.	.	H	α-helix	trans	-69.1	-33.8	-178.8	-50.2	0	0	0	0	111.9	L377 T404 T405 V410 T411 Y412	L377-T408 HydrophobicContact CD2-CG2 4.35Å; L377-T408 HydrophobicContact CG-CG2 3.95Å; L377-T408 WeakPolarHBondContact O-CG2 3.37Å; T404-T408 WeakPolarHBondContact OG1-CB 3.44Å; T405-T408 PolarHBondContact O-N 2.97Å; T405-T408 WeakPolarHBondContact OG1-CB 3.26Å; T405-T408 PolarHBondContact OG1-N 3.37Å; T405-T408 PolarHBondContact OG1-OG1 2.98Å; T408-V410 VanDerWaalsContact C-N 3.35Å; T408-T411 PolarHBondContact O-N 3.49Å; T408-Y412 HydrophobicContact CG2-CD2 3.6Å; T408-Y412 HydrophobicContact CG2-CE2 3.79Å; T408-Y412 PolarHBondContact O-N 3.46Å
409	L	91.3	Very high	88.5	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-61	-40.9	173	-179	153.6	0	0	0	111.6	V352 T404 T405 S407 R413 L416 A442 V443 F446	V352-L409 HydrophobicContact CG1-CD1 4.16Å; V352-L409 HydrophobicContact CG2-CD1 3.57Å; T404-L409 HydrophobicContact CG2-CB 4.44Å; T405-L409 WeakPolarHBondContact O-CB 3.21Å; T405-L409 PolarHBondContact O-N 3.25Å; S407-L409 VanDerWaalsContact C-N 3.33Å; S407-L409 PolarHBondContact O-N 2.98Å; L409-R413 WeakPolarHBondContact O-CA 3.29Å; L409-R413 VanDerWaalsContact O-CB 3.27Å; L409-R413 WeakPolarHBondContact O-CB 3.39Å; L409-R413 PolarHBondContact O-N 3.34Å; L409-L416 HydrophobicContact CG-CD1 4.46Å; L409-A442 HydrophobicContact CD2-CB 3.59Å; L409-V443 HydrophobicContact CD1-CG2 3.89Å; L409-V443 HydrophobicContact CD2-CG2 3.91Å; L409-F446 HydrophobicContact CD1-CE2 3.98Å; L409-F446 HydrophobicContact CD1-CZ 4.34Å; L409-F446 HydrophobicContact CD2-CE2 4.16Å; L409-F446 HydrophobicContact CG-CE2 4.13Å; L409-F446 HydrophobicContact CG-CZ 4.44Å
410	V	91.3	Very high	88.8	Confident	38 Å²	38	38.4 Å²	38.4	23%	0.23	20%	0.202	C	C	.	.	H	α-helix	trans	-65.9	-43	174.5	173.9	0	0	0	0	111.1	Y406 S407 T408 Y412 E438 A439 A442	Y406-V410 WeakPolarHBondContact O-CG2 3.24Å; Y406-V410 PolarHBondContact O-N 3.43Å; S407-V410 PolarHBondContact O-N 2.83Å; T408-V410 VanDerWaalsContact C-N 3.35Å; V410-Y412 VanDerWaalsContact C-N 3.34Å; V410-Y412 PolarHBondContact O-N 3.4Å; V410-E438 HydrophobicContact CG1-CB 4.41Å; V410-A439 HydrophobicContact CG2-CB 3.91Å; V410-A442 HydrophobicContact CG2-CB 4.24Å
411	T	90.3	Very high	88.9	Confident	93 Å²	93	38.4 Å²	38.4	57%	0.571	20%	0.202	S	C	*	.	H	α-helix	trans	-62.8	-35.7	179.6	-53.8	0	0	0	0	113.6	S407 T408	S407-T411 PolarHBondContact O-N 2.86Å; S407-T411 PolarHBondContact O-OG1 3.24Å; T408-T411 PolarHBondContact O-N 3.49Å
412	Y	88	Confident	88.6	Confident	45 Å²	45	38.5 Å²	38.5	18%	0.176	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	21.4	-176.3	-59.3	-48.4	0	0	0	113.6	L377 Y384 P387 T408 V410 D414 M415 L416	L377-Y412 HydrophobicContact CD1-CD2 4.28Å; L377-Y412 HydrophobicContact CD1-CE2 4.29Å; L377-Y412 HydrophobicContact CD2-CD2 4.17Å; L377-Y412 HydrophobicContact CG-CD2 4.34Å; Y384-Y412 HydrophobicContact CE2-CE2 4.1Å; Y384-Y412 PolarHBondContact OH-OH 2.91Å; P387-Y412 HydrophobicContact CB-CE2 4.37Å; P387-Y412 HydrophobicContact CG-CE1 4.42Å; T408-Y412 HydrophobicContact CG2-CD2 3.6Å; T408-Y412 HydrophobicContact CG2-CE2 3.79Å; T408-Y412 PolarHBondContact O-N 3.46Å; V410-Y412 VanDerWaalsContact C-N 3.34Å; V410-Y412 PolarHBondContact O-N 3.4Å; Y412-D414 VanDerWaalsContact C-N 3.29Å; Y412-D414 PolarHBondContact O-N 3.42Å; Y412-M415 HydrophobicContact CD1-CE 3.46Å; Y412-M415 VanDerWaalsContact CD1-CE 3.46Å; Y412-M415 HydrophobicContact CE1-CE 4.18Å; Y412-M415 HydrophobicContact CG-CE 3.86Å; Y412-M415 PolarHBondContact O-N 2.85Å; Y412-L416 PolarHBondContact O-N 3.35Å
413	R	88.5	Confident	88.6	Confident	130 Å²	130	38.7 Å²	38.7	49%	0.491	20%	0.204	S	C	.	.	H	α-helix	trans	-51.7	-46.4	-172.8	76.8	-171.7	-170.5	168.2	9.1	112	L409 M415 L416 T417 A442	L409-R413 WeakPolarHBondContact O-CA 3.29Å; L409-R413 VanDerWaalsContact O-CB 3.27Å; L409-R413 WeakPolarHBondContact O-CB 3.39Å; L409-R413 PolarHBondContact O-N 3.34Å; R413-M415 VanDerWaalsContact C-N 3.28Å; R413-M415 PolarHBondContact O-N 2.71Å; R413-L416 PolarHBondContact O-N 2.94Å; R413-T417 WeakPolarHBondContact O-CB 3.3Å; R413-T417 PolarHBondContact O-N 3.48Å; R413-T417 PolarHBondContact O-OG1 2.81Å; R413-A442 HydrophobicContact CB-CB 4.23Å
414	D	85.6	Confident	88.6	Confident	105 Å²	105	38.7 Å²	38.7	56%	0.561	20%	0.204	S	C	*	.	H	α-helix	trans	-69.1	-33.2	-170	-43.8	-69.1	0	0	0	110.3	Y412 S418	Y412-D414 VanDerWaalsContact C-N 3.29Å; Y412-D414 PolarHBondContact O-N 3.42Å; D414-S418 WeakPolarHBondContact O-CB 3.42Å; D414-S418 PolarHBondContact O-N 3.23Å
415	M	85.8	Confident	88.8	Confident	54 Å²	54	38.7 Å²	38.7	27%	0.266	20%	0.204	S	C	.	.	H	α-helix	trans	-76.1	-38.2	175.4	-57.1	-167.5	-56	0	0	112.5	N388 I391 Y412 R413 S418	N388-M415 VanDerWaalsContact CG-SD 3.51Å; N388-M415 PolarHBondContact ND2-SD 2.73Å; N388-M415 VanDerWaalsContact ND2-SD 3.37Å; N388-M415 WeakPolarHBondContact OD1-CE 3.39Å; N388-M415 PolarHBondContact OD1-SD 2.73Å; N388-M415 VanDerWaalsContact OD1-SD 3.37Å; I391-M415 HydrophobicContact CD1-CB 4.48Å; I391-M415 HydrophobicContact CD1-CE 4.41Å; Y412-M415 HydrophobicContact CD1-CE 3.46Å; Y412-M415 VanDerWaalsContact CD1-CE 3.46Å; Y412-M415 HydrophobicContact CE1-CE 4.18Å; Y412-M415 HydrophobicContact CG-CE 3.86Å; Y412-M415 PolarHBondContact O-N 2.85Å; R413-M415 VanDerWaalsContact C-N 3.28Å; R413-M415 PolarHBondContact O-N 2.71Å; M415-S418 PolarHBondContact O-OG 3.41Å
416	L	88	Confident	88.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-71.7	-40.5	178.3	-68.7	170	0	0	0	112	L377 I391 L402 L409 Y412 R413 S418 R419 W421 F446	L377-L416 HydrophobicContact CD2-CD1 4.3Å; L377-L416 HydrophobicContact CD2-CD2 4.1Å; I391-L416 HydrophobicContact CD1-CD2 3.75Å; I391-L416 HydrophobicContact CD1-CG 4.3Å; I391-L416 HydrophobicContact CG1-CD2 3.98Å; I391-L416 HydrophobicContact CG2-CD2 4.42Å; L402-L416 HydrophobicContact CD2-CD2 4.08Å; L409-L416 HydrophobicContact CG-CD1 4.46Å; Y412-L416 PolarHBondContact O-N 3.35Å; R413-L416 PolarHBondContact O-N 2.94Å; L416-S418 VanDerWaalsContact C-N 3.29Å; L416-S418 PolarHBondContact O-N 3.08Å; L416-R419 PolarHBondContact O-N 3.33Å; L416-W421 HydrophobicContact CD2-CZ2 3.94Å; L416-W421 PolarHBondContact O-NE1 2.69Å; L416-F446 HydrophobicContact CB-CE1 3.93Å; L416-F446 HydrophobicContact CB-CZ 3.64Å
417	T	86	Confident	88.9	Confident	41 Å²	41	38.3 Å²	38.3	25%	0.252	20%	0.203	S	C	.	.	H	α-helix	trans	-72.4	-20.9	177.1	-55.8	0	0	0	0	112.6	R413 R419	R413-T417 WeakPolarHBondContact O-CB 3.3Å; R413-T417 PolarHBondContact O-N 3.48Å; R413-T417 PolarHBondContact O-OG1 2.81Å; T417-R419 PolarHBondContact O-N 3.45Å
418	S	82.9	Confident	88.8	Confident	73 Å²	73	35.6 Å²	35.6	51%	0.51	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-11.6	170.8	80.6	0	0	0	0	114.3	D414 M415 L416	D414-S418 WeakPolarHBondContact O-CB 3.42Å; D414-S418 PolarHBondContact O-N 3.23Å; M415-S418 PolarHBondContact O-OG 3.41Å; L416-S418 VanDerWaalsContact C-N 3.29Å; L416-S418 PolarHBondContact O-N 3.08Å
419	R	82.9	Confident	88.6	Confident	83 Å²	83	35.1 Å²	35.1	31%	0.313	18%	0.179	S	C	.	.	S	Bend	trans	-110.2	145.9	-175.9	-60.8	-69.4	148.5	172.4	-8.2	110.9	I391 T395 L416 T417 W421	I391-R419 HydrophobicContact CG2-CG 4.03Å; T395-R419 HydrophobicContact CG2-CB 4.16Å; T395-R419 HydrophobicContact CG2-CG 4.45Å; L416-R419 PolarHBondContact O-N 3.33Å; T417-R419 PolarHBondContact O-N 3.45Å; R419-W421 VanDerWaalsContact O-CD1 3.25Å
420	N	82.2	Confident	88.3	Confident	28 Å²	28	35.8 Å²	35.8	15%	0.15	18%	0.182	C	C	.	.			trans	-80.5	130.6	171.1	-64.3	-35.9	0	0	0	109	Y326 L330 R333 L335	Y326-N420 HydrophobicContact CE2-CB 4.33Å; L330-N420 HydrophobicContact CD2-CB 4.14Å; L330-N420 VanDerWaalsContact CD2-ND2 3.32Å; L330-N420 WeakPolarHBondContact CD2-ND2 3.44Å; R333-N420 PolarHBondContact NH1-OD1 3.2Å; L335-N420 WeakPolarHBondContact CD1-ND2 3.35Å
421	W	87.9	Confident	88	Confident	1 Å²	1	38.5 Å²	38.5	0%	0.004	19%	0.19	C	C	.	.			trans	-122.9	140.1	175.8	-59.7	89.5	0	0	0	108.1	P348 L350 I391 I394 L402 L416 R419 T448	P348-W421 HydrophobicContact CB-CE3 4.1Å; P348-W421 HydrophobicContact CB-CZ3 4.31Å; L350-W421 HydrophobicContact CB-CD2 3.98Å; L350-W421 HydrophobicContact CB-CE3 3.75Å; L350-W421 HydrophobicContact CB-CZ3 4.1Å; L350-W421 HydrophobicContact CD1-CH2 4.37Å; I391-W421 HydrophobicContact CG2-CZ2 4.49Å; I394-W421 HydrophobicContact CG2-CH2 4.34Å; I394-W421 HydrophobicContact CG2-CZ3 4.2Å; L402-W421 HydrophobicContact CB-CH2 4.09Å; L402-W421 HydrophobicContact CB-CZ3 4.16Å; L402-W421 HydrophobicContact CD2-CH2 3.69Å; L402-W421 HydrophobicContact CD2-CZ2 4.33Å; L416-W421 HydrophobicContact CD2-CZ2 3.94Å; L416-W421 PolarHBondContact O-NE1 2.69Å; R419-W421 VanDerWaalsContact O-CD1 3.25Å; W421-T448 HydrophobicContact CB-CG2 3.84Å; W421-T448 VanDerWaalsContact O-CG2 3.3Å; W421-T448 WeakPolarHBondContact O-CG2 3.49Å
422	S	87.4	Confident	87.9	Confident	2 Å²	2	34 Å²	34	1%	0.014	16%	0.163	C	C	.	.	S	Bend	trans	-78.2	-49.6	174.1	162.8	0	0	0	0	109.9	D323 P348 H450	D323-S422 PolarHBondContact OD2-OG 3.2Å; P348-S422 PolarHBondContact O-N 2.92Å; S422-H450 PolarHBondContact O-N 3.13Å
423	Y	91.9	Very high	87.8	Confident	4 Å²	4	35 Å²	35	2%	0.016	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	135.2	179.8	-87.2	-94.1	0	0	0	112.9	H289 L312 L316 L350 I425 H450 L452	H289-Y423 AromaticContact ND1-CE2 3.82Å; H289-Y423 AromaticContact ND1-CZ 3.7Å; H289-Y423 PolarHBondContact ND1-OH 3.26Å; L312-Y423 HydrophobicContact CD2-CE1 4.11Å; L316-Y423 HydrophobicContact CD1-CE2 3.59Å; L350-Y423 PolarHBondContact N-O 2.76Å; Y423-I425 HydrophobicContact CD1-CD1 4.19Å; Y423-I425 HydrophobicContact CD1-CG1 4.23Å; Y423-H450 HydrophobicContact CD1-CB 3.55Å; Y423-H450 HydrophobicContact CD2-CB 4.02Å; Y423-H450 HydrophobicContact CE1-CB 3.47Å; Y423-H450 VanDerWaalsContact CE1-CB 3.47Å; Y423-H450 HydrophobicContact CE2-CB 3.94Å; Y423-H450 AromaticContact CE2-CD2 3.64Å; Y423-H450 AromaticContact CE2-CG 3.84Å; Y423-H450 HydrophobicContact CG-CB 3.83Å; Y423-H450 AromaticContact CZ-CG 3.74Å; Y423-L452 HydrophobicContact CD1-CD1 4.16Å; Y423-L452 HydrophobicContact CD1-CG 4.48Å; Y423-L452 HydrophobicContact CE1-CD1 3.81Å; Y423-L452 HydrophobicContact CE1-CG 4.3Å
424	V	94.2	Very high	87.8	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.006	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.3	158.2	174	0	0	0	0	108.9	L350 L426 F446 T448 H450 L452 F472	L350-V424 HydrophobicContact CB-CG2 4.27Å; L350-V424 HydrophobicContact CD2-CG2 4.37Å; L350-V424 WeakPolarHBondContact O-CA 3.31Å; V424-L426 HydrophobicContact CG1-CD2 3.9Å; V424-L426 HydrophobicContact CG1-CG 4.48Å; V424-F446 HydrophobicContact CG2-CB 4.39Å; V424-F446 HydrophobicContact CG2-CD1 4.33Å; V424-F446 HydrophobicContact CG2-CG 4.48Å; V424-T448 HydrophobicContact CG2-CG2 3.69Å; V424-H450 PolarHBondContact N-O 2.9Å; V424-H450 VanDerWaalsContact N-O 3.08Å; V424-L452 PolarHBondContact O-N 3.41Å; V424-F472 HydrophobicContact CB-CZ 4.27Å; V424-F472 HydrophobicContact CG1-CE2 4.46Å; V424-F472 HydrophobicContact CG1-CZ 3.79Å
425	I	95.8	Very high	87.8	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	121.5	-177	-49.1	-174.8	0	0	0	109.4	I309 L313 T349 L350 I351 V352 Y423 L452 L454	I309-I425 HydrophobicContact CG2-CD1 3.55Å; I309-I425 HydrophobicContact CG2-CG2 4.49Å; L313-I425 HydrophobicContact CD1-CD1 4.29Å; T349-I425 HydrophobicContact CG2-CD1 4.41Å; L350-I425 PolarHBondContact O-N 3.01Å; I351-I425 WeakPolarHBondContact CA-O 3.47Å; I351-I425 HydrophobicContact CD1-CD1 4.49Å; I351-I425 HydrophobicContact CG1-CB 4.22Å; I351-I425 HydrophobicContact CG1-CD1 4.45Å; I351-I425 HydrophobicContact CG2-CB 4.46Å; V352-I425 PolarHBondContact N-O 2.9Å; Y423-I425 HydrophobicContact CD1-CD1 4.19Å; Y423-I425 HydrophobicContact CD1-CG1 4.23Å; I425-L452 CarbonylContact C-O 3.47Å; I425-L452 WeakPolarHBondContact CA-O 3.35Å; I425-L452 HydrophobicContact CD1-CD1 4.41Å; I425-L452 HydrophobicContact CG1-CB 4.31Å; I425-L452 HydrophobicContact CG2-CB 4.21Å; I425-L454 HydrophobicContact CG2-CD1 4.25Å; I425-L454 HydrophobicContact CG2-CG 4.29Å
426	L	95	Very high	88	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	109.6	-177.1	-53.8	-176.9	0	0	0	110.5	V352 V424 I432 V443 L452 I453 L454 F472	V352-L426 HydrophobicContact CB-CD2 3.81Å; V352-L426 HydrophobicContact CG2-CD2 3.83Å; V424-L426 HydrophobicContact CG1-CD2 3.9Å; V424-L426 HydrophobicContact CG1-CG 4.48Å; L426-I432 HydrophobicContact CD1-CD1 3.58Å; L426-I432 HydrophobicContact CD1-CG1 4.33Å; L426-V443 HydrophobicContact CD1-CG1 3.56Å; L426-V443 HydrophobicContact CD2-CG1 4.05Å; L426-V443 HydrophobicContact CD2-CG2 4.31Å; L426-V443 HydrophobicContact CG-CG1 4.43Å; L426-L452 PolarHBondContact N-O 3.21Å; L426-I453 HydrophobicContact CB-CG1 4.39Å; L426-I453 HydrophobicContact CD1-CG1 4.22Å; L426-L454 PolarHBondContact O-N 2.8Å; L426-F472 HydrophobicContact CD1-CD1 3.67Å; L426-F472 HydrophobicContact CD1-CD2 4.43Å; L426-F472 HydrophobicContact CD1-CE1 3.48Å; L426-F472 VanDerWaalsContact CD1-CE1 3.48Å; L426-F472 HydrophobicContact CD1-CE2 4.28Å; L426-F472 HydrophobicContact CD1-CG 4.14Å; L426-F472 HydrophobicContact CD1-CZ 3.81Å; L426-F472 HydrophobicContact CG-CE1 3.88Å; L426-F472 HydrophobicContact CG-CZ 4.09Å
427	D	92.6	Very high	88.1	Confident	16 Å²	16	32 Å²	32	9%	0.086	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	144.3	174.9	-173.5	30.1	0	0	0	111.8	V352 C353 W361 Y406 G429 L454	V352-D427 PolarHBondContact O-N 3.07Å; C353-D427 HydrophobicContact CB-CB 3.66Å; W361-D427 HydrophobicContact CZ2-CB 3.95Å; W361-D427 PolarHBondContact NE1-OD2 3.12Å; Y406-D427 WeakPolarHBondContact CE2-O 3.48Å; Y406-D427 PolarHBondContact OH-O 3.22Å; D427-G429 VanDerWaalsContact C-N 3.27Å; D427-G429 PolarHBondContact O-N 3.38Å; D427-L454 HydrophobicContact CB-CD1 4.4Å
428	E	87.6	Confident	88.4	Confident	22 Å²	22	36.6 Å²	36.6	10%	0.103	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.5	48.1	-168.1	-71.5	-73	-164.9	0	0	112.6	P354 H430 K431 L454 R753	P354-E428 HydrophobicContact CG-CB 4.02Å; P354-E428 HydrophobicContact CG-CG 4.21Å; E428-H430 PolarHBondContact O-N 3.28Å; E428-H430 PolarHBondContact O-ND1 2.84Å; E428-H430 IonicContact OE2-CE1 2.82Å; E428-H430 PolarHBondContact OE2-CE1 2.85Å; E428-H430 IonicContact OE2-ND1 3.86Å; E428-H430 PolarHBondContact OE2-ND1 3.5Å; E428-K431 WeakPolarHBondContact O-CG 3.47Å; E428-K431 PolarHBondContact O-N 2.9Å; E428-L454 WeakPolarHBondContact CA-O 3.18Å; E428-L454 PolarHBondContact N-O 3.49Å; E428-R753 IonicContact OE1-NH2 3.66Å
429	G	85.1	Confident	88.8	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-55.9	-10.6	-171.5	0	0	0	0	0	116.4	D427 K431 I432 L454 L469	D427-G429 VanDerWaalsContact C-N 3.27Å; D427-G429 PolarHBondContact O-N 3.38Å; G429-K431 PolarHBondContact O-N 2.62Å; G429-I432 WeakPolarHBondContact O-CG1 3.46Å; G429-I432 PolarHBondContact O-N 3.46Å; G429-L454 PolarHBondContact N-O 3.43Å; G429-L469 VanDerWaalsContact O-CD2 3.28Å; G429-L469 WeakPolarHBondContact O-CD2 3.42Å
430	H	84.7	Confident	89.2	Confident	15 Å²	15	30.4 Å²	30.4	7%	0.069	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-53.5	-11.1	162.9	78.8	-103.5	0	0	0	113.9	E428 K433 Q460 Q749	E428-H430 PolarHBondContact O-N 3.28Å; E428-H430 PolarHBondContact O-ND1 2.84Å; E428-H430 IonicContact OE2-CE1 2.82Å; E428-H430 PolarHBondContact OE2-CE1 2.85Å; E428-H430 IonicContact OE2-ND1 3.86Å; E428-H430 PolarHBondContact OE2-ND1 3.5Å; H430-K433 WeakPolarHBondContact O-CB 2.96Å; H430-K433 WeakPolarHBondContact O-CD 3.43Å; H430-K433 WeakPolarHBondContact O-CG 3.49Å; H430-Q460 PolarHBondContact CD2-NE2 3.47Å; H430-Q460 VanDerWaalsContact CD2-NE2 3.28Å; H430-Q749 PolarHBondContact CE1-NE2 2.94Å
431	K	85.5	Confident	89.7	Confident	95 Å²	95	33 Å²	33	41%	0.413	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-65.7	-39.3	168.9	-62.1	-44.8	179.2	-159	0	113.6	Y406 E428 G429 K433	Y406-K431 HydrophobicContact CD1-CB 4.43Å; Y406-K431 HydrophobicContact CD2-CB 4.31Å; Y406-K431 HydrophobicContact CD2-CG 4.08Å; Y406-K431 HydrophobicContact CE1-CB 4.17Å; Y406-K431 HydrophobicContact CE2-CB 4.04Å; Y406-K431 HydrophobicContact CE2-CG 3.79Å; Y406-K431 HydrophobicContact CG-CB 4.49Å; E428-K431 WeakPolarHBondContact O-CG 3.47Å; E428-K431 PolarHBondContact O-N 2.9Å; G429-K431 PolarHBondContact O-N 2.62Å; K431-K433 PolarHBondContact O-N 2.71Å; K431-K433 VanDerWaalsContact O-N 3.15Å
432	I	87.5	Confident	89.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-87.2	29.8	-177.2	58	151.9	0	0	0	113.5	Y406 L426 G429 T440 V443 I453 S468 L469 F472	Y406-I432 HydrophobicContact CD1-CG2 4.25Å; Y406-I432 HydrophobicContact CE1-CG2 3.83Å; L426-I432 HydrophobicContact CD1-CD1 3.58Å; L426-I432 HydrophobicContact CD1-CG1 4.33Å; G429-I432 WeakPolarHBondContact O-CG1 3.46Å; G429-I432 PolarHBondContact O-N 3.46Å; I432-T440 WeakPolarHBondContact CA-OG1 3.21Å; I432-T440 HydrophobicContact CB-CG2 4.1Å; I432-T440 PolarHBondContact O-OG1 3.02Å; I432-V443 HydrophobicContact CG2-CG2 4.47Å; I432-I453 HydrophobicContact CD1-CD1 4.16Å; I432-S468 PolarHBondContact O-OG 2.93Å; I432-L469 HydrophobicContact CD1-CD2 4.13Å; I432-L469 HydrophobicContact CG1-CD2 3.8Å; I432-F472 HydrophobicContact CD1-CB 4.2Å; I432-F472 HydrophobicContact CD1-CG 4.43Å
433	K	86.6	Confident	90.1	Very high	64 Å²	64	33.2 Å²	33.2	28%	0.278	17%	0.171	S	C	.	.			trans	-77.2	-21.5	-172.3	71	177.9	-157.2	153.5	0	115.3	H430 K431 N461 E465	H430-K433 WeakPolarHBondContact O-CB 2.96Å; H430-K433 WeakPolarHBondContact O-CD 3.43Å; H430-K433 WeakPolarHBondContact O-CG 3.49Å; K431-K433 PolarHBondContact O-N 2.71Å; K431-K433 VanDerWaalsContact O-N 3.15Å; K433-N461 PolarHBondContact NZ-ND2 3.14Å; K433-E465 HydrophobicContact CB-CB 4.03Å; K433-E465 HydrophobicContact CB-CG 4.07Å; K433-E465 HydrophobicContact CD-CG 4.35Å; K433-E465 WeakPolarHBondContact CD-OE1 3.49Å; K433-E465 WeakPolarHBondContact CE-OE1 3.42Å; K433-E465 HydrophobicContact CG-CG 4.48Å; K433-E465 IonicContact NZ-OE1 3.56Å; K433-E465 PolarHBondContact NZ-OE1 3.43Å; K433-E465 WeakPolarHBondContact O-CA 3.47Å
434	N	87.8	Confident	90	Very high	61 Å²	61	35.3 Å²	35.3	33%	0.326	18%	0.18	S	C	.	.	S	Bend	trans	-94.6	119.7	169.1	-173.6	12.2	0	0	0	108.5	E436 A437 T440	N434-E436 PolarHBondContact ND2-OE2 3.14Å; N434-E436 PolarHBondContact O-N 2.88Å; N434-E436 PolarHBondContact OD1-N 2.87Å; N434-E436 PolarHBondContact OD1-OE2 2.91Å; N434-A437 HydrophobicContact CB-CB 4.23Å; N434-A437 PolarHBondContact O-N 3.26Å; N434-T440 VanDerWaalsContact O-CB 3.26Å; N434-T440 WeakPolarHBondContact O-CB 3.37Å; N434-T440 PolarHBondContact O-OG1 2.67Å
435	P	87.4	Confident	89.8	Confident	15 Å²	15	41.5 Å²	41.5	10%	0.097	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-28.5	176.3	23.8	-35.2	0	0	0	113.6	R464 W467 L481	P435-R464 HydrophobicContact CG-CG 4.48Å; P435-W467 HydrophobicContact CB-CZ3 3.97Å; P435-L481 HydrophobicContact CG-CD2 3.95Å
436	E	88.4	Confident	89.5	Confident	115 Å²	115	41.8 Å²	41.8	54%	0.537	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-10.5	-176.7	-58.9	141.9	-166.9	0	0	114	N434 R464	N434-E436 PolarHBondContact ND2-OE2 3.14Å; N434-E436 PolarHBondContact O-N 2.88Å; N434-E436 PolarHBondContact OD1-N 2.87Å; N434-E436 PolarHBondContact OD1-OE2 2.91Å; E436-R464 IonicContact OE1-CZ 3.33Å; E436-R464 IonicContact OE1-NH1 3.37Å; E436-R464 PolarHBondContact OE1-NH1 2.89Å; E436-R464 IonicContact OE1-NH2 3.51Å; E436-R464 IonicContact OE2-NH1 2.66Å
437	A	91.1	Very high	88.9	Confident	36 Å²	36	44.5 Å²	44.5	30%	0.298	23%	0.229	S	C	.	.	S	Bend	trans	-74.2	138.1	-173.2	0	0	0	0	0	112.1	N434 A439 T440 L441	N434-A437 HydrophobicContact CB-CB 4.23Å; N434-A437 PolarHBondContact O-N 3.26Å; A437-A439 PolarHBondContact O-N 3.45Å; A437-A439 VanDerWaalsContact O-N 3.07Å; A437-T440 WeakPolarHBondContact O-CA 3.49Å; A437-T440 WeakPolarHBondContact O-CB 3.5Å; A437-T440 PolarHBondContact O-N 2.88Å; A437-L441 PolarHBondContact O-N 3.09Å
438	E	91.3	Very high	88.5	Confident	137 Å²	137	44 Å²	44	64%	0.64	23%	0.226	S	C	*	.	H	α-helix	trans	-49	-40.3	-179.9	-64.3	-179.2	165.6	0	0	113.3	V410 L441 A442	V410-E438 HydrophobicContact CG1-CB 4.41Å; E438-L441 PolarHBondContact O-N 3.08Å; E438-A442 VanDerWaalsContact O-CB 3.27Å; E438-A442 WeakPolarHBondContact O-CB 3.48Å; E438-A442 PolarHBondContact O-N 3.05Å
439	A	91.4	Very high	88.4	Confident	27 Å²	27	44 Å²	44	22%	0.223	23%	0.228	C	C	.	.	H	α-helix	trans	-68.7	-38.2	176.7	0	0	0	0	0	113.1	V410 A437 V443	V410-A439 HydrophobicContact CG2-CB 3.91Å; A437-A439 PolarHBondContact O-N 3.45Å; A437-A439 VanDerWaalsContact O-N 3.07Å; A439-V443 VanDerWaalsContact O-CB 3.26Å; A439-V443 WeakPolarHBondContact O-CB 3.25Å; A439-V443 WeakPolarHBondContact O-CG2 3.35Å; A439-V443 PolarHBondContact O-N 2.82Å
440	T	92.6	Very high	88.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66.4	-44.2	174.1	-52.7	0	0	0	0	110.7	I432 N434 A437 V443 K444	I432-T440 WeakPolarHBondContact CA-OG1 3.21Å; I432-T440 HydrophobicContact CB-CG2 4.1Å; I432-T440 PolarHBondContact O-OG1 3.02Å; N434-T440 VanDerWaalsContact O-CB 3.26Å; N434-T440 WeakPolarHBondContact O-CB 3.37Å; N434-T440 PolarHBondContact O-OG1 2.67Å; A437-T440 WeakPolarHBondContact O-CA 3.49Å; A437-T440 WeakPolarHBondContact O-CB 3.5Å; A437-T440 PolarHBondContact O-N 2.88Å; T440-V443 PolarHBondContact O-N 3.15Å; T440-K444 HydrophobicContact CG2-CD 4.15Å; T440-K444 WeakPolarHBondContact O-CB 3.48Å; T440-K444 WeakPolarHBondContact O-CG 3.35Å; T440-K444 PolarHBondContact O-N 3.25Å
441	L	91.9	Very high	89.1	Confident	82 Å²	82	45 Å²	45	43%	0.429	23%	0.231	S	C	.	.	H	α-helix	trans	-61.4	-52.8	176.8	-65.5	174.8	0	0	0	110.6	A437 E438 V443 K444 H445	A437-L441 PolarHBondContact O-N 3.09Å; E438-L441 PolarHBondContact O-N 3.08Å; L441-V443 VanDerWaalsContact C-N 3.29Å; L441-V443 PolarHBondContact O-N 2.85Å; L441-K444 PolarHBondContact O-N 2.85Å; L441-H445 PolarHBondContact O-N 2.86Å; L441-H445 VanDerWaalsContact O-N 3.1Å; L441-H445 PolarHBondContact O-ND1 3.2Å
442	A	92	Very high	89.5	Confident	7 Å²	7	40.8 Å²	40.8	6%	0.058	21%	0.213	C	C	.	.	H	α-helix	trans	-59	-39	179.4	0	0	0	0	0	112.4	L409 V410 R413 E438 H445 F446	L409-A442 HydrophobicContact CD2-CB 3.59Å; V410-A442 HydrophobicContact CG2-CB 4.24Å; R413-A442 HydrophobicContact CB-CB 4.23Å; E438-A442 VanDerWaalsContact O-CB 3.27Å; E438-A442 WeakPolarHBondContact O-CB 3.48Å; E438-A442 PolarHBondContact O-N 3.05Å; A442-H445 PolarHBondContact O-N 3.4Å; A442-F446 VanDerWaalsContact O-CD2 3.23Å; A442-F446 WeakPolarHBondContact O-CD2 3.35Å; A442-F446 WeakPolarHBondContact O-CE2 3.46Å
443	V	92.3	Very high	89.9	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.006	21%	0.213	C	C	.	.	H	α-helix	trans	-65.6	-39.4	173.7	162.5	0	0	0	0	112.4	L409 L426 I432 A439 T440 L441 H445 F446 F472	L409-V443 HydrophobicContact CD1-CG2 3.89Å; L409-V443 HydrophobicContact CD2-CG2 3.91Å; L426-V443 HydrophobicContact CD1-CG1 3.56Å; L426-V443 HydrophobicContact CD2-CG1 4.05Å; L426-V443 HydrophobicContact CD2-CG2 4.31Å; L426-V443 HydrophobicContact CG-CG1 4.43Å; I432-V443 HydrophobicContact CG2-CG2 4.47Å; A439-V443 VanDerWaalsContact O-CB 3.26Å; A439-V443 WeakPolarHBondContact O-CB 3.25Å; A439-V443 WeakPolarHBondContact O-CG2 3.35Å; A439-V443 PolarHBondContact O-N 2.82Å; T440-V443 PolarHBondContact O-N 3.15Å; L441-V443 VanDerWaalsContact C-N 3.29Å; L441-V443 PolarHBondContact O-N 2.85Å; V443-H445 VanDerWaalsContact C-N 3.3Å; V443-H445 PolarHBondContact O-N 3Å; V443-F446 PolarHBondContact O-N 3.27Å; V443-F472 HydrophobicContact CG1-CD2 3.53Å; V443-F472 HydrophobicContact CG1-CE2 3.48Å; V443-F472 VanDerWaalsContact CG1-CE2 3.48Å; V443-F472 HydrophobicContact CG1-CG 4.27Å; V443-F472 HydrophobicContact CG1-CZ 4.18Å
444	K	90.4	Very high	90.2	Very high	47 Å²	47	37.7 Å²	37.7	20%	0.204	20%	0.2	C	C	.	.	H	α-helix	trans	-72.2	-17	177.6	-73.9	-179.9	-179.9	-173.3	0	114.4	T440 L441 F446 S468 D471 F472	T440-K444 HydrophobicContact CG2-CD 4.15Å; T440-K444 WeakPolarHBondContact O-CB 3.48Å; T440-K444 WeakPolarHBondContact O-CG 3.35Å; T440-K444 PolarHBondContact O-N 3.25Å; L441-K444 PolarHBondContact O-N 2.85Å; K444-F446 PolarHBondContact O-N 3.41Å; K444-S468 WeakPolarHBondContact CE-O 3.32Å; K444-D471 VanDerWaalsContact CE-OD2 3.29Å; K444-D471 WeakPolarHBondContact CE-OD2 3.36Å; K444-D471 IonicContact NZ-OD2 3.55Å; K444-D471 PolarHBondContact NZ-OD2 3.3Å; K444-F472 HydrophobicContact CG-CB 4.46Å; K444-F472 HydrophobicContact CG-CD2 4.49Å
445	H	89.3	Confident	90.3	Very high	132 Å²	132	34.9 Å²	34.9	61%	0.611	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-11.5	172.9	-75.5	65.4	0	0	0	113.3	L441 A442 V443 S447	L441-H445 PolarHBondContact O-N 2.86Å; L441-H445 VanDerWaalsContact O-N 3.1Å; L441-H445 PolarHBondContact O-ND1 3.2Å; A442-H445 PolarHBondContact O-N 3.4Å; V443-H445 VanDerWaalsContact C-N 3.3Å; V443-H445 PolarHBondContact O-N 3Å; H445-S447 PolarHBondContact O-N 2.88Å
446	F	88.6	Confident	89.9	Confident	6 Å²	6	34.6 Å²	34.6	3%	0.026	18%	0.184	C	C	.	.			trans	-74.7	108.1	174.3	-74.6	-94.2	0	0	0	110.7	L350 L409 L416 V424 A442 V443 K444 T448	L350-F446 HydrophobicContact CD2-CD1 4.42Å; L350-F446 HydrophobicContact CD2-CE1 3.8Å; L350-F446 HydrophobicContact CD2-CZ 4.01Å; L409-F446 HydrophobicContact CD1-CE2 3.98Å; L409-F446 HydrophobicContact CD1-CZ 4.34Å; L409-F446 HydrophobicContact CD2-CE2 4.16Å; L409-F446 HydrophobicContact CG-CE2 4.13Å; L409-F446 HydrophobicContact CG-CZ 4.44Å; L416-F446 HydrophobicContact CB-CE1 3.93Å; L416-F446 HydrophobicContact CB-CZ 3.64Å; V424-F446 HydrophobicContact CG2-CB 4.39Å; V424-F446 HydrophobicContact CG2-CD1 4.33Å; V424-F446 HydrophobicContact CG2-CG 4.48Å; A442-F446 VanDerWaalsContact O-CD2 3.23Å; A442-F446 WeakPolarHBondContact O-CD2 3.35Å; A442-F446 WeakPolarHBondContact O-CE2 3.46Å; V443-F446 PolarHBondContact O-N 3.27Å; K444-F446 PolarHBondContact O-N 3.41Å; F446-T448 HydrophobicContact CB-CG2 4.5Å; F446-T448 PolarHBondContact O-N 3.41Å
447	S	82.1	Confident	89.5	Confident	57 Å²	57	29.6 Å²	29.6	40%	0.399	16%	0.162	S	C	.	.			trans	-80.9	107.1	162.5	-164.5	0	0	0	0	109	Y329 H445	Y329-S447 WeakPolarHBondContact CE2-OG 3.3Å; Y329-S447 VanDerWaalsContact CZ-O 3.28Å; Y329-S447 WeakPolarHBondContact OH-CB 3.47Å; Y329-S447 PolarHBondContact OH-O 2.75Å; H445-S447 PolarHBondContact O-N 2.88Å
448	T	85.6	Confident	88.7	Confident	6 Å²	6	28 Å²	28	4%	0.037	15%	0.149	C	C	.	.			trans	-137.9	153.3	170.3	65.1	0	0	0	0	109.9	W421 V424 F446 H450 R451	W421-T448 HydrophobicContact CB-CG2 3.84Å; W421-T448 VanDerWaalsContact O-CG2 3.3Å; W421-T448 WeakPolarHBondContact O-CG2 3.49Å; V424-T448 HydrophobicContact CG2-CG2 3.69Å; F446-T448 HydrophobicContact CB-CG2 4.5Å; F446-T448 PolarHBondContact O-N 3.41Å; T448-H450 PolarHBondContact OG1-O 2.83Å; T448-R451 PolarHBondContact O-NE 3.38Å
449	P	84.5	Confident	88.1	Confident	20 Å²	20	21.9 Å²	21.9	13%	0.13	12%	0.12	C	C	.	.	S	Bend	trans	-68.5	-51	174.3	26.3	-31.9	0	0	0	111.1	Y326	Y326-P449 HydrophobicContact CD2-CG 4.31Å
450	H	90.8	Very high	87	Confident	3 Å²	3	21 Å²	21	1%	0.014	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.2	-174.4	-51.4	-65.2	0	0	0	111.3	H289 D323 S422 Y423 V424 T448	H289-H450 AromaticContact CE1-CE1 3.66Å; H289-H450 AromaticContact CE1-NE2 3.34Å; H289-H450 PolarHBondContact CE1-NE2 2.8Å; H289-H450 VanDerWaalsContact CE1-NE2 3.34Å; H289-H450 AromaticContact CG-CE1 3.79Å; H289-H450 AromaticContact ND1-CD2 3.77Å; H289-H450 AromaticContact ND1-CE1 3.21Å; H289-H450 PolarHBondContact ND1-CE1 2.72Å; H289-H450 AromaticContact ND1-CG 3.99Å; H289-H450 AromaticContact ND1-ND1 3.68Å; H289-H450 AromaticContact ND1-NE2 3.27Å; H289-H450 PolarHBondContact ND1-NE2 3.15Å; H289-H450 PolarHBondContact O-CE1 3.15Å; D323-H450 VanDerWaalsContact CG-NE2 3.31Å; D323-H450 IonicContact OD1-CE1 3.7Å; D323-H450 IonicContact OD1-NE2 3.46Å; D323-H450 PolarHBondContact OD1-NE2 2.89Å; D323-H450 VanDerWaalsContact OD1-NE2 3.07Å; D323-H450 IonicContact OD2-CD2 2.74Å; D323-H450 PolarHBondContact OD2-CD2 3.33Å; D323-H450 VanDerWaalsContact OD2-CD2 3.24Å; D323-H450 IonicContact OD2-NE2 3.17Å; D323-H450 PolarHBondContact OD2-NE2 3.2Å; S422-H450 PolarHBondContact O-N 3.13Å; Y423-H450 HydrophobicContact CD1-CB 3.55Å; Y423-H450 HydrophobicContact CD2-CB 4.02Å; Y423-H450 HydrophobicContact CE1-CB 3.47Å; Y423-H450 VanDerWaalsContact CE1-CB 3.47Å; Y423-H450 HydrophobicContact CE2-CB 3.94Å; Y423-H450 AromaticContact CE2-CD2 3.64Å; Y423-H450 AromaticContact CE2-CG 3.84Å; Y423-H450 HydrophobicContact CG-CB 3.83Å; Y423-H450 AromaticContact CZ-CG 3.74Å; V424-H450 PolarHBondContact N-O 2.9Å; V424-H450 VanDerWaalsContact N-O 3.08Å; T448-H450 PolarHBondContact OG1-O 2.83Å
451	R	93.4	Very high	86	Confident	35 Å²	35	22.9 Å²	22.9	13%	0.132	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	104.2	-172.7	-59.6	-176	-164.9	-168.7	1.1	110.6	G294 G295 T448 F472	G294-R451 CarbonylContact C-O 3.14Å; G294-R451 WeakPolarHBondContact CA-O 3.34Å; G295-R451 PolarHBondContact N-O 2.84Å; G295-R451 VanDerWaalsContact N-O 3.08Å; T448-R451 PolarHBondContact O-NE 3.38Å; R451-F472 HydrophobicContact CB-CD1 4.41Å; R451-F472 HydrophobicContact CB-CE1 3.78Å; R451-F472 HydrophobicContact CB-CZ 4.02Å; R451-F472 WeakPolarHBondContact CD-O 3.48Å; R451-F472 HydrophobicContact CG-CE1 4.44Å; R451-F472 HydrophobicContact CG-CZ 4.2Å; R451-F472 PolarHBondContact NH1-O 2.89Å
452	L	95.2	Very high	85.4	Confident	5 Å²	5	22.3 Å²	22.3	3%	0.026	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	135.9	-175.4	-62.1	-178.4	0	0	0	111.6	L285 G295 I309 L312 Y423 V424 I425 L426	L285-L452 HydrophobicContact CD2-CD1 4.05Å; L285-L452 HydrophobicContact CD2-CD2 3.99Å; G295-L452 WeakPolarHBondContact O-CA 3.45Å; I309-L452 HydrophobicContact CD1-CD1 3.62Å; L312-L452 HydrophobicContact CD2-CD1 4.05Å; Y423-L452 HydrophobicContact CD1-CD1 4.16Å; Y423-L452 HydrophobicContact CD1-CG 4.48Å; Y423-L452 HydrophobicContact CE1-CD1 3.81Å; Y423-L452 HydrophobicContact CE1-CG 4.3Å; V424-L452 PolarHBondContact O-N 3.41Å; I425-L452 CarbonylContact C-O 3.47Å; I425-L452 WeakPolarHBondContact CA-O 3.35Å; I425-L452 HydrophobicContact CD1-CD1 4.41Å; I425-L452 HydrophobicContact CG1-CB 4.31Å; I425-L452 HydrophobicContact CG2-CB 4.21Å; L426-L452 PolarHBondContact N-O 3.21Å
453	I	94.9	Very high	85.1	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	132.9	171.1	-62.1	-174.8	0	0	0	109.9	G295 I296 I297 L426 I432 L469 F472 V473	G295-I453 PolarHBondContact O-N 3.23Å; I296-I453 CarbonylContact C-O 3.59Å; I296-I453 WeakPolarHBondContact CA-O 3.44Å; I296-I453 HydrophobicContact CG1-CB 4.18Å; I296-I453 HydrophobicContact CG2-CB 4.25Å; I296-I453 HydrophobicContact CG2-CG2 4.21Å; I297-I453 PolarHBondContact N-O 3.43Å; L426-I453 HydrophobicContact CB-CG1 4.39Å; L426-I453 HydrophobicContact CD1-CG1 4.22Å; I432-I453 HydrophobicContact CD1-CD1 4.16Å; I453-L469 HydrophobicContact CD1-CB 3.97Å; I453-L469 HydrophobicContact CD1-CD2 4.16Å; I453-F472 HydrophobicContact CD1-CD1 3.91Å; I453-F472 HydrophobicContact CG1-CD1 3.92Å; I453-F472 HydrophobicContact CG1-CE1 4.26Å; I453-V473 HydrophobicContact CB-CG2 4.48Å; I453-V473 HydrophobicContact CD1-CG2 3.49Å; I453-V473 VanDerWaalsContact CD1-CG2 3.49Å; I453-V473 HydrophobicContact CG1-CG2 3.69Å
454	L	93.9	Very high	84.9	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.3	169.2	-45.4	178.2	0	0	0	108.9	I297 K305 I309 W361 I425 L426 D427 E428 G429	I297-L454 HydrophobicContact CB-CD2 3.93Å; I297-L454 HydrophobicContact CD1-CD2 3.56Å; I297-L454 HydrophobicContact CG1-CD2 3.8Å; K305-L454 HydrophobicContact CD-CB 4.35Å; I309-L454 HydrophobicContact CD1-CD2 4.05Å; I309-L454 HydrophobicContact CG1-CD1 4.05Å; I309-L454 HydrophobicContact CG1-CD2 3.76Å; I309-L454 HydrophobicContact CG1-CG 4.48Å; W361-L454 HydrophobicContact CH2-CD1 3.71Å; W361-L454 HydrophobicContact CZ2-CD1 3.67Å; I425-L454 HydrophobicContact CG2-CD1 4.25Å; I425-L454 HydrophobicContact CG2-CG 4.29Å; L426-L454 PolarHBondContact O-N 2.8Å; D427-L454 HydrophobicContact CB-CD1 4.4Å; E428-L454 WeakPolarHBondContact CA-O 3.18Å; E428-L454 PolarHBondContact N-O 3.49Å; G429-L454 PolarHBondContact N-O 3.43Å
455	S	88.8	Confident	84.8	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.007	13%	0.127	C	C	.	.			trans	-152.2	133.5	173.9	-172.1	0	0	0	0	111.6	I297 G298 S457	I297-S455 PolarHBondContact O-N 3.24Å; G298-S455 CarbonylContact C-O 3.59Å; G298-S455 WeakPolarHBondContact CA-O 3.41Å; S455-S457 PolarHBondContact O-N 3.05Å; S455-S457 PolarHBondContact OG-N 2.82Å; S455-S457 VanDerWaalsContact OG-N 3.1Å; S455-S457 PolarHBondContact OG-O 3.15Å
456	G	80.4	Confident	84.7	Confident	9 Å²	9	18.6 Å²	18.6	9%	0.093	10%	0.098	C	C	.	.	S	Bend	trans	-71	-11.8	166.5	0	0	0	0	0	113.8	D299	D299-G456 WeakPolarHBondContact O-CA 3.31Å
457	S	80	Confident	84.8	Confident	10 Å²	10	19.3 Å²	19.3	7%	0.07	10%	0.101	C	C	.	.			trans	-152	85.1	-171.6	57.1	0	0	0	0	109.6	S455 I459 T745	S455-S457 PolarHBondContact O-N 3.05Å; S455-S457 PolarHBondContact OG-N 2.82Å; S455-S457 VanDerWaalsContact OG-N 3.1Å; S455-S457 PolarHBondContact OG-O 3.15Å; S457-I459 PolarHBondContact O-N 3.24Å; S457-T745 WeakPolarHBondContact OG-CG2 3.5Å
458	P	74.3	Confident	85.3	Confident	4 Å²	4	16.6 Å²	16.6	3%	0.026	8%	0.082	C	C	.	.	S	Bend	trans	-68.2	-13	-178.5	25.8	-34	0	0	0	114	L469 L523 L793	P458-L469 VanDerWaalsContact O-CD1 3.27Å; P458-L469 WeakPolarHBondContact O-CD1 3.15Å; P458-L523 HydrophobicContact CB-CD1 4.44Å; P458-L523 HydrophobicContact CG-CD1 4.43Å; P458-L793 HydrophobicContact CG-CD1 3.87Å
459	I	77.3	Confident	85.5	Confident	7 Å²	7	16.5 Å²	16.5	4%	0.036	8%	0.081	C	C	.	.			trans	-133.1	144.6	171.7	-53.2	174.3	0	0	0	107.4	S457 L466 T789 I792 L793	S457-I459 PolarHBondContact O-N 3.24Å; I459-L466 HydrophobicContact CD1-CD1 4.31Å; I459-L466 HydrophobicContact CD1-CD2 3.85Å; I459-L466 HydrophobicContact CG1-CB 4.3Å; I459-L466 HydrophobicContact CG1-CD1 3.92Å; I459-L466 HydrophobicContact CG1-CD2 4.25Å; I459-L466 HydrophobicContact CG1-CG 4.4Å; I459-T789 HydrophobicContact CB-CG2 4.07Å; I459-I792 HydrophobicContact CD1-CB 4.22Å; I459-I792 HydrophobicContact CD1-CD1 3.91Å; I459-I792 HydrophobicContact CD1-CG2 4.07Å; I459-L793 HydrophobicContact CD1-CD1 3.72Å; I459-L793 HydrophobicContact CD1-CD2 4.27Å; I459-L793 HydrophobicContact CD1-CG 3.84Å; I459-L793 HydrophobicContact CG1-CD1 4.05Å
460	Q	68.1	Low	85.8	Confident	10 Å²	10	15.9 Å²	15.9	5%	0.047	8%	0.076	C	C	.	.	S	Bend	trans	-121.2	-47.3	173.9	-59.9	-168.5	-24.4	0	0	113.2	H430 E465 N743 T745	H430-Q460 PolarHBondContact CD2-NE2 3.47Å; H430-Q460 VanDerWaalsContact CD2-NE2 3.28Å; Q460-E465 WeakPolarHBondContact CB-OE2 3.48Å; Q460-E465 PolarHBondContact N-OE2 3.12Å; Q460-E465 VanDerWaalsContact N-OE2 3.15Å; Q460-N743 PolarHBondContact OE1-ND2 3.48Å; Q460-T745 HydrophobicContact CG-CG2 4.14Å
461	N	71.6	Confident	85.8	Confident	38 Å²	38	17.6 Å²	17.6	20%	0.203	9%	0.086	C	C	.	.	S	Bend	trans	-138.4	-36.8	-168.8	-53.5	-93.1	0	0	0	113.6	K433 E465 K785	K433-N461 PolarHBondContact NZ-ND2 3.14Å; N461-E465 PolarHBondContact N-OE2 2.8Å; N461-E465 PolarHBondContact ND2-OE1 2.85Å; N461-K785 WeakPolarHBondContact OD1-CD 3.24Å; N461-K785 VanDerWaalsContact OD1-CE 3.32Å; N461-K785 WeakPolarHBondContact OD1-CE 3.28Å; N461-K785 PolarHBondContact OD1-NZ 3.35Å
462	N	80.6	Confident	85.7	Confident	70 Å²	70	16 Å²	16	37%	0.374	8%	0.079	S	C	.	.			trans	-152.5	148.8	-165.2	-162.5	-5	0	0	0	112.9	R464 E465	N462-R464 VanDerWaalsContact C-N 3.28Å; N462-R464 PolarHBondContact O-N 2.91Å; N462-E465 HydrophobicContact CB-CG 4.49Å; N462-E465 PolarHBondContact N-OE2 2.71Å; N462-E465 VanDerWaalsContact N-OE2 3.15Å; N462-E465 VanDerWaalsContact O-CB 3.24Å; N462-E465 WeakPolarHBondContact O-CB 3.48Å; N462-E465 PolarHBondContact O-N 3.07Å
463	L	84.9	Confident	85.5	Confident	7 Å²	7	15.9 Å²	15.9	4%	0.037	8%	0.079	C	C	.	.	H	α-helix	trans	-65	-26.4	-179.8	-85.8	165	0	0	0	113.6	E465 L466 W467 F484 I492 L515 I792	L463-E465 PolarHBondContact O-N 3.49Å; L463-L466 HydrophobicContact CD2-CD2 3.79Å; L463-L466 WeakPolarHBondContact O-CB 3.27Å; L463-L466 PolarHBondContact O-N 3.2Å; L463-L466 VanDerWaalsContact O-N 3.09Å; L463-W467 PolarHBondContact O-N 3.3Å; L463-W467 VanDerWaalsContact O-N 3.14Å; L463-F484 HydrophobicContact CB-CE1 4.17Å; L463-F484 HydrophobicContact CB-CZ 4.43Å; L463-F484 HydrophobicContact CD2-CZ 4.35Å; L463-F484 WeakPolarHBondContact O-CE1 3.29Å; L463-I492 HydrophobicContact CD1-CB 3.94Å; L463-I492 HydrophobicContact CD1-CD1 3.92Å; L463-I492 HydrophobicContact CD1-CG2 3.97Å; L463-L515 HydrophobicContact CD2-CD2 3.73Å; L463-I792 HydrophobicContact CD1-CD1 4.23Å; L463-I792 HydrophobicContact CD2-CD1 3.58Å; L463-I792 HydrophobicContact CD2-CG1 4.39Å; L463-I792 HydrophobicContact CG-CD1 3.86Å
464	R	88.2	Confident	85.1	Confident	82 Å²	82	16.8 Å²	16.8	31%	0.309	9%	0.085	S	C	.	.	H	α-helix	trans	-55.1	-34.3	168.1	179.5	-175.4	-106.5	-137.2	-2.3	112.6	P435 E436 N462 S468 L481 M485	P435-R464 HydrophobicContact CG-CG 4.48Å; E436-R464 IonicContact OE1-CZ 3.33Å; E436-R464 IonicContact OE1-NH1 3.37Å; E436-R464 PolarHBondContact OE1-NH1 2.89Å; E436-R464 IonicContact OE1-NH2 3.51Å; E436-R464 IonicContact OE2-NH1 2.66Å; N462-R464 VanDerWaalsContact C-N 3.28Å; N462-R464 PolarHBondContact O-N 2.91Å; R464-S468 PolarHBondContact O-N 3.35Å; R464-L481 HydrophobicContact CG-CD1 4.08Å; R464-L481 HydrophobicContact CG-CD2 4.42Å; R464-M485 HydrophobicContact CB-SD 4.05Å
465	E	87.4	Confident	84.7	Confident	20 Å²	20	20.3 Å²	20.3	9%	0.093	11%	0.108	C	C	.	.	H	α-helix	trans	-66.2	-40.3	177.4	-59.4	175.2	144.9	0	0	111	K433 Q460 N461 N462 L463 S468 L469	K433-E465 HydrophobicContact CB-CB 4.03Å; K433-E465 HydrophobicContact CB-CG 4.07Å; K433-E465 HydrophobicContact CD-CG 4.35Å; K433-E465 WeakPolarHBondContact CD-OE1 3.49Å; K433-E465 WeakPolarHBondContact CE-OE1 3.42Å; K433-E465 HydrophobicContact CG-CG 4.48Å; K433-E465 IonicContact NZ-OE1 3.56Å; K433-E465 PolarHBondContact NZ-OE1 3.43Å; K433-E465 WeakPolarHBondContact O-CA 3.47Å; Q460-E465 WeakPolarHBondContact CB-OE2 3.48Å; Q460-E465 PolarHBondContact N-OE2 3.12Å; Q460-E465 VanDerWaalsContact N-OE2 3.15Å; N461-E465 PolarHBondContact N-OE2 2.8Å; N461-E465 PolarHBondContact ND2-OE1 2.85Å; N462-E465 HydrophobicContact CB-CG 4.49Å; N462-E465 PolarHBondContact N-OE2 2.71Å; N462-E465 VanDerWaalsContact N-OE2 3.15Å; N462-E465 VanDerWaalsContact O-CB 3.24Å; N462-E465 WeakPolarHBondContact O-CB 3.48Å; N462-E465 PolarHBondContact O-N 3.07Å; L463-E465 PolarHBondContact O-N 3.49Å; E465-S468 WeakPolarHBondContact O-CB 3.34Å; E465-S468 PolarHBondContact O-N 2.94Å; E465-L469 PolarHBondContact O-N 3.4Å
466	L	88.4	Confident	84.4	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66.5	-44.9	179.6	-174.6	62.2	0	0	0	111.8	I459 L463 S468 L469 F470 L515 L519 I792	I459-L466 HydrophobicContact CD1-CD1 4.31Å; I459-L466 HydrophobicContact CD1-CD2 3.85Å; I459-L466 HydrophobicContact CG1-CB 4.3Å; I459-L466 HydrophobicContact CG1-CD1 3.92Å; I459-L466 HydrophobicContact CG1-CD2 4.25Å; I459-L466 HydrophobicContact CG1-CG 4.4Å; L463-L466 HydrophobicContact CD2-CD2 3.79Å; L463-L466 WeakPolarHBondContact O-CB 3.27Å; L463-L466 PolarHBondContact O-N 3.2Å; L463-L466 VanDerWaalsContact O-N 3.09Å; L466-S468 VanDerWaalsContact C-N 3.27Å; L466-S468 PolarHBondContact O-N 2.8Å; L466-L469 PolarHBondContact O-N 3.08Å; L466-F470 HydrophobicContact CD1-CD2 3.87Å; L466-F470 HydrophobicContact CD1-CE2 3.7Å; L466-F470 HydrophobicContact CG-CD2 4.21Å; L466-F470 HydrophobicContact CG-CE2 4.38Å; L466-F470 PolarHBondContact O-N 2.79Å; L466-F470 VanDerWaalsContact O-N 3.1Å; L466-L515 HydrophobicContact CD2-CD2 4.48Å; L466-L519 HydrophobicContact CD1-CD1 4.46Å; L466-L519 HydrophobicContact CD2-CD1 3.66Å; L466-L519 HydrophobicContact CG-CD1 4.26Å; L466-I792 HydrophobicContact CD2-CG2 4.48Å
467	W	91.4	Very high	84.7	Confident	22 Å²	22	29.9 Å²	29.9	8%	0.083	16%	0.159	C	C	.	.	H	α-helix	trans	-56.8	-42.1	174.2	-179.2	90.6	0	0	0	111.5	P435 L463 L469 F470 D471 G479 L481 F484	P435-W467 HydrophobicContact CB-CZ3 3.97Å; L463-W467 PolarHBondContact O-N 3.3Å; L463-W467 VanDerWaalsContact O-N 3.14Å; W467-L469 VanDerWaalsContact C-N 3.28Å; W467-L469 PolarHBondContact O-N 2.92Å; W467-F470 PolarHBondContact O-N 3.47Å; W467-D471 HydrophobicContact CD2-CB 4.42Å; W467-D471 HydrophobicContact CE3-CB 4.44Å; W467-D471 HydrophobicContact CH2-CB 4.1Å; W467-D471 HydrophobicContact CZ2-CB 4.1Å; W467-D471 HydrophobicContact CZ3-CB 4.29Å; W467-D471 VanDerWaalsContact O-CB 3.32Å; W467-D471 WeakPolarHBondContact O-CB 3.42Å; W467-D471 PolarHBondContact O-N 3.04Å; W467-G479 PolarHBondContact NE1-O 2.84Å; W467-L481 HydrophobicContact CB-CD1 4.35Å; W467-L481 HydrophobicContact CD2-CB 4.03Å; W467-L481 HydrophobicContact CD2-CD1 3.81Å; W467-L481 HydrophobicContact CD2-CG 4.47Å; W467-L481 HydrophobicContact CE3-CB 3.96Å; W467-L481 HydrophobicContact CE3-CD1 3.77Å; W467-L481 HydrophobicContact CE3-CD2 4.38Å; W467-L481 HydrophobicContact CE3-CG 4.24Å; W467-L481 HydrophobicContact CG-CD1 4.06Å; W467-L481 HydrophobicContact CH2-CB 3.86Å; W467-L481 HydrophobicContact CZ2-CB 3.89Å; W467-L481 HydrophobicContact CZ3-CB 3.88Å; W467-L481 HydrophobicContact CZ3-CD1 4.46Å; W467-L481 HydrophobicContact CZ3-CD2 4.35Å; W467-L481 HydrophobicContact CZ3-CG 4.45Å; W467-F484 HydrophobicContact CB-CD1 3.75Å; W467-F484 HydrophobicContact CB-CE1 3.73Å; W467-F484 HydrophobicContact CB-CG 4.24Å; W467-F484 HydrophobicContact CB-CZ 4.2Å; W467-F484 AromaticContact CD1-CD1 3.83Å; W467-F484 AromaticContact CD1-CD2 3.86Å; W467-F484 AromaticContact CD1-CG 3.46Å; W467-F484 VanDerWaalsContact CD1-CG 3.46Å; W467-F484 HydrophobicContact CG-CB 4.44Å; W467-F484 AromaticContact CG-CD1 3.98Å; W467-F484 HydrophobicContact CG-CD1 3.98Å; W467-F484 HydrophobicContact CG-CE1 4.45Å; W467-F484 HydrophobicContact CG-CG 4.09Å
468	S	90.7	Very high	85	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.4	-34.6	179.1	-164.1	0	0	0	0	113.5	I432 K444 R464 E465 L466	I432-S468 PolarHBondContact O-OG 2.93Å; K444-S468 WeakPolarHBondContact CE-O 3.32Å; R464-S468 PolarHBondContact O-N 3.35Å; E465-S468 WeakPolarHBondContact O-CB 3.34Å; E465-S468 PolarHBondContact O-N 2.94Å; L466-S468 VanDerWaalsContact C-N 3.27Å; L466-S468 PolarHBondContact O-N 2.8Å
469	L	90.9	Very high	85.6	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-72.1	-47.7	174.6	-57.4	-175.4	0	0	0	111.6	I296 G429 I432 I453 P458 E465 L466 W467 D471 F472 V473	I296-L469 HydrophobicContact CD1-CB 4.08Å; G429-L469 VanDerWaalsContact O-CD2 3.28Å; G429-L469 WeakPolarHBondContact O-CD2 3.42Å; I432-L469 HydrophobicContact CD1-CD2 4.13Å; I432-L469 HydrophobicContact CG1-CD2 3.8Å; I453-L469 HydrophobicContact CD1-CB 3.97Å; I453-L469 HydrophobicContact CD1-CD2 4.16Å; P458-L469 VanDerWaalsContact O-CD1 3.27Å; P458-L469 WeakPolarHBondContact O-CD1 3.15Å; E465-L469 PolarHBondContact O-N 3.4Å; L466-L469 PolarHBondContact O-N 3.08Å; W467-L469 VanDerWaalsContact C-N 3.28Å; W467-L469 PolarHBondContact O-N 2.92Å; L469-D471 PolarHBondContact O-N 3.09Å; L469-F472 PolarHBondContact O-N 3.38Å; L469-V473 WeakPolarHBondContact O-CG2 3.28Å; L469-V473 PolarHBondContact O-N 2.85Å
470	F	90.4	Very high	86.2	Confident	8 Å²	8	34.5 Å²	34.5	4%	0.035	19%	0.192	C	C	.	.	H	α-helix	trans	-68.6	-32.8	-176.3	-89.9	-94.3	0	0	0	113.2	I296 L466 W467 F472 V473 C474 L478 L519 L523	I296-F470 HydrophobicContact CD1-CD2 3.79Å; I296-F470 HydrophobicContact CD1-CE2 3.44Å; I296-F470 VanDerWaalsContact CD1-CE2 3.44Å; I296-F470 HydrophobicContact CD1-CG 4.47Å; I296-F470 HydrophobicContact CD1-CZ 3.86Å; L466-F470 HydrophobicContact CD1-CD2 3.87Å; L466-F470 HydrophobicContact CD1-CE2 3.7Å; L466-F470 HydrophobicContact CG-CD2 4.21Å; L466-F470 HydrophobicContact CG-CE2 4.38Å; L466-F470 PolarHBondContact O-N 2.79Å; L466-F470 VanDerWaalsContact O-N 3.1Å; W467-F470 PolarHBondContact O-N 3.47Å; F470-F472 VanDerWaalsContact C-N 3.29Å; F470-F472 PolarHBondContact O-N 3.27Å; F470-V473 PolarHBondContact O-N 3.11Å; F470-V473 VanDerWaalsContact O-N 3.17Å; F470-C474 CarbonylContact O-C 3.55Å; F470-C474 PolarHBondContact O-N 3.26Å; F470-L478 HydrophobicContact CB-CD1 3.52Å; F470-L478 HydrophobicContact CB-CG 4.42Å; F470-L478 HydrophobicContact CD1-CD1 4.5Å; F470-L478 HydrophobicContact CG-CD1 4.04Å; F470-L519 HydrophobicContact CD1-CD2 3.57Å; F470-L519 HydrophobicContact CD2-CD2 3.92Å; F470-L519 HydrophobicContact CE1-CB 4.07Å; F470-L519 HydrophobicContact CE1-CD2 3.38Å; F470-L519 HydrophobicContact CE1-CG 4.23Å; F470-L519 HydrophobicContact CE2-CB 4.45Å; F470-L519 HydrophobicContact CE2-CD1 4.21Å; F470-L519 HydrophobicContact CE2-CD2 3.76Å; F470-L519 HydrophobicContact CE2-CG 4.32Å; F470-L519 HydrophobicContact CG-CD2 3.83Å; F470-L519 HydrophobicContact CZ-CB 3.73Å; F470-L519 HydrophobicContact CZ-CD1 4.3Å; F470-L519 HydrophobicContact CZ-CD2 3.48Å; F470-L519 VanDerWaalsContact CZ-CD2 3.48Å; F470-L519 HydrophobicContact CZ-CG 3.98Å; F470-L523 HydrophobicContact CZ-CB 4.05Å
471	D	91.7	Very high	87.3	Confident	39 Å²	39	35.2 Å²	35.2	21%	0.209	20%	0.196	C	C	.	.	H	α-helix	trans	-65.8	-28	174.4	-177.5	53.9	0	0	0	113.1	K444 W467 L469 P475	K444-D471 VanDerWaalsContact CE-OD2 3.29Å; K444-D471 WeakPolarHBondContact CE-OD2 3.36Å; K444-D471 IonicContact NZ-OD2 3.55Å; K444-D471 PolarHBondContact NZ-OD2 3.3Å; W467-D471 HydrophobicContact CD2-CB 4.42Å; W467-D471 HydrophobicContact CE3-CB 4.44Å; W467-D471 HydrophobicContact CH2-CB 4.1Å; W467-D471 HydrophobicContact CZ2-CB 4.1Å; W467-D471 HydrophobicContact CZ3-CB 4.29Å; W467-D471 VanDerWaalsContact O-CB 3.32Å; W467-D471 WeakPolarHBondContact O-CB 3.42Å; W467-D471 PolarHBondContact O-N 3.04Å; L469-D471 PolarHBondContact O-N 3.09Å; D471-P475 WeakPolarHBondContact O-CA 3.45Å; D471-P475 WeakPolarHBondContact O-CB 3.47Å
472	F	91.4	Very high	88.2	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-70.8	-46.1	168.1	172	-102.4	0	0	0	111.8	V424 L426 I432 V443 K444 R451 I453 L469 F470	V424-F472 HydrophobicContact CB-CZ 4.27Å; V424-F472 HydrophobicContact CG1-CE2 4.46Å; V424-F472 HydrophobicContact CG1-CZ 3.79Å; L426-F472 HydrophobicContact CD1-CD1 3.67Å; L426-F472 HydrophobicContact CD1-CD2 4.43Å; L426-F472 HydrophobicContact CD1-CE1 3.48Å; L426-F472 VanDerWaalsContact CD1-CE1 3.48Å; L426-F472 HydrophobicContact CD1-CE2 4.28Å; L426-F472 HydrophobicContact CD1-CG 4.14Å; L426-F472 HydrophobicContact CD1-CZ 3.81Å; L426-F472 HydrophobicContact CG-CE1 3.88Å; L426-F472 HydrophobicContact CG-CZ 4.09Å; I432-F472 HydrophobicContact CD1-CB 4.2Å; I432-F472 HydrophobicContact CD1-CG 4.43Å; V443-F472 HydrophobicContact CG1-CD2 3.53Å; V443-F472 HydrophobicContact CG1-CE2 3.48Å; V443-F472 VanDerWaalsContact CG1-CE2 3.48Å; V443-F472 HydrophobicContact CG1-CG 4.27Å; V443-F472 HydrophobicContact CG1-CZ 4.18Å; K444-F472 HydrophobicContact CG-CB 4.46Å; K444-F472 HydrophobicContact CG-CD2 4.49Å; R451-F472 HydrophobicContact CB-CD1 4.41Å; R451-F472 HydrophobicContact CB-CE1 3.78Å; R451-F472 HydrophobicContact CB-CZ 4.02Å; R451-F472 WeakPolarHBondContact CD-O 3.48Å; R451-F472 HydrophobicContact CG-CE1 4.44Å; R451-F472 HydrophobicContact CG-CZ 4.2Å; R451-F472 PolarHBondContact NH1-O 2.89Å; I453-F472 HydrophobicContact CD1-CD1 3.91Å; I453-F472 HydrophobicContact CG1-CD1 3.92Å; I453-F472 HydrophobicContact CG1-CE1 4.26Å; L469-F472 PolarHBondContact O-N 3.38Å; F470-F472 VanDerWaalsContact C-N 3.29Å; F470-F472 PolarHBondContact O-N 3.27Å
473	V	90.5	Very high	88.7	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.024	22%	0.218	C	C	.	.	H	α-helix	trans	-72.1	-49.3	-170.1	172.7	0	0	0	0	112.8	I296 I453 L469 F470	I296-V473 HydrophobicContact CD1-CG2 4.3Å; I296-V473 HydrophobicContact CG1-CG2 3.87Å; I453-V473 HydrophobicContact CB-CG2 4.48Å; I453-V473 HydrophobicContact CD1-CG2 3.49Å; I453-V473 VanDerWaalsContact CD1-CG2 3.49Å; I453-V473 HydrophobicContact CG1-CG2 3.69Å; L469-V473 WeakPolarHBondContact O-CG2 3.28Å; L469-V473 PolarHBondContact O-N 2.85Å; F470-V473 PolarHBondContact O-N 3.11Å; F470-V473 VanDerWaalsContact O-N 3.17Å
474	C	87.2	Confident	89.1	Confident	18 Å²	18	38.5 Å²	38.5	12%	0.122	22%	0.216	C	C	.	.	S	Bend	trans	-136.8	76	-178.5	-74.1	0	0	0	0	108.5	F470 R477	F470-C474 CarbonylContact O-C 3.55Å; F470-C474 PolarHBondContact O-N 3.26Å; C474-R477 HydrophobicContact CB-CB 4.05Å; C474-R477 WeakPolarHBondContact O-CB 3.39Å; C474-R477 PolarHBondContact O-N 3.03Å
475	P	85.4	Confident	89.2	Confident	75 Å²	75	36.6 Å²	36.6	49%	0.487	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	140.4	-175.8	22.3	-34.4	0	0	0	112	D471 R477	D471-P475 WeakPolarHBondContact O-CA 3.45Å; D471-P475 WeakPolarHBondContact O-CB 3.47Å; P475-R477 PolarHBondContact O-N 2.69Å
476	G	81.9	Confident	89.3	Confident	57 Å²	57	42.7 Å²	42.7	59%	0.588	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.8	-17.7	-179.2	0	0	0	0	0	116.3	L478 G479	G476-L478 PolarHBondContact O-N 3.48Å; G476-L478 VanDerWaalsContact O-N 3.14Å; G476-G479 PolarHBondContact O-N 2.88Å
477	R	85.6	Confident	89.4	Confident	154 Å²	154	47 Å²	47	58%	0.581	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-21.1	-173.8	-174.2	56.1	177.8	-168.6	1.2	115	C474 P475	C474-R477 HydrophobicContact CB-CB 4.05Å; C474-R477 WeakPolarHBondContact O-CB 3.39Å; C474-R477 PolarHBondContact O-N 3.03Å; P475-R477 PolarHBondContact O-N 2.69Å
478	L	86.2	Confident	89.3	Confident	21 Å²	21	46.9 Å²	46.9	11%	0.11	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	11	176.4	-63.7	-179	0	0	0	113.5	F470 G476 F484 L515 L519	F470-L478 HydrophobicContact CB-CD1 3.52Å; F470-L478 HydrophobicContact CB-CG 4.42Å; F470-L478 HydrophobicContact CD1-CD1 4.5Å; F470-L478 HydrophobicContact CG-CD1 4.04Å; G476-L478 PolarHBondContact O-N 3.48Å; G476-L478 VanDerWaalsContact O-N 3.14Å; L478-F484 HydrophobicContact CB-CD2 4.3Å; L478-F484 HydrophobicContact CD1-CD2 4.44Å; L478-F484 HydrophobicContact CD1-CE2 4.23Å; L478-L515 HydrophobicContact CD2-CD1 4.45Å; L478-L519 HydrophobicContact CD1-CD2 4.06Å; L478-L519 HydrophobicContact CD2-CD2 4.13Å
479	G	87.4	Confident	89.1	Confident	23 Å²	23	47 Å²	47	24%	0.237	26%	0.261	C	S	.	.			trans	65.5	-179.1	-172	0	0	0	0	0	113.9	W467 G476	W467-G479 PolarHBondContact NE1-O 2.84Å; G476-G479 PolarHBondContact O-N 2.88Å
480	P	90.9	Very high	88.9	Confident	73 Å²	73	51 Å²	51	47%	0.474	28%	0.281	S	S	.	.			trans	-70.1	153	177.1	31.4	-36.2	0	0	0	112	P482 E483 F484	P480-P482 VanDerWaalsContact C-CD 3.47Å; P480-E483 WeakPolarHBondContact CD-OE2 3.39Å; P480-E483 HydrophobicContact CG-CB 4.07Å; P480-E483 PolarHBondContact O-N 2.98Å; P480-E483 VanDerWaalsContact O-N 3.13Å; P480-F484 PolarHBondContact O-N 3.01Å; P480-F484 VanDerWaalsContact O-N 3.16Å
481	L	90.2	Very high	88.9	Confident	25 Å²	25	51.9 Å²	51.9	13%	0.131	29%	0.288	C	S	.	.	H	α-helix	trans	-52	-42.8	-174.3	177.8	61.3	0	0	0	115.5	P435 R464 W467 E483 F484 M485	P435-L481 HydrophobicContact CG-CD2 3.95Å; R464-L481 HydrophobicContact CG-CD1 4.08Å; R464-L481 HydrophobicContact CG-CD2 4.42Å; W467-L481 HydrophobicContact CB-CD1 4.35Å; W467-L481 HydrophobicContact CD2-CB 4.03Å; W467-L481 HydrophobicContact CD2-CD1 3.81Å; W467-L481 HydrophobicContact CD2-CG 4.47Å; W467-L481 HydrophobicContact CE3-CB 3.96Å; W467-L481 HydrophobicContact CE3-CD1 3.77Å; W467-L481 HydrophobicContact CE3-CD2 4.38Å; W467-L481 HydrophobicContact CE3-CG 4.24Å; W467-L481 HydrophobicContact CG-CD1 4.06Å; W467-L481 HydrophobicContact CH2-CB 3.86Å; W467-L481 HydrophobicContact CZ2-CB 3.89Å; W467-L481 HydrophobicContact CZ3-CB 3.88Å; W467-L481 HydrophobicContact CZ3-CD1 4.46Å; W467-L481 HydrophobicContact CZ3-CD2 4.35Å; W467-L481 HydrophobicContact CZ3-CG 4.45Å; L481-E483 VanDerWaalsContact C-N 3.33Å; L481-E483 PolarHBondContact O-N 3.48Å; L481-F484 PolarHBondContact O-N 3.23Å; L481-M485 HydrophobicContact CD1-CG 3.82Å; L481-M485 HydrophobicContact CD1-SD 4.28Å; L481-M485 HydrophobicContact CG-CG 4.25Å; L481-M485 WeakPolarHBondContact O-CB 3.38Å; L481-M485 WeakPolarHBondContact O-CG 3.48Å; L481-M485 PolarHBondContact O-N 3.43Å
482	P	91.3	Very high	88.6	Confident	97 Å²	97	50.2 Å²	50.2	63%	0.63	28%	0.279	S	S	*	.	H	α-helix	trans	-62.4	-39.4	-179.7	-23.2	35.4	0	0	0	112.9	P480 M485 Q486	P480-P482 VanDerWaalsContact C-CD 3.47Å; P482-M485 PolarHBondContact O-N 3.36Å; P482-Q486 PolarHBondContact O-N 3.19Å
483	E	91.1	Very high	88.2	Confident	86 Å²	86	52 Å²	52	40%	0.402	29%	0.29	S	S	.	.	H	α-helix	trans	-67.2	-48	178.5	-176.8	178.7	174.3	0	0	110.9	P480 L481 M485 Q486 Q487	P480-E483 WeakPolarHBondContact CD-OE2 3.39Å; P480-E483 HydrophobicContact CG-CB 4.07Å; P480-E483 PolarHBondContact O-N 2.98Å; P480-E483 VanDerWaalsContact O-N 3.13Å; L481-E483 VanDerWaalsContact C-N 3.33Å; L481-E483 PolarHBondContact O-N 3.48Å; E483-M485 VanDerWaalsContact C-N 3.27Å; E483-M485 PolarHBondContact O-N 3.1Å; E483-Q486 PolarHBondContact O-N 2.92Å; E483-Q486 VanDerWaalsContact O-N 3.1Å; E483-Q487 HydrophobicContact CG-CG 4.29Å; E483-Q487 WeakPolarHBondContact O-CB 3.43Å; E483-Q487 WeakPolarHBondContact O-CG 3.43Å; E483-Q487 PolarHBondContact O-N 3.04Å; E483-Q487 PolarHBondContact OE1-NE2 2.72Å
484	F	92	Very high	87.8	Confident	1 Å²	1	56.1 Å²	56.1	0%	0.004	31%	0.309	C	S	.	.	H	α-helix	trans	-57.3	-39.6	173.8	174.3	-91.8	0	0	0	112.5	L463 W467 L478 P480 L481 F488 S489 L515	L463-F484 HydrophobicContact CB-CE1 4.17Å; L463-F484 HydrophobicContact CB-CZ 4.43Å; L463-F484 HydrophobicContact CD2-CZ 4.35Å; L463-F484 WeakPolarHBondContact O-CE1 3.29Å; W467-F484 HydrophobicContact CB-CD1 3.75Å; W467-F484 HydrophobicContact CB-CE1 3.73Å; W467-F484 HydrophobicContact CB-CG 4.24Å; W467-F484 HydrophobicContact CB-CZ 4.2Å; W467-F484 AromaticContact CD1-CD1 3.83Å; W467-F484 AromaticContact CD1-CD2 3.86Å; W467-F484 AromaticContact CD1-CG 3.46Å; W467-F484 VanDerWaalsContact CD1-CG 3.46Å; W467-F484 HydrophobicContact CG-CB 4.44Å; W467-F484 AromaticContact CG-CD1 3.98Å; W467-F484 HydrophobicContact CG-CD1 3.98Å; W467-F484 HydrophobicContact CG-CE1 4.45Å; W467-F484 HydrophobicContact CG-CG 4.09Å; L478-F484 HydrophobicContact CB-CD2 4.3Å; L478-F484 HydrophobicContact CD1-CD2 4.44Å; L478-F484 HydrophobicContact CD1-CE2 4.23Å; P480-F484 PolarHBondContact O-N 3.01Å; P480-F484 VanDerWaalsContact O-N 3.16Å; L481-F484 PolarHBondContact O-N 3.23Å; F484-F488 HydrophobicContact CD2-CB 4.4Å; F484-F488 AromaticContact CD2-CD2 3.64Å; F484-F488 HydrophobicContact CD2-CD2 3.64Å; F484-F488 HydrophobicContact CD2-CE2 4.38Å; F484-F488 HydrophobicContact CD2-CG 4.35Å; F484-F488 HydrophobicContact CE2-CB 4.1Å; F484-F488 AromaticContact CE2-CD2 3.92Å; F484-F488 HydrophobicContact CE2-CD2 3.92Å; F484-F488 HydrophobicContact CE2-CG 4.21Å; F484-F488 HydrophobicContact CG-CD2 4.43Å; F484-F488 HydrophobicContact CZ-CB 4.33Å; F484-F488 PolarHBondContact O-N 2.67Å; F484-S489 PolarHBondContact O-N 2.99Å; F484-L515 HydrophobicContact CE2-CD1 3.89Å; F484-L515 HydrophobicContact CE2-CD2 4.43Å; F484-L515 HydrophobicContact CZ-CD2 4.39Å
485	M	90.8	Very high	87.5	Confident	43 Å²	43	55.3 Å²	55.3	21%	0.212	30%	0.303	C	S	.	.	I	π-helix	trans	-64.2	-39.8	176.7	-74	-63.9	-64	0	0	111.9	R464 L481 P482 E483 S489 I490	R464-M485 HydrophobicContact CB-SD 4.05Å; L481-M485 HydrophobicContact CD1-CG 3.82Å; L481-M485 HydrophobicContact CD1-SD 4.28Å; L481-M485 HydrophobicContact CG-CG 4.25Å; L481-M485 WeakPolarHBondContact O-CB 3.38Å; L481-M485 WeakPolarHBondContact O-CG 3.48Å; L481-M485 PolarHBondContact O-N 3.43Å; P482-M485 PolarHBondContact O-N 3.36Å; E483-M485 VanDerWaalsContact C-N 3.27Å; E483-M485 PolarHBondContact O-N 3.1Å; M485-S489 PolarHBondContact O-N 3.5Å; M485-S489 VanDerWaalsContact SD-CB 3.53Å; M485-I490 WeakPolarHBondContact O-CG1 3.35Å; M485-I490 PolarHBondContact O-N 3.36Å
486	Q	90.5	Very high	86.9	Confident	148 Å²	148	51.8 Å²	51.8	69%	0.692	28%	0.281	S	S	*	.	I	π-helix	trans	-73.5	-45.1	178.5	-173.2	174.9	0.7	0	0	112.7	P482 E483 P491	P482-Q486 PolarHBondContact O-N 3.19Å; E483-Q486 PolarHBondContact O-N 2.92Å; E483-Q486 VanDerWaalsContact O-N 3.1Å; Q486-P491 VanDerWaalsContact O-CD 3.29Å; Q486-P491 WeakPolarHBondContact O-CD 3.42Å
487	Q	89.3	Confident	86.5	Confident	89 Å²	89	51 Å²	51	42%	0.416	26%	0.261	S	S	.	.	I	π-helix	trans	-73.6	-42	-177	-70.3	175.3	0.3	0	0	113	E483	E483-Q487 HydrophobicContact CG-CG 4.29Å; E483-Q487 WeakPolarHBondContact O-CB 3.43Å; E483-Q487 WeakPolarHBondContact O-CG 3.43Å; E483-Q487 PolarHBondContact O-N 3.04Å; E483-Q487 PolarHBondContact OE1-NE2 2.72Å
488	F	89.2	Confident	85.8	Confident	20 Å²	20	45.9 Å²	45.9	9%	0.088	25%	0.251	C	S	.	.	I	π-helix	trans	-115.7	-52.7	-172.2	-60.7	-78.5	0	0	0	113.2	F484 I492 C511 T514 L515 L518	F484-F488 HydrophobicContact CD2-CB 4.4Å; F484-F488 AromaticContact CD2-CD2 3.64Å; F484-F488 HydrophobicContact CD2-CD2 3.64Å; F484-F488 HydrophobicContact CD2-CE2 4.38Å; F484-F488 HydrophobicContact CD2-CG 4.35Å; F484-F488 HydrophobicContact CE2-CB 4.1Å; F484-F488 AromaticContact CE2-CD2 3.92Å; F484-F488 HydrophobicContact CE2-CD2 3.92Å; F484-F488 HydrophobicContact CE2-CG 4.21Å; F484-F488 HydrophobicContact CG-CD2 4.43Å; F484-F488 HydrophobicContact CZ-CB 4.33Å; F484-F488 PolarHBondContact O-N 2.67Å; F488-I492 HydrophobicContact CB-CD1 4.33Å; F488-I492 WeakPolarHBondContact O-CB 3.46Å; F488-I492 WeakPolarHBondContact O-CD1 3.47Å; F488-I492 WeakPolarHBondContact O-CG1 3.39Å; F488-I492 PolarHBondContact O-N 3.09Å; F488-I492 VanDerWaalsContact O-N 3.12Å; F488-C511 HydrophobicContact CD1-CB 4.34Å; F488-T514 HydrophobicContact CE1-CG2 4.22Å; F488-L515 HydrophobicContact CB-CD2 4.4Å; F488-L515 HydrophobicContact CD1-CB 3.8Å; F488-L515 HydrophobicContact CD1-CD1 4.44Å; F488-L515 HydrophobicContact CD1-CD2 4.5Å; F488-L515 HydrophobicContact CD1-CG 4.47Å; F488-L515 HydrophobicContact CE1-CB 4.01Å; F488-L518 HydrophobicContact CZ-CD1 4.31Å
489	S	87.6	Confident	85.2	Confident	4 Å²	4	48.8 Å²	48.8	3%	0.028	28%	0.278	C	S	.	.	I	π-helix	trans	-65.9	-49.1	-168	-166.9	0	0	0	0	113.2	F484 M485 T493	F484-S489 PolarHBondContact O-N 2.99Å; M485-S489 PolarHBondContact O-N 3.5Å; M485-S489 VanDerWaalsContact SD-CB 3.53Å; S489-T493 WeakPolarHBondContact O-CB 3.19Å; S489-T493 PolarHBondContact O-N 2.87Å; S489-T493 VanDerWaalsContact O-N 3.11Å; S489-T493 PolarHBondContact O-OG1 2.85Å
490	I	87.2	Confident	84.7	Confident	85 Å²	85	48.3 Å²	48.3	44%	0.436	27%	0.271	S	S	.	.	H	α-helix	trans	-67.2	-48.2	-176.1	-67.9	166.9	0	0	0	111.1	M485 I492 T493 Q494	M485-I490 WeakPolarHBondContact O-CG1 3.35Å; M485-I490 PolarHBondContact O-N 3.36Å; I490-I492 PolarHBondContact O-N 3.29Å; I490-T493 PolarHBondContact O-N 2.9Å; I490-Q494 HydrophobicContact CG2-CG 4.28Å; I490-Q494 WeakPolarHBondContact O-CB 3.35Å; I490-Q494 WeakPolarHBondContact O-CG 3.48Å; I490-Q494 PolarHBondContact O-N 3.29Å
491	P	88.7	Confident	84.4	Confident	28 Å²	28	46.9 Å²	46.9	18%	0.182	26%	0.264	C	S	.	.	H	α-helix	trans	-58	-47.4	175.1	-28.4	37.4	0	0	0	113.5	Q486 T493 Q494 G495 A508	Q486-P491 VanDerWaalsContact O-CD 3.29Å; Q486-P491 WeakPolarHBondContact O-CD 3.42Å; P491-T493 PolarHBondContact O-N 2.83Å; P491-Q494 PolarHBondContact O-N 3.13Å; P491-G495 PolarHBondContact O-N 3.49Å; P491-A508 WeakPolarHBondContact O-CB 3.35Å
492	I	86.2	Confident	84.1	Confident	3 Å²	3	51 Å²	51	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-64.1	-39.9	-176.8	-66.5	169.5	0	0	0	111.5	L463 F488 I490 G496 C511 A512 L515 R791	L463-I492 HydrophobicContact CD1-CB 3.94Å; L463-I492 HydrophobicContact CD1-CD1 3.92Å; L463-I492 HydrophobicContact CD1-CG2 3.97Å; F488-I492 HydrophobicContact CB-CD1 4.33Å; F488-I492 WeakPolarHBondContact O-CB 3.46Å; F488-I492 WeakPolarHBondContact O-CD1 3.47Å; F488-I492 WeakPolarHBondContact O-CG1 3.39Å; F488-I492 PolarHBondContact O-N 3.09Å; F488-I492 VanDerWaalsContact O-N 3.12Å; I490-I492 PolarHBondContact O-N 3.29Å; I492-G496 PolarHBondContact O-N 3.44Å; I492-C511 HydrophobicContact CD1-CB 4.17Å; I492-C511 HydrophobicContact CG1-CB 3.91Å; I492-A512 HydrophobicContact CD1-CB 4.14Å; I492-A512 HydrophobicContact CG1-CB 4.34Å; I492-L515 HydrophobicContact CD1-CD2 4.24Å; I492-R791 PolarHBondContact O-NH1 3.36Å
493	T	83.9	Confident	83.9	Confident	39 Å²	39	52.5 Å²	52.5	24%	0.239	29%	0.294	C	S	.	.	H	α-helix	trans	-70.1	-46.1	175.3	-62.1	0	0	0	0	112	S489 I490 P491 G495 G496 Y497	S489-T493 WeakPolarHBondContact O-CB 3.19Å; S489-T493 PolarHBondContact O-N 2.87Å; S489-T493 VanDerWaalsContact O-N 3.11Å; S489-T493 PolarHBondContact O-OG1 2.85Å; I490-T493 PolarHBondContact O-N 2.9Å; P491-T493 PolarHBondContact O-N 2.83Å; T493-G495 PolarHBondContact O-N 2.85Å; T493-G496 PolarHBondContact O-N 3.3Å; T493-Y497 HydrophobicContact CG2-CE2 3.93Å; T493-Y497 WeakPolarHBondContact O-CD2 3.47Å; T493-Y497 WeakPolarHBondContact O-CE2 3.48Å
494	Q	82.2	Confident	83.7	Confident	90 Å²	90	51.5 Å²	51.5	42%	0.421	29%	0.289	S	S	.	.	H	α-helix	trans	-58.5	-51.1	178	-76.2	-172.5	19.5	0	0	111.8	I490 P491 G496 Y497 A500	I490-Q494 HydrophobicContact CG2-CG 4.28Å; I490-Q494 WeakPolarHBondContact O-CB 3.35Å; I490-Q494 WeakPolarHBondContact O-CG 3.48Å; I490-Q494 PolarHBondContact O-N 3.29Å; P491-Q494 PolarHBondContact O-N 3.13Å; Q494-G496 PolarHBondContact O-N 3.19Å; Q494-Y497 PolarHBondContact O-N 2.94Å; Q494-A500 VanDerWaalsContact O-CB 3.3Å; Q494-A500 WeakPolarHBondContact O-CB 3.31Å
495	G	79.7	Confident	83.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	12.8	176.7	0	0	0	0	0	114.6	P491 T493 Q504 R791 R800	P491-G495 PolarHBondContact O-N 3.49Å; T493-G495 PolarHBondContact O-N 2.85Å; G495-Q504 WeakPolarHBondContact CA-O 3.3Å; G495-R791 VanDerWaalsContact C-NH1 3.33Å; G495-R791 PolarHBondContact O-NH1 3.23Å; G495-R791 PolarHBondContact O-NH2 2.97Å; G495-R800 WeakPolarHBondContact O-CD 3.23Å
496	G	73	Confident	83.1	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.01	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-17.3	175.5	0	0	0	0	0	114.6	I492 T493 Q494 R800	I492-G496 PolarHBondContact O-N 3.44Å; T493-G496 PolarHBondContact O-N 3.3Å; Q494-G496 PolarHBondContact O-N 3.19Å; G496-R800 WeakPolarHBondContact O-CG 3.41Å
497	Y	73.2	Confident	83	Confident	42 Å²	42	50.2 Å²	50.2	17%	0.165	29%	0.288	C	S	.	.	S	Bend	trans	-76.9	151.3	177	-64.9	-72.1	0	0	0	112.2	T493 Q494 A499 A500 F784 R800	T493-Y497 HydrophobicContact CG2-CE2 3.93Å; T493-Y497 WeakPolarHBondContact O-CD2 3.47Å; T493-Y497 WeakPolarHBondContact O-CE2 3.48Å; Q494-Y497 PolarHBondContact O-N 2.94Å; Y497-A499 PolarHBondContact O-N 3.12Å; Y497-A500 WeakPolarHBondContact O-CB 3.47Å; Y497-A500 PolarHBondContact O-N 3.26Å; Y497-A500 VanDerWaalsContact O-N 3.09Å; Y497-F784 HydrophobicContact CE1-CZ 4.04Å; Y497-R800 PolarHBondContact O-NH1 3.23Å
498	A	70.5	Confident	82.9	Confident	45 Å²	45	46 Å²	46	37%	0.372	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-35	172.9	0	0	0	0	0	111.8	A500 F802	A498-A500 PolarHBondContact O-N 3.26Å; A498-F802 WeakPolarHBondContact CB-O 3.49Å; A498-F802 PolarHBondContact N-O 3.3Å
499	A	74.4	Confident	82.8	Confident	83 Å²	83	47.9 Å²	47.9	69%	0.686	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	2.2	177.4	0	0	0	0	0	115.2	Y497	Y497-A499 PolarHBondContact O-N 3.12Å
500	A	76.4	Confident	82.9	Confident	12 Å²	12	52.5 Å²	52.5	10%	0.099	30%	0.296	C	S	.	.			trans	-72.3	135.9	-178.3	0	0	0	0	0	112.6	Q494 Y497 A498 V505 R800	Q494-A500 VanDerWaalsContact O-CB 3.3Å; Q494-A500 WeakPolarHBondContact O-CB 3.31Å; Y497-A500 WeakPolarHBondContact O-CB 3.47Å; Y497-A500 PolarHBondContact O-N 3.26Å; Y497-A500 VanDerWaalsContact O-N 3.09Å; A498-A500 PolarHBondContact O-N 3.26Å; A500-V505 HydrophobicContact CB-CG2 3.76Å; A500-R800 PolarHBondContact O-NH1 3.13Å
501	S	84.6	Confident	83	Confident	44 Å²	44	49.8 Å²	49.8	31%	0.308	28%	0.284	S	S	.	.			trans	-64.1	151.9	174	66.6	0	0	0	0	111.6	L503 Q504 V505	S501-L503 PolarHBondContact O-N 3.11Å; S501-Q504 VanDerWaalsContact N-OE1 3.11Å; S501-Q504 PolarHBondContact O-N 3.18Å; S501-Q504 VanDerWaalsContact O-N 3.09Å; S501-Q504 WeakPolarHBondContact OG-CG 3.33Å; S501-Q504 PolarHBondContact OG-N 3.43Å; S501-Q504 PolarHBondContact OG-OE1 3.27Å; S501-V505 VanDerWaalsContact O-CG2 3.26Å; S501-V505 WeakPolarHBondContact O-CG2 3.44Å; S501-V505 PolarHBondContact O-N 3.18Å; S501-V505 VanDerWaalsContact O-N 3.15Å
502	P	85.3	Confident	82.9	Confident	112 Å²	112	48.5 Å²	48.5	73%	0.727	28%	0.276	S	S	*	.	H	α-helix	trans	-57.3	-34.9	-179.8	21.6	-33	0	0	0	112.7	V505 E506	P502-V505 PolarHBondContact O-N 3.28Å; P502-E506 PolarHBondContact O-N 3.12Å
503	L	87.1	Confident	83	Confident	128 Å²	128	49.2 Å²	49.2	67%	0.67	28%	0.281	S	S	*	.	H	α-helix	trans	-62.1	-48.8	174.7	-179.7	61.3	0	0	0	112.2	S501 V505 E506 T507	S501-L503 PolarHBondContact O-N 3.11Å; L503-V505 PolarHBondContact O-N 2.89Å; L503-E506 PolarHBondContact O-N 3.04Å; L503-T507 HydrophobicContact CD1-CG2 4.38Å; L503-T507 WeakPolarHBondContact O-CG2 3.45Å; L503-T507 PolarHBondContact O-N 3.01Å; L503-T507 PolarHBondContact O-OG1 3.15Å
504	Q	86.1	Confident	83.4	Confident	64 Å²	64	51 Å²	51	30%	0.299	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-29	177.4	-75.8	167.1	-61	0	0	112.6	G495 S501 T507 A508	G495-Q504 WeakPolarHBondContact CA-O 3.3Å; S501-Q504 VanDerWaalsContact N-OE1 3.11Å; S501-Q504 PolarHBondContact O-N 3.18Å; S501-Q504 VanDerWaalsContact O-N 3.09Å; S501-Q504 WeakPolarHBondContact OG-CG 3.33Å; S501-Q504 PolarHBondContact OG-N 3.43Å; S501-Q504 PolarHBondContact OG-OE1 3.27Å; Q504-T507 VanDerWaalsContact CA-OG1 3.31Å; Q504-T507 WeakPolarHBondContact CA-OG1 3.34Å; Q504-T507 PolarHBondContact O-OG1 2.81Å; Q504-A508 WeakPolarHBondContact O-CB 3.34Å; Q504-A508 PolarHBondContact O-N 3.44Å
505	V	83.7	Confident	83.7	Confident	27 Å²	27	46.8 Å²	46.8	16%	0.164	27%	0.272	C	S	.	.	H	α-helix	trans	-77.5	-40.8	-179.7	177.3	0	0	0	0	110.8	A500 S501 P502 L503 A508 Y509	A500-V505 HydrophobicContact CB-CG2 3.76Å; S501-V505 VanDerWaalsContact O-CG2 3.26Å; S501-V505 WeakPolarHBondContact O-CG2 3.44Å; S501-V505 PolarHBondContact O-N 3.18Å; S501-V505 VanDerWaalsContact O-N 3.15Å; P502-V505 PolarHBondContact O-N 3.28Å; L503-V505 PolarHBondContact O-N 2.89Å; V505-A508 PolarHBondContact O-N 2.84Å; V505-Y509 WeakPolarHBondContact O-CB 3.35Å; V505-Y509 PolarHBondContact O-N 2.92Å
506	E	86.6	Confident	84.1	Confident	88 Å²	88	51.1 Å²	51.1	41%	0.411	29%	0.289	S	S	.	.	H	α-helix	trans	-67.4	-44.2	174.1	-175.4	51.8	-143.4	0	0	111.1	P502 L503 A508 Y509 Q510	P502-E506 PolarHBondContact O-N 3.12Å; L503-E506 PolarHBondContact O-N 3.04Å; E506-A508 VanDerWaalsContact C-N 3.3Å; E506-A508 PolarHBondContact O-N 3.5Å; E506-Y509 WeakPolarHBondContact O-CB 3.48Å; E506-Y509 PolarHBondContact O-N 3.06Å; E506-Y509 VanDerWaalsContact O-N 3.15Å; E506-Q510 WeakPolarHBondContact O-CG 3.46Å; E506-Q510 PolarHBondContact O-N 3.19Å; E506-Q510 WeakPolarHBondContact OE1-CG 3.39Å; E506-Q510 PolarHBondContact OE1-NE2 3Å
507	T	88.8	Confident	84.8	Confident	51 Å²	51	54.8 Å²	54.8	31%	0.313	31%	0.308	S	S	.	.	H	α-helix	trans	-60.9	-39.2	172.3	56	0	0	0	0	111.8	L503 Q504 Q510 C511	L503-T507 HydrophobicContact CD1-CG2 4.38Å; L503-T507 WeakPolarHBondContact O-CG2 3.45Å; L503-T507 PolarHBondContact O-N 3.01Å; L503-T507 PolarHBondContact O-OG1 3.15Å; Q504-T507 VanDerWaalsContact CA-OG1 3.31Å; Q504-T507 WeakPolarHBondContact CA-OG1 3.34Å; Q504-T507 PolarHBondContact O-OG1 2.81Å; T507-Q510 PolarHBondContact O-N 2.85Å; T507-C511 WeakPolarHBondContact O-CB 3.32Å; T507-C511 PolarHBondContact O-N 3.49Å; T507-C511 PolarHBondContact O-SG 3.37Å
508	A	86.2	Confident	85.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-67.2	-35.1	175.5	0	0	0	0	0	113	P491 Q504 V505 E506 A512	P491-A508 WeakPolarHBondContact O-CB 3.35Å; Q504-A508 WeakPolarHBondContact O-CB 3.34Å; Q504-A508 PolarHBondContact O-N 3.44Å; V505-A508 PolarHBondContact O-N 2.84Å; E506-A508 VanDerWaalsContact C-N 3.3Å; E506-A508 PolarHBondContact O-N 3.5Å; A508-A512 WeakPolarHBondContact O-CB 3.46Å; A508-A512 PolarHBondContact O-N 3.4Å
509	Y	87	Confident	86.5	Confident	60 Å²	60	53.8 Å²	53.8	24%	0.235	30%	0.299	C	S	.	.	H	α-helix	trans	-66.4	-46.5	174.3	172.8	-103	0	0	0	111.1	V505 E506 A512 C513 P796 R797	V505-Y509 WeakPolarHBondContact O-CB 3.35Å; V505-Y509 PolarHBondContact O-N 2.92Å; E506-Y509 WeakPolarHBondContact O-CB 3.48Å; E506-Y509 PolarHBondContact O-N 3.06Å; E506-Y509 VanDerWaalsContact O-N 3.15Å; Y509-A512 PolarHBondContact O-N 3.24Å; Y509-C513 PolarHBondContact O-N 2.89Å; Y509-C513 PolarHBondContact O-SG 3.49Å; Y509-C513 VanDerWaalsContact O-SG 3.36Å; Y509-P796 HydrophobicContact CD2-CB 3.83Å; Y509-P796 HydrophobicContact CD2-CG 4.24Å; Y509-P796 HydrophobicContact CE2-CB 3.99Å; Y509-P796 HydrophobicContact CE2-CG 3.87Å; Y509-R797 HydrophobicContact CD2-CG 3.9Å; Y509-R797 HydrophobicContact CE2-CG 3.46Å; Y509-R797 VanDerWaalsContact CE2-CG 3.46Å
510	Q	89.8	Confident	87.1	Confident	101 Å²	101	57.1 Å²	57.1	47%	0.472	30%	0.298	S	S	.	.	H	α-helix	trans	-61.7	-51.5	176	-68.3	172.6	10.5	0	0	111.2	E506 T507 A512 C513 T514	E506-Q510 WeakPolarHBondContact O-CG 3.46Å; E506-Q510 PolarHBondContact O-N 3.19Å; E506-Q510 WeakPolarHBondContact OE1-CG 3.39Å; E506-Q510 PolarHBondContact OE1-NE2 3Å; T507-Q510 PolarHBondContact O-N 2.85Å; Q510-A512 VanDerWaalsContact C-N 3.29Å; Q510-A512 PolarHBondContact O-N 2.96Å; Q510-C513 PolarHBondContact O-N 2.71Å; Q510-C513 VanDerWaalsContact O-N 3.13Å; Q510-T514 PolarHBondContact O-N 3.39Å; Q510-T514 PolarHBondContact O-OG1 3.26Å
511	C	90.2	Very high	87.7	Confident	27 Å²	27	59.9 Å²	59.9	18%	0.182	32%	0.315	C	S	.	.	H	α-helix	trans	-57.7	-39.8	176.5	-65.9	0	0	0	0	112.4	F488 I492 T507 L515	F488-C511 HydrophobicContact CD1-CB 4.34Å; I492-C511 HydrophobicContact CD1-CB 4.17Å; I492-C511 HydrophobicContact CG1-CB 3.91Å; T507-C511 WeakPolarHBondContact O-CB 3.32Å; T507-C511 PolarHBondContact O-N 3.49Å; T507-C511 PolarHBondContact O-SG 3.37Å; C511-L515 VanDerWaalsContact O-CB 3.23Å; C511-L515 WeakPolarHBondContact O-CB 3.31Å; C511-L515 PolarHBondContact O-N 2.87Å
512	A	87	Confident	88	Confident	1 Å²	1	60 Å²	60	1%	0.008	31%	0.309	C	S	.	.	H	α-helix	trans	-68.7	-38.1	177.3	0	0	0	0	0	112.7	I492 A508 Y509 Q510 R516 P796	I492-A512 HydrophobicContact CD1-CB 4.14Å; I492-A512 HydrophobicContact CG1-CB 4.34Å; A508-A512 WeakPolarHBondContact O-CB 3.46Å; A508-A512 PolarHBondContact O-N 3.4Å; Y509-A512 PolarHBondContact O-N 3.24Å; Q510-A512 VanDerWaalsContact C-N 3.29Å; Q510-A512 PolarHBondContact O-N 2.96Å; A512-R516 VanDerWaalsContact O-CB 3.24Å; A512-R516 WeakPolarHBondContact O-CB 3.46Å; A512-R516 PolarHBondContact O-N 3.45Å; A512-P796 HydrophobicContact CB-CB 4.16Å
513	C	88	Confident	88.3	Confident	18 Å²	18	55.7 Å²	55.7	12%	0.122	28%	0.28	C	S	.	.	H	α-helix	trans	-66	-51.9	173.8	-72.8	0	0	0	0	111.4	Y509 Q510 L515 R516 D517	Y509-C513 PolarHBondContact O-N 2.89Å; Y509-C513 PolarHBondContact O-SG 3.49Å; Y509-C513 VanDerWaalsContact O-SG 3.36Å; Q510-C513 PolarHBondContact O-N 2.71Å; Q510-C513 VanDerWaalsContact O-N 3.13Å; C513-L515 VanDerWaalsContact C-N 3.29Å; C513-L515 PolarHBondContact O-N 2.94Å; C513-R516 PolarHBondContact O-N 3.47Å; C513-D517 WeakPolarHBondContact O-CB 3.39Å; C513-D517 PolarHBondContact O-N 2.94Å
514	T	90.9	Very high	88.5	Confident	78 Å²	78	51.1 Å²	51.1	48%	0.479	26%	0.256	S	S	.	.	H	α-helix	trans	-55.3	-45.1	176.4	-57.7	0	0	0	0	111.4	F488 Q510 D517 L518	F488-T514 HydrophobicContact CE1-CG2 4.22Å; Q510-T514 PolarHBondContact O-N 3.39Å; Q510-T514 PolarHBondContact O-OG1 3.26Å; T514-D517 PolarHBondContact O-N 3.44Å; T514-L518 HydrophobicContact CG2-CD1 4.21Å; T514-L518 VanDerWaalsContact O-CG 3.31Å; T514-L518 WeakPolarHBondContact O-CG 3.31Å; T514-L518 PolarHBondContact O-N 2.8Å; T514-L518 VanDerWaalsContact O-N 3.08Å
515	L	89.8	Confident	88.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-54.5	175.4	-178	58.9	0	0	0	111.3	L463 L466 L478 F484 F488 I492 C511 C513 D517 L518 L519	L463-L515 HydrophobicContact CD2-CD2 3.73Å; L466-L515 HydrophobicContact CD2-CD2 4.48Å; L478-L515 HydrophobicContact CD2-CD1 4.45Å; F484-L515 HydrophobicContact CE2-CD1 3.89Å; F484-L515 HydrophobicContact CE2-CD2 4.43Å; F484-L515 HydrophobicContact CZ-CD2 4.39Å; F488-L515 HydrophobicContact CB-CD2 4.4Å; F488-L515 HydrophobicContact CD1-CB 3.8Å; F488-L515 HydrophobicContact CD1-CD1 4.44Å; F488-L515 HydrophobicContact CD1-CD2 4.5Å; F488-L515 HydrophobicContact CD1-CG 4.47Å; F488-L515 HydrophobicContact CE1-CB 4.01Å; I492-L515 HydrophobicContact CD1-CD2 4.24Å; C511-L515 VanDerWaalsContact O-CB 3.23Å; C511-L515 WeakPolarHBondContact O-CB 3.31Å; C511-L515 PolarHBondContact O-N 2.87Å; C513-L515 VanDerWaalsContact C-N 3.29Å; C513-L515 PolarHBondContact O-N 2.94Å; L515-D517 PolarHBondContact O-N 2.95Å; L515-L518 WeakPolarHBondContact O-CB 3.29Å; L515-L518 PolarHBondContact O-N 3.29Å; L515-L518 VanDerWaalsContact O-N 3.12Å; L515-L519 HydrophobicContact CD1-CD1 3.9Å; L515-L519 HydrophobicContact CD1-CD2 4.08Å; L515-L519 HydrophobicContact CD1-CG 3.96Å; L515-L519 HydrophobicContact CG-CD1 3.89Å; L515-L519 HydrophobicContact CG-CG 4.3Å; L515-L519 VanDerWaalsContact O-CG 3.28Å; L515-L519 WeakPolarHBondContact O-CG 3.5Å; L515-L519 PolarHBondContact O-N 3.49Å
516	R	86.9	Confident	88.9	Confident	91 Å²	91	51.5 Å²	51.5	34%	0.343	25%	0.252	S	S	.	.	H	α-helix	trans	-50.5	-44.3	179	179.8	-159.6	66.6	-153	-11.6	111.6	A512 C513 L519 K520	A512-R516 VanDerWaalsContact O-CB 3.24Å; A512-R516 WeakPolarHBondContact O-CB 3.46Å; A512-R516 PolarHBondContact O-N 3.45Å; C513-R516 PolarHBondContact O-N 3.47Å; R516-L519 PolarHBondContact O-N 2.98Å; R516-K520 WeakPolarHBondContact O-CB 3.38Å; R516-K520 PolarHBondContact O-N 2.83Å
517	D	89.2	Confident	88.8	Confident	79 Å²	79	48.8 Å²	48.8	42%	0.422	24%	0.24	S	C	.	.	H	α-helix	trans	-75.4	-29	-174.5	-62	-22.8	0	0	0	112.4	C513 T514 L515	C513-D517 WeakPolarHBondContact O-CB 3.39Å; C513-D517 PolarHBondContact O-N 2.94Å; T514-D517 PolarHBondContact O-N 3.44Å; L515-D517 PolarHBondContact O-N 2.95Å
518	L	89.2	Confident	88.6	Confident	62 Å²	62	47 Å²	47	33%	0.325	23%	0.227	S	C	.	.	H	α-helix	trans	-68.4	-35.3	167.3	-73.4	169.2	0	0	0	113.2	F488 T514 L515	F488-L518 HydrophobicContact CZ-CD1 4.31Å; T514-L518 HydrophobicContact CG2-CD1 4.21Å; T514-L518 VanDerWaalsContact O-CG 3.31Å; T514-L518 WeakPolarHBondContact O-CG 3.31Å; T514-L518 PolarHBondContact O-N 2.8Å; T514-L518 VanDerWaalsContact O-N 3.08Å; L515-L518 WeakPolarHBondContact O-CB 3.29Å; L515-L518 PolarHBondContact O-N 3.29Å; L515-L518 VanDerWaalsContact O-N 3.12Å
519	L	88.4	Confident	88.3	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-82.8	-29.3	-178.5	-56.5	178.9	0	0	0	112.8	L466 F470 L478 L515 R516 P521 Y522 L523	L466-L519 HydrophobicContact CD1-CD1 4.46Å; L466-L519 HydrophobicContact CD2-CD1 3.66Å; L466-L519 HydrophobicContact CG-CD1 4.26Å; F470-L519 HydrophobicContact CD1-CD2 3.57Å; F470-L519 HydrophobicContact CD2-CD2 3.92Å; F470-L519 HydrophobicContact CE1-CB 4.07Å; F470-L519 HydrophobicContact CE1-CD2 3.38Å; F470-L519 HydrophobicContact CE1-CG 4.23Å; F470-L519 HydrophobicContact CE2-CB 4.45Å; F470-L519 HydrophobicContact CE2-CD1 4.21Å; F470-L519 HydrophobicContact CE2-CD2 3.76Å; F470-L519 HydrophobicContact CE2-CG 4.32Å; F470-L519 HydrophobicContact CG-CD2 3.83Å; F470-L519 HydrophobicContact CZ-CB 3.73Å; F470-L519 HydrophobicContact CZ-CD1 4.3Å; F470-L519 HydrophobicContact CZ-CD2 3.48Å; F470-L519 VanDerWaalsContact CZ-CD2 3.48Å; F470-L519 HydrophobicContact CZ-CG 3.98Å; L478-L519 HydrophobicContact CD1-CD2 4.06Å; L478-L519 HydrophobicContact CD2-CD2 4.13Å; L515-L519 HydrophobicContact CD1-CD1 3.9Å; L515-L519 HydrophobicContact CD1-CD2 4.08Å; L515-L519 HydrophobicContact CD1-CG 3.96Å; L515-L519 HydrophobicContact CG-CD1 3.89Å; L515-L519 HydrophobicContact CG-CG 4.3Å; L515-L519 VanDerWaalsContact O-CG 3.28Å; L515-L519 WeakPolarHBondContact O-CG 3.5Å; L515-L519 PolarHBondContact O-N 3.49Å; R516-L519 PolarHBondContact O-N 2.98Å; L519-P521 VanDerWaalsContact C-CD 3.48Å; L519-Y522 PolarHBondContact O-N 3.01Å; L519-L523 PolarHBondContact O-N 3.36Å; L519-L523 VanDerWaalsContact O-N 3.13Å
520	K	87.7	Confident	88	Confident	152 Å²	152	52.9 Å²	52.9	66%	0.661	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-44.7	-46.3	-176.9	-175	179.3	179.1	-175.9	0	115.9	R516 Y522	R516-K520 WeakPolarHBondContact O-CB 3.38Å; R516-K520 PolarHBondContact O-N 2.83Å; K520-Y522 VanDerWaalsContact C-N 3.29Å; K520-Y522 PolarHBondContact O-N 3.06Å
521	P	89.6	Confident	87.4	Confident	70 Å²	70	49.3 Å²	49.3	46%	0.455	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-68.1	-24.4	-179.3	24.3	-33.4	0	0	0	114.4	W284 L519	W284-P521 PolarHBondContact NE1-O 3.45Å; L519-P521 VanDerWaalsContact C-CD 3.48Å
522	Y	91	Very high	86.3	Confident	47 Å²	47	56.6 Å²	56.6	18%	0.184	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-107.7	-1.3	-175	-52.4	-74.8	0	0	0	113.8	L288 C293 G295 I296 L519 K520	L288-Y522 HydrophobicContact CD2-CD1 4.36Å; C293-Y522 HydrophobicContact CB-CE1 4.39Å; G295-Y522 CarbonylContact C-O 3.52Å; G295-Y522 WeakPolarHBondContact CA-O 3.33Å; I296-Y522 PolarHBondContact N-O 2.77Å; L519-Y522 PolarHBondContact O-N 3.01Å; K520-Y522 VanDerWaalsContact C-N 3.29Å; K520-Y522 PolarHBondContact O-N 3.06Å
523	L	91.1	Very high	85.6	Confident	21 Å²	21	58 Å²	58	11%	0.11	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	102.5	-179.3	172.4	63.7	0	0	0	110.8	I296 P458 F470 L519 L793	I296-L523 HydrophobicContact CB-CD1 3.77Å; I296-L523 HydrophobicContact CG2-CD1 3.7Å; P458-L523 HydrophobicContact CB-CD1 4.44Å; P458-L523 HydrophobicContact CG-CD1 4.43Å; F470-L523 HydrophobicContact CZ-CB 4.05Å; L519-L523 PolarHBondContact O-N 3.36Å; L519-L523 VanDerWaalsContact O-N 3.13Å; L523-L793 HydrophobicContact CD2-CD2 3.89Å
524	I	91.2	Very high	84.9	Confident	32 Å²	32	66.6 Å²	66.6	16%	0.164	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	134.4	165.3	-164.3	168	0	0	0	109.4	W284 I296 I297 G298	W284-I524 HydrophobicContact CB-CD1 4.49Å; W284-I524 HydrophobicContact CD2-CB 4.07Å; W284-I524 HydrophobicContact CD2-CD1 4.36Å; W284-I524 HydrophobicContact CD2-CG2 4.25Å; W284-I524 HydrophobicContact CE3-CB 3.94Å; W284-I524 HydrophobicContact CE3-CD1 4.45Å; W284-I524 HydrophobicContact CE3-CG2 3.59Å; W284-I524 HydrophobicContact CG-CD1 4.41Å; W284-I524 HydrophobicContact CH2-CB 3.96Å; W284-I524 HydrophobicContact CH2-CG2 3.77Å; W284-I524 HydrophobicContact CZ2-CB 4.09Å; W284-I524 HydrophobicContact CZ2-CG2 4.4Å; W284-I524 HydrophobicContact CZ3-CB 3.9Å; W284-I524 HydrophobicContact CZ3-CG2 3.34Å; I296-I524 PolarHBondContact O-N 2.9Å; I297-I524 HydrophobicContact CB-CG2 4.42Å; I297-I524 HydrophobicContact CG2-CG2 4.06Å; G298-I524 VanDerWaalsContact CA-O 3.29Å; G298-I524 WeakPolarHBondContact CA-O 3.43Å; G298-I524 PolarHBondContact N-O 3.01Å
525	R	89	Confident	84.4	Confident	70 Å²	70	64.7 Å²	64.7	26%	0.264	32%	0.323	S	S	.	.			trans	-144.4	119.6	174	176.6	167.6	-161.7	-147.3	2.7	110.2	G298	G298-R525 WeakPolarHBondContact O-CG 3.36Å
526	R	89	Confident	84.2	Confident	30 Å²	30	65.9 Å²	65.9	11%	0.113	33%	0.331	C	S	.	.			trans	-120.4	143.9	173.1	-64.7	161.3	-71.2	-159.9	8.6	110.3	Y277 D299 E300 L303 V531	Y277-R526 PolarHBondContact O-NH1 2.84Å; D299-R526 VanDerWaalsContact CG-NH2 3.33Å; D299-R526 IonicContact OD1-CZ 2.73Å; D299-R526 PolarHBondContact OD1-N 3.04Å; D299-R526 IonicContact OD1-NE 3.91Å; D299-R526 PolarHBondContact OD1-NE 3.06Å; D299-R526 IonicContact OD1-NH2 2.85Å; D299-R526 PolarHBondContact OD1-NH2 3.38Å; D299-R526 IonicContact OD2-CZ 2.65Å; D299-R526 IonicContact OD2-NE 3.41Å; D299-R526 IonicContact OD2-NH2 2.89Å; D299-R526 PolarHBondContact OD2-NH2 3.19Å; E300-R526 PolarHBondContact N-O 3.17Å; L303-R526 HydrophobicContact CD1-CB 4.22Å; L303-R526 WeakPolarHBondContact CD1-O 3.41Å; R526-V531 HydrophobicContact CB-CG2 4.15Å
527	L	86.1	Confident	84.2	Confident	31 Å²	31	64.5 Å²	64.5	16%	0.162	34%	0.339	C	S	.	.			trans	-99.4	160.4	172.5	-50.3	175	0	0	0	110.2	E300 A529 D530 V531 K794	E300-L527 WeakPolarHBondContact OE2-CA 3.39Å; E300-L527 WeakPolarHBondContact OE2-CB 3.2Å; L527-A529 PolarHBondContact O-N 2.79Å; L527-D530 WeakPolarHBondContact CB-OD2 3.36Å; L527-D530 WeakPolarHBondContact CG-OD2 3.49Å; L527-D530 PolarHBondContact N-OD2 3.02Å; L527-D530 PolarHBondContact O-N 2.99Å; L527-V531 VanDerWaalsContact O-CG2 3.28Å; L527-V531 WeakPolarHBondContact O-CG2 3.46Å; L527-K794 VanDerWaalsContact CD1-NZ 3.3Å
528	K	84.4	Confident	84.1	Confident	12 Å²	12	64 Å²	64	5%	0.052	33%	0.333	C	S	.	.	S	Bend	trans	-58.6	-36.9	174.8	-75	170.1	166.5	176	0	112.6	E300 M301 L303 V531 Q532 L535 E752 W755	E300-K528 HydrophobicContact CG-CD 4.48Å; E300-K528 HydrophobicContact CG-CG 4.34Å; E300-K528 PolarHBondContact OE2-N 3.25Å; M301-K528 WeakPolarHBondContact O-CE 3.45Å; L303-K528 HydrophobicContact CD2-CG 4.02Å; L303-K528 HydrophobicContact CG-CG 4.45Å; K528-V531 PolarHBondContact O-N 3.4Å; K528-Q532 PolarHBondContact O-N 3.19Å; K528-L535 HydrophobicContact CD-CD1 3.9Å; K528-L535 HydrophobicContact CG-CD1 4.34Å; K528-E752 IonicContact NZ-OE2 2.74Å; K528-E752 PolarHBondContact NZ-OE2 3.38Å; K528-W755 HydrophobicContact CD-CE3 3.96Å; K528-W755 HydrophobicContact CD-CH2 3.71Å; K528-W755 HydrophobicContact CD-CZ3 3.35Å; K528-W755 VanDerWaalsContact NZ-CZ3 3.33Å; K528-W755 PolarHBondContact NZ-O 2.72Å
529	A	79.8	Confident	84.1	Confident	82 Å²	82	63.5 Å²	63.5	68%	0.678	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-60.9	-45.3	176.4	0	0	0	0	0	112.1	L527 V531 Q532	L527-A529 PolarHBondContact O-N 2.79Å; A529-V531 PolarHBondContact O-N 3.28Å; A529-V531 VanDerWaalsContact O-N 3.08Å; A529-Q532 PolarHBondContact O-N 3.1Å
530	D	80.4	Confident	84	Confident	102 Å²	102	66.8 Å²	66.8	55%	0.545	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-64.6	-13.9	-179.5	-38.2	-21.5	0	0	0	113.3	L527	L527-D530 WeakPolarHBondContact CB-OD2 3.36Å; L527-D530 WeakPolarHBondContact CG-OD2 3.49Å; L527-D530 PolarHBondContact N-OD2 3.02Å; L527-D530 PolarHBondContact O-N 2.99Å
531	V	76.6	Confident	84	Confident	27 Å²	27	63.8 Å²	63.8	16%	0.164	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-111.4	-9.5	-169.4	-179.4	0	0	0	0	112.5	Y277 L303 R526 L527 K528 A529 I533	Y277-V531 HydrophobicContact CD1-CB 4.49Å; Y277-V531 HydrophobicContact CD1-CG1 3.12Å; Y277-V531 HydrophobicContact CD2-CG1 4.16Å; Y277-V531 HydrophobicContact CD2-CG2 4.42Å; Y277-V531 HydrophobicContact CE1-CG1 3.32Å; Y277-V531 HydrophobicContact CE2-CG1 4.32Å; Y277-V531 HydrophobicContact CG-CG1 3.58Å; Y277-V531 HydrophobicContact CG-CG2 4.23Å; L303-V531 HydrophobicContact CD1-CG2 4.47Å; L303-V531 HydrophobicContact CD2-CG1 4.45Å; R526-V531 HydrophobicContact CB-CG2 4.15Å; L527-V531 VanDerWaalsContact O-CG2 3.28Å; L527-V531 WeakPolarHBondContact O-CG2 3.46Å; K528-V531 PolarHBondContact O-N 3.4Å; A529-V531 PolarHBondContact O-N 3.28Å; A529-V531 VanDerWaalsContact O-N 3.08Å; V531-I533 HydrophobicContact CB-CG1 4.21Å; V531-I533 HydrophobicContact CG1-CD1 3.93Å; V531-I533 HydrophobicContact CG1-CG1 3.59Å; V531-I533 PolarHBondContact O-N 3.4Å; V531-I533 VanDerWaalsContact O-N 3.15Å
532	Q	66.1	Low	84	Confident	179 Å²	179	62.3 Å²	62.3	84%	0.836	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	33.7	176.3	-61	-176.9	-21	0	0	114.7	K528 A529 Q534	K528-Q532 PolarHBondContact O-N 3.19Å; A529-Q532 PolarHBondContact O-N 3.1Å; Q532-Q534 PolarHBondContact O-N 2.92Å
533	I	72.3	Confident	83.9	Confident	32 Å²	32	62.3 Å²	62.3	16%	0.164	33%	0.331	C	S	.	.			trans	-67.1	130.8	174.5	-50.4	-173.3	0	0	0	109	Y277 L303 V531 L535 I757	Y277-I533 HydrophobicContact CE1-CD1 4.15Å; L303-I533 HydrophobicContact CD2-CD1 3.51Å; V531-I533 HydrophobicContact CB-CG1 4.21Å; V531-I533 HydrophobicContact CG1-CD1 3.93Å; V531-I533 HydrophobicContact CG1-CG1 3.59Å; V531-I533 PolarHBondContact O-N 3.4Å; V531-I533 VanDerWaalsContact O-N 3.15Å; I533-L535 HydrophobicContact CB-CD1 4.48Å; I533-L535 HydrophobicContact CB-CG 4.25Å; I533-L535 HydrophobicContact CG2-CD2 4.31Å; I533-L535 HydrophobicContact CG2-CG 3.99Å; I533-L535 PolarHBondContact O-N 3.06Å; I533-I757 HydrophobicContact CD1-CD1 3.95Å; I533-I757 HydrophobicContact CD1-CG1 4.48Å; I533-I757 HydrophobicContact CG2-CG1 4.43Å
534	Q	74.8	Confident	83.6	Confident	197 Å²	197	64.4 Å²	64.4	92%	0.921	34%	0.34	S	S	*	.			trans	-60.1	99.2	167	-66.9	177.9	-4.5	0	0	109.5	Q532	Q532-Q534 PolarHBondContact O-N 2.92Å
535	L	80.3	Confident	83.4	Confident	38 Å²	38	63.2 Å²	63.2	20%	0.199	33%	0.334	C	S	.	.			trans	-129.5	141.8	173.9	-68.8	175.9	0	0	0	108	K528 I533 W755 I757	K528-L535 HydrophobicContact CD-CD1 3.9Å; K528-L535 HydrophobicContact CG-CD1 4.34Å; I533-L535 HydrophobicContact CB-CD1 4.48Å; I533-L535 HydrophobicContact CB-CG 4.25Å; I533-L535 HydrophobicContact CG2-CD2 4.31Å; I533-L535 HydrophobicContact CG2-CG 3.99Å; I533-L535 PolarHBondContact O-N 3.06Å; L535-W755 HydrophobicContact CB-CZ2 4.21Å; L535-W755 HydrophobicContact CD1-CH2 4.49Å; L535-W755 HydrophobicContact CD1-CZ2 4.11Å; L535-I757 HydrophobicContact CD2-CG1 4.33Å
536	P	85.4	Confident	83.2	Confident	25 Å²	25	67.7 Å²	67.7	16%	0.162	35%	0.351	C	S	.	.			trans	-65.7	163.5	175.3	27.7	-33.2	0	0	0	111.1	W755 Q759 R761 D762	P536-W755 PolarHBondContact O-NE1 2.82Å; P536-Q759 VanDerWaalsContact CD-O 3.31Å; P536-Q759 WeakPolarHBondContact CD-O 3.39Å; P536-Q759 HydrophobicContact CG-CB 4.33Å; P536-Q759 HydrophobicContact CG-CG 3.74Å; P536-R761 WeakPolarHBondContact CG-O 3.32Å; P536-D762 WeakPolarHBondContact CB-OD1 3.46Å
537	A	86.8	Confident	83	Confident	63 Å²	63	67.4 Å²	67.4	52%	0.521	35%	0.351	S	S	.	.			trans	-62.2	146	-174.1	0	0	0	0	0	111.7	D762 V763	A537-D762 HydrophobicContact CB-CB 4.42Å; A537-D762 WeakPolarHBondContact CB-OD1 3.38Å; A537-D762 PolarHBondContact N-OD1 3.43Å; A537-D762 WeakPolarHBondContact O-CA 3.41Å; A537-V763 PolarHBondContact O-N 2.84Å
538	K	87.3	Confident	83	Confident	67 Å²	67	67.4 Å²	67.4	29%	0.291	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	121.6	174.4	170	-177.5	158.9	-167.1	0	109	E752 W755 V763 I765	K538-E752 IonicContact NZ-OE1 2.69Å; K538-E752 PolarHBondContact NZ-OE1 2.99Å; K538-W755 HydrophobicContact CB-CD2 3.9Å; K538-W755 HydrophobicContact CB-CE3 4.37Å; K538-W755 HydrophobicContact CB-CG 4.26Å; K538-W755 HydrophobicContact CB-CH2 4.44Å; K538-W755 HydrophobicContact CB-CZ2 3.96Å; K538-W755 HydrophobicContact CD-CD2 3.54Å; K538-W755 HydrophobicContact CD-CE3 3.25Å; K538-W755 HydrophobicContact CD-CG 4.1Å; K538-W755 HydrophobicContact CD-CH2 4.21Å; K538-W755 HydrophobicContact CD-CZ2 4.42Å; K538-W755 HydrophobicContact CD-CZ3 3.63Å; K538-W755 HydrophobicContact CG-CD2 4.27Å; K538-W755 HydrophobicContact CG-CE3 4.41Å; K538-V763 WeakPolarHBondContact CA-O 3.37Å; K538-I765 HydrophobicContact CD-CD1 4.06Å; K538-I765 HydrophobicContact CG-CD1 3.91Å
539	S	88.2	Confident	82.9	Confident	52 Å²	52	71.8 Å²	71.8	36%	0.364	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	148.2	172.5	55.6	0	0	0	0	110.5	V763 I765	S539-V763 PolarHBondContact N-O 3.12Å; S539-I765 PolarHBondContact O-N 2.73Å
540	E	87.2	Confident	82.9	Confident	73 Å²	73	70 Å²	70	34%	0.341	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	125.8	174.1	-176.3	163	-173.5	0	0	109	R751 I765 R767	E540-R751 VanDerWaalsContact CD-NH1 3.29Å; E540-R751 IonicContact OE1-CZ 3.85Å; E540-R751 IonicContact OE1-NH1 2.83Å; E540-R751 PolarHBondContact OE1-NH1 2.85Å; E540-R751 VanDerWaalsContact OE1-NH1 3.1Å; E540-R751 IonicContact OE2-CZ 3.27Å; E540-R751 IonicContact OE2-NH1 3.68Å; E540-R751 PolarHBondContact OE2-NH1 3.04Å; E540-I765 CarbonylContact C-O 3.55Å; E540-I765 WeakPolarHBondContact CA-O 3.33Å; E540-I765 HydrophobicContact CB-CB 4.29Å; E540-I765 HydrophobicContact CG-CB 4.26Å; E540-I765 HydrophobicContact CG-CG2 4.01Å; E540-R767 IonicContact OE1-CZ 2.73Å; E540-R767 IonicContact OE1-NE 2.69Å; E540-R767 PolarHBondContact OE1-NE 2.97Å; E540-R767 IonicContact OE1-NH2 3.35Å; E540-R767 PolarHBondContact OE1-NH2 3.3Å
541	Q	88.4	Confident	83.2	Confident	89 Å²	89	65.1 Å²	65.1	42%	0.416	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	128.2	-179.8	-64.7	-175.8	-8.7	0	0	108.6	V764 I765 Y766 R767	Q541-V764 HydrophobicContact CG-CG1 4.47Å; Q541-I765 PolarHBondContact N-O 3.48Å; Q541-Y766 HydrophobicContact CB-CD1 4.25Å; Q541-Y766 HydrophobicContact CB-CE1 4.49Å; Q541-Y766 WeakPolarHBondContact O-CA 3.22Å; Q541-R767 PolarHBondContact O-N 3.39Å
542	V	88.3	Confident	83.7	Confident	39 Å²	39	66.6 Å²	66.6	24%	0.236	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	118.7	173.6	-176.1	0	0	0	0	107.4	F544 L769 Y779	V542-F544 HydrophobicContact CB-CE2 4.29Å; V542-F544 HydrophobicContact CB-CZ 4.3Å; V542-F544 HydrophobicContact CG1-CE1 4.05Å; V542-F544 HydrophobicContact CG1-CE2 3.93Å; V542-F544 HydrophobicContact CG1-CZ 3.59Å; V542-L769 HydrophobicContact CG1-CD1 3.49Å; V542-L769 VanDerWaalsContact CG1-CD1 3.49Å; V542-L769 HydrophobicContact CG1-CG 3.95Å; V542-Y779 HydrophobicContact CG2-CE1 4.47Å
543	L	88.5	Confident	84.6	Confident	48 Å²	48	63.5 Å²	63.5	25%	0.251	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	119.8	178.9	-58.9	-177	0	0	0	108.7	L639 Y766 R767 L768 L769	L543-L639 HydrophobicContact CD1-CD1 3.79Å; L543-Y766 HydrophobicContact CD1-CD1 3.9Å; L543-Y766 HydrophobicContact CG-CD1 4.31Å; L543-R767 PolarHBondContact N-O 3.43Å; L543-L768 HydrophobicContact CB-CD2 3.98Å; L543-L768 HydrophobicContact CD1-CD2 3.89Å; L543-L768 HydrophobicContact CG-CD2 4.45Å; L543-L769 PolarHBondContact O-N 3.43Å
544	F	86.5	Confident	85.2	Confident	65 Å²	65	63.4 Å²	63.4	29%	0.285	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	112	175.4	-60.9	-81.8	0	0	0	109.3	V542 L769 P822 T824	V542-F544 HydrophobicContact CB-CE2 4.29Å; V542-F544 HydrophobicContact CB-CZ 4.3Å; V542-F544 HydrophobicContact CG1-CE1 4.05Å; V542-F544 HydrophobicContact CG1-CE2 3.93Å; V542-F544 HydrophobicContact CG1-CZ 3.59Å; F544-L769 WeakPolarHBondContact CA-O 3.16Å; F544-L769 HydrophobicContact CD1-CB 4.46Å; F544-L769 HydrophobicContact CE1-CD1 4.18Å; F544-P822 HydrophobicContact CB-CG 4.3Å; F544-P822 HydrophobicContact CD1-CB 4.15Å; F544-P822 HydrophobicContact CD1-CG 4.47Å; F544-P822 HydrophobicContact CE1-CB 4.49Å; F544-P822 HydrophobicContact CG-CB 4.34Å; F544-P822 HydrophobicContact CG-CG 4.18Å; F544-T824 HydrophobicContact CE1-CG2 4.11Å; F544-T824 HydrophobicContact CZ-CG2 3.65Å
545	C	86.1	Confident	85.8	Confident	6 Å²	6	54.1 Å²	54.1	4%	0.041	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	120.6	173.2	-57.4	0	0	0	0	108.8	K632 L769 T770 S771	C545-K632 HydrophobicContact CB-CG 4.35Å; C545-L769 PolarHBondContact N-O 3.1Å; C545-T770 HydrophobicContact CB-CG2 4.08Å; C545-T770 WeakPolarHBondContact O-CA 3.32Å; C545-S771 PolarHBondContact O-N 3.17Å
546	R	85.5	Confident	86.1	Confident	165 Å²	165	57.5 Å²	57.5	62%	0.623	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-59.3	151	163.1	-73.5	176.8	164.3	153.4	-3	109.7	S631 E816	R546-S631 WeakPolarHBondContact O-CB 3.49Å; R546-S631 PolarHBondContact O-OG 3.02Å; R546-E816 IonicContact CZ-OE2 3.43Å; R546-E816 IonicContact NE-OE1 2.71Å; R546-E816 IonicContact NE-OE2 3.1Å; R546-E816 PolarHBondContact NE-OE2 2.94Å; R546-E816 IonicContact NH2-OE2 3.62Å; R546-E816 PolarHBondContact NH2-OE2 3.46Å
547	L	84.9	Confident	85.9	Confident	24 Å²	24	58.7 Å²	58.7	13%	0.126	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-70.1	153.5	167.6	-67.2	-178.4	0	0	0	110	Q551 Q552 Y555 T770 T773 F813	L547-Q551 HydrophobicContact CB-CB 4.08Å; L547-Q551 HydrophobicContact CD2-CB 4.14Å; L547-Q551 HydrophobicContact CG-CB 4.5Å; L547-Q552 HydrophobicContact CB-CB 4.35Å; L547-Y555 HydrophobicContact CD1-CD2 4.29Å; L547-Y555 HydrophobicContact CD1-CG 4.28Å; L547-T770 HydrophobicContact CD2-CG2 3.78Å; L547-T773 HydrophobicContact CD1-CG2 3.92Å; L547-T773 HydrophobicContact CD2-CG2 4.18Å; L547-T773 HydrophobicContact CG-CG2 4.1Å; L547-F813 HydrophobicContact CD1-CE2 4.1Å; L547-F813 HydrophobicContact CD1-CZ 4.01Å
548	T	84.4	Confident	85.9	Confident	31 Å²	31	57.4 Å²	57.4	19%	0.19	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-72.3	154.3	162.4	62.8	0	0	0	0	109.8	Y550 Q551 Q552 R629	T548-Y550 PolarHBondContact O-N 2.99Å; T548-Y550 VanDerWaalsContact O-N 3.12Å; T548-Q551 CarbonylContact O-C 3.54Å; T548-Q551 WeakPolarHBondContact O-CA 3.34Å; T548-Q551 WeakPolarHBondContact O-CB 3.49Å; T548-Q551 PolarHBondContact O-N 3.24Å; T548-Q551 WeakPolarHBondContact OG1-CG 3.34Å; T548-Q551 PolarHBondContact OG1-N 3.42Å; T548-Q551 VanDerWaalsContact OG1-N 3.15Å; T548-Q551 PolarHBondContact OG1-OE1 3.46Å; T548-Q552 PolarHBondContact O-N 2.99Å; T548-R629 PolarHBondContact OG1-O 3.32Å
549	D	82.1	Confident	85.7	Confident	104 Å²	104	55.6 Å²	55.6	56%	0.556	26%	0.26	S	S	*	.	H	α-helix	trans	-51.4	-37.9	175	-62.4	24.9	0	0	0	112.3	Q552 K553	D549-Q552 PolarHBondContact O-N 3.3Å; D549-K553 VanDerWaalsContact O-CB 3.3Å; D549-K553 WeakPolarHBondContact O-CB 3.49Å; D549-K553 WeakPolarHBondContact O-CD 3.35Å; D549-K553 WeakPolarHBondContact O-CG 3.37Å; D549-K553 PolarHBondContact O-N 2.89Å
550	Y	80.9	Confident	85.4	Confident	44 Å²	44	56.4 Å²	56.4	17%	0.173	26%	0.258	C	S	.	.	H	α-helix	trans	-65.5	-43.6	175.5	-178.1	-110.2	0	0	0	112.3	T548 L554 P588 R629	T548-Y550 PolarHBondContact O-N 2.99Å; T548-Y550 VanDerWaalsContact O-N 3.12Å; Y550-L554 HydrophobicContact CD1-CD1 4.21Å; Y550-L554 HydrophobicContact CE1-CD1 3.79Å; Y550-L554 HydrophobicContact CE2-CD1 4.22Å; Y550-L554 WeakPolarHBondContact O-CG 3.43Å; Y550-L554 PolarHBondContact O-N 2.91Å; Y550-P588 HydrophobicContact CD1-CB 4.13Å; Y550-P588 HydrophobicContact CD1-CG 3.78Å; Y550-P588 HydrophobicContact CE1-CB 3.68Å; Y550-P588 HydrophobicContact CE1-CG 3.6Å; Y550-R629 HydrophobicContact CD1-CB 4.07Å; Y550-R629 HydrophobicContact CD1-CG 4.34Å; Y550-R629 HydrophobicContact CE1-CB 4.33Å; Y550-R629 HydrophobicContact CE1-CG 4.43Å
551	Q	87.6	Confident	85.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.2	-41.1	172.4	-72.7	175	-72.5	0	0	111.9	L547 T548 L554 Y555 L584 C585 P588 R629 S631	L547-Q551 HydrophobicContact CB-CB 4.08Å; L547-Q551 HydrophobicContact CD2-CB 4.14Å; L547-Q551 HydrophobicContact CG-CB 4.5Å; T548-Q551 CarbonylContact O-C 3.54Å; T548-Q551 WeakPolarHBondContact O-CA 3.34Å; T548-Q551 WeakPolarHBondContact O-CB 3.49Å; T548-Q551 PolarHBondContact O-N 3.24Å; T548-Q551 WeakPolarHBondContact OG1-CG 3.34Å; T548-Q551 PolarHBondContact OG1-N 3.42Å; T548-Q551 VanDerWaalsContact OG1-N 3.15Å; T548-Q551 PolarHBondContact OG1-OE1 3.46Å; Q551-L554 PolarHBondContact O-N 3.1Å; Q551-Y555 VanDerWaalsContact O-CB 3.24Å; Q551-Y555 WeakPolarHBondContact O-CB 3.42Å; Q551-Y555 PolarHBondContact O-N 3.4Å; Q551-L584 PolarHBondContact NE2-O 2.76Å; Q551-C585 PolarHBondContact NE2-O 2.63Å; Q551-C585 VanDerWaalsContact NE2-O 3.12Å; Q551-P588 HydrophobicContact CG-CG 4.19Å; Q551-R629 WeakPolarHBondContact CG-O 3.2Å; Q551-S631 VanDerWaalsContact OE1-N 3.16Å
552	Q	85.6	Confident	84.5	Confident	58 Å²	58	53.4 Å²	53.4	27%	0.271	25%	0.246	S	C	.	.	H	α-helix	trans	-65.6	-46	-178.5	-170.4	-175.9	19.3	0	0	111.6	L547 T548 D549 Y555 R556 F813 D815	L547-Q552 HydrophobicContact CB-CB 4.35Å; T548-Q552 PolarHBondContact O-N 2.99Å; D549-Q552 PolarHBondContact O-N 3.3Å; Q552-Y555 PolarHBondContact O-N 3.08Å; Q552-Y555 VanDerWaalsContact O-N 3.15Å; Q552-R556 PolarHBondContact O-N 3.4Å; Q552-F813 HydrophobicContact CG-CE1 3.9Å; Q552-F813 HydrophobicContact CG-CZ 4.07Å; Q552-D815 PolarHBondContact NE2-OD1 3.4Å
553	K	85.1	Confident	83.9	Confident	113 Å²	113	55.3 Å²	55.3	49%	0.491	26%	0.257	S	S	.	.	H	α-helix	trans	-53.7	-54.8	173.1	-75.1	166.1	-176.4	175	0	110.4	D549 Y555 R556 E557	D549-K553 VanDerWaalsContact O-CB 3.3Å; D549-K553 WeakPolarHBondContact O-CB 3.49Å; D549-K553 WeakPolarHBondContact O-CD 3.35Å; D549-K553 WeakPolarHBondContact O-CG 3.37Å; D549-K553 PolarHBondContact O-N 2.89Å; K553-Y555 VanDerWaalsContact C-N 3.3Å; K553-Y555 PolarHBondContact O-N 3.45Å; K553-R556 PolarHBondContact O-N 3.24Å; K553-E557 WeakPolarHBondContact O-CB 3.5Å; K553-E557 PolarHBondContact O-N 3.45Å
554	L	85.6	Confident	83.1	Confident	31 Å²	31	53.1 Å²	53.1	16%	0.162	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-32.4	177.1	-71.3	171.6	0	0	0	113.6	Y550 Q551 Y558 L584 P588 T592	Y550-L554 HydrophobicContact CD1-CD1 4.21Å; Y550-L554 HydrophobicContact CE1-CD1 3.79Å; Y550-L554 HydrophobicContact CE2-CD1 4.22Å; Y550-L554 WeakPolarHBondContact O-CG 3.43Å; Y550-L554 PolarHBondContact O-N 2.91Å; Q551-L554 PolarHBondContact O-N 3.1Å; L554-Y558 WeakPolarHBondContact O-CB 3.29Å; L554-Y558 PolarHBondContact O-N 2.74Å; L554-L584 HydrophobicContact CB-CD1 3.9Å; L554-L584 HydrophobicContact CB-CD2 3.98Å; L554-L584 HydrophobicContact CD1-CD1 4Å; L554-P588 HydrophobicContact CD1-CB 3.81Å; L554-T592 HydrophobicContact CD1-CG2 4.05Å; L554-T592 HydrophobicContact CD2-CG2 4.29Å
555	Y	87	Confident	82.5	Confident	1 Å²	1	53.3 Å²	53.3	0%	0.004	25%	0.247	C	C	.	.	H	α-helix	trans	-73.5	-43	-177.7	-164.4	-82.8	0	0	0	111.1	L547 Q551 Q552 K553 L559 L581 L584 T773 I774 F813	L547-Y555 HydrophobicContact CD1-CD2 4.29Å; L547-Y555 HydrophobicContact CD1-CG 4.28Å; Q551-Y555 VanDerWaalsContact O-CB 3.24Å; Q551-Y555 WeakPolarHBondContact O-CB 3.42Å; Q551-Y555 PolarHBondContact O-N 3.4Å; Q552-Y555 PolarHBondContact O-N 3.08Å; Q552-Y555 VanDerWaalsContact O-N 3.15Å; K553-Y555 VanDerWaalsContact C-N 3.3Å; K553-Y555 PolarHBondContact O-N 3.45Å; Y555-L559 HydrophobicContact CD1-CD1 3.91Å; Y555-L559 HydrophobicContact CD1-CG 4.37Å; Y555-L559 HydrophobicContact CE1-CD1 3.69Å; Y555-L559 HydrophobicContact CE1-CG 4.3Å; Y555-L559 WeakPolarHBondContact O-CG 3.25Å; Y555-L559 PolarHBondContact O-N 3.15Å; Y555-L559 VanDerWaalsContact O-N 3.11Å; Y555-L581 HydrophobicContact CD2-CD2 4Å; Y555-L581 HydrophobicContact CE1-CD2 4.21Å; Y555-L581 HydrophobicContact CE2-CB 4.33Å; Y555-L581 HydrophobicContact CE2-CD2 3.6Å; Y555-L581 HydrophobicContact CG-CD2 4.46Å; Y555-L584 HydrophobicContact CD2-CD2 3.98Å; Y555-L584 HydrophobicContact CD2-CG 4.41Å; Y555-L584 HydrophobicContact CG-CD2 4.35Å; Y555-T773 HydrophobicContact CE2-CG2 4.25Å; Y555-T773 WeakPolarHBondContact OH-CA 3.41Å; Y555-I774 PolarHBondContact OH-N 2.67Å; Y555-F813 HydrophobicContact CD1-CB 4.19Å; Y555-F813 HydrophobicContact CD1-CD1 4.16Å; Y555-F813 AromaticContact CD1-CD2 3.75Å; Y555-F813 HydrophobicContact CD1-CD2 3.75Å; Y555-F813 HydrophobicContact CD1-CE1 4.47Å; Y555-F813 HydrophobicContact CD1-CE2 4.13Å; Y555-F813 AromaticContact CD1-CG 3.79Å; Y555-F813 HydrophobicContact CD1-CG 3.79Å; Y555-F813 HydrophobicContact CD1-CZ 4.48Å; Y555-F813 HydrophobicContact CE1-CB 3.89Å; Y555-F813 AromaticContact CE1-CD2 3.48Å; Y555-F813 HydrophobicContact CE1-CD2 3.48Å; Y555-F813 VanDerWaalsContact CE1-CD2 3.48Å; Y555-F813 HydrophobicContact CE1-CE2 4.15Å; Y555-F813 AromaticContact CE1-CG 3.75Å; Y555-F813 HydrophobicContact CE1-CG 3.75Å
556	R	85.9	Confident	81.8	Confident	110 Å²	110	56 Å²	56	42%	0.415	26%	0.26	S	S	.	.	H	α-helix	trans	-62	-53	171.1	-68.1	-169.1	-174	168.7	10.8	110.9	Q552 K553 Y558 L559 E560 F813 D815	Q552-R556 PolarHBondContact O-N 3.4Å; K553-R556 PolarHBondContact O-N 3.24Å; R556-Y558 PolarHBondContact O-N 2.99Å; R556-Y558 VanDerWaalsContact O-N 3.12Å; R556-L559 PolarHBondContact O-N 3Å; R556-E560 WeakPolarHBondContact O-CB 3.44Å; R556-E560 WeakPolarHBondContact O-CG 3.28Å; R556-E560 PolarHBondContact O-N 3.36Å; R556-F813 HydrophobicContact CG-CD1 4.07Å; R556-F813 HydrophobicContact CG-CE1 4.21Å; R556-D815 IonicContact CZ-OD1 3.18Å; R556-D815 IonicContact CZ-OD2 3.86Å; R556-D815 IonicContact NE-OD1 3.9Å; R556-D815 PolarHBondContact NE-OD1 3.09Å; R556-D815 IonicContact NE-OD2 2.71Å; R556-D815 PolarHBondContact NE-OD2 3.1Å; R556-D815 IonicContact NH2-OD1 2.62Å; R556-D815 PolarHBondContact NH2-OD1 2.94Å; R556-D815 IonicContact NH2-OD2 2.77Å; R556-D815 PolarHBondContact NH2-OD2 3.32Å
557	E	83.1	Confident	81	Confident	50 Å²	50	48.7 Å²	48.7	23%	0.234	23%	0.234	C	C	.	.	H	α-helix	trans	-52.9	-40	179.3	-140.8	-168.3	-176	0	0	111.7	K553 S561 F846	K553-E557 WeakPolarHBondContact O-CB 3.5Å; K553-E557 PolarHBondContact O-N 3.45Å; E557-S561 PolarHBondContact O-N 3.14Å; E557-S561 VanDerWaalsContact O-N 3.07Å; E557-F846 HydrophobicContact CB-CD2 4.36Å; E557-F846 HydrophobicContact CB-CE2 3.74Å; E557-F846 HydrophobicContact CB-CZ 4.4Å; E557-F846 VanDerWaalsContact CD-CE2 3.44Å; E557-F846 VanDerWaalsContact CD-CZ 3.4Å; E557-F846 HydrophobicContact CG-CD2 3.66Å; E557-F846 HydrophobicContact CG-CE2 3.35Å; E557-F846 HydrophobicContact CG-CG 4.47Å; E557-F846 HydrophobicContact CG-CZ 3.9Å; E557-F846 WeakPolarHBondContact O-CD2 3.36Å; E557-F846 WeakPolarHBondContact O-CE2 3.45Å; E557-F846 WeakPolarHBondContact OE2-CZ 3.33Å
558	Y	85.2	Confident	80.2	Confident	36 Å²	36	51.7 Å²	51.7	14%	0.141	25%	0.249	C	C	.	.	H	α-helix	trans	-71.3	-40.4	177	-174.4	-105.5	0	0	0	114	L554 R556 E560 S561 C564 S577 L580 L581	L554-Y558 WeakPolarHBondContact O-CB 3.29Å; L554-Y558 PolarHBondContact O-N 2.74Å; R556-Y558 PolarHBondContact O-N 2.99Å; R556-Y558 VanDerWaalsContact O-N 3.12Å; Y558-E560 VanDerWaalsContact C-N 3.27Å; Y558-E560 PolarHBondContact O-N 3.42Å; Y558-S561 VanDerWaalsContact O-CB 3.27Å; Y558-S561 WeakPolarHBondContact O-CB 3.34Å; Y558-S561 PolarHBondContact O-N 3.29Å; Y558-S561 PolarHBondContact O-OG 3.48Å; Y558-C564 VanDerWaalsContact CE1-SG 3.51Å; Y558-C564 PolarHBondContact O-SG 3.17Å; Y558-S577 WeakPolarHBondContact OH-CA 3.32Å; Y558-S577 VanDerWaalsContact OH-CB 3.25Å; Y558-S577 WeakPolarHBondContact OH-CB 3.49Å; Y558-S577 PolarHBondContact OH-OG 2.97Å; Y558-L580 HydrophobicContact CD1-CD2 4.45Å; Y558-L580 HydrophobicContact CD2-CD2 3.7Å; Y558-L580 HydrophobicContact CE1-CD2 4.16Å; Y558-L580 HydrophobicContact CE2-CD2 3.38Å; Y558-L580 HydrophobicContact CG-CD2 4.24Å; Y558-L581 HydrophobicContact CD1-CD2 3.68Å; Y558-L581 HydrophobicContact CD1-CG 4.02Å; Y558-L581 HydrophobicContact CE1-CD2 4.24Å; Y558-L581 HydrophobicContact CE1-CG 4.06Å
559	L	82.9	Confident	79.5	Confident	28 Å²	28	55.7 Å²	55.7	15%	0.147	27%	0.27	C	S	.	.	H	α-helix	trans	-66.2	-31.8	175	-73.4	-178.9	0	0	0	112.6	Y555 R556 S561 C564 L581 L811 F813	Y555-L559 HydrophobicContact CD1-CD1 3.91Å; Y555-L559 HydrophobicContact CD1-CG 4.37Å; Y555-L559 HydrophobicContact CE1-CD1 3.69Å; Y555-L559 HydrophobicContact CE1-CG 4.3Å; Y555-L559 WeakPolarHBondContact O-CG 3.25Å; Y555-L559 PolarHBondContact O-N 3.15Å; Y555-L559 VanDerWaalsContact O-N 3.11Å; R556-L559 PolarHBondContact O-N 3Å; L559-S561 VanDerWaalsContact C-N 3.32Å; L559-C564 WeakPolarHBondContact O-CB 3.45Å; L559-L581 HydrophobicContact CD2-CD1 4.3Å; L559-L581 HydrophobicContact CD2-CD2 4.08Å; L559-L581 HydrophobicContact CG-CD2 4.43Å; L559-L811 WeakPolarHBondContact CD1-O 3.32Å; L559-L811 HydrophobicContact CD2-CD2 4.48Å; L559-L811 WeakPolarHBondContact CD2-O 3.49Å; L559-F813 HydrophobicContact CD1-CB 3.57Å
560	E	82.4	Confident	78.6	Confident	69 Å²	69	53.9 Å²	53.9	32%	0.322	28%	0.275	S	S	.	.	H	α-helix	trans	-84.1	-10.1	179.1	-63.7	172.3	119.2	0	0	112.4	R556 Y558 K565 N844	R556-E560 WeakPolarHBondContact O-CB 3.44Å; R556-E560 WeakPolarHBondContact O-CG 3.28Å; R556-E560 PolarHBondContact O-N 3.36Å; Y558-E560 VanDerWaalsContact C-N 3.27Å; Y558-E560 PolarHBondContact O-N 3.42Å; E560-K565 WeakPolarHBondContact O-CE 3.47Å; E560-K565 PolarHBondContact O-NZ 3.02Å; E560-N844 WeakPolarHBondContact CB-ND2 3.25Å; E560-N844 WeakPolarHBondContact CB-OD1 3.43Å; E560-N844 PolarHBondContact OE1-ND2 2.91Å; E560-N844 PolarHBondContact OE2-ND2 2.89Å
561	S	82.2	Confident	77.6	Confident	11 Å²	11	58.9 Å²	58.9	8%	0.077	30%	0.298	C	S	.	.	S	Bend	trans	-60	151.1	174	79.1	0	0	0	0	113.1	E557 Y558 L559 V563 C564 K565	E557-S561 PolarHBondContact O-N 3.14Å; E557-S561 VanDerWaalsContact O-N 3.07Å; Y558-S561 VanDerWaalsContact O-CB 3.27Å; Y558-S561 WeakPolarHBondContact O-CB 3.34Å; Y558-S561 PolarHBondContact O-N 3.29Å; Y558-S561 PolarHBondContact O-OG 3.48Å; L559-S561 VanDerWaalsContact C-N 3.32Å; S561-V563 PolarHBondContact O-N 3.5Å; S561-V563 VanDerWaalsContact O-N 3.12Å; S561-C564 PolarHBondContact O-N 2.91Å; S561-C564 VanDerWaalsContact O-N 3.11Å; S561-K565 PolarHBondContact O-N 3.08Å; S561-K565 VanDerWaalsContact O-N 3.16Å
562	Q	74.6	Confident	76.3	Confident	89 Å²	89	61.5 Å²	61.5	42%	0.416	33%	0.325	S	S	.	.	H	α-helix	trans	-61.3	-23.3	178.2	-169.4	58.1	30.9	0	0	113.4	K565 D566	Q562-K565 PolarHBondContact O-N 2.83Å; Q562-D566 PolarHBondContact NE2-OD1 3.16Å; Q562-D566 WeakPolarHBondContact O-CB 3.44Å; Q562-D566 PolarHBondContact O-N 3.33Å
563	V	75.5	Confident	75.5	Confident	79 Å²	79	64.9 Å²	64.9	48%	0.479	35%	0.345	S	S	.	.	H	α-helix	trans	-63	-47.5	174.4	-177.6	0	0	0	0	110.7	S561 D566 L567	S561-V563 PolarHBondContact O-N 3.5Å; S561-V563 VanDerWaalsContact O-N 3.12Å; V563-D566 PolarHBondContact O-N 3.29Å; V563-L567 HydrophobicContact CG1-CD1 4.2Å; V563-L567 WeakPolarHBondContact O-CB 3.07Å; V563-L567 VanDerWaalsContact O-CG 3.24Å; V563-L567 WeakPolarHBondContact O-CG 3.38Å; V563-L567 PolarHBondContact O-N 3.45Å
564	C	71.7	Confident	75.1	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.007	33%	0.333	C	S	.	.	H	α-helix	trans	-68.5	-39.3	177.8	-72.2	0	0	0	0	111.7	Y558 L559 S561 D566 L567 L568	Y558-C564 VanDerWaalsContact CE1-SG 3.51Å; Y558-C564 PolarHBondContact O-SG 3.17Å; L559-C564 WeakPolarHBondContact O-CB 3.45Å; S561-C564 PolarHBondContact O-N 2.91Å; S561-C564 VanDerWaalsContact O-N 3.11Å; C564-D566 PolarHBondContact O-N 3.05Å; C564-L567 PolarHBondContact O-N 3.11Å; C564-L568 WeakPolarHBondContact O-CG 2.89Å; C564-L568 PolarHBondContact O-N 3.45Å
565	K	73.5	Confident	74.8	Confident	70 Å²	70	67.9 Å²	67.9	30%	0.304	36%	0.358	S	S	.	.	H	α-helix	trans	-58.9	-43.6	172.2	-66.4	163.4	172.9	152.2	0	112	E560 S561 Q562 N569 D847	E560-K565 WeakPolarHBondContact O-CE 3.47Å; E560-K565 PolarHBondContact O-NZ 3.02Å; S561-K565 PolarHBondContact O-N 3.08Å; S561-K565 VanDerWaalsContact O-N 3.16Å; Q562-K565 PolarHBondContact O-N 2.83Å; K565-N569 PolarHBondContact O-N 3.47Å; K565-N569 PolarHBondContact O-ND2 2.66Å; K565-D847 IonicContact NZ-OD2 2.69Å; K565-D847 PolarHBondContact NZ-OD2 2.99Å; K565-D847 VanDerWaalsContact NZ-OD2 3.12Å
566	D	73.3	Confident	74.6	Confident	62 Å²	62	71.4 Å²	71.4	33%	0.332	38%	0.382	S	S	.	.	H	α-helix	trans	-70.1	-37.6	178.6	-78	-12.8	0	0	0	112.5	Q562 V563 C564 N569 G570 K571	Q562-D566 PolarHBondContact NE2-OD1 3.16Å; Q562-D566 WeakPolarHBondContact O-CB 3.44Å; Q562-D566 PolarHBondContact O-N 3.33Å; V563-D566 PolarHBondContact O-N 3.29Å; C564-D566 PolarHBondContact O-N 3.05Å; D566-N569 CarbonylContact O-C 3.53Å; D566-N569 WeakPolarHBondContact O-CA 3.35Å; D566-N569 WeakPolarHBondContact O-CB 3.2Å; D566-N569 PolarHBondContact O-N 2.9Å; D566-N569 VanDerWaalsContact O-N 3.1Å; D566-G570 PolarHBondContact O-N 3.07Å; D566-K571 CarbonylContact C-O 3.49Å; D566-K571 HydrophobicContact CB-CB 4.43Å; D566-K571 PolarHBondContact O-N 3.47Å
567	L	68.8	Low	74.3	Confident	12 Å²	12	66.3 Å²	66.3	6%	0.063	36%	0.363	C	S	.	.	H	α-helix	trans	-65.9	-38.9	175	-71.2	173.9	0	0	0	113	V563 C564 N569 G570 G572 N573 I574 S577	V563-L567 HydrophobicContact CG1-CD1 4.2Å; V563-L567 WeakPolarHBondContact O-CB 3.07Å; V563-L567 VanDerWaalsContact O-CG 3.24Å; V563-L567 WeakPolarHBondContact O-CG 3.38Å; V563-L567 PolarHBondContact O-N 3.45Å; C564-L567 PolarHBondContact O-N 3.11Å; L567-N569 PolarHBondContact O-N 3.27Å; L567-G570 WeakPolarHBondContact O-CA 3.28Å; L567-G570 PolarHBondContact O-N 3.32Å; L567-G572 WeakPolarHBondContact CD2-O 3.33Å; L567-N573 VanDerWaalsContact CD2-C 3.47Å; L567-N573 WeakPolarHBondContact CD2-O 3.29Å; L567-I574 HydrophobicContact CD2-CG1 3.98Å; L567-S577 WeakPolarHBondContact CD1-OG 3.35Å
568	L	68	Low	74.4	Confident	87 Å²	87	64.7 Å²	64.7	46%	0.455	36%	0.356	S	S	.	.	H	α-helix	trans	-63.6	-26.9	171.6	-73.2	167.5	0	0	0	112.3	C564 G570 Q808 L811	C564-L568 WeakPolarHBondContact O-CG 2.89Å; C564-L568 PolarHBondContact O-N 3.45Å; L568-G570 VanDerWaalsContact C-N 3.26Å; L568-G570 PolarHBondContact O-N 2.96Å; L568-Q808 HydrophobicContact CD2-CG 4.1Å; L568-L811 HydrophobicContact CD2-CD1 3.88Å; L568-L811 HydrophobicContact CG-CD1 4.18Å
569	N	68	Low	74.4	Confident	115 Å²	115	67.1 Å²	67.1	62%	0.615	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	8.9	170.3	-70.5	-57.6	0	0	0	113.7	K565 D566 L567 K571	K565-N569 PolarHBondContact O-N 3.47Å; K565-N569 PolarHBondContact O-ND2 2.66Å; D566-N569 CarbonylContact O-C 3.53Å; D566-N569 WeakPolarHBondContact O-CA 3.35Å; D566-N569 WeakPolarHBondContact O-CB 3.2Å; D566-N569 PolarHBondContact O-N 2.9Å; D566-N569 VanDerWaalsContact O-N 3.1Å; L567-N569 PolarHBondContact O-N 3.27Å; N569-K571 VanDerWaalsContact C-N 3.3Å; N569-K571 PolarHBondContact O-N 2.93Å
570	G	63.9	Low	74.6	Confident	65 Å²	65	68.3 Å²	68.3	67%	0.67	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	13.5	179.4	0	0	0	0	0	114.9	D566 L567 L568	D566-G570 PolarHBondContact O-N 3.07Å; L567-G570 WeakPolarHBondContact O-CA 3.28Å; L567-G570 PolarHBondContact O-N 3.32Å; L568-G570 VanDerWaalsContact C-N 3.26Å; L568-G570 PolarHBondContact O-N 2.96Å
571	K	58.9	Low	74.9	Confident	150 Å²	150	65 Å²	65	65%	0.652	36%	0.361	S	S	*	.			trans	-106.9	98	-178.1	-66.9	178.7	-176.4	172.1	0	110.9	D566 N569	D566-K571 CarbonylContact C-O 3.49Å; D566-K571 HydrophobicContact CB-CB 4.43Å; D566-K571 PolarHBondContact O-N 3.47Å; N569-K571 VanDerWaalsContact C-N 3.3Å; N569-K571 PolarHBondContact O-N 2.93Å
572	G	61.6	Low	75.3	Confident	55 Å²	55	66.1 Å²	66.1	57%	0.567	36%	0.363	S	S	*	.	S	Bend	trans	129.4	-179.4	170.7	0	0	0	0	0	113.8	L567	L567-G572 WeakPolarHBondContact CD2-O 3.33Å
573	N	68.8	Low	76	Confident	129 Å²	129	63.1 Å²	63.1	69%	0.69	35%	0.351	S	S	*	.			trans	-87.3	117.2	178.6	-69.5	-31.9	0	0	0	110.1	L567 P576	L567-N573 VanDerWaalsContact CD2-C 3.47Å; L567-N573 WeakPolarHBondContact CD2-O 3.29Å; N573-P576 HydrophobicContact CB-CG 4.2Å; N573-P576 WeakPolarHBondContact O-CD 3.34Å
574	I	76.9	Confident	76.7	Confident	47 Å²	47	59.8 Å²	59.8	24%	0.241	33%	0.33	C	S	.	.	H	α-helix	trans	-70.2	-32.3	-179.8	-60.1	167.7	0	0	0	111.7	L567 S577 L578 L807	L567-I574 HydrophobicContact CD2-CG1 3.98Å; I574-S577 PolarHBondContact O-N 3.21Å; I574-L578 HydrophobicContact CG2-CD1 3.81Å; I574-L578 HydrophobicContact CG2-CD2 4.37Å; I574-L578 HydrophobicContact CG2-CG 3.88Å; I574-L578 PolarHBondContact O-N 2.89Å; I574-L578 VanDerWaalsContact O-N 3.16Å; I574-L807 HydrophobicContact CD1-CD1 3.82Å; I574-L807 HydrophobicContact CD1-CD2 4.24Å
575	F	79	Confident	77.5	Confident	159 Å²	159	59.7 Å²	59.7	70%	0.697	33%	0.329	S	S	*	.	H	α-helix	trans	-61.3	-44.6	-171.9	-60.5	-70.8	0	0	0	115.3	S577 L578 I579	F575-S577 VanDerWaalsContact C-N 3.27Å; F575-S577 PolarHBondContact O-N 3.15Å; F575-L578 PolarHBondContact O-N 3.09Å; F575-I579 WeakPolarHBondContact O-CD1 3.47Å; F575-I579 VanDerWaalsContact O-CG1 3.26Å; F575-I579 WeakPolarHBondContact O-CG1 3.22Å; F575-I579 PolarHBondContact O-N 2.78Å
576	P	81.7	Confident	78.4	Confident	76 Å²	76	56.4 Å²	56.4	49%	0.494	32%	0.315	S	S	.	.	H	α-helix	trans	-52.6	-41.4	172.2	-29.5	35.9	0	0	0	113.9	N573 I579 L580	N573-P576 HydrophobicContact CB-CG 4.2Å; N573-P576 WeakPolarHBondContact O-CD 3.34Å; P576-I579 PolarHBondContact O-N 3.33Å; P576-L580 PolarHBondContact O-N 3.23Å
577	S	81.1	Confident	79.2	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-69.7	-42.3	-179.8	-61.5	0	0	0	0	112.7	Y558 L567 I574 F575 I579 L580 L581	Y558-S577 WeakPolarHBondContact OH-CA 3.32Å; Y558-S577 VanDerWaalsContact OH-CB 3.25Å; Y558-S577 WeakPolarHBondContact OH-CB 3.49Å; Y558-S577 PolarHBondContact OH-OG 2.97Å; L567-S577 WeakPolarHBondContact CD1-OG 3.35Å; I574-S577 PolarHBondContact O-N 3.21Å; F575-S577 VanDerWaalsContact C-N 3.27Å; F575-S577 PolarHBondContact O-N 3.15Å; S577-I579 VanDerWaalsContact C-N 3.25Å; S577-I579 PolarHBondContact O-N 3.08Å; S577-L580 PolarHBondContact O-N 2.84Å; S577-L581 WeakPolarHBondContact O-CG 3.12Å; S577-L581 PolarHBondContact O-N 2.84Å
578	L	85.1	Confident	79.9	Confident	16 Å²	16	52.9 Å²	52.9	8%	0.084	30%	0.296	C	S	.	.	H	α-helix	trans	-63	-34	172.9	-60.3	178.1	0	0	0	111.8	I574 F575 R582 W742 I774 L810 L811	I574-L578 HydrophobicContact CG2-CD1 3.81Å; I574-L578 HydrophobicContact CG2-CD2 4.37Å; I574-L578 HydrophobicContact CG2-CG 3.88Å; I574-L578 PolarHBondContact O-N 2.89Å; I574-L578 VanDerWaalsContact O-N 3.16Å; F575-L578 PolarHBondContact O-N 3.09Å; L578-R582 PolarHBondContact O-N 2.86Å; L578-W742 HydrophobicContact CB-CZ2 4.44Å; L578-W742 HydrophobicContact CD1-CH2 4.14Å; L578-W742 HydrophobicContact CD1-CZ2 4.15Å; L578-I774 HydrophobicContact CB-CD1 3.78Å; L578-I774 HydrophobicContact CD2-CD1 3.55Å; L578-I774 HydrophobicContact CG-CD1 4.23Å; L578-I774 WeakPolarHBondContact O-CD1 3.12Å; L578-L810 HydrophobicContact CD2-CD1 4.45Å; L578-L811 HydrophobicContact CD2-CD2 4.15Å
579	I	85.5	Confident	80.7	Confident	86 Å²	86	48.8 Å²	48.8	44%	0.441	28%	0.275	S	S	.	.	H	α-helix	trans	-69.4	-40.7	174.1	-68.9	164.4	0	0	0	110.8	F575 P576 S577 N583	F575-I579 WeakPolarHBondContact O-CD1 3.47Å; F575-I579 VanDerWaalsContact O-CG1 3.26Å; F575-I579 WeakPolarHBondContact O-CG1 3.22Å; F575-I579 PolarHBondContact O-N 2.78Å; P576-I579 PolarHBondContact O-N 3.33Å; S577-I579 VanDerWaalsContact C-N 3.25Å; S577-I579 PolarHBondContact O-N 3.08Å; I579-N583 WeakPolarHBondContact O-CB 3.29Å; I579-N583 PolarHBondContact O-N 3.29Å; I579-N583 PolarHBondContact O-OD1 3.08Å
580	L	86.9	Confident	81.5	Confident	53 Å²	53	43.9 Å²	43.9	28%	0.277	25%	0.249	S	C	.	.	H	α-helix	trans	-68.3	-45.8	179.2	-162.8	76	0	0	0	112.1	Y558 P576 S577 R582 N583 L584 A591	Y558-L580 HydrophobicContact CD1-CD2 4.45Å; Y558-L580 HydrophobicContact CD2-CD2 3.7Å; Y558-L580 HydrophobicContact CE1-CD2 4.16Å; Y558-L580 HydrophobicContact CE2-CD2 3.38Å; Y558-L580 HydrophobicContact CG-CD2 4.24Å; P576-L580 PolarHBondContact O-N 3.23Å; S577-L580 PolarHBondContact O-N 2.84Å; L580-R582 VanDerWaalsContact C-N 3.33Å; L580-R582 PolarHBondContact O-N 3.28Å; L580-N583 WeakPolarHBondContact O-CB 3.24Å; L580-N583 PolarHBondContact O-N 2.82Å; L580-N583 VanDerWaalsContact O-N 3.09Å; L580-L584 WeakPolarHBondContact O-CB 3.46Å; L580-L584 PolarHBondContact O-N 2.88Å; L580-A591 HydrophobicContact CD1-CB 3.64Å; L580-A591 HydrophobicContact CG-CB 4.04Å
581	L	88.3	Confident	82.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-55.1	-47.8	175.1	-73.2	167.7	0	0	0	111.1	Y555 Y558 L559 S577 L584 C585 I774 L811	Y555-L581 HydrophobicContact CD2-CD2 4Å; Y555-L581 HydrophobicContact CE1-CD2 4.21Å; Y555-L581 HydrophobicContact CE2-CB 4.33Å; Y555-L581 HydrophobicContact CE2-CD2 3.6Å; Y555-L581 HydrophobicContact CG-CD2 4.46Å; Y558-L581 HydrophobicContact CD1-CD2 3.68Å; Y558-L581 HydrophobicContact CD1-CG 4.02Å; Y558-L581 HydrophobicContact CE1-CD2 4.24Å; Y558-L581 HydrophobicContact CE1-CG 4.06Å; L559-L581 HydrophobicContact CD2-CD1 4.3Å; L559-L581 HydrophobicContact CD2-CD2 4.08Å; L559-L581 HydrophobicContact CG-CD2 4.43Å; S577-L581 WeakPolarHBondContact O-CG 3.12Å; S577-L581 PolarHBondContact O-N 2.84Å; L581-L584 WeakPolarHBondContact O-CB 3.24Å; L581-L584 PolarHBondContact O-N 3.43Å; L581-C585 PolarHBondContact O-N 2.95Å; L581-C585 PolarHBondContact O-SG 2.92Å; L581-I774 HydrophobicContact CB-CB 4.41Å; L581-I774 HydrophobicContact CB-CD1 4.08Å; L581-I774 HydrophobicContact CB-CG2 3.96Å; L581-I774 HydrophobicContact CD1-CD1 4.28Å; L581-L811 HydrophobicContact CD1-CD2 3.83Å
582	R	89.6	Confident	82.7	Confident	34 Å²	34	38.1 Å²	38.1	13%	0.128	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-36	176	-171.2	-171.3	62	155.7	4.1	112.8	L578 L580 L584 C585 N586 D739 I774	L578-R582 PolarHBondContact O-N 2.86Å; L580-R582 VanDerWaalsContact C-N 3.33Å; L580-R582 PolarHBondContact O-N 3.28Å; R582-L584 VanDerWaalsContact C-N 3.28Å; R582-L584 PolarHBondContact O-N 3.42Å; R582-C585 PolarHBondContact O-N 3.39Å; R582-N586 WeakPolarHBondContact O-CB 3.48Å; R582-N586 PolarHBondContact O-N 3.49Å; R582-N586 PolarHBondContact O-ND2 2.88Å; R582-D739 IonicContact CZ-OD2 3.65Å; R582-D739 IonicContact NH1-OD2 2.71Å; R582-D739 PolarHBondContact NH1-OD2 2.82Å; R582-I774 HydrophobicContact CB-CG2 4.43Å
583	N	90.2	Very high	82.8	Confident	27 Å²	27	37.7 Å²	37.7	14%	0.144	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-38.1	173.4	-74.5	-8.2	0	0	0	111.1	I579 L580 N586 H587 L590	I579-N583 WeakPolarHBondContact O-CB 3.29Å; I579-N583 PolarHBondContact O-N 3.29Å; I579-N583 PolarHBondContact O-OD1 3.08Å; L580-N583 WeakPolarHBondContact O-CB 3.24Å; L580-N583 PolarHBondContact O-N 2.82Å; L580-N583 VanDerWaalsContact O-N 3.09Å; N583-N586 PolarHBondContact O-N 3.23Å; N583-H587 CarbonylContact O-C 3.45Å; N583-H587 PolarHBondContact O-N 2.9Å; N583-L590 HydrophobicContact CB-CB 4.08Å
584	L	89.2	Confident	82.6	Confident	8 Å²	8	31.9 Å²	31.9	4%	0.042	18%	0.183	C	C	.	.	H	α-helix	trans	-68.5	-42.5	177.7	178.4	56.4	0	0	0	112.4	Q551 L554 Y555 L580 L581 R582 N586 P588 A591	Q551-L584 PolarHBondContact NE2-O 2.76Å; L554-L584 HydrophobicContact CB-CD1 3.9Å; L554-L584 HydrophobicContact CB-CD2 3.98Å; L554-L584 HydrophobicContact CD1-CD1 4Å; Y555-L584 HydrophobicContact CD2-CD2 3.98Å; Y555-L584 HydrophobicContact CD2-CG 4.41Å; Y555-L584 HydrophobicContact CG-CD2 4.35Å; L580-L584 WeakPolarHBondContact O-CB 3.46Å; L580-L584 PolarHBondContact O-N 2.88Å; L581-L584 WeakPolarHBondContact O-CB 3.24Å; L581-L584 PolarHBondContact O-N 3.43Å; R582-L584 VanDerWaalsContact C-N 3.28Å; R582-L584 PolarHBondContact O-N 3.42Å; L584-N586 VanDerWaalsContact C-N 3.25Å; L584-N586 PolarHBondContact O-N 2.96Å; L584-P588 HydrophobicContact CD1-CB 3.76Å; L584-A591 HydrophobicContact CB-CB 4.46Å
585	C	90.1	Very high	81.6	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-57.4	-38.7	169.6	-63.7	0	0	0	0	112.3	Q551 L581 R582 T770 E775	Q551-C585 PolarHBondContact NE2-O 2.63Å; Q551-C585 VanDerWaalsContact NE2-O 3.12Å; L581-C585 PolarHBondContact O-N 2.95Å; L581-C585 PolarHBondContact O-SG 2.92Å; R582-C585 PolarHBondContact O-N 3.39Å; C585-T770 HydrophobicContact CB-CG2 4.45Å; C585-T770 WeakPolarHBondContact CB-OG1 3.25Å; C585-T770 PolarHBondContact SG-OG1 2.97Å; C585-T770 VanDerWaalsContact SG-OG1 3.37Å; C585-E775 HydrophobicContact CB-CG 4.13Å
586	N	91.6	Very high	80.1	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-73.4	-57.2	179.4	-78.6	-21.3	0	0	0	113	R582 N583 L584 S630 K632 M659 Y738 D739	R582-N586 WeakPolarHBondContact O-CB 3.48Å; R582-N586 PolarHBondContact O-N 3.49Å; R582-N586 PolarHBondContact O-ND2 2.88Å; N583-N586 PolarHBondContact O-N 3.23Å; L584-N586 VanDerWaalsContact C-N 3.25Å; L584-N586 PolarHBondContact O-N 2.96Å; N586-S630 PolarHBondContact O-OG 3.47Å; N586-K632 PolarHBondContact OD1-NZ 2.88Å; N586-M659 HydrophobicContact CB-SD 4.01Å; N586-Y738 HydrophobicContact CB-CE1 3.9Å; N586-Y738 PolarHBondContact O-OH 2.87Å; N586-Y738 WeakPolarHBondContact OD1-CE1 3.47Å; N586-D739 WeakPolarHBondContact OD1-CB 3.41Å
587	H	89.7	Confident	78.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.195	C	C	.	.			trans	-162.3	125.9	172.8	-165.6	-83.5	0	0	0	111	N583 D589 L590 C626 S630 M633 M659 L662	N583-H587 CarbonylContact O-C 3.45Å; N583-H587 PolarHBondContact O-N 2.9Å; H587-D589 VanDerWaalsContact C-N 3.32Å; H587-D589 IonicContact CE1-OD1 3.62Å; H587-D589 PolarHBondContact CE1-OD1 3.26Å; H587-D589 IonicContact CE1-OD2 2.64Å; H587-D589 WeakPolarHBondContact ND1-CB 3.3Å; H587-D589 PolarHBondContact ND1-N 3.42Å; H587-D589 IonicContact ND1-OD1 2.68Å; H587-D589 PolarHBondContact ND1-OD1 2.91Å; H587-D589 PolarHBondContact O-N 2.66Å; H587-L590 HydrophobicContact CB-CD1 4.16Å; H587-L590 HydrophobicContact CB-CG 4.23Å; H587-L590 WeakPolarHBondContact O-CB 3.48Å; H587-L590 PolarHBondContact O-N 3.29Å; H587-C626 PolarHBondContact NE2-O 2.9Å; H587-C626 VanDerWaalsContact NE2-O 3.14Å; H587-S630 VanDerWaalsContact CD2-CB 3.46Å; H587-S630 WeakPolarHBondContact CD2-CB 3.49Å; H587-M633 PolarHBondContact CD2-SD 3.37Å; H587-M659 HydrophobicContact CB-SD 4.35Å; H587-L662 HydrophobicContact CB-CD1 3.89Å
588	P	84.8	Confident	76.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-38	-172.3	20.5	-31.9	0	0	0	113.9	Y550 Q551 L554 L584 L590 A591 T592 R629	Y550-P588 HydrophobicContact CD1-CB 4.13Å; Y550-P588 HydrophobicContact CD1-CG 3.78Å; Y550-P588 HydrophobicContact CE1-CB 3.68Å; Y550-P588 HydrophobicContact CE1-CG 3.6Å; Q551-P588 HydrophobicContact CG-CG 4.19Å; L554-P588 HydrophobicContact CD1-CB 3.81Å; L584-P588 HydrophobicContact CD1-CB 3.76Å; P588-L590 PolarHBondContact O-N 3.02Å; P588-A591 WeakPolarHBondContact O-CA 3.3Å; P588-A591 WeakPolarHBondContact O-CB 3.38Å; P588-A591 PolarHBondContact O-N 2.95Å; P588-T592 PolarHBondContact O-N 3.35Å; P588-T592 PolarHBondContact O-OG1 3.49Å; P588-R629 HydrophobicContact CG-CB 3.76Å; P588-R629 WeakPolarHBondContact CG-O 3.44Å
589	D	84.5	Confident	74.5	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-57.7	-22.7	176.2	-55.8	27.8	0	0	0	114.2	H587 A591 G593 F624 G625 R629	H587-D589 VanDerWaalsContact C-N 3.32Å; H587-D589 IonicContact CE1-OD1 3.62Å; H587-D589 PolarHBondContact CE1-OD1 3.26Å; H587-D589 IonicContact CE1-OD2 2.64Å; H587-D589 WeakPolarHBondContact ND1-CB 3.3Å; H587-D589 PolarHBondContact ND1-N 3.42Å; H587-D589 IonicContact ND1-OD1 2.68Å; H587-D589 PolarHBondContact ND1-OD1 2.91Å; H587-D589 PolarHBondContact O-N 2.66Å; D589-A591 PolarHBondContact O-N 3.25Å; D589-G593 WeakPolarHBondContact O-CA 3.07Å; D589-G593 PolarHBondContact O-N 2.93Å; D589-F624 HydrophobicContact CB-CD2 3.84Å; D589-F624 HydrophobicContact CB-CE2 3.63Å; D589-F624 HydrophobicContact CB-CG 4.38Å; D589-F624 HydrophobicContact CB-CZ 3.98Å; D589-F624 WeakPolarHBondContact O-CE2 3.48Å; D589-F624 VanDerWaalsContact OD2-CA 3.3Å; D589-F624 WeakPolarHBondContact OD2-CA 3.49Å; D589-G625 PolarHBondContact OD2-N 2.61Å; D589-R629 IonicContact OD1-CZ 3.75Å; D589-R629 IonicContact OD1-NH1 2.7Å; D589-R629 PolarHBondContact OD1-NH1 3.43Å; D589-R629 IonicContact OD2-CZ 3.85Å; D589-R629 IonicContact OD2-NH1 2.81Å; D589-R629 PolarHBondContact OD2-NH1 2.89Å
590	L	83.3	Confident	72.6	Confident	12 Å²	12	44.2 Å²	44.2	6%	0.063	25%	0.247	C	C	.	.	H	α-helix	trans	-72.1	-17	174	-65.8	175.6	0	0	0	113	N583 H587 P588 R658 M659 L662	N583-L590 HydrophobicContact CB-CB 4.08Å; H587-L590 HydrophobicContact CB-CD1 4.16Å; H587-L590 HydrophobicContact CB-CG 4.23Å; H587-L590 WeakPolarHBondContact O-CB 3.48Å; H587-L590 PolarHBondContact O-N 3.29Å; P588-L590 PolarHBondContact O-N 3.02Å; L590-R658 HydrophobicContact CD2-CB 3.82Å; L590-M659 HydrophobicContact CD1-CB 4.44Å; L590-M659 HydrophobicContact CD1-SD 3.75Å; L590-L662 HydrophobicContact CD1-CD1 4.11Å; L590-L662 HydrophobicContact CD2-CD1 3.86Å; L590-L662 HydrophobicContact CG-CD1 3.85Å
591	A	76.7	Confident	70.6	Confident	36 Å²	36	46.7 Å²	46.7	30%	0.298	26%	0.26	S	S	.	.	H	α-helix	trans	-101.7	-46.2	174.2	0	0	0	0	0	111.9	L580 L584 P588 D589	L580-A591 HydrophobicContact CD1-CB 3.64Å; L580-A591 HydrophobicContact CG-CB 4.04Å; L584-A591 HydrophobicContact CB-CB 4.46Å; P588-A591 WeakPolarHBondContact O-CA 3.3Å; P588-A591 WeakPolarHBondContact O-CB 3.38Å; P588-A591 PolarHBondContact O-N 2.95Å; D589-A591 PolarHBondContact O-N 3.25Å
592	T	71.2	Confident	68.2	Low	58 Å²	58	53.5 Å²	53.5	36%	0.356	30%	0.296	S	S	.	.	H	α-helix	trans	-81	-24.4	-176.8	64.7	0	0	0	0	114.2	L554 P588 G594	L554-T592 HydrophobicContact CD1-CG2 4.05Å; L554-T592 HydrophobicContact CD2-CG2 4.29Å; P588-T592 PolarHBondContact O-N 3.35Å; P588-T592 PolarHBondContact O-OG1 3.49Å; T592-G594 PolarHBondContact OG1-N 2.84Å; T592-G594 PolarHBondContact OG1-O 3.32Å
593	G	64.6	Low	65.8	Low	45 Å²	45	58.1 Å²	58.1	46%	0.464	32%	0.319	S	S	.	.			trans	88.4	4.2	-169.9	0	0	0	0	0	114.4	D589 F624	D589-G593 WeakPolarHBondContact O-CA 3.07Å; D589-G593 PolarHBondContact O-N 2.93Å; G593-F624 WeakPolarHBondContact O-CD2 3.44Å
594	G	63.6	Low	63.2	Low	7 Å²	7	63.7 Å²	63.7	7%	0.072	35%	0.345	C	S	.	.	S	Bend	trans	106.9	173.4	-174.2	0	0	0	0	0	112.1	T592 R596	T592-G594 PolarHBondContact OG1-N 2.84Å; T592-G594 PolarHBondContact OG1-O 3.32Å; G594-R596 PolarHBondContact O-N 2.85Å; G594-R596 VanDerWaalsContact O-N 3.12Å
595	P	56.6	Low	61	Low	49 Å²	49	69.2 Å²	69.2	32%	0.318	37%	0.368	S	S	.	.			trans	-70.5	106.6	175.8	29.6	-33.5	0	0	0	109.9	S622	P595-S622 WeakPolarHBondContact CG-O 3.37Å
596	R	48.6	Very low	58.6	Low	207 Å²	207	75.3 Å²	75.3	78%	0.781	40%	0.397	S	S	*	.			trans	-109.3	-8.4	171.6	-74.5	-173.4	166.6	-153.2	-9.2	113.4	G594	G594-R596 PolarHBondContact O-N 2.85Å; G594-R596 VanDerWaalsContact O-N 3.12Å
597	D	44	Very low	56.1	Low	110 Å²	110	79.7 Å²	79.7	59%	0.588	43%	0.427	S	S	*	.			trans	-103.9	123.2	-177.2	-53.4	-58.4	0	0	0	110.8	C599	D597-C599 PolarHBondContact O-N 3.46Å
598	S	42.2	Very low	53.8	Low	80 Å²	80	83.2 Å²	83.2	56%	0.559	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-64.8	-16.9	172.9	49.1	0	0	0	0	113.2	F600 L601	S598-F600 PolarHBondContact O-N 3Å; S598-L601 PolarHBondContact O-N 3.01Å
599	C	43	Very low	51.9	Low	85 Å²	85	88.7 Å²	88.7	57%	0.574	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-61.3	-12.9	-177.2	-53.1	0	0	0	0	115.4	D597	D597-C599 PolarHBondContact O-N 3.46Å
600	F	45	Very low	49.7	Very low	115 Å²	115	97.6 Å²	97.6	50%	0.504	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-116	10.1	175.1	-69.6	-73.2	0	0	0	113.4	S598	S598-F600 PolarHBondContact O-N 3Å
601	L	46	Very low	47.6	Very low	106 Å²	106	100.8 Å²	100.8	56%	0.555	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-11.5	175	-69.5	174.8	0	0	0	113.3	S598	S598-L601 PolarHBondContact O-N 3.01Å
602	N	38.5	Very low	45.9	Very low	142 Å²	142	101.6 Å²	101.6	76%	0.759	55%	0.546	S	S	*	.	S	Bend	trans	-102.8	-5	-171.1	-65.1	17.8	0	0	0	114.1
603	E	38.6	Very low	44.7	Very low	132 Å²	132	103.7 Å²	103.7	62%	0.617	55%	0.552	S	S	*	*			trans	-107.9	94.7	169	-73.7	178.7	176.3	0	0	108.5	F605	E603-F605 HydrophobicContact CB-CD2 4.39Å; E603-F605 HydrophobicContact CB-CE2 4.18Å; E603-F605 PolarHBondContact O-N 3.09Å; E603-F605 VanDerWaalsContact O-N 3.11Å
604	E	35.7	Very low	43.9	Very low	144 Å²	144	108.2 Å²	108.2	67%	0.673	57%	0.566	S	S	*	*			trans	-66.6	107.3	162.3	-81	-156.6	-146.9	0	0	108.7	E606 K609	E604-E606 HydrophobicContact CB-CG 3.91Å; E604-E606 PolarHBondContact O-N 2.95Å; E604-K609 WeakPolarHBondContact OE2-CE 3.37Å; E604-K609 IonicContact OE2-NZ 2.74Å; E604-K609 PolarHBondContact OE2-NZ 3.31Å
605	F	43.2	Very low	43.3	Very low	124 Å²	124	111.2 Å²	111.2	54%	0.544	58%	0.582	S	S	.	*			trans	-70.2	76.8	163.6	-84.8	-98.3	0	0	0	109.1	E603 S607 D608	E603-F605 HydrophobicContact CB-CD2 4.39Å; E603-F605 HydrophobicContact CB-CE2 4.18Å; E603-F605 PolarHBondContact O-N 3.09Å; E603-F605 VanDerWaalsContact O-N 3.11Å; F605-S607 PolarHBondContact O-N 2.86Å; F605-D608 WeakPolarHBondContact O-CB 3.41Å; F605-D608 PolarHBondContact O-N 3.34Å
606	E	38.6	Very low	43.1	Very low	127 Å²	127	109.6 Å²	109.6	59%	0.593	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-62.6	-25.1	-177.3	-66.1	-147.5	83.3	0	0	113.4	E604 D608 K609	E604-E606 HydrophobicContact CB-CG 3.91Å; E604-E606 PolarHBondContact O-N 2.95Å; E606-D608 PolarHBondContact O-N 2.82Å; E606-D608 VanDerWaalsContact O-N 3.16Å; E606-K609 HydrophobicContact CB-CD 4.36Å; E606-K609 WeakPolarHBondContact O-CB 3.39Å; E606-K609 VanDerWaalsContact O-CG 3.26Å; E606-K609 WeakPolarHBondContact O-CG 3.24Å; E606-K609 PolarHBondContact O-N 3.46Å; E606-K609 IonicContact OE1-NZ 2.66Å; E606-K609 PolarHBondContact OE1-NZ 3.24Å
607	S	40	Very low	43.1	Very low	93 Å²	93	103.9 Å²	103.9	65%	0.65	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-54.7	-30.9	175.2	54	0	0	0	0	113.5	F605 K609	F605-S607 PolarHBondContact O-N 2.86Å; S607-K609 PolarHBondContact O-N 2.88Å
608	D	41.3	Very low	43.5	Very low	74 Å²	74	102.9 Å²	102.9	40%	0.396	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-78.5	1	-174.2	-121	49.5	0	0	0	113.4	F605 E606 Q610 R628	F605-D608 WeakPolarHBondContact O-CB 3.41Å; F605-D608 PolarHBondContact O-N 3.34Å; E606-D608 PolarHBondContact O-N 2.82Å; E606-D608 VanDerWaalsContact O-N 3.16Å; D608-Q610 VanDerWaalsContact C-N 3.26Å; D608-Q610 PolarHBondContact O-N 2.75Å; D608-R628 IonicContact OD2-NH2 2.67Å; D608-R628 PolarHBondContact OD2-NH2 3.45Å
609	K	44.6	Very low	44.2	Very low	116 Å²	116	100.2 Å²	100.2	50%	0.504	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-75.7	-9.4	-178.5	-66.6	173.5	-178.4	177.8	0	112.9	E604 E606 S607	E604-K609 WeakPolarHBondContact OE2-CE 3.37Å; E604-K609 IonicContact OE2-NZ 2.74Å; E604-K609 PolarHBondContact OE2-NZ 3.31Å; E606-K609 HydrophobicContact CB-CD 4.36Å; E606-K609 WeakPolarHBondContact O-CB 3.39Å; E606-K609 VanDerWaalsContact O-CG 3.26Å; E606-K609 WeakPolarHBondContact O-CG 3.24Å; E606-K609 PolarHBondContact O-N 3.46Å; E606-K609 IonicContact OE1-NZ 2.66Å; E606-K609 PolarHBondContact OE1-NZ 3.24Å; S607-K609 PolarHBondContact O-N 2.88Å
610	Q	38.7	Very low	44.8	Very low	188 Å²	188	99.2 Å²	99.2	88%	0.879	53%	0.53	S	S	*	.	S	Bend	trans	-117.4	90.3	-174.7	-65.4	176.5	-2.7	0	0	112.6	D608	D608-Q610 VanDerWaalsContact C-N 3.26Å; D608-Q610 PolarHBondContact O-N 2.75Å
611	G	38.3	Very low	45.4	Very low	79 Å²	79	99.1 Å²	99.1	81%	0.814	53%	0.526	S	S	*	.	S	Bend	trans	140.9	-11.4	163.8	0	0	0	0	0	117.9
612	I	40.7	Very low	45.8	Very low	52 Å²	52	97.4 Å²	97.4	27%	0.267	52%	0.523	S	S	.	.	S	Bend	trans	-98.5	125.7	-177.9	-56.1	177.1	0	0	0	110.4	C616 L634	I612-C616 HydrophobicContact CG2-CB 4.24Å; I612-L634 HydrophobicContact CG2-CD1 4.23Å
613	E	46.3	Very low	47.1	Very low	103 Å²	103	97.9 Å²	97.9	48%	0.481	51%	0.514	S	S	.	.			trans	-54.2	139.7	-171.7	-60.8	-165.6	149.9	0	0	115	V615 C616 K641	E613-V615 PolarHBondContact O-N 3.48Å; E613-C616 PolarHBondContact O-N 3.26Å; E613-K641 IonicContact OE1-NZ 3.48Å; E613-K641 PolarHBondContact OE1-NZ 3.17Å; E613-K641 WeakPolarHBondContact OE2-CD 3.38Å; E613-K641 IonicContact OE2-NZ 2.67Å; E613-K641 PolarHBondContact OE2-NZ 3.01Å
614	N	48.7	Very low	48.8	Very low	140 Å²	140	94.5 Å²	94.5	75%	0.749	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-43.5	-31	-173.6	-64.1	-8.2	0	0	0	116.3	C616 L617	N614-C616 VanDerWaalsContact C-N 3.32Å; N614-C616 PolarHBondContact O-N 3.06Å; N614-L617 PolarHBondContact O-N 3.23Å
615	V	50.6	Low	50.6	Low	70 Å²	70	88 Å²	88	42%	0.424	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-59.4	-41.7	-179.7	-174.3	0	0	0	0	111.5	E613 L617 S618 M670	E613-V615 PolarHBondContact O-N 3.48Å; V615-L617 VanDerWaalsContact C-N 3.33Å; V615-L617 PolarHBondContact O-N 3.5Å; V615-S618 PolarHBondContact O-N 2.95Å; V615-S618 PolarHBondContact O-OG 2.74Å; V615-M670 HydrophobicContact CG1-CE 4.38Å; V615-M670 HydrophobicContact CG1-CG 4.46Å
616	C	51.8	Low	52.3	Low	15 Å²	15	82 Å²	82	10%	0.101	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-77.9	-15.5	-177.3	-73	0	0	0	0	113.9	I612 E613 N614 S618 R628	I612-C616 HydrophobicContact CG2-CB 4.24Å; E613-C616 PolarHBondContact O-N 3.26Å; N614-C616 VanDerWaalsContact C-N 3.32Å; N614-C616 PolarHBondContact O-N 3.06Å; C616-S618 VanDerWaalsContact C-N 3.33Å; C616-R628 HydrophobicContact CB-CG 4.33Å
617	L	49	Very low	54.3	Low	86 Å²	86	76.4 Å²	76.4	45%	0.45	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-75.8	-22.7	176.3	-61.3	178.2	0	0	0	112.5	N614 V615 Y619	N614-L617 PolarHBondContact O-N 3.23Å; V615-L617 VanDerWaalsContact C-N 3.33Å; V615-L617 PolarHBondContact O-N 3.5Å; L617-Y619 PolarHBondContact O-N 3.29Å
618	S	52.9	Low	56.2	Low	89 Å²	89	74.2 Å²	74.2	62%	0.622	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-66.8	-13.4	178.8	70	0	0	0	0	115	V615 C616	V615-S618 PolarHBondContact O-N 2.95Å; V615-S618 PolarHBondContact O-OG 2.74Å; C616-S618 VanDerWaalsContact C-N 3.33Å
619	Y	57.1	Low	58.1	Low	25 Å²	25	70.8 Å²	70.8	10%	0.098	38%	0.376	C	S	.	.	S	Bend	trans	-102.3	107.5	-173.6	-157.3	-89	0	0	0	111.7	L617 W621 R623 F624 C626 L669	L617-Y619 PolarHBondContact O-N 3.29Å; Y619-W621 PolarHBondContact O-N 2.84Å; Y619-R623 HydrophobicContact CD1-CB 4.17Å; Y619-R623 HydrophobicContact CE1-CB 3.36Å; Y619-F624 PolarHBondContact OH-O 2.83Å; Y619-C626 HydrophobicContact CD1-CB 3.6Å; Y619-C626 VanDerWaalsContact CE1-CA 3.47Å; Y619-C626 HydrophobicContact CE1-CB 3.76Å; Y619-L669 HydrophobicContact CD2-CD1 3.52Å; Y619-L669 HydrophobicContact CD2-CD2 4.21Å; Y619-L669 HydrophobicContact CE2-CD1 3.69Å; Y619-L669 HydrophobicContact CE2-CD2 4.49Å
620	S	54.7	Low	60.2	Low	63 Å²	63	65.3 Å²	65.3	44%	0.441	35%	0.352	S	S	.	.			trans	-54.2	133.9	-179.2	-178.6	0	0	0	0	112.9	S622 R623	S620-S622 PolarHBondContact O-N 3.2Å; S620-S622 PolarHBondContact OG-OG 2.82Å; S620-R623 PolarHBondContact O-N 3.06Å
621	W	58.8	Low	62.5	Low	113 Å²	113	57 Å²	57	43%	0.428	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-9.2	-179.5	-96.1	91.1	0	0	0	114.9	Y619 R628 R629	Y619-W621 PolarHBondContact O-N 2.84Å; W621-R628 HydrophobicContact CZ2-CB 4.18Å; W621-R629 HydrophobicContact CE3-CG 4.34Å; W621-R629 HydrophobicContact CH2-CG 4.3Å; W621-R629 HydrophobicContact CZ3-CG 3.88Å; W621-R629 PolarHBondContact O-NH2 2.97Å
622	S	54.5	Low	65	Low	71 Å²	71	53.3 Å²	53.3	50%	0.497	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-20.1	172.3	61.5	0	0	0	0	114.4	P595 S620	P595-S622 WeakPolarHBondContact CG-O 3.37Å; S620-S622 PolarHBondContact O-N 3.2Å; S620-S622 PolarHBondContact OG-OG 2.82Å
623	R	64.8	Low	67.3	Low	151 Å²	151	50.9 Å²	50.9	57%	0.57	26%	0.264	S	S	*	.	S	Bend	trans	-82.5	147	-168.1	-72.4	-179	173.5	-178.8	-2	113.8	Y619 S620 G625 R629	Y619-R623 HydrophobicContact CD1-CB 4.17Å; Y619-R623 HydrophobicContact CE1-CB 3.36Å; S620-R623 PolarHBondContact O-N 3.06Å; R623-G625 PolarHBondContact O-N 3.02Å; R623-R629 PolarHBondContact O-NH1 3.16Å; R623-R629 PolarHBondContact O-NH2 2.8Å
624	F	73.5	Confident	69.3	Low	62 Å²	62	49 Å²	49	27%	0.272	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	116.6	178.9	-176.4	-80.6	0	0	0	111.6	D589 G593 Y619 L662 R665	D589-F624 HydrophobicContact CB-CD2 3.84Å; D589-F624 HydrophobicContact CB-CE2 3.63Å; D589-F624 HydrophobicContact CB-CG 4.38Å; D589-F624 HydrophobicContact CB-CZ 3.98Å; D589-F624 WeakPolarHBondContact O-CE2 3.48Å; D589-F624 VanDerWaalsContact OD2-CA 3.3Å; D589-F624 WeakPolarHBondContact OD2-CA 3.49Å; G593-F624 WeakPolarHBondContact O-CD2 3.44Å; Y619-F624 PolarHBondContact OH-O 2.83Å; F624-L662 HydrophobicContact CD1-CD2 3.93Å; F624-L662 HydrophobicContact CE1-CD2 3.76Å; F624-L662 HydrophobicContact CE1-CG 4.5Å; F624-R665 PolarHBondContact O-NH1 2.68Å
625	G	74.6	Confident	71.2	Confident	6 Å²	6	44.3 Å²	44.3	6%	0.062	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.4	27.9	-177.8	0	0	0	0	0	115.7	D589 R623 P627	D589-G625 PolarHBondContact OD2-N 2.61Å; R623-G625 PolarHBondContact O-N 3.02Å; G625-P627 WeakPolarHBondContact O-CD 3.49Å
626	C	79.5	Confident	73.2	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.			trans	-65.6	118	179.6	-178.9	0	0	0	0	111.8	H587 Y619 R628 R629	H587-C626 PolarHBondContact NE2-O 2.9Å; H587-C626 VanDerWaalsContact NE2-O 3.14Å; Y619-C626 HydrophobicContact CD1-CB 3.6Å; Y619-C626 VanDerWaalsContact CE1-CA 3.47Å; Y619-C626 HydrophobicContact CE1-CB 3.76Å; C626-R628 PolarHBondContact O-N 3.01Å; C626-R629 HydrophobicContact CB-CG 4.32Å; C626-R629 PolarHBondContact O-N 3.19Å
627	P	79.3	Confident	75	Confident	9 Å²	9	40.5 Å²	40.5	6%	0.058	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-55.3	-32	-175.7	-26.5	34.5	0	0	0	114.3	G625 R629 S630 M633 L666	G625-P627 WeakPolarHBondContact O-CD 3.49Å; P627-R629 PolarHBondContact O-N 3.4Å; P627-R629 VanDerWaalsContact O-N 3.17Å; P627-S630 PolarHBondContact O-N 3.12Å; P627-S630 VanDerWaalsContact O-N 3.16Å; P627-M633 HydrophobicContact CB-CB 4.24Å; P627-M633 HydrophobicContact CB-CE 4.46Å; P627-M633 HydrophobicContact CG-CE 4.2Å; P627-L666 HydrophobicContact CB-CD1 4.34Å; P627-L666 HydrophobicContact CG-CD1 4.19Å
628	R	79.5	Confident	76.8	Confident	46 Å²	46	39 Å²	39	17%	0.174	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-59.5	-24.4	178.1	-66.3	-174.1	66.8	177.8	-0.5	113.8	D608 C616 W621 C626	D608-R628 IonicContact OD2-NH2 2.67Å; D608-R628 PolarHBondContact OD2-NH2 3.45Å; C616-R628 HydrophobicContact CB-CG 4.33Å; W621-R628 HydrophobicContact CZ2-CB 4.18Å; C626-R628 PolarHBondContact O-N 3.01Å
629	R	82.6	Confident	78.7	Confident	3 Å²	3	36 Å²	36	1%	0.011	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-82.1	-11.5	-179.8	-55.8	-163.2	-146.9	97.3	5.2	113.9	T548 Y550 Q551 P588 D589 W621 R623 C626 P627	T548-R629 PolarHBondContact OG1-O 3.32Å; Y550-R629 HydrophobicContact CD1-CB 4.07Å; Y550-R629 HydrophobicContact CD1-CG 4.34Å; Y550-R629 HydrophobicContact CE1-CB 4.33Å; Y550-R629 HydrophobicContact CE1-CG 4.43Å; Q551-R629 WeakPolarHBondContact CG-O 3.2Å; P588-R629 HydrophobicContact CG-CB 3.76Å; P588-R629 WeakPolarHBondContact CG-O 3.44Å; D589-R629 IonicContact OD1-CZ 3.75Å; D589-R629 IonicContact OD1-NH1 2.7Å; D589-R629 PolarHBondContact OD1-NH1 3.43Å; D589-R629 IonicContact OD2-CZ 3.85Å; D589-R629 IonicContact OD2-NH1 2.81Å; D589-R629 PolarHBondContact OD2-NH1 2.89Å; W621-R629 HydrophobicContact CE3-CG 4.34Å; W621-R629 HydrophobicContact CH2-CG 4.3Å; W621-R629 HydrophobicContact CZ3-CG 3.88Å; W621-R629 PolarHBondContact O-NH2 2.97Å; R623-R629 PolarHBondContact O-NH1 3.16Å; R623-R629 PolarHBondContact O-NH2 2.8Å; C626-R629 HydrophobicContact CB-CG 4.32Å; C626-R629 PolarHBondContact O-N 3.19Å; P627-R629 PolarHBondContact O-N 3.4Å; P627-R629 VanDerWaalsContact O-N 3.17Å
630	S	87.8	Confident	80.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.18	C	C	.	.			trans	-126.1	116.5	179.2	171.8	0	0	0	0	111.1	N586 H587 P627 K632 M633 L634	N586-S630 PolarHBondContact O-OG 3.47Å; H587-S630 VanDerWaalsContact CD2-CB 3.46Å; H587-S630 WeakPolarHBondContact CD2-CB 3.49Å; P627-S630 PolarHBondContact O-N 3.12Å; P627-S630 VanDerWaalsContact O-N 3.16Å; S630-K632 PolarHBondContact O-N 3.06Å; S630-M633 PolarHBondContact O-N 3.26Å; S630-M633 PolarHBondContact OG-N 3.02Å; S630-L634 PolarHBondContact O-N 3.24Å
631	S	86.8	Confident	82	Confident	15 Å²	15	35 Å²	35	11%	0.105	17%	0.172	C	C	.	.	H	α-helix	trans	-58.6	-36.5	177.2	59.8	0	0	0	0	112.1	R546 Q551 L634 V635	R546-S631 WeakPolarHBondContact O-CB 3.49Å; R546-S631 PolarHBondContact O-OG 3.02Å; Q551-S631 VanDerWaalsContact OE1-N 3.16Å; S631-L634 PolarHBondContact O-N 3.33Å; S631-V635 WeakPolarHBondContact O-CG2 3.22Å; S631-V635 PolarHBondContact O-N 2.95Å
632	K	90.7	Very high	83.5	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.6	-43.6	172	-75.9	-166.9	176.8	-171.8	0	112.6	C545 N586 S630 L634 V635 V636 Y738 L768 T770 E775	C545-K632 HydrophobicContact CB-CG 4.35Å; N586-K632 PolarHBondContact OD1-NZ 2.88Å; S630-K632 PolarHBondContact O-N 3.06Å; K632-L634 VanDerWaalsContact C-N 3.32Å; K632-V635 PolarHBondContact O-N 2.86Å; K632-V636 VanDerWaalsContact O-CG2 3.28Å; K632-V636 WeakPolarHBondContact O-CG2 3.2Å; K632-V636 PolarHBondContact O-N 2.9Å; K632-Y738 HydrophobicContact CB-CE2 3.81Å; K632-Y738 VanDerWaalsContact CB-OH 3.29Å; K632-Y738 WeakPolarHBondContact CB-OH 3.38Å; K632-Y738 HydrophobicContact CD-CE1 4.07Å; K632-Y738 HydrophobicContact CD-CE2 4.32Å; K632-Y738 PolarHBondContact NZ-O 2.74Å; K632-L768 HydrophobicContact CB-CD1 4.45Å; K632-L768 HydrophobicContact CD-CB 4.35Å; K632-L768 HydrophobicContact CG-CD1 4.49Å; K632-T770 HydrophobicContact CG-CG2 4.18Å; K632-E775 WeakPolarHBondContact CE-OE2 3.42Å; K632-E775 IonicContact NZ-OE1 3.27Å; K632-E775 PolarHBondContact NZ-OE1 2.82Å; K632-E775 IonicContact NZ-OE2 3.83Å; K632-E775 PolarHBondContact NZ-OE2 2.78Å
633	M	89.7	Confident	85.4	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-68.2	-33.3	178	-74	-169.6	59.2	0	0	112.2	H587 P627 S630 V636 A637 M659 L662 L666 Y738	H587-M633 PolarHBondContact CD2-SD 3.37Å; P627-M633 HydrophobicContact CB-CB 4.24Å; P627-M633 HydrophobicContact CB-CE 4.46Å; P627-M633 HydrophobicContact CG-CE 4.2Å; S630-M633 PolarHBondContact O-N 3.26Å; S630-M633 PolarHBondContact OG-N 3.02Å; M633-V636 PolarHBondContact O-N 3.04Å; M633-A637 WeakPolarHBondContact O-CB 3.36Å; M633-A637 PolarHBondContact O-N 3.37Å; M633-M659 HydrophobicContact CG-CE 3.92Å; M633-M659 HydrophobicContact SD-CE 3.64Å; M633-L662 HydrophobicContact SD-CB 4.47Å; M633-L666 HydrophobicContact CB-CD1 4.25Å; M633-L666 HydrophobicContact CE-CB 3.94Å; M633-L666 HydrophobicContact CE-CD1 3.57Å; M633-L666 HydrophobicContact CE-CG 4.41Å; M633-Y738 WeakPolarHBondContact CG-OH 3.48Å
634	L	87.5	Confident	86.5	Confident	63 Å²	63	28.7 Å²	28.7	33%	0.33	14%	0.144	S	C	.	.	H	α-helix	trans	-65.5	-41.7	172.3	-171	64.5	0	0	0	112.2	I612 S630 S631 K632 A637 S638	I612-L634 HydrophobicContact CG2-CD1 4.23Å; S630-L634 PolarHBondContact O-N 3.24Å; S631-L634 PolarHBondContact O-N 3.33Å; K632-L634 VanDerWaalsContact C-N 3.32Å; L634-A637 WeakPolarHBondContact O-CB 3.45Å; L634-A637 PolarHBondContact O-N 3.3Å; L634-S638 PolarHBondContact O-N 3.31Å; L634-S638 PolarHBondContact O-OG 3.09Å
635	V	89.6	Confident	87.2	Confident	42 Å²	42	31.1 Å²	31.1	26%	0.255	16%	0.16	S	C	.	.	H	α-helix	trans	-68.4	-37	174.6	171.1	0	0	0	0	112.1	S631 K632 A637 S638 L639 L768	S631-V635 WeakPolarHBondContact O-CG2 3.22Å; S631-V635 PolarHBondContact O-N 2.95Å; K632-V635 PolarHBondContact O-N 2.86Å; V635-A637 VanDerWaalsContact C-N 3.33Å; V635-S638 PolarHBondContact O-OG 3.36Å; V635-L639 HydrophobicContact CG1-CD1 3.82Å; V635-L639 HydrophobicContact CG1-CG 4.34Å; V635-L639 WeakPolarHBondContact O-CB 3.29Å; V635-L639 WeakPolarHBondContact O-CG 3.34Å; V635-L639 PolarHBondContact O-N 3.08Å; V635-L639 VanDerWaalsContact O-N 3.08Å; V635-L768 HydrophobicContact CG1-CD2 4.04Å
636	V	92.4	Very high	87.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.6	-41.7	171.4	171.1	0	0	0	0	111.1	K632 M633 L639 L640 L652 L663 L666 L736 Y738 L768	K632-V636 VanDerWaalsContact O-CG2 3.28Å; K632-V636 WeakPolarHBondContact O-CG2 3.2Å; K632-V636 PolarHBondContact O-N 2.9Å; M633-V636 PolarHBondContact O-N 3.04Å; V636-L639 PolarHBondContact O-N 3.39Å; V636-L640 HydrophobicContact CG1-CD1 3.61Å; V636-L640 HydrophobicContact CG1-CG 4.01Å; V636-L640 WeakPolarHBondContact O-CB 3.2Å; V636-L640 VanDerWaalsContact O-CG 3.31Å; V636-L640 WeakPolarHBondContact O-CG 3.31Å; V636-L640 PolarHBondContact O-N 2.95Å; V636-L652 HydrophobicContact CG1-CD1 4.3Å; V636-L663 HydrophobicContact CG1-CD2 4.21Å; V636-L666 HydrophobicContact CG1-CD2 4.42Å; V636-L736 HydrophobicContact CG2-CD2 4.15Å; V636-Y738 HydrophobicContact CG2-CD2 3.64Å; V636-Y738 HydrophobicContact CG2-CE2 3.6Å; V636-L768 HydrophobicContact CG2-CD1 3.74Å
637	A	89.3	Confident	88.2	Confident	6 Å²	6	38.2 Å²	38.2	5%	0.05	21%	0.205	C	C	.	.	H	α-helix	trans	-59.4	-50.2	-179.6	0	0	0	0	0	112	M633 L634 V635 K641 L666 M670	M633-A637 WeakPolarHBondContact O-CB 3.36Å; M633-A637 PolarHBondContact O-N 3.37Å; L634-A637 WeakPolarHBondContact O-CB 3.45Å; L634-A637 PolarHBondContact O-N 3.3Å; V635-A637 VanDerWaalsContact C-N 3.33Å; A637-K641 PolarHBondContact O-N 2.86Å; A637-K641 VanDerWaalsContact O-N 3.16Å; A637-L666 HydrophobicContact CB-CD1 4.43Å; A637-M670 HydrophobicContact CB-CE 3.55Å
638	S	88.3	Confident	88.8	Confident	54 Å²	54	39.2 Å²	39.2	38%	0.378	21%	0.209	S	C	.	.	H	α-helix	trans	-68.9	-39.1	179.1	58.3	0	0	0	0	112.9	L634 V635 N642	L634-S638 PolarHBondContact O-N 3.31Å; L634-S638 PolarHBondContact O-OG 3.09Å; V635-S638 PolarHBondContact O-OG 3.36Å; S638-N642 WeakPolarHBondContact O-CB 3.43Å; S638-N642 PolarHBondContact O-N 3.28Å; S638-N642 PolarHBondContact O-ND2 3.11Å; S638-N642 PolarHBondContact O-OD1 3.47Å
639	L	91.8	Very high	89.3	Confident	26 Å²	26	37.7 Å²	37.7	14%	0.136	20%	0.203	C	C	.	.	H	α-helix	trans	-63.7	-44.3	175.7	-72.3	173.7	0	0	0	112.7	L543 V635 V636 N642 W643	L543-L639 HydrophobicContact CD1-CD1 3.79Å; V635-L639 HydrophobicContact CG1-CD1 3.82Å; V635-L639 HydrophobicContact CG1-CG 4.34Å; V635-L639 WeakPolarHBondContact O-CB 3.29Å; V635-L639 WeakPolarHBondContact O-CG 3.34Å; V635-L639 PolarHBondContact O-N 3.08Å; V635-L639 VanDerWaalsContact O-N 3.08Å; V636-L639 PolarHBondContact O-N 3.39Å; L639-N642 PolarHBondContact O-N 3.18Å; L639-W643 HydrophobicContact CB-CE3 4.49Å; L639-W643 HydrophobicContact CB-CH2 4.04Å; L639-W643 HydrophobicContact CB-CZ2 4.06Å; L639-W643 HydrophobicContact CB-CZ3 4.27Å; L639-W643 HydrophobicContact CD1-CH2 4.18Å; L639-W643 HydrophobicContact CD1-CZ2 4.32Å; L639-W643 HydrophobicContact CD2-CZ2 3.91Å; L639-W643 HydrophobicContact CG-CZ2 4.33Å; L639-W643 WeakPolarHBondContact O-CB 3.49Å; L639-W643 VanDerWaalsContact O-CD2 3.31Å; L639-W643 PolarHBondContact O-N 3.28Å
640	L	92.6	Very high	89.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.5	-40.6	179.3	-73	178.4	0	0	0	112	V636 W643 Y644 V650 L666 V667 F672 F714 L715	V636-L640 HydrophobicContact CG1-CD1 3.61Å; V636-L640 HydrophobicContact CG1-CG 4.01Å; V636-L640 WeakPolarHBondContact O-CB 3.2Å; V636-L640 VanDerWaalsContact O-CG 3.31Å; V636-L640 WeakPolarHBondContact O-CG 3.31Å; V636-L640 PolarHBondContact O-N 2.95Å; L640-W643 HydrophobicContact CD2-CE3 4.27Å; L640-W643 PolarHBondContact O-N 3.26Å; L640-Y644 WeakPolarHBondContact O-CB 3.49Å; L640-Y644 PolarHBondContact O-N 3.39Å; L640-V650 HydrophobicContact CD2-CG1 4.15Å; L640-L666 HydrophobicContact CD1-CD2 4.09Å; L640-V667 HydrophobicContact CD1-CG2 4.21Å; L640-F672 HydrophobicContact CB-CE2 3.99Å; L640-F714 HydrophobicContact CD2-CE1 4.29Å; L640-F714 WeakPolarHBondContact O-CZ 3.49Å; L640-L715 HydrophobicContact CD1-CD2 4.35Å; L640-L715 HydrophobicContact CD2-CD1 4.09Å; L640-L715 HydrophobicContact CD2-CD2 4.4Å
641	K	89.1	Confident	90.1	Very high	67 Å²	67	37.5 Å²	37.5	29%	0.291	20%	0.203	S	C	.	.	H	α-helix	trans	-56.9	-56.9	172.6	-178	-171.5	176	-174.3	0	110.9	E613 A637 W643 Y644 D645	E613-K641 IonicContact OE1-NZ 3.48Å; E613-K641 PolarHBondContact OE1-NZ 3.17Å; E613-K641 WeakPolarHBondContact OE2-CD 3.38Å; E613-K641 IonicContact OE2-NZ 2.67Å; E613-K641 PolarHBondContact OE2-NZ 3.01Å; A637-K641 PolarHBondContact O-N 2.86Å; A637-K641 VanDerWaalsContact O-N 3.16Å; K641-W643 VanDerWaalsContact C-N 3.27Å; K641-W643 PolarHBondContact O-N 3.29Å; K641-Y644 WeakPolarHBondContact O-CB 3.46Å; K641-Y644 PolarHBondContact O-N 2.84Å; K641-D645 PolarHBondContact O-N 3.34Å; K641-D645 VanDerWaalsContact O-N 3.08Å
642	N	90.8	Very high	90.5	Very high	78 Å²	78	36.8 Å²	36.8	42%	0.417	20%	0.198	S	C	.	.	H	α-helix	trans	-59.8	-34.7	-178	-66.2	-5.9	0	0	0	112.8	S638 L639 Q646	S638-N642 WeakPolarHBondContact O-CB 3.43Å; S638-N642 PolarHBondContact O-N 3.28Å; S638-N642 PolarHBondContact O-ND2 3.11Å; S638-N642 PolarHBondContact O-OD1 3.47Å; L639-N642 PolarHBondContact O-N 3.18Å; N642-Q646 WeakPolarHBondContact O-CB 3.36Å; N642-Q646 WeakPolarHBondContact O-CG 3.28Å; N642-Q646 PolarHBondContact O-N 3.48Å
643	W	92.7	Very high	90.6	Very high	6 Å²	6	36.8 Å²	36.8	2%	0.023	20%	0.198	C	C	.	.	H	α-helix	trans	-77.5	-26.5	176.6	-64.9	-21	0	0	0	113.9	L639 L640 K641 Q646 G647 H648 V650 F714 R734 L736 Y766	L639-W643 HydrophobicContact CB-CE3 4.49Å; L639-W643 HydrophobicContact CB-CH2 4.04Å; L639-W643 HydrophobicContact CB-CZ2 4.06Å; L639-W643 HydrophobicContact CB-CZ3 4.27Å; L639-W643 HydrophobicContact CD1-CH2 4.18Å; L639-W643 HydrophobicContact CD1-CZ2 4.32Å; L639-W643 HydrophobicContact CD2-CZ2 3.91Å; L639-W643 HydrophobicContact CG-CZ2 4.33Å; L639-W643 WeakPolarHBondContact O-CB 3.49Å; L639-W643 VanDerWaalsContact O-CD2 3.31Å; L639-W643 PolarHBondContact O-N 3.28Å; L640-W643 HydrophobicContact CD2-CE3 4.27Å; L640-W643 PolarHBondContact O-N 3.26Å; K641-W643 VanDerWaalsContact C-N 3.27Å; K641-W643 PolarHBondContact O-N 3.29Å; W643-Q646 PolarHBondContact O-N 2.99Å; W643-G647 PolarHBondContact O-N 2.95Å; W643-H648 HydrophobicContact CB-CB 4.26Å; W643-H648 PolarHBondContact O-N 2.78Å; W643-H648 VanDerWaalsContact O-N 3.08Å; W643-V650 HydrophobicContact CB-CG2 4.18Å; W643-V650 HydrophobicContact CD2-CG2 4.43Å; W643-V650 HydrophobicContact CE3-CB 4.46Å; W643-V650 HydrophobicContact CE3-CG1 3.78Å; W643-V650 HydrophobicContact CE3-CG2 3.75Å; W643-V650 HydrophobicContact CZ3-CG1 3.77Å; W643-F714 HydrophobicContact CB-CE2 4.43Å; W643-F714 HydrophobicContact CB-CZ 4.3Å; W643-R734 HydrophobicContact CD2-CB 4.3Å; W643-R734 HydrophobicContact CD2-CG 4.22Å; W643-R734 HydrophobicContact CE3-CB 4.3Å; W643-R734 HydrophobicContact CG-CG 4.31Å; W643-L736 HydrophobicContact CH2-CB 4.23Å; W643-L736 HydrophobicContact CH2-CD1 4.39Å; W643-L736 HydrophobicContact CH2-CD2 4.18Å; W643-L736 HydrophobicContact CZ3-CB 4.2Å; W643-L736 HydrophobicContact CZ3-CD2 4.01Å; W643-Y766 AromaticContact CH2-CD2 3.64Å; W643-Y766 HydrophobicContact CH2-CD2 3.64Å; W643-Y766 AromaticContact CH2-CE2 4Å; W643-Y766 HydrophobicContact CH2-CE2 4Å; W643-Y766 HydrophobicContact CH2-CG 4.06Å; W643-Y766 HydrophobicContact CZ2-CD1 4.26Å; W643-Y766 AromaticContact CZ2-CD2 3.42Å; W643-Y766 HydrophobicContact CZ2-CD2 3.42Å; W643-Y766 VanDerWaalsContact CZ2-CD2 3.42Å; W643-Y766 HydrophobicContact CZ2-CE1 4.14Å; W643-Y766 AromaticContact CZ2-CE2 3.3Å; W643-Y766 HydrophobicContact CZ2-CE2 3.3Å; W643-Y766 AromaticContact CZ2-CG 3.91Å; W643-Y766 HydrophobicContact CZ2-CG 3.91Å; W643-Y766 AromaticContact CZ2-CZ 3.67Å
644	Y	88.9	Confident	90.7	Very high	119 Å²	119	36.8 Å²	36.8	47%	0.467	20%	0.198	S	C	.	.	H	α-helix	trans	-66.8	-49.5	172.4	-176	-96.1	0	0	0	110.1	L640 K641 Q646 G647 F672 F714	L640-Y644 WeakPolarHBondContact O-CB 3.49Å; L640-Y644 PolarHBondContact O-N 3.39Å; K641-Y644 WeakPolarHBondContact O-CB 3.46Å; K641-Y644 PolarHBondContact O-N 2.84Å; Y644-Q646 PolarHBondContact O-N 3.13Å; Y644-G647 PolarHBondContact O-N 3.42Å; Y644-F672 HydrophobicContact CD1-CD1 4.38Å; Y644-F672 AromaticContact CD1-CE1 3.73Å; Y644-F672 HydrophobicContact CD1-CE1 3.73Å; Y644-F672 AromaticContact CD2-CD1 3.44Å; Y644-F672 HydrophobicContact CD2-CD1 3.44Å; Y644-F672 VanDerWaalsContact CD2-CD1 3.44Å; Y644-F672 AromaticContact CD2-CE1 3.53Å; Y644-F672 HydrophobicContact CD2-CE1 3.53Å; Y644-F672 HydrophobicContact CD2-CG 4.29Å; Y644-F672 HydrophobicContact CD2-CZ 4.42Å; Y644-F672 HydrophobicContact CE1-CE1 4.17Å; Y644-F672 AromaticContact CE2-CD1 3.64Å; Y644-F672 HydrophobicContact CE2-CD1 3.64Å; Y644-F672 AromaticContact CE2-CE1 3.99Å; Y644-F672 HydrophobicContact CE2-CE1 3.99Å; Y644-F672 AromaticContact CG-CD1 3.84Å; Y644-F672 HydrophobicContact CG-CD1 3.84Å; Y644-F672 AromaticContact CG-CE1 3.38Å; Y644-F672 HydrophobicContact CG-CE1 3.38Å; Y644-F672 HydrophobicContact CG-CZ 4.07Å; Y644-F714 VanDerWaalsContact CA-CE2 3.45Å; Y644-F714 HydrophobicContact CD2-CD1 4.15Å; Y644-F714 HydrophobicContact CD2-CD2 4.03Å; Y644-F714 HydrophobicContact CD2-CE1 4.25Å; Y644-F714 HydrophobicContact CD2-CE2 4.15Å; Y644-F714 HydrophobicContact CD2-CG 4.04Å; Y644-F714 HydrophobicContact CD2-CZ 4.25Å
645	D	88.6	Confident	90.8	Very high	113 Å²	113	35 Å²	35	60%	0.604	19%	0.188	S	C	*	.	H	α-helix	trans	-61	-27.9	176.4	-57.4	-25.5	0	0	0	112	K641	K641-D645 PolarHBondContact O-N 3.34Å; K641-D645 VanDerWaalsContact O-N 3.08Å
646	Q	88.4	Confident	90.8	Very high	104 Å²	104	34.1 Å²	34.1	49%	0.486	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	0.7	175	-70	167	7.1	0	0	115	N642 W643 Y644 H648	N642-Q646 WeakPolarHBondContact O-CB 3.36Å; N642-Q646 WeakPolarHBondContact O-CG 3.28Å; N642-Q646 PolarHBondContact O-N 3.48Å; W643-Q646 PolarHBondContact O-N 2.99Å; Y644-Q646 PolarHBondContact O-N 3.13Å; Q646-H648 VanDerWaalsContact C-N 3.29Å; Q646-H648 PolarHBondContact O-CE1 3.23Å; Q646-H648 PolarHBondContact O-N 3.38Å; Q646-H648 PolarHBondContact O-ND1 3.4Å; Q646-H648 PolarHBondContact OE1-CD2 3.15Å; Q646-H648 PolarHBondContact OE1-NE2 3.07Å
647	G	86.7	Confident	90.7	Very high	50 Å²	50	40 Å²	40	52%	0.515	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	36.7	179.9	0	0	0	0	0	114	W643 Y644 R761	W643-G647 PolarHBondContact O-N 2.95Å; Y644-G647 PolarHBondContact O-N 3.42Å; G647-R761 PolarHBondContact O-NH1 2.93Å
648	H	90.4	Very high	90.7	Very high	31 Å²	31	47.5 Å²	47.5	14%	0.144	23%	0.233	C	C	.	.			trans	-97.1	143.2	-178.2	-70.6	0.9	0	0	0	111.7	W643 Q646 F714 N733 R734	W643-H648 HydrophobicContact CB-CB 4.26Å; W643-H648 PolarHBondContact O-N 2.78Å; W643-H648 VanDerWaalsContact O-N 3.08Å; Q646-H648 VanDerWaalsContact C-N 3.29Å; Q646-H648 PolarHBondContact O-CE1 3.23Å; Q646-H648 PolarHBondContact O-N 3.38Å; Q646-H648 PolarHBondContact O-ND1 3.4Å; Q646-H648 PolarHBondContact OE1-CD2 3.15Å; Q646-H648 PolarHBondContact OE1-NE2 3.07Å; H648-F714 WeakPolarHBondContact O-CD2 3.36Å; H648-F714 WeakPolarHBondContact O-CE2 3.44Å; H648-N733 WeakPolarHBondContact CA-OD1 3.34Å; H648-N733 VanDerWaalsContact CG-ND2 3.26Å; H648-N733 PolarHBondContact ND1-ND2 3.06Å; H648-R734 HydrophobicContact CB-CG 3.93Å; H648-R734 PolarHBondContact CD2-NE 3.41Å; H648-R734 PolarHBondContact CD2-NH2 2.73Å; H648-R734 PolarHBondContact NE2-NH2 3.27Å
649	K	91.4	Very high	90.8	Very high	13 Å²	13	44.9 Å²	44.9	6%	0.057	22%	0.215	C	C	.	.			trans	-96.1	133.2	173.1	-72.2	-161.5	178.2	-148.9	0	111	F693 D712 I713 S731 A732 N733 R734	K649-F693 HydrophobicContact CB-CZ 4.3Å; K649-D712 VanDerWaalsContact CE-OD1 3.31Å; K649-D712 WeakPolarHBondContact CE-OD1 3.38Å; K649-D712 IonicContact NZ-OD1 3.69Å; K649-D712 PolarHBondContact NZ-OD1 3.11Å; K649-D712 IonicContact NZ-OD2 3.6Å; K649-I713 WeakPolarHBondContact CD-O 3.4Å; K649-I713 WeakPolarHBondContact CE-O 3.3Å; K649-I713 PolarHBondContact NZ-O 2.6Å; K649-S731 WeakPolarHBondContact CB-O 3.29Å; K649-A732 WeakPolarHBondContact O-CA 3.38Å; K649-N733 PolarHBondContact N-OD1 3.27Å; K649-N733 PolarHBondContact O-N 3.26Å; K649-R734 PolarHBondContact O-N 3Å; K649-R734 VanDerWaalsContact O-N 3.1Å
650	V	93.6	Very high	90.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.1	-163.2	-172.4	0	0	0	0	111.5	L640 W643 F714 L715 F716 R734	L640-V650 HydrophobicContact CD2-CG1 4.15Å; W643-V650 HydrophobicContact CB-CG2 4.18Å; W643-V650 HydrophobicContact CD2-CG2 4.43Å; W643-V650 HydrophobicContact CE3-CB 4.46Å; W643-V650 HydrophobicContact CE3-CG1 3.78Å; W643-V650 HydrophobicContact CE3-CG2 3.75Å; W643-V650 HydrophobicContact CZ3-CG1 3.77Å; V650-F714 HydrophobicContact CG2-CE1 4.47Å; V650-F714 HydrophobicContact CG2-CE2 3.85Å; V650-F714 HydrophobicContact CG2-CZ 3.83Å; V650-F714 PolarHBondContact N-O 3.12Å; V650-L715 HydrophobicContact CB-CD1 3.75Å; V650-L715 HydrophobicContact CG1-CD1 3.71Å; V650-L715 WeakPolarHBondContact O-CA 3.47Å; V650-F716 PolarHBondContact O-N 3.11Å; V650-R734 WeakPolarHBondContact CA-O 3.49Å; V650-R734 HydrophobicContact CG2-CB 4.25Å
651	L	93.8	Very high	90.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	128.5	162.5	-54	-176.1	0	0	0	109.6	F653 F693 F716 L718 L729 A732 R734 V735 L736 A754	L651-F653 HydrophobicContact CB-CD2 4.41Å; L651-F653 HydrophobicContact CB-CE2 3.84Å; L651-F653 HydrophobicContact CB-CZ 4.29Å; L651-F653 HydrophobicContact CD1-CE2 4.01Å; L651-F653 HydrophobicContact CD1-CZ 3.98Å; L651-F693 HydrophobicContact CD2-CD1 4.48Å; L651-F693 HydrophobicContact CD2-CE1 3.62Å; L651-F693 HydrophobicContact CD2-CZ 3.67Å; L651-F716 HydrophobicContact CD2-CB 3.67Å; L651-F716 HydrophobicContact CD2-CD1 4.42Å; L651-F716 HydrophobicContact CD2-CG 4.47Å; L651-L718 HydrophobicContact CD2-CD1 4.18Å; L651-L729 HydrophobicContact CD1-CB 3.9Å; L651-L729 HydrophobicContact CD1-CD1 3.69Å; L651-L729 HydrophobicContact CD1-CG 4.45Å; L651-L729 HydrophobicContact CD2-CB 4.31Å; L651-L729 HydrophobicContact CD2-CD1 3.93Å; L651-L729 HydrophobicContact CG-CD1 4.48Å; L651-A732 HydrophobicContact CD1-CB 4.13Å; L651-A732 HydrophobicContact CD2-CB 3.79Å; L651-A732 HydrophobicContact CG-CB 3.54Å; L651-R734 PolarHBondContact N-O 2.91Å; L651-V735 HydrophobicContact CB-CG2 4.45Å; L651-V735 HydrophobicContact CD1-CG2 4.34Å; L651-L736 PolarHBondContact O-N 3.14Å; L651-A754 HydrophobicContact CD1-CB 4.03Å
652	L	93.9	Very high	90.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	115.4	173.6	-162.1	175.1	0	0	0	109.5	V636 L663 L715 F716 L717 L718 L736	V636-L652 HydrophobicContact CG1-CD1 4.3Å; L652-L663 HydrophobicContact CD1-CD1 4.2Å; L652-L663 HydrophobicContact CD1-CD2 4.26Å; L652-L663 HydrophobicContact CD2-CD1 3.65Å; L652-L715 HydrophobicContact CB-CD1 4.02Å; L652-F716 PolarHBondContact N-O 3.27Å; L652-L717 HydrophobicContact CB-CD2 4.09Å; L652-L717 HydrophobicContact CD1-CD2 4.06Å; L652-L718 PolarHBondContact O-N 3.34Å; L652-L736 WeakPolarHBondContact CA-O 3.39Å; L652-L736 HydrophobicContact CD1-CD2 4.36Å; L652-L736 HydrophobicContact CG-CB 4.44Å; L652-L736 HydrophobicContact CG-CD2 4.19Å; L652-L736 HydrophobicContact CG-CG 4.39Å
653	F	92.8	Very high	90.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131.5	179.1	-67.2	-74.6	0	0	0	112.4	L651 L718 T720 V735 L736 Y738 A750	L651-F653 HydrophobicContact CB-CD2 4.41Å; L651-F653 HydrophobicContact CB-CE2 3.84Å; L651-F653 HydrophobicContact CB-CZ 4.29Å; L651-F653 HydrophobicContact CD1-CE2 4.01Å; L651-F653 HydrophobicContact CD1-CZ 3.98Å; F653-L718 WeakPolarHBondContact CA-O 3.21Å; F653-L718 HydrophobicContact CD1-CB 3.58Å; F653-L718 HydrophobicContact CD1-CD1 4.3Å; F653-L718 HydrophobicContact CE1-CB 3.6Å; F653-L718 HydrophobicContact CE1-CD1 3.51Å; F653-L718 HydrophobicContact CE1-CG 4.2Å; F653-L718 HydrophobicContact CZ-CD1 3.76Å; F653-T720 HydrophobicContact CB-CG2 3.86Å; F653-V735 HydrophobicContact CD2-CG1 3.85Å; F653-V735 HydrophobicContact CE2-CG1 3.76Å; F653-L736 PolarHBondContact N-O 3.08Å; F653-Y738 WeakPolarHBondContact O-CB 3.47Å; F653-Y738 PolarHBondContact O-N 3.06Å; F653-A750 HydrophobicContact CD1-CB 4.16Å; F653-A750 HydrophobicContact CD2-CB 4.21Å; F653-A750 HydrophobicContact CE1-CB 3.97Å; F653-A750 HydrophobicContact CE2-CB 4.02Å; F653-A750 HydrophobicContact CG-CB 4.27Å; F653-A750 HydrophobicContact CZ-CB 3.9Å
654	S	92.7	Very high	90.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	157.7	167.1	177.5	0	0	0	0	112	S656 L718 T719 T720 D739	S654-S656 PolarHBondContact OG-N 2.81Å; S654-L718 PolarHBondContact N-O 2.98Å; S654-L718 VanDerWaalsContact N-O 3.12Å; S654-T719 VanDerWaalsContact O-CA 3.22Å; S654-T719 WeakPolarHBondContact O-CA 3.17Å; S654-T720 PolarHBondContact O-N 3.48Å; S654-D739 WeakPolarHBondContact CA-OD1 3.15Å; S654-D739 VanDerWaalsContact CB-OD1 3.3Å; S654-D739 WeakPolarHBondContact CB-OD1 3Å; S654-D739 PolarHBondContact OG-OD1 3.03Å
655	Q	89.8	Confident	90.8	Very high	26 Å²	26	40.1 Å²	40.1	12%	0.121	19%	0.194	C	C	.	.	S	Bend	trans	-78.3	-25.1	173.3	-63.6	-75.5	-22.3	0	0	113.2	T720 D739 D741	Q655-T720 HydrophobicContact CG-CG2 4.49Å; Q655-T720 PolarHBondContact NE2-OG1 2.93Å; Q655-T720 PolarHBondContact OE1-OG1 2.91Å; Q655-D739 VanDerWaalsContact CB-OD2 3.29Å; Q655-D739 WeakPolarHBondContact CB-OD2 3.46Å; Q655-D739 PolarHBondContact N-OD1 2.91Å; Q655-D741 PolarHBondContact NE2-OD2 3.17Å
656	S	88.1	Confident	90.7	Very high	24 Å²	24	35 Å²	35	17%	0.168	17%	0.166	C	C	.	.			trans	-110.2	123.8	-165.4	-179.9	0	0	0	0	113.3	S654 R658 M659 L660	S654-S656 PolarHBondContact OG-N 2.81Å; S656-R658 PolarHBondContact O-N 3.01Å; S656-R658 PolarHBondContact OG-N 3.39Å; S656-M659 PolarHBondContact O-N 2.84Å; S656-M659 VanDerWaalsContact O-N 3.1Å; S656-M659 PolarHBondContact OG-N 3.29Å; S656-L660 PolarHBondContact O-N 3.48Å
657	R	90.3	Very high	90.7	Very high	123 Å²	123	30 Å²	30	46%	0.464	14%	0.143	S	C	.	.	H	α-helix	trans	-60.7	-29.9	172.4	-67.9	179.9	72.1	-136.7	1	112.8	T661 D678 T680	R657-T661 PolarHBondContact O-N 3.1Å; R657-T661 PolarHBondContact O-OG1 3.01Å; R657-D678 HydrophobicContact CG-CB 4.35Å; R657-D678 IonicContact CZ-OD2 3.48Å; R657-D678 IonicContact NE-OD1 3.19Å; R657-D678 IonicContact NE-OD2 2.67Å; R657-D678 PolarHBondContact NE-OD2 2.92Å; R657-D678 IonicContact NH2-OD1 3.45Å; R657-D678 IonicContact NH2-OD2 3.53Å; R657-D678 PolarHBondContact NH2-OD2 3.24Å; R657-T680 PolarHBondContact NH2-OG1 2.85Å
658	R	89.5	Confident	90.8	Very high	163 Å²	163	32.4 Å²	32.4	62%	0.615	14%	0.141	S	C	*	.	H	α-helix	trans	-70.1	-39.1	174.5	-58.6	-175.1	89.7	-172.7	7.3	111.1	L590 S656 T661 L662	L590-R658 HydrophobicContact CD2-CB 3.82Å; S656-R658 PolarHBondContact O-N 3.01Å; S656-R658 PolarHBondContact OG-N 3.39Å; R658-T661 PolarHBondContact O-N 3.32Å; R658-L662 PolarHBondContact O-N 2.81Å
659	M	91.5	Very high	90.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-68.8	-40.2	175.6	-167.7	67	-136.8	0	0	111.6	N586 H587 L590 M633 S656 T661 L662 L663 Y738	N586-M659 HydrophobicContact CB-SD 4.01Å; H587-M659 HydrophobicContact CB-SD 4.35Å; L590-M659 HydrophobicContact CD1-CB 4.44Å; L590-M659 HydrophobicContact CD1-SD 3.75Å; M633-M659 HydrophobicContact CG-CE 3.92Å; M633-M659 HydrophobicContact SD-CE 3.64Å; S656-M659 PolarHBondContact O-N 2.84Å; S656-M659 VanDerWaalsContact O-N 3.1Å; S656-M659 PolarHBondContact OG-N 3.29Å; M659-T661 VanDerWaalsContact C-N 3.28Å; M659-T661 PolarHBondContact O-N 3.16Å; M659-L662 HydrophobicContact CE-CB 4.01Å; M659-L662 HydrophobicContact CE-CD1 4.4Å; M659-L662 WeakPolarHBondContact O-CB 3.48Å; M659-L662 PolarHBondContact O-N 2.92Å; M659-L662 HydrophobicContact SD-CD1 4.25Å; M659-L663 HydrophobicContact CE-CD1 4.38Å; M659-L663 HydrophobicContact CE-CD2 4.04Å; M659-L663 HydrophobicContact CE-CG 3.84Å; M659-L663 HydrophobicContact CG-CD1 4.12Å; M659-L663 HydrophobicContact CG-CG 4.48Å; M659-L663 WeakPolarHBondContact O-CG 3.38Å; M659-L663 PolarHBondContact O-N 2.99Å; M659-Y738 HydrophobicContact CE-CD1 4.49Å; M659-Y738 HydrophobicContact CE-CE1 3.61Å; M659-Y738 HydrophobicContact CE-CE2 4.26Å; M659-Y738 VanDerWaalsContact CE-CZ 3.47Å; M659-Y738 VanDerWaalsContact CE-OH 3.31Å; M659-Y738 WeakPolarHBondContact CE-OH 3.46Å; M659-Y738 HydrophobicContact CG-CD1 3.86Å; M659-Y738 HydrophobicContact CG-CE1 3.68Å; M659-Y738 HydrophobicContact SD-CD1 4.43Å; M659-Y738 HydrophobicContact SD-CE1 3.64Å
660	L	92.3	Very high	90	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58.6	-38.2	173.3	-71.1	-178	0	0	0	112.4	S656 L662 L663 E664 L717 T719	S656-L660 PolarHBondContact O-N 3.48Å; L660-L662 VanDerWaalsContact C-N 3.35Å; L660-L663 HydrophobicContact CD2-CD1 4.36Å; L660-L663 PolarHBondContact O-N 3.37Å; L660-E664 WeakPolarHBondContact O-CB 3.49Å; L660-E664 PolarHBondContact O-N 2.97Å; L660-L717 HydrophobicContact CD2-CB 4.42Å; L660-T719 HydrophobicContact CD1-CG2 3.47Å; L660-T719 VanDerWaalsContact CD1-CG2 3.47Å
661	T	91.2	Very high	89.6	Confident	53 Å²	53	44.6 Å²	44.6	33%	0.325	20%	0.198	S	C	.	.	H	α-helix	trans	-68.7	-28.7	174	-65.2	0	0	0	0	113.2	R657 R658 M659 R665 R676	R657-T661 PolarHBondContact O-N 3.1Å; R657-T661 PolarHBondContact O-OG1 3.01Å; R658-T661 PolarHBondContact O-N 3.32Å; M659-T661 VanDerWaalsContact C-N 3.28Å; M659-T661 PolarHBondContact O-N 3.16Å; T661-R665 WeakPolarHBondContact O-CG 3.28Å; T661-R665 PolarHBondContact O-N 3.24Å; T661-R676 PolarHBondContact OG1-NH1 3.35Å
662	L	90.4	Very high	89.3	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-72	-41.9	171	-73	-177.2	0	0	0	112.2	H587 L590 F624 M633 R658 M659 L660 R665 L666	H587-L662 HydrophobicContact CB-CD1 3.89Å; L590-L662 HydrophobicContact CD1-CD1 4.11Å; L590-L662 HydrophobicContact CD2-CD1 3.86Å; L590-L662 HydrophobicContact CG-CD1 3.85Å; F624-L662 HydrophobicContact CD1-CD2 3.93Å; F624-L662 HydrophobicContact CE1-CD2 3.76Å; F624-L662 HydrophobicContact CE1-CG 4.5Å; M633-L662 HydrophobicContact SD-CB 4.47Å; R658-L662 PolarHBondContact O-N 2.81Å; M659-L662 HydrophobicContact CE-CB 4.01Å; M659-L662 HydrophobicContact CE-CD1 4.4Å; M659-L662 WeakPolarHBondContact O-CB 3.48Å; M659-L662 PolarHBondContact O-N 2.92Å; M659-L662 HydrophobicContact SD-CD1 4.25Å; L660-L662 VanDerWaalsContact C-N 3.35Å; L662-R665 PolarHBondContact O-N 2.97Å; L662-L666 PolarHBondContact O-N 3.39Å; L662-L666 VanDerWaalsContact O-N 3.11Å
663	L	92.3	Very high	89	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.5	-39.5	176.1	-67.6	164.9	0	0	0	111.7	V636 L652 M659 L660 R665 L666 V667 Y738	V636-L663 HydrophobicContact CG1-CD2 4.21Å; L652-L663 HydrophobicContact CD1-CD1 4.2Å; L652-L663 HydrophobicContact CD1-CD2 4.26Å; L652-L663 HydrophobicContact CD2-CD1 3.65Å; M659-L663 HydrophobicContact CE-CD1 4.38Å; M659-L663 HydrophobicContact CE-CD2 4.04Å; M659-L663 HydrophobicContact CE-CG 3.84Å; M659-L663 HydrophobicContact CG-CD1 4.12Å; M659-L663 HydrophobicContact CG-CG 4.48Å; M659-L663 WeakPolarHBondContact O-CG 3.38Å; M659-L663 PolarHBondContact O-N 2.99Å; L660-L663 HydrophobicContact CD2-CD1 4.36Å; L660-L663 PolarHBondContact O-N 3.37Å; L663-R665 VanDerWaalsContact C-N 3.33Å; L663-R665 PolarHBondContact O-N 3.3Å; L663-L666 WeakPolarHBondContact O-CB 3.37Å; L663-L666 PolarHBondContact O-N 2.9Å; L663-L666 VanDerWaalsContact O-N 3.15Å; L663-V667 WeakPolarHBondContact O-CB 3.48Å; L663-V667 WeakPolarHBondContact O-CG2 3.45Å; L663-V667 PolarHBondContact O-N 3.4Å; L663-Y738 HydrophobicContact CD1-CD2 4.43Å; L663-Y738 HydrophobicContact CD1-CG 4.38Å; L663-Y738 HydrophobicContact CD2-CD2 4.23Å; L663-Y738 HydrophobicContact CD2-CE2 4.09Å
664	E	91.9	Very high	89	Confident	32 Å²	32	51.1 Å²	51.1	15%	0.15	23%	0.231	C	C	.	.	H	α-helix	trans	-58.8	-41.3	173.5	-177.4	165.2	-134.3	0	0	111.8	L660 V667 Q668 Y674 R676 L717	L660-E664 WeakPolarHBondContact O-CB 3.49Å; L660-E664 PolarHBondContact O-N 2.97Å; E664-V667 PolarHBondContact O-N 3.36Å; E664-Q668 WeakPolarHBondContact O-CB 3.18Å; E664-Q668 WeakPolarHBondContact O-CG 3.43Å; E664-Q668 PolarHBondContact O-N 3.17Å; E664-Y674 HydrophobicContact CG-CE2 3.8Å; E664-R676 WeakPolarHBondContact OE1-CD 3.5Å; E664-R676 IonicContact OE2-CZ 2.62Å; E664-R676 IonicContact OE2-NE 3.2Å; E664-R676 IonicContact OE2-NH1 2.71Å; E664-R676 PolarHBondContact OE2-NH1 3.13Å; E664-L717 HydrophobicContact CB-CD1 3.84Å; E664-L717 HydrophobicContact CG-CD1 4.39Å
665	R	86.7	Confident	89	Confident	106 Å²	106	52.4 Å²	52.4	40%	0.4	24%	0.237	S	C	.	.	H	α-helix	trans	-63	-43.7	171.3	-72.2	170.8	177.2	-166.4	-1.9	112.6	F624 T661 L662 L663 V667 Q668 L669	F624-R665 PolarHBondContact O-NH1 2.68Å; T661-R665 WeakPolarHBondContact O-CG 3.28Å; T661-R665 PolarHBondContact O-N 3.24Å; L662-R665 PolarHBondContact O-N 2.97Å; L663-R665 VanDerWaalsContact C-N 3.33Å; L663-R665 PolarHBondContact O-N 3.3Å; R665-V667 VanDerWaalsContact C-N 3.34Å; R665-V667 PolarHBondContact O-N 2.69Å; R665-Q668 PolarHBondContact O-N 3.41Å; R665-L669 VanDerWaalsContact O-CG 3.29Å; R665-L669 WeakPolarHBondContact O-CG 3.36Å; R665-L669 PolarHBondContact O-N 2.76Å
666	L	87.1	Confident	89.1	Confident	5 Å²	5	53.6 Å²	53.6	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-60.6	-43.3	176.2	177.6	153.5	0	0	0	111.5	P627 M633 V636 A637 L640 L662 L663 L669 M670	P627-L666 HydrophobicContact CB-CD1 4.34Å; P627-L666 HydrophobicContact CG-CD1 4.19Å; M633-L666 HydrophobicContact CB-CD1 4.25Å; M633-L666 HydrophobicContact CE-CB 3.94Å; M633-L666 HydrophobicContact CE-CD1 3.57Å; M633-L666 HydrophobicContact CE-CG 4.41Å; V636-L666 HydrophobicContact CG1-CD2 4.42Å; A637-L666 HydrophobicContact CB-CD1 4.43Å; L640-L666 HydrophobicContact CD1-CD2 4.09Å; L662-L666 PolarHBondContact O-N 3.39Å; L662-L666 VanDerWaalsContact O-N 3.11Å; L663-L666 WeakPolarHBondContact O-CB 3.37Å; L663-L666 PolarHBondContact O-N 2.9Å; L663-L666 VanDerWaalsContact O-N 3.15Å; L666-L669 PolarHBondContact O-N 2.8Å; L666-M670 HydrophobicContact CD2-SD 3.76Å; L666-M670 WeakPolarHBondContact O-CG 3.24Å; L666-M670 PolarHBondContact O-N 2.95Å; L666-M670 VanDerWaalsContact O-N 3.09Å
667	V	89.1	Confident	89.1	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-67.1	-39.1	178.9	170.6	0	0	0	0	111.8	L640 L663 E664 R665 M670 K671 F672 Y674 L715	L640-V667 HydrophobicContact CD1-CG2 4.21Å; L663-V667 WeakPolarHBondContact O-CB 3.48Å; L663-V667 WeakPolarHBondContact O-CG2 3.45Å; L663-V667 PolarHBondContact O-N 3.4Å; E664-V667 PolarHBondContact O-N 3.36Å; R665-V667 VanDerWaalsContact C-N 3.34Å; R665-V667 PolarHBondContact O-N 2.69Å; V667-M670 CarbonylContact O-C 3.55Å; V667-M670 PolarHBondContact O-N 3.15Å; V667-K671 PolarHBondContact O-N 3.3Å; V667-K671 VanDerWaalsContact O-N 3.09Å; V667-F672 HydrophobicContact CG1-CB 4.23Å; V667-F672 PolarHBondContact O-N 3.37Å; V667-Y674 HydrophobicContact CG1-CD1 3.55Å; V667-Y674 HydrophobicContact CG1-CE1 4.33Å; V667-Y674 HydrophobicContact CG1-CG 3.77Å; V667-L715 HydrophobicContact CB-CD2 4.32Å; V667-L715 HydrophobicContact CG1-CD2 3.92Å; V667-L715 HydrophobicContact CG2-CD2 3.36Å
668	Q	87.3	Confident	89.1	Confident	99 Å²	99	46.8 Å²	46.8	46%	0.463	21%	0.212	S	C	.	.	H	α-helix	trans	-62.6	-42.6	172.9	-73.5	165.4	4.9	0	0	112.1	E664 R665 M670 K671 Y674	E664-Q668 WeakPolarHBondContact O-CB 3.18Å; E664-Q668 WeakPolarHBondContact O-CG 3.43Å; E664-Q668 PolarHBondContact O-N 3.17Å; R665-Q668 PolarHBondContact O-N 3.41Å; Q668-M670 VanDerWaalsContact C-N 3.29Å; Q668-M670 PolarHBondContact O-N 2.64Å; Q668-K671 PolarHBondContact O-N 2.99Å; Q668-Y674 HydrophobicContact CG-CE1 4.03Å; Q668-Y674 PolarHBondContact NE2-OH 2.84Å
669	L	82.8	Confident	88.7	Confident	79 Å²	79	41.5 Å²	41.5	41%	0.414	21%	0.208	S	C	.	.	H	α-helix	trans	-61.8	-37.4	175.1	-69.9	163.7	0	0	0	112.1	Y619 R665 L666 K671	Y619-L669 HydrophobicContact CD2-CD1 3.52Å; Y619-L669 HydrophobicContact CD2-CD2 4.21Å; Y619-L669 HydrophobicContact CE2-CD1 3.69Å; Y619-L669 HydrophobicContact CE2-CD2 4.49Å; R665-L669 VanDerWaalsContact O-CG 3.29Å; R665-L669 WeakPolarHBondContact O-CG 3.36Å; R665-L669 PolarHBondContact O-N 2.76Å; L666-L669 PolarHBondContact O-N 2.8Å; L669-K671 VanDerWaalsContact C-N 3.26Å; L669-K671 PolarHBondContact O-N 3.26Å
670	M	83.6	Confident	88.4	Confident	34 Å²	34	45.8 Å²	45.8	17%	0.167	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-3.7	175.2	-67.8	-176.6	151.1	0	0	114.2	V615 A637 L666 V667 Q668 F672	V615-M670 HydrophobicContact CG1-CE 4.38Å; V615-M670 HydrophobicContact CG1-CG 4.46Å; A637-M670 HydrophobicContact CB-CE 3.55Å; L666-M670 HydrophobicContact CD2-SD 3.76Å; L666-M670 WeakPolarHBondContact O-CG 3.24Å; L666-M670 PolarHBondContact O-N 2.95Å; L666-M670 VanDerWaalsContact O-N 3.09Å; V667-M670 CarbonylContact O-C 3.55Å; V667-M670 PolarHBondContact O-N 3.15Å; Q668-M670 VanDerWaalsContact C-N 3.29Å; Q668-M670 PolarHBondContact O-N 2.64Å; M670-F672 HydrophobicContact CB-CD2 3.64Å; M670-F672 HydrophobicContact CB-CE2 3.59Å; M670-F672 HydrophobicContact CB-CG 4.17Å; M670-F672 HydrophobicContact CB-CZ 4.06Å; M670-F672 HydrophobicContact CG-CE2 4.17Å; M670-F672 PolarHBondContact O-N 2.92Å; M670-F672 HydrophobicContact SD-CD2 4.28Å; M670-F672 HydrophobicContact SD-CE2 3.62Å; M670-F672 HydrophobicContact SD-CZ 4.37Å
671	K	84	Confident	88.1	Confident	188 Å²	188	46.7 Å²	46.7	82%	0.817	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	23.4	179.7	-53.2	-179.2	-178.5	178.1	0	115.1	V667 Q668 L669	V667-K671 PolarHBondContact O-N 3.3Å; V667-K671 VanDerWaalsContact O-N 3.09Å; Q668-K671 PolarHBondContact O-N 2.99Å; L669-K671 VanDerWaalsContact C-N 3.26Å; L669-K671 PolarHBondContact O-N 3.26Å
672	F	87.4	Confident	87.6	Confident	23 Å²	23	47 Å²	47	10%	0.101	24%	0.243	C	C	.	.			trans	-80.5	142.8	179.5	-60.9	-39.4	0	0	0	112.8	L640 Y644 V667 M670 Y674 F714	L640-F672 HydrophobicContact CB-CE2 3.99Å; Y644-F672 HydrophobicContact CD1-CD1 4.38Å; Y644-F672 AromaticContact CD1-CE1 3.73Å; Y644-F672 HydrophobicContact CD1-CE1 3.73Å; Y644-F672 AromaticContact CD2-CD1 3.44Å; Y644-F672 HydrophobicContact CD2-CD1 3.44Å; Y644-F672 VanDerWaalsContact CD2-CD1 3.44Å; Y644-F672 AromaticContact CD2-CE1 3.53Å; Y644-F672 HydrophobicContact CD2-CE1 3.53Å; Y644-F672 HydrophobicContact CD2-CG 4.29Å; Y644-F672 HydrophobicContact CD2-CZ 4.42Å; Y644-F672 HydrophobicContact CE1-CE1 4.17Å; Y644-F672 AromaticContact CE2-CD1 3.64Å; Y644-F672 HydrophobicContact CE2-CD1 3.64Å; Y644-F672 AromaticContact CE2-CE1 3.99Å; Y644-F672 HydrophobicContact CE2-CE1 3.99Å; Y644-F672 AromaticContact CG-CD1 3.84Å; Y644-F672 HydrophobicContact CG-CD1 3.84Å; Y644-F672 AromaticContact CG-CE1 3.38Å; Y644-F672 HydrophobicContact CG-CE1 3.38Å; Y644-F672 HydrophobicContact CG-CZ 4.07Å; V667-F672 HydrophobicContact CG1-CB 4.23Å; V667-F672 PolarHBondContact O-N 3.37Å; M670-F672 HydrophobicContact CB-CD2 3.64Å; M670-F672 HydrophobicContact CB-CE2 3.59Å; M670-F672 HydrophobicContact CB-CG 4.17Å; M670-F672 HydrophobicContact CB-CZ 4.06Å; M670-F672 HydrophobicContact CG-CE2 4.17Å; M670-F672 PolarHBondContact O-N 2.92Å; M670-F672 HydrophobicContact SD-CD2 4.28Å; M670-F672 HydrophobicContact SD-CE2 3.62Å; M670-F672 HydrophobicContact SD-CZ 4.37Å; F672-Y674 WeakPolarHBondContact O-CD1 3.4Å; F672-Y674 PolarHBondContact O-N 3.07Å; F672-F714 HydrophobicContact CB-CD1 4.02Å; F672-F714 HydrophobicContact CB-CE1 4.45Å; F672-F714 HydrophobicContact CD2-CD1 4.43Å; F672-F714 HydrophobicContact CD2-CE1 4.03Å; F672-F714 HydrophobicContact CE2-CE1 4.42Å; F672-F714 HydrophobicContact CG-CD1 4.19Å; F672-F714 HydrophobicContact CG-CE1 4.18Å
673	S	89	Confident	86.9	Confident	44 Å²	44	48.3 Å²	48.3	31%	0.308	25%	0.251	S	S	.	.			trans	-68.5	120.5	173.4	-61.1	0	0	0	0	112.2	F714 L715	S673-F714 PolarHBondContact O-N 2.81Å; S673-L715 PolarHBondContact O-N 3.03Å; S673-L715 VanDerWaalsContact O-N 3.17Å
674	Y	91.7	Very high	86.2	Confident	70 Å²	70	52.6 Å²	52.6	28%	0.275	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	159.2	-177.3	71.8	-78.2	0	0	0	114.3	E664 V667 Q668 F672 L715 L717	E664-Y674 HydrophobicContact CG-CE2 3.8Å; V667-Y674 HydrophobicContact CG1-CD1 3.55Å; V667-Y674 HydrophobicContact CG1-CE1 4.33Å; V667-Y674 HydrophobicContact CG1-CG 3.77Å; Q668-Y674 HydrophobicContact CG-CE1 4.03Å; Q668-Y674 PolarHBondContact NE2-OH 2.84Å; F672-Y674 WeakPolarHBondContact O-CD1 3.4Å; F672-Y674 PolarHBondContact O-N 3.07Å; Y674-L715 CarbonylContact C-O 3.53Å; Y674-L715 WeakPolarHBondContact CA-O 3.15Å; Y674-L717 HydrophobicContact CD2-CD1 3.97Å; Y674-L717 HydrophobicContact CD2-CG 4.5Å; Y674-L717 HydrophobicContact CE2-CD1 4.47Å
675	L	92.4	Very high	85.7	Confident	27 Å²	27	56.4 Å²	56.4	14%	0.141	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	156.2	161.8	-68.9	177.8	0	0	0	110.7	L689 R692 F693 I713 L715 F716 L717	L675-L689 HydrophobicContact CD2-CD2 4.11Å; L675-R692 HydrophobicContact CD1-CB 4.25Å; L675-F693 HydrophobicContact CD1-CB 4.18Å; L675-I713 HydrophobicContact CD1-CD1 3.64Å; L675-I713 HydrophobicContact CD1-CG2 4.24Å; L675-I713 HydrophobicContact CD2-CD1 4.22Å; L675-I713 HydrophobicContact CG-CD1 3.86Å; L675-I713 HydrophobicContact CG-CG2 3.92Å; L675-L715 PolarHBondContact N-O 2.93Å; L675-F716 HydrophobicContact CB-CD2 3.76Å; L675-F716 HydrophobicContact CB-CE2 3.69Å; L675-F716 HydrophobicContact CB-CG 4.34Å; L675-F716 HydrophobicContact CB-CZ 4.23Å; L675-F716 HydrophobicContact CD1-CZ 4.39Å; L675-F716 WeakPolarHBondContact O-CD2 3.41Å; L675-L717 PolarHBondContact O-N 3.2Å
676	R	92.1	Very high	85.5	Confident	50 Å²	50	52.9 Å²	52.9	19%	0.189	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	132.6	175.1	177.9	177.7	165.5	141.3	3.8	110.8	T661 E664 D678 L717	T661-R676 PolarHBondContact OG1-NH1 3.35Å; E664-R676 WeakPolarHBondContact OE1-CD 3.5Å; E664-R676 IonicContact OE2-CZ 2.62Å; E664-R676 IonicContact OE2-NE 3.2Å; E664-R676 IonicContact OE2-NH1 2.71Å; E664-R676 PolarHBondContact OE2-NH1 3.13Å; R676-D678 IonicContact CZ-OD2 3.94Å; R676-D678 IonicContact NE-OD2 3.34Å; R676-D678 IonicContact NH2-OD2 3.65Å; R676-D678 PolarHBondContact NH2-OD2 3.08Å; R676-L717 WeakPolarHBondContact CA-O 3.27Å; R676-L717 HydrophobicContact CB-CB 4.38Å
677	M	89.3	Confident	85	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	122.1	167.6	-162.6	-165.3	-53.1	0	0	111.6	T681 R686 L689 I690 F716 L717 L718 T719 V722	M677-T681 HydrophobicContact CG-CG2 4.1Å; M677-R686 HydrophobicContact CE-CB 4.05Å; M677-R686 HydrophobicContact CE-CG 4.4Å; M677-R686 HydrophobicContact CG-CG 4.29Å; M677-R686 HydrophobicContact SD-CB 3.83Å; M677-R686 HydrophobicContact SD-CG 3.61Å; M677-L689 HydrophobicContact CB-CD1 4.44Å; M677-L689 HydrophobicContact CE-CB 4.12Å; M677-L689 HydrophobicContact CE-CD1 4.3Å; M677-L689 HydrophobicContact CG-CD1 4.35Å; M677-I690 HydrophobicContact CE-CD1 4.17Å; M677-I690 HydrophobicContact CE-CG1 3.85Å; M677-F716 HydrophobicContact CB-CE2 3.85Å; M677-F716 HydrophobicContact CB-CZ 4.26Å; M677-F716 HydrophobicContact CE-CZ 3.84Å; M677-L717 PolarHBondContact N-O 2.94Å; M677-L718 HydrophobicContact CB-CD2 3.79Å; M677-T719 PolarHBondContact O-N 2.9Å; M677-V722 HydrophobicContact CB-CG1 4.47Å; M677-V722 HydrophobicContact CG-CG1 4.07Å; M677-V722 HydrophobicContact SD-CG1 3.54Å; M677-V722 VanDerWaalsContact SD-CG1 3.54Å
678	D	88.4	Confident	84.7	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	31%	0.311	C	S	.	.			trans	-130.5	-175.2	176.2	77.9	21.9	0	0	0	111.8	R657 R676 T680 T681 T719	R657-D678 HydrophobicContact CG-CB 4.35Å; R657-D678 IonicContact CZ-OD2 3.48Å; R657-D678 IonicContact NE-OD1 3.19Å; R657-D678 IonicContact NE-OD2 2.67Å; R657-D678 PolarHBondContact NE-OD2 2.92Å; R657-D678 IonicContact NH2-OD1 3.45Å; R657-D678 IonicContact NH2-OD2 3.53Å; R657-D678 PolarHBondContact NH2-OD2 3.24Å; R676-D678 IonicContact CZ-OD2 3.94Å; R676-D678 IonicContact NE-OD2 3.34Å; R676-D678 IonicContact NH2-OD2 3.65Å; R676-D678 PolarHBondContact NH2-OD2 3.08Å; D678-T680 PolarHBondContact O-N 3.23Å; D678-T680 VanDerWaalsContact O-N 3.12Å; D678-T680 WeakPolarHBondContact OD1-CA 3.48Å; D678-T680 WeakPolarHBondContact OD1-CB 3.39Å; D678-T680 PolarHBondContact OD1-N 3.46Å; D678-T680 PolarHBondContact OD1-OG1 2.75Å; D678-T681 PolarHBondContact N-OG1 2.75Å; D678-T681 PolarHBondContact O-N 2.81Å; D678-T681 PolarHBondContact O-OG1 3.4Å; D678-T719 HydrophobicContact CB-CG2 3.82Å
679	G	81.2	Confident	84.7	Confident	52 Å²	52	55.4 Å²	55.4	54%	0.536	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-21.1	-178.1	0	0	0	0	0	115.1	R686	G679-R686 PolarHBondContact O-NH2 3.16Å
680	T	85.9	Confident	84.8	Confident	90 Å²	90	52.9 Å²	52.9	55%	0.552	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-14.2	179.6	51.8	0	0	0	0	114.6	R657 D678	R657-T680 PolarHBondContact NH2-OG1 2.85Å; D678-T680 PolarHBondContact O-N 3.23Å; D678-T680 VanDerWaalsContact O-N 3.12Å; D678-T680 WeakPolarHBondContact OD1-CA 3.48Å; D678-T680 WeakPolarHBondContact OD1-CB 3.39Å; D678-T680 PolarHBondContact OD1-N 3.46Å; D678-T680 PolarHBondContact OD1-OG1 2.75Å
681	T	85.3	Confident	84.7	Confident	18 Å²	18	58.8 Å²	58.8	11%	0.11	30%	0.304	C	S	.	.	S	Bend	trans	-62.2	125.3	173.5	-49.2	0	0	0	0	110.1	M677 D678 Q685 R686 L689	M677-T681 HydrophobicContact CG-CG2 4.1Å; D678-T681 PolarHBondContact N-OG1 2.75Å; D678-T681 PolarHBondContact O-N 2.81Å; D678-T681 PolarHBondContact O-OG1 3.4Å; T681-Q685 HydrophobicContact CG2-CB 4.28Å; T681-R686 HydrophobicContact CG2-CG 3.98Å; T681-R686 PolarHBondContact O-NE 3.2Å; T681-R686 PolarHBondContact O-NH2 2.7Å; T681-L689 HydrophobicContact CG2-CD1 3.81Å
682	P	81.2	Confident	84.8	Confident	61 Å²	61	56.5 Å²	56.5	40%	0.396	29%	0.291	S	S	.	.			trans	-69.2	146.4	-178.4	28	-35.2	0	0	0	112.2	S684 Q685 R686	P682-S684 PolarHBondContact O-N 3.02Å; P682-S684 VanDerWaalsContact O-N 3.14Å; P682-Q685 VanDerWaalsContact CD-OE1 3.31Å; P682-Q685 HydrophobicContact CG-CB 4.15Å; P682-Q685 HydrophobicContact CG-CG 3.91Å; P682-Q685 VanDerWaalsContact CG-OE1 3.3Å; P682-Q685 PolarHBondContact O-N 3.22Å; P682-R686 WeakPolarHBondContact O-CG 3.48Å; P682-R686 PolarHBondContact O-N 3.44Å
683	V	76.2	Confident	84.8	Confident	31 Å²	31	55.4 Å²	55.4	19%	0.188	29%	0.286	C	S	.	.	H	α-helix	trans	-58.5	-32	-170.3	-179	0	0	0	0	113.4	H687	V683-H687 PolarHBondContact O-ND1 2.86Å
684	S	76.9	Confident	84.6	Confident	90 Å²	90	55.7 Å²	55.7	63%	0.629	28%	0.284	S	S	*	.	H	α-helix	trans	-60.7	-44.8	174.1	47.8	0	0	0	0	112.9	P682	P682-S684 PolarHBondContact O-N 3.02Å; P682-S684 VanDerWaalsContact O-N 3.14Å
685	Q	82.2	Confident	83.9	Confident	112 Å²	112	59.8 Å²	59.8	52%	0.523	30%	0.3	S	S	.	.	H	α-helix	trans	-75.7	-28.3	-178.9	-69.8	177.1	-11.2	0	0	113.1	T681 P682 H687 E688 L689	T681-Q685 HydrophobicContact CG2-CB 4.28Å; P682-Q685 VanDerWaalsContact CD-OE1 3.31Å; P682-Q685 HydrophobicContact CG-CB 4.15Å; P682-Q685 HydrophobicContact CG-CG 3.91Å; P682-Q685 VanDerWaalsContact CG-OE1 3.3Å; P682-Q685 PolarHBondContact O-N 3.22Å; Q685-H687 VanDerWaalsContact C-N 3.31Å; Q685-H687 PolarHBondContact O-N 3.28Å; Q685-E688 PolarHBondContact O-N 3.15Å; Q685-L689 PolarHBondContact O-N 2.98Å; Q685-L689 VanDerWaalsContact O-N 3.1Å
686	R	82.1	Confident	82.4	Confident	32 Å²	32	64.1 Å²	64.1	12%	0.121	32%	0.315	C	S	.	.	H	α-helix	trans	-54	-47.3	-176.8	-63.6	-176.8	-169.3	-177.7	-1.1	112	M677 G679 T681 P682 E688 L689 I690	M677-R686 HydrophobicContact CE-CB 4.05Å; M677-R686 HydrophobicContact CE-CG 4.4Å; M677-R686 HydrophobicContact CG-CG 4.29Å; M677-R686 HydrophobicContact SD-CB 3.83Å; M677-R686 HydrophobicContact SD-CG 3.61Å; G679-R686 PolarHBondContact O-NH2 3.16Å; T681-R686 HydrophobicContact CG2-CG 3.98Å; T681-R686 PolarHBondContact O-NE 3.2Å; T681-R686 PolarHBondContact O-NH2 2.7Å; P682-R686 WeakPolarHBondContact O-CG 3.48Å; P682-R686 PolarHBondContact O-N 3.44Å; R686-E688 VanDerWaalsContact C-N 3.26Å; R686-E688 PolarHBondContact O-N 3.17Å; R686-L689 PolarHBondContact O-N 2.9Å; R686-I690 VanDerWaalsContact O-CD1 3.22Å; R686-I690 WeakPolarHBondContact O-CD1 3.45Å; R686-I690 WeakPolarHBondContact O-CG1 3.26Å; R686-I690 PolarHBondContact O-N 3.21Å
687	H	77.6	Confident	80.4	Confident	58 Å²	58	66.7 Å²	66.7	27%	0.269	34%	0.34	S	S	.	.	H	α-helix	trans	-59.8	-34.4	179.7	-70	87.4	0	0	0	113.2	V683 Q685 R691	V683-H687 PolarHBondContact O-ND1 2.86Å; Q685-H687 VanDerWaalsContact C-N 3.31Å; Q685-H687 PolarHBondContact O-N 3.28Å; H687-R691 PolarHBondContact O-N 3.45Å
688	E	82.3	Confident	78.3	Confident	66 Å²	66	70.5 Å²	70.5	31%	0.308	36%	0.364	S	S	.	.	H	α-helix	trans	-76.7	-39.6	179.4	176.6	57.8	-169.4	0	0	112.1	Q685 R686 I690 R691 R692	Q685-E688 PolarHBondContact O-N 3.15Å; R686-E688 VanDerWaalsContact C-N 3.26Å; R686-E688 PolarHBondContact O-N 3.17Å; E688-I690 VanDerWaalsContact C-N 3.27Å; E688-I690 PolarHBondContact O-N 3.37Å; E688-R691 PolarHBondContact O-N 2.71Å; E688-R691 IonicContact OE2-CZ 2.73Å; E688-R691 IonicContact OE2-NH1 3.62Å; E688-R691 PolarHBondContact OE2-NH1 3.4Å; E688-R692 WeakPolarHBondContact O-CG 3.34Å; E688-R692 PolarHBondContact O-N 3.23Å; E688-R692 IonicContact OE1-CZ 2.97Å; E688-R692 VanDerWaalsContact OE1-CZ 3.28Å; E688-R692 IonicContact OE1-NE 2.73Å; E688-R692 PolarHBondContact OE1-NE 3.25Å; E688-R692 IonicContact OE1-NH2 3.41Å; E688-R692 PolarHBondContact OE1-NH2 2.88Å
689	L	86.7	Confident	76.1	Confident	34 Å²	34	75.5 Å²	75.5	18%	0.178	40%	0.399	C	S	.	.	H	α-helix	trans	-60.3	-38.8	171.3	-63	172.7	0	0	0	111.8	L675 M677 T681 Q685 R686 R692 F693 F716	L675-L689 HydrophobicContact CD2-CD2 4.11Å; M677-L689 HydrophobicContact CB-CD1 4.44Å; M677-L689 HydrophobicContact CE-CB 4.12Å; M677-L689 HydrophobicContact CE-CD1 4.3Å; M677-L689 HydrophobicContact CG-CD1 4.35Å; T681-L689 HydrophobicContact CG2-CD1 3.81Å; Q685-L689 PolarHBondContact O-N 2.98Å; Q685-L689 VanDerWaalsContact O-N 3.1Å; R686-L689 PolarHBondContact O-N 2.9Å; L689-R692 PolarHBondContact O-N 2.91Å; L689-F693 PolarHBondContact O-N 2.86Å; L689-F693 VanDerWaalsContact O-N 3.08Å; L689-F716 HydrophobicContact CB-CZ 4.11Å
690	I	84.5	Confident	74.1	Confident	26 Å²	26	79.4 Å²	79.4	13%	0.133	41%	0.408	C	S	.	.	H	α-helix	trans	-65.4	-44.8	176.2	-64.1	156.6	0	0	0	110.8	M677 R686 E688 R692 F693 N694 V727 N728 L729	M677-I690 HydrophobicContact CE-CD1 4.17Å; M677-I690 HydrophobicContact CE-CG1 3.85Å; R686-I690 VanDerWaalsContact O-CD1 3.22Å; R686-I690 WeakPolarHBondContact O-CD1 3.45Å; R686-I690 WeakPolarHBondContact O-CG1 3.26Å; R686-I690 PolarHBondContact O-N 3.21Å; E688-I690 VanDerWaalsContact C-N 3.27Å; E688-I690 PolarHBondContact O-N 3.37Å; I690-R692 PolarHBondContact O-N 3.1Å; I690-F693 PolarHBondContact O-N 2.67Å; I690-N694 WeakPolarHBondContact CG2-ND2 3.36Å; I690-N694 WeakPolarHBondContact O-CB 3.47Å; I690-N694 PolarHBondContact O-N 2.65Å; I690-N694 PolarHBondContact O-ND2 2.65Å; I690-V727 HydrophobicContact CB-CG1 4.5Å; I690-V727 HydrophobicContact CD1-CB 4.43Å; I690-V727 HydrophobicContact CD1-CG1 3.47Å; I690-V727 VanDerWaalsContact CD1-CG1 3.47Å; I690-V727 HydrophobicContact CD1-CG2 4.22Å; I690-V727 HydrophobicContact CG1-CG1 3.52Å; I690-V727 HydrophobicContact CG2-CG1 4.13Å; I690-N728 WeakPolarHBondContact CG2-O 3.31Å; I690-L729 HydrophobicContact CG2-CD2 4.44Å
691	R	82.9	Confident	71.7	Confident	157 Å²	157	79.6 Å²	79.6	59%	0.592	41%	0.413	S	S	*	.	H	α-helix	trans	-58	-47.6	175.2	-178.9	-178.7	-69.3	110.9	-0.4	111.2	H687 E688 F693 N694 Y695	H687-R691 PolarHBondContact O-N 3.45Å; E688-R691 PolarHBondContact O-N 2.71Å; E688-R691 IonicContact OE2-CZ 2.73Å; E688-R691 IonicContact OE2-NH1 3.62Å; E688-R691 PolarHBondContact OE2-NH1 3.4Å; R691-F693 PolarHBondContact O-N 3.23Å; R691-N694 PolarHBondContact O-N 2.66Å; R691-Y695 PolarHBondContact O-N 2.75Å
692	R	85.6	Confident	69.3	Low	140 Å²	140	86 Å²	86	53%	0.528	44%	0.441	S	S	.	.	H	α-helix	trans	-61.4	-39.7	179.4	-70.5	174.6	-170.1	-150.2	-3	113.1	L675 E688 L689 I690 I713	L675-R692 HydrophobicContact CD1-CB 4.25Å; E688-R692 WeakPolarHBondContact O-CG 3.34Å; E688-R692 PolarHBondContact O-N 3.23Å; E688-R692 IonicContact OE1-CZ 2.97Å; E688-R692 VanDerWaalsContact OE1-CZ 3.28Å; E688-R692 IonicContact OE1-NE 2.73Å; E688-R692 PolarHBondContact OE1-NE 3.25Å; E688-R692 IonicContact OE1-NH2 3.41Å; E688-R692 PolarHBondContact OE1-NH2 2.88Å; L689-R692 PolarHBondContact O-N 2.91Å; I690-R692 PolarHBondContact O-N 3.1Å; R692-I713 HydrophobicContact CB-CD1 4.03Å
693	F	87	Confident	66.9	Low	0 Å²	0	92.5 Å²	92.5	0%	0	46%	0.463	C	S	.	.	H	α-helix	trans	-73.5	-33.9	177.8	-173.5	-100.8	0	0	0	113.7	K649 L651 L675 L689 I690 R691 I713 F716 L729 S731 A732	K649-F693 HydrophobicContact CB-CZ 4.3Å; L651-F693 HydrophobicContact CD2-CD1 4.48Å; L651-F693 HydrophobicContact CD2-CE1 3.62Å; L651-F693 HydrophobicContact CD2-CZ 3.67Å; L675-F693 HydrophobicContact CD1-CB 4.18Å; L689-F693 PolarHBondContact O-N 2.86Å; L689-F693 VanDerWaalsContact O-N 3.08Å; I690-F693 PolarHBondContact O-N 2.67Å; R691-F693 PolarHBondContact O-N 3.23Å; F693-I713 HydrophobicContact CD2-CB 4.43Å; F693-I713 HydrophobicContact CD2-CG2 3.96Å; F693-I713 HydrophobicContact CE2-CG2 4.47Å; F693-F716 HydrophobicContact CB-CD1 3.75Å; F693-F716 HydrophobicContact CB-CE1 3.75Å; F693-F716 AromaticContact CD1-CD1 3.79Å; F693-F716 HydrophobicContact CD1-CD1 3.79Å; F693-F716 HydrophobicContact CD1-CE1 4.43Å; F693-F716 HydrophobicContact CD2-CB 4Å; F693-F716 AromaticContact CD2-CD1 3.73Å; F693-F716 HydrophobicContact CD2-CD1 3.73Å; F693-F716 HydrophobicContact CD2-CG 4.18Å; F693-F716 HydrophobicContact CE1-CD1 4.34Å; F693-F716 HydrophobicContact CE2-CB 3.84Å; F693-F716 HydrophobicContact CE2-CD1 4.3Å; F693-F716 HydrophobicContact CG-CB 4.5Å; F693-F716 AromaticContact CG-CD1 3.44Å; F693-F716 HydrophobicContact CG-CD1 3.44Å; F693-F716 VanDerWaalsContact CG-CD1 3.44Å; F693-F716 AromaticContact CG-CE1 3.99Å; F693-F716 HydrophobicContact CG-CE1 3.99Å; F693-F716 HydrophobicContact CG-CG 4.34Å; F693-F716 HydrophobicContact CZ-CB 4.19Å; F693-L729 HydrophobicContact CD1-CD2 4Å; F693-S731 WeakPolarHBondContact CD1-OG 3.38Å; F693-S731 WeakPolarHBondContact CE1-OG 3.42Å; F693-S731 PolarHBondContact O-OG 3.25Å; F693-A732 HydrophobicContact CE1-CB 3.88Å; F693-A732 HydrophobicContact CZ-CB 3.94Å
694	N	84.2	Confident	65	Low	50 Å²	50	97 Å²	97	27%	0.267	49%	0.485	S	S	.	.	H	α-helix	trans	-80.7	-19.1	177	-71.4	-26.1	0	0	0	112.9	I690 R691 N728 S731	I690-N694 WeakPolarHBondContact CG2-ND2 3.36Å; I690-N694 WeakPolarHBondContact O-CB 3.47Å; I690-N694 PolarHBondContact O-N 2.65Å; I690-N694 PolarHBondContact O-ND2 2.65Å; R691-N694 PolarHBondContact O-N 2.66Å; N694-N728 PolarHBondContact ND2-O 3.02Å; N694-S731 PolarHBondContact OD1-OG 2.94Å
695	Y	77.4	Confident	63.1	Low	156 Å²	156	98.5 Å²	98.5	61%	0.612	49%	0.486	S	S	*	.			trans	-62.1	139.8	169.2	-160.7	-101.9	0	0	0	109.8	R691	R691-Y695 PolarHBondContact O-N 2.75Å
696	R	62.1	Low	60.8	Low	118 Å²	118	104.1 Å²	104.1	45%	0.445	50%	0.502	S	S	.	.			trans	-145.1	128.9	-179.1	-177.7	175.1	177.4	-165	-8.9	107.8	T698	R696-T698 VanDerWaalsContact C-N 3.33Å; R696-T698 PolarHBondContact O-N 3.15Å
697	S	48.9	Very low	58.8	Low	104 Å²	104	108.5 Å²	108.5	73%	0.727	53%	0.533	S	S	*	.			trans	-71.8	91.5	170.7	-165.1	0	0	0	0	108.8
698	T	45.2	Very low	56.9	Low	81 Å²	81	108.8 Å²	108.8	50%	0.497	54%	0.542	S	S	.	.			trans	-79.9	135.6	165	42.8	0	0	0	0	108.7	R696 D700	R696-T698 VanDerWaalsContact C-N 3.33Å; R696-T698 PolarHBondContact O-N 3.15Å; T698-D700 PolarHBondContact O-N 3.33Å
699	S	42.3	Very low	55.1	Low	110 Å²	110	113 Å²	113	77%	0.769	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-16.4	-167.7	37.7	0	0	0	0	115.5
700	D	39.5	Very low	53.3	Low	133 Å²	133	118 Å²	118	71%	0.711	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	22.5	-153.3	-38.2	-47.6	0	0	0	113.2	T698	T698-D700 PolarHBondContact O-N 3.33Å
701	S	35.2	Very low	51.9	Low	94 Å²	94	122.9 Å²	122.9	66%	0.657	61%	0.614	S	S	*	*	S	Bend	trans	-143.9	91.8	-175.2	-62.5	0	0	0	0	114.3
702	E	34.6	Very low	51.4	Low	153 Å²	153	119.9 Å²	119.9	72%	0.715	61%	0.61	S	S	*	*			trans	47.3	84.3	148.8	-57	-168.2	137.9	0	0	119.2	I704	E702-I704 PolarHBondContact O-N 3.48Å
703	K	32.6	Very low	51.3	Low	197 Å²	197	114.2 Å²	114.2	86%	0.857	59%	0.59	S	S	*	*				33.8	-2.2	123.7	-85.2	-177	178	176	0	123.8
704	I	35.2	Very low	51.5	Low	126 Å²	126	115 Å²	115	65%	0.646	59%	0.593	S	S	*	*			trans	-84.8	132.8	-171.1	-61.5	172.7	0	0	0	110.5	E702	E702-I704 PolarHBondContact O-N 3.48Å
705	D	36.4	Very low	51.9	Low	121 Å²	121	112.7 Å²	112.7	65%	0.647	58%	0.581	S	S	*	*			trans	54.3	80.3	172	-57.4	-19.9	0	0	0	117.3	T707	D705-T707 PolarHBondContact O-N 3.4Å
706	R	34.5	Very low	52.6	Low	230 Å²	230	105.2 Å²	105.2	87%	0.868	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	31.2	171.8	-64.7	-175.4	171.3	-167.4	-4.2	114.4
707	T	40.4	Very low	54.1	Low	124 Å²	124	99.6 Å²	99.6	76%	0.761	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.9	12.2	-162.2	46.7	0	0	0	0	115.5	D705	D705-T707 PolarHBondContact O-N 3.4Å
708	S	37.6	Very low	56.2	Low	65 Å²	65	94.8 Å²	94.8	46%	0.455	50%	0.496	S	S	.	.	S	Bend	trans	-146.2	149.5	170.3	45.3	0	0	0	0	114.1	H710	S708-H710 PolarHBondContact O-CD2 3.46Å; S708-H710 VanDerWaalsContact O-CD2 3.3Å; S708-H710 PolarHBondContact O-N 3.25Å; S708-H710 PolarHBondContact OG-NE2 3.15Å
709	D	44.1	Very low	58.3	Low	153 Å²	153	91.5 Å²	91.5	82%	0.818	48%	0.476	S	S	*	.			trans	-70.2	75.8	-167.4	-52.3	-77.6	0	0	0	114.9	L711	D709-L711 PolarHBondContact O-N 3.06Å
710	H	48.6	Very low	60.3	Low	140 Å²	140	86.3 Å²	86.3	65%	0.648	44%	0.44	S	S	*	.			trans	-84.9	61.1	178.1	-62.7	-45.1	0	0	0	112.9	S708 D712	S708-H710 PolarHBondContact O-CD2 3.46Å; S708-H710 VanDerWaalsContact O-CD2 3.3Å; S708-H710 PolarHBondContact O-N 3.25Å; S708-H710 PolarHBondContact OG-NE2 3.15Å; H710-D712 PolarHBondContact O-N 3.22Å
711	L	56.8	Low	62.2	Low	129 Å²	129	88.1 Å²	88.1	68%	0.675	44%	0.437	S	S	*	.			trans	-55.9	128.6	169.9	-74.6	157.5	0	0	0	111.2	D709 I713	D709-L711 PolarHBondContact O-N 3.06Å; L711-I713 WeakPolarHBondContact O-CG1 3.42Å; L711-I713 PolarHBondContact O-N 3.34Å
712	D	71.1	Confident	64.1	Low	93 Å²	93	83.9 Å²	83.9	50%	0.497	41%	0.407	S	S	.	.			trans	-72.3	130.9	173.1	-164.3	26.3	0	0	0	110.8	K649 H710	K649-D712 VanDerWaalsContact CE-OD1 3.31Å; K649-D712 WeakPolarHBondContact CE-OD1 3.38Å; K649-D712 IonicContact NZ-OD1 3.69Å; K649-D712 PolarHBondContact NZ-OD1 3.11Å; K649-D712 IonicContact NZ-OD2 3.6Å; H710-D712 PolarHBondContact O-N 3.22Å
713	I	84.5	Confident	65.6	Low	22 Å²	22	76.6 Å²	76.6	11%	0.113	37%	0.373	C	S	.	.			trans	-97.5	114.7	-168.6	-52.3	-176.2	0	0	0	109.5	K649 L675 R692 F693 L711	K649-I713 WeakPolarHBondContact CD-O 3.4Å; K649-I713 WeakPolarHBondContact CE-O 3.3Å; K649-I713 PolarHBondContact NZ-O 2.6Å; L675-I713 HydrophobicContact CD1-CD1 3.64Å; L675-I713 HydrophobicContact CD1-CG2 4.24Å; L675-I713 HydrophobicContact CD2-CD1 4.22Å; L675-I713 HydrophobicContact CG-CD1 3.86Å; L675-I713 HydrophobicContact CG-CG2 3.92Å; R692-I713 HydrophobicContact CB-CD1 4.03Å; F693-I713 HydrophobicContact CD2-CB 4.43Å; F693-I713 HydrophobicContact CD2-CG2 3.96Å; F693-I713 HydrophobicContact CE2-CG2 4.47Å; L711-I713 WeakPolarHBondContact O-CG1 3.42Å; L711-I713 PolarHBondContact O-N 3.34Å
714	F	90.5	Very high	67	Low	17 Å²	17	67.6 Å²	67.6	8%	0.075	34%	0.336	C	S	.	.			trans	-80.4	-49.1	-177	168.8	-111.7	0	0	0	112.7	L640 W643 Y644 H648 V650 F672 S673	L640-F714 HydrophobicContact CD2-CE1 4.29Å; L640-F714 WeakPolarHBondContact O-CZ 3.49Å; W643-F714 HydrophobicContact CB-CE2 4.43Å; W643-F714 HydrophobicContact CB-CZ 4.3Å; Y644-F714 VanDerWaalsContact CA-CE2 3.45Å; Y644-F714 HydrophobicContact CD2-CD1 4.15Å; Y644-F714 HydrophobicContact CD2-CD2 4.03Å; Y644-F714 HydrophobicContact CD2-CE1 4.25Å; Y644-F714 HydrophobicContact CD2-CE2 4.15Å; Y644-F714 HydrophobicContact CD2-CG 4.04Å; Y644-F714 HydrophobicContact CD2-CZ 4.25Å; H648-F714 WeakPolarHBondContact O-CD2 3.36Å; H648-F714 WeakPolarHBondContact O-CE2 3.44Å; V650-F714 HydrophobicContact CG2-CE1 4.47Å; V650-F714 HydrophobicContact CG2-CE2 3.85Å; V650-F714 HydrophobicContact CG2-CZ 3.83Å; V650-F714 PolarHBondContact N-O 3.12Å; F672-F714 HydrophobicContact CB-CD1 4.02Å; F672-F714 HydrophobicContact CB-CE1 4.45Å; F672-F714 HydrophobicContact CD2-CD1 4.43Å; F672-F714 HydrophobicContact CD2-CE1 4.03Å; F672-F714 HydrophobicContact CE2-CE1 4.42Å; F672-F714 HydrophobicContact CG-CD1 4.19Å; F672-F714 HydrophobicContact CG-CE1 4.18Å; S673-F714 PolarHBondContact O-N 2.81Å
715	L	92.6	Very high	68.3	Low	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.9	-167.8	-179.2	63.6	0	0	0	113.2	L640 V650 L652 V667 S673 Y674 L675 L717	L640-L715 HydrophobicContact CD1-CD2 4.35Å; L640-L715 HydrophobicContact CD2-CD1 4.09Å; L640-L715 HydrophobicContact CD2-CD2 4.4Å; V650-L715 HydrophobicContact CB-CD1 3.75Å; V650-L715 HydrophobicContact CG1-CD1 3.71Å; V650-L715 WeakPolarHBondContact O-CA 3.47Å; L652-L715 HydrophobicContact CB-CD1 4.02Å; V667-L715 HydrophobicContact CB-CD2 4.32Å; V667-L715 HydrophobicContact CG1-CD2 3.92Å; V667-L715 HydrophobicContact CG2-CD2 3.36Å; S673-L715 PolarHBondContact O-N 3.03Å; S673-L715 VanDerWaalsContact O-N 3.17Å; Y674-L715 CarbonylContact C-O 3.53Å; Y674-L715 WeakPolarHBondContact CA-O 3.15Å; L675-L715 PolarHBondContact N-O 2.93Å; L715-L717 HydrophobicContact CD2-CD2 3.87Å; L715-L717 HydrophobicContact CD2-CG 4.42Å; L715-L717 HydrophobicContact CG-CD2 4.14Å
716	F	92.9	Very high	69.5	Low	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	111.2	167.6	-146.6	155.5	0	0	0	110.9	V650 L651 L652 L675 M677 L689 F693 L718 L729	V650-F716 PolarHBondContact O-N 3.11Å; L651-F716 HydrophobicContact CD2-CB 3.67Å; L651-F716 HydrophobicContact CD2-CD1 4.42Å; L651-F716 HydrophobicContact CD2-CG 4.47Å; L652-F716 PolarHBondContact N-O 3.27Å; L675-F716 HydrophobicContact CB-CD2 3.76Å; L675-F716 HydrophobicContact CB-CE2 3.69Å; L675-F716 HydrophobicContact CB-CG 4.34Å; L675-F716 HydrophobicContact CB-CZ 4.23Å; L675-F716 HydrophobicContact CD1-CZ 4.39Å; L675-F716 WeakPolarHBondContact O-CD2 3.41Å; M677-F716 HydrophobicContact CB-CE2 3.85Å; M677-F716 HydrophobicContact CB-CZ 4.26Å; M677-F716 HydrophobicContact CE-CZ 3.84Å; L689-F716 HydrophobicContact CB-CZ 4.11Å; F693-F716 HydrophobicContact CB-CD1 3.75Å; F693-F716 HydrophobicContact CB-CE1 3.75Å; F693-F716 AromaticContact CD1-CD1 3.79Å; F693-F716 HydrophobicContact CD1-CD1 3.79Å; F693-F716 HydrophobicContact CD1-CE1 4.43Å; F693-F716 HydrophobicContact CD2-CB 4Å; F693-F716 AromaticContact CD2-CD1 3.73Å; F693-F716 HydrophobicContact CD2-CD1 3.73Å; F693-F716 HydrophobicContact CD2-CG 4.18Å; F693-F716 HydrophobicContact CE1-CD1 4.34Å; F693-F716 HydrophobicContact CE2-CB 3.84Å; F693-F716 HydrophobicContact CE2-CD1 4.3Å; F693-F716 HydrophobicContact CG-CB 4.5Å; F693-F716 AromaticContact CG-CD1 3.44Å; F693-F716 HydrophobicContact CG-CD1 3.44Å; F693-F716 VanDerWaalsContact CG-CD1 3.44Å; F693-F716 AromaticContact CG-CE1 3.99Å; F693-F716 HydrophobicContact CG-CE1 3.99Å; F693-F716 HydrophobicContact CG-CG 4.34Å; F693-F716 HydrophobicContact CZ-CB 4.19Å; F716-L718 HydrophobicContact CB-CD1 4.41Å; F716-L718 HydrophobicContact CB-CG 4.35Å; F716-L718 HydrophobicContact CD1-CD2 4.42Å; F716-L718 HydrophobicContact CD2-CD2 3.53Å; F716-L718 HydrophobicContact CD2-CG 3.86Å; F716-L718 HydrophobicContact CE1-CD2 4.45Å; F716-L718 HydrophobicContact CE2-CD2 3.57Å; F716-L718 HydrophobicContact CE2-CG 4.41Å; F716-L718 HydrophobicContact CG-CD1 4.24Å; F716-L718 HydrophobicContact CG-CD2 4.01Å; F716-L718 HydrophobicContact CG-CG 4.03Å; F716-L718 HydrophobicContact CZ-CD2 4.06Å; F716-L729 HydrophobicContact CD1-CD2 4Å; F716-L729 HydrophobicContact CE1-CD2 3.9Å
717	L	93.4	Very high	71.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	116.1	170.6	-60	-178.3	0	0	0	109.9	L652 L660 E664 Y674 L675 R676 M677 L715	L652-L717 HydrophobicContact CB-CD2 4.09Å; L652-L717 HydrophobicContact CD1-CD2 4.06Å; L660-L717 HydrophobicContact CD2-CB 4.42Å; E664-L717 HydrophobicContact CB-CD1 3.84Å; E664-L717 HydrophobicContact CG-CD1 4.39Å; Y674-L717 HydrophobicContact CD2-CD1 3.97Å; Y674-L717 HydrophobicContact CD2-CG 4.5Å; Y674-L717 HydrophobicContact CE2-CD1 4.47Å; L675-L717 PolarHBondContact O-N 3.2Å; R676-L717 WeakPolarHBondContact CA-O 3.27Å; R676-L717 HydrophobicContact CB-CB 4.38Å; M677-L717 PolarHBondContact N-O 2.94Å; L715-L717 HydrophobicContact CD2-CD2 3.87Å; L715-L717 HydrophobicContact CD2-CG 4.42Å; L715-L717 HydrophobicContact CG-CD2 4.14Å
718	L	92.2	Very high	73.2	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	146.8	-173.1	-66	173.7	0	0	0	111.4	L651 L652 F653 S654 M677 F716 L729	L651-L718 HydrophobicContact CD2-CD1 4.18Å; L652-L718 PolarHBondContact O-N 3.34Å; F653-L718 WeakPolarHBondContact CA-O 3.21Å; F653-L718 HydrophobicContact CD1-CB 3.58Å; F653-L718 HydrophobicContact CD1-CD1 4.3Å; F653-L718 HydrophobicContact CE1-CB 3.6Å; F653-L718 HydrophobicContact CE1-CD1 3.51Å; F653-L718 HydrophobicContact CE1-CG 4.2Å; F653-L718 HydrophobicContact CZ-CD1 3.76Å; S654-L718 PolarHBondContact N-O 2.98Å; S654-L718 VanDerWaalsContact N-O 3.12Å; M677-L718 HydrophobicContact CB-CD2 3.79Å; F716-L718 HydrophobicContact CB-CD1 4.41Å; F716-L718 HydrophobicContact CB-CG 4.35Å; F716-L718 HydrophobicContact CD1-CD2 4.42Å; F716-L718 HydrophobicContact CD2-CD2 3.53Å; F716-L718 HydrophobicContact CD2-CG 3.86Å; F716-L718 HydrophobicContact CE1-CD2 4.45Å; F716-L718 HydrophobicContact CE2-CD2 3.57Å; F716-L718 HydrophobicContact CE2-CG 4.41Å; F716-L718 HydrophobicContact CG-CD1 4.24Å; F716-L718 HydrophobicContact CG-CD2 4.01Å; F716-L718 HydrophobicContact CG-CG 4.03Å; F716-L718 HydrophobicContact CZ-CD2 4.06Å; L718-L729 HydrophobicContact CD1-CD1 3.47Å; L718-L729 VanDerWaalsContact CD1-CD1 3.47Å
719	T	90	Very high	75.5	Confident	11 Å²	11	41.8 Å²	41.8	7%	0.067	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	138.8	159.8	58.4	0	0	0	0	110.2	S654 L660 M677 D678 R721 V722 G723	S654-T719 VanDerWaalsContact O-CA 3.22Å; S654-T719 WeakPolarHBondContact O-CA 3.17Å; L660-T719 HydrophobicContact CD1-CG2 3.47Å; L660-T719 VanDerWaalsContact CD1-CG2 3.47Å; M677-T719 PolarHBondContact O-N 2.9Å; D678-T719 HydrophobicContact CB-CG2 3.82Å; T719-R721 PolarHBondContact O-N 3.2Å; T719-V722 WeakPolarHBondContact O-CA 3.25Å; T719-V722 PolarHBondContact O-N 3.34Å; T719-V722 WeakPolarHBondContact OG1-CB 3.42Å; T719-V722 WeakPolarHBondContact OG1-CG2 3.35Å; T719-V722 PolarHBondContact OG1-N 2.97Å; T719-G723 PolarHBondContact O-N 3.04Å
720	T	83.5	Confident	77.4	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-48.7	-42.8	173.3	50.7	0	0	0	0	111.7	F653 S654 Q655 V722 G723 G724	F653-T720 HydrophobicContact CB-CG2 3.86Å; S654-T720 PolarHBondContact O-N 3.48Å; Q655-T720 HydrophobicContact CG-CG2 4.49Å; Q655-T720 PolarHBondContact NE2-OG1 2.93Å; Q655-T720 PolarHBondContact OE1-OG1 2.91Å; T720-V722 VanDerWaalsContact C-N 3.33Å; T720-V722 PolarHBondContact O-N 3.26Å; T720-G723 WeakPolarHBondContact O-CA 3.13Å; T720-G723 PolarHBondContact O-N 2.86Å; T720-G723 VanDerWaalsContact O-N 3.15Å; T720-G724 PolarHBondContact O-N 3.36Å
721	R	79.1	Confident	79.2	Confident	172 Å²	172	30.7 Å²	30.7	65%	0.649	16%	0.158	S	C	*	.	H	α-helix	trans	-62.2	-35.2	177.6	-63.6	-175.6	-179.8	-161.5	-3.1	113.1	T719 G724 L725	T719-R721 PolarHBondContact O-N 3.2Å; R721-G724 PolarHBondContact O-N 2.99Å; R721-L725 WeakPolarHBondContact O-CG 3.39Å
722	V	76.5	Confident	80.8	Confident	4 Å²	4	24.6 Å²	24.6	2%	0.024	13%	0.126	C	C	.	.	H	α-helix	trans	-75.4	-35.1	173.4	166.8	0	0	0	0	111.5	M677 T719 T720 G724 L725	M677-V722 HydrophobicContact CB-CG1 4.47Å; M677-V722 HydrophobicContact CG-CG1 4.07Å; M677-V722 HydrophobicContact SD-CG1 3.54Å; M677-V722 VanDerWaalsContact SD-CG1 3.54Å; T719-V722 WeakPolarHBondContact O-CA 3.25Å; T719-V722 PolarHBondContact O-N 3.34Å; T719-V722 WeakPolarHBondContact OG1-CB 3.42Å; T719-V722 WeakPolarHBondContact OG1-CG2 3.35Å; T719-V722 PolarHBondContact OG1-N 2.97Å; T720-V722 VanDerWaalsContact C-N 3.33Å; T720-V722 PolarHBondContact O-N 3.26Å; V722-G724 PolarHBondContact O-N 2.96Å; V722-L725 HydrophobicContact CG2-CD1 4.22Å; V722-L725 WeakPolarHBondContact O-CB 3.36Å; V722-L725 PolarHBondContact O-N 3.21Å
723	G	64.9	Low	81.8	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-56.6	-35.1	166.3	0	0	0	0	0	112.6	T719 T720 L725 R753	T719-G723 PolarHBondContact O-N 3.04Å; T720-G723 WeakPolarHBondContact O-CA 3.13Å; T720-G723 PolarHBondContact O-N 2.86Å; T720-G723 VanDerWaalsContact O-N 3.15Å; G723-L725 PolarHBondContact O-N 3.11Å; G723-R753 WeakPolarHBondContact O-CG 3.44Å; G723-R753 PolarHBondContact O-NE 3.04Å
724	G	62.2	Low	82.2	Confident	8 Å²	8	20.9 Å²	20.9	8%	0.082	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.9	171.2	0	0	0	0	0	115.3	T720 R721 V722 G726 R753	T720-G724 PolarHBondContact O-N 3.36Å; R721-G724 PolarHBondContact O-N 2.99Å; V722-G724 PolarHBondContact O-N 2.96Å; G724-G726 PolarHBondContact O-N 3.22Å; G724-R753 PolarHBondContact O-NH2 3.48Å
725	L	63.7	Low	82.3	Confident	47 Å²	47	20.1 Å²	20.1	25%	0.246	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	9.9	-162.5	-75	177.5	0	0	0	117.3	T356 R721 V722 G723	T356-L725 WeakPolarHBondContact CB-O 3.29Å; T356-L725 HydrophobicContact CG2-CB 3.96Å; T356-L725 HydrophobicContact CG2-CD1 3.88Å; T356-L725 HydrophobicContact CG2-CG 4.38Å; T356-L725 WeakPolarHBondContact OG1-CB 3.31Å; T356-L725 PolarHBondContact OG1-O 3.24Å; R721-L725 WeakPolarHBondContact O-CG 3.39Å; V722-L725 HydrophobicContact CG2-CD1 4.22Å; V722-L725 WeakPolarHBondContact O-CB 3.36Å; V722-L725 PolarHBondContact O-N 3.21Å; G723-L725 PolarHBondContact O-N 3.11Å
726	G	60.7	Low	82.4	Confident	9 Å²	9	20.1 Å²	20.1	9%	0.093	10%	0.1	C	C	.	.			trans	116.6	-7.5	170.9	0	0	0	0	0	116.2	G724 R753	G724-G726 PolarHBondContact O-N 3.22Å; G726-R753 VanDerWaalsContact CA-CZ 3.43Å
727	V	73.3	Confident	82.4	Confident	19 Å²	19	20.1 Å²	20.1	12%	0.115	10%	0.101	C	C	.	.			trans	-63.6	141.6	-164.6	-169.4	0	0	0	0	114.2	I690 L729 R753	I690-V727 HydrophobicContact CB-CG1 4.5Å; I690-V727 HydrophobicContact CD1-CB 4.43Å; I690-V727 HydrophobicContact CD1-CG1 3.47Å; I690-V727 VanDerWaalsContact CD1-CG1 3.47Å; I690-V727 HydrophobicContact CD1-CG2 4.22Å; I690-V727 HydrophobicContact CG1-CG1 3.52Å; I690-V727 HydrophobicContact CG2-CG1 4.13Å; V727-L729 HydrophobicContact CB-CG 4.48Å; V727-L729 HydrophobicContact CG1-CD1 4.17Å; V727-L729 HydrophobicContact CG1-CD2 3.72Å; V727-L729 HydrophobicContact CG1-CG 3.7Å; V727-R753 VanDerWaalsContact O-CB 3.27Å; V727-R753 WeakPolarHBondContact O-CB 3.25Å; V727-R753 WeakPolarHBondContact O-CD 3.25Å; V727-R753 VanDerWaalsContact O-CG 3.25Å; V727-R753 WeakPolarHBondContact O-CG 3.24Å
728	N	80.1	Confident	82.4	Confident	47 Å²	47	20.1 Å²	20.1	25%	0.251	10%	0.101	S	C	.	.			trans	-97	118.8	169.1	-65.1	-22.2	0	0	0	110.5	I690 N694 R756	I690-N728 WeakPolarHBondContact CG2-O 3.31Å; N694-N728 PolarHBondContact ND2-O 3.02Å; N728-R756 VanDerWaalsContact OD1-CD 3.25Å; N728-R756 WeakPolarHBondContact OD1-CD 3.45Å; N728-R756 VanDerWaalsContact OD1-CZ 3.27Å; N728-R756 PolarHBondContact OD1-NE 3.02Å; N728-R756 PolarHBondContact OD1-NH1 3.46Å
729	L	84.9	Confident	82.4	Confident	2 Å²	2	20 Å²	20	1%	0.01	10%	0.1	C	C	.	.			trans	-130.2	49.4	-178.1	-61.2	173	0	0	0	111.2	L651 I690 F693 F716 L718 V727 S731 A732 R753	L651-L729 HydrophobicContact CD1-CB 3.9Å; L651-L729 HydrophobicContact CD1-CD1 3.69Å; L651-L729 HydrophobicContact CD1-CG 4.45Å; L651-L729 HydrophobicContact CD2-CB 4.31Å; L651-L729 HydrophobicContact CD2-CD1 3.93Å; L651-L729 HydrophobicContact CG-CD1 4.48Å; I690-L729 HydrophobicContact CG2-CD2 4.44Å; F693-L729 HydrophobicContact CD1-CD2 4Å; F716-L729 HydrophobicContact CD1-CD2 4Å; F716-L729 HydrophobicContact CE1-CD2 3.9Å; L718-L729 HydrophobicContact CD1-CD1 3.47Å; L718-L729 VanDerWaalsContact CD1-CD1 3.47Å; V727-L729 HydrophobicContact CB-CG 4.48Å; V727-L729 HydrophobicContact CG1-CD1 4.17Å; V727-L729 HydrophobicContact CG1-CD2 3.72Å; V727-L729 HydrophobicContact CG1-CG 3.7Å; L729-S731 PolarHBondContact O-N 2.86Å; L729-A732 PolarHBondContact O-N 3.29Å; L729-R753 PolarHBondContact N-O 3.31Å
730	T	84.8	Confident	82.2	Confident	38 Å²	38	19.5 Å²	19.5	23%	0.233	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-8.6	-173.3	45.8	0	0	0	0	114.4	A732 R756 Q759	T730-A732 VanDerWaalsContact C-N 3.31Å; T730-R756 HydrophobicContact CG2-CB 3.96Å; T730-Q759 PolarHBondContact O-NE2 2.86Å; T730-Q759 PolarHBondContact O-OE1 3.41Å
731	S	86.1	Confident	82.4	Confident	22 Å²	22	20.3 Å²	20.3	15%	0.154	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-15.9	174.1	60.6	0	0	0	0	114	K649 F693 N694 L729	K649-S731 WeakPolarHBondContact CB-O 3.29Å; F693-S731 WeakPolarHBondContact CD1-OG 3.38Å; F693-S731 WeakPolarHBondContact CE1-OG 3.42Å; F693-S731 PolarHBondContact O-OG 3.25Å; N694-S731 PolarHBondContact OD1-OG 2.94Å; L729-S731 PolarHBondContact O-N 2.86Å
732	A	90.1	Very high	82.6	Confident	0 Å²	0	16 Å²	16	0%	0	9%	0.085	C	C	.	.			trans	-90.7	131.3	-178.1	0	0	0	0	0	113.5	K649 L651 F693 L729 T730 Q759	K649-A732 WeakPolarHBondContact O-CA 3.38Å; L651-A732 HydrophobicContact CD1-CB 4.13Å; L651-A732 HydrophobicContact CD2-CB 3.79Å; L651-A732 HydrophobicContact CG-CB 3.54Å; F693-A732 HydrophobicContact CE1-CB 3.88Å; F693-A732 HydrophobicContact CZ-CB 3.94Å; L729-A732 PolarHBondContact O-N 3.29Å; T730-A732 VanDerWaalsContact C-N 3.31Å; A732-Q759 PolarHBondContact O-NE2 2.91Å
733	N	91.3	Very high	82.8	Confident	4 Å²	4	16.8 Å²	16.8	2%	0.021	9%	0.089	C	C	.	.			trans	-109.7	-5.4	177.6	68.4	-74.5	0	0	0	113.8	H648 K649 R761 V764	H648-N733 WeakPolarHBondContact CA-OD1 3.34Å; H648-N733 VanDerWaalsContact CG-ND2 3.26Å; H648-N733 PolarHBondContact ND1-ND2 3.06Å; K649-N733 PolarHBondContact N-OD1 3.27Å; K649-N733 PolarHBondContact O-N 3.26Å; N733-R761 HydrophobicContact CB-CB 3.78Å; N733-V764 PolarHBondContact O-N 2.9Å
734	R	93.4	Very high	83.8	Confident	34 Å²	34	17 Å²	17	13%	0.128	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	133	173.6	-60.1	-67.6	171.5	-101.3	6.7	109.7	W643 H648 K649 V650 L651 D762	W643-R734 HydrophobicContact CD2-CB 4.3Å; W643-R734 HydrophobicContact CD2-CG 4.22Å; W643-R734 HydrophobicContact CE3-CB 4.3Å; W643-R734 HydrophobicContact CG-CG 4.31Å; H648-R734 HydrophobicContact CB-CG 3.93Å; H648-R734 PolarHBondContact CD2-NE 3.41Å; H648-R734 PolarHBondContact CD2-NH2 2.73Å; H648-R734 PolarHBondContact NE2-NH2 3.27Å; K649-R734 PolarHBondContact O-N 3Å; K649-R734 VanDerWaalsContact O-N 3.1Å; V650-R734 WeakPolarHBondContact CA-O 3.49Å; V650-R734 HydrophobicContact CG2-CB 4.25Å; L651-R734 PolarHBondContact N-O 2.91Å; R734-D762 PolarHBondContact NH1-O 2.88Å
735	V	93.2	Very high	84.7	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	124.4	179.4	176.4	0	0	0	0	109	L651 F653 A754 V763 V764 I765 Y766	L651-V735 HydrophobicContact CB-CG2 4.45Å; L651-V735 HydrophobicContact CD1-CG2 4.34Å; F653-V735 HydrophobicContact CD2-CG1 3.85Å; F653-V735 HydrophobicContact CE2-CG1 3.76Å; V735-A754 HydrophobicContact CG2-CB 3.77Å; V735-V763 HydrophobicContact CG2-CG1 4.22Å; V735-V764 PolarHBondContact N-O 2.91Å; V735-I765 HydrophobicContact CB-CG1 4.12Å; V735-I765 CarbonylContact O-C 3.53Å; V735-I765 WeakPolarHBondContact O-CA 3.29Å; V735-Y766 PolarHBondContact O-N 3.14Å
736	L	94.1	Very high	85.6	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	118.4	-178.1	-178.5	58.2	0	0	0	110.2	V636 W643 L651 L652 F653 Y766 L768	V636-L736 HydrophobicContact CG2-CD2 4.15Å; W643-L736 HydrophobicContact CH2-CB 4.23Å; W643-L736 HydrophobicContact CH2-CD1 4.39Å; W643-L736 HydrophobicContact CH2-CD2 4.18Å; W643-L736 HydrophobicContact CZ3-CB 4.2Å; W643-L736 HydrophobicContact CZ3-CD2 4.01Å; L651-L736 PolarHBondContact O-N 3.14Å; L652-L736 WeakPolarHBondContact CA-O 3.39Å; L652-L736 HydrophobicContact CD1-CD2 4.36Å; L652-L736 HydrophobicContact CG-CB 4.44Å; L652-L736 HydrophobicContact CG-CD2 4.19Å; L652-L736 HydrophobicContact CG-CG 4.39Å; F653-L736 PolarHBondContact N-O 3.08Å; L736-Y766 WeakPolarHBondContact CA-O 3.5Å; L736-L768 HydrophobicContact CD1-CD1 4.25Å; L736-L768 HydrophobicContact CD1-CD2 4.04Å; L736-L768 HydrophobicContact CD1-CG 3.9Å
737	I	93	Very high	86.9	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.005	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	110.1	172.5	-58.9	175.4	0	0	0	107.4	D747 R751 Y766 L768	I737-D747 HydrophobicContact CD1-CB 4.33Å; I737-R751 HydrophobicContact CD1-CG 4.1Å; I737-Y766 PolarHBondContact N-O 3.44Å; I737-L768 PolarHBondContact O-N 3.12Å
738	Y	94	Very high	87.4	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.085	C	C	.	.	S	Bend	trans	-77.5	-42.1	-176.4	-171.7	-91.9	0	0	0	112.8	N586 K632 M633 V636 F653 M659 L663 L768	N586-Y738 HydrophobicContact CB-CE1 3.9Å; N586-Y738 PolarHBondContact O-OH 2.87Å; N586-Y738 WeakPolarHBondContact OD1-CE1 3.47Å; K632-Y738 HydrophobicContact CB-CE2 3.81Å; K632-Y738 VanDerWaalsContact CB-OH 3.29Å; K632-Y738 WeakPolarHBondContact CB-OH 3.38Å; K632-Y738 HydrophobicContact CD-CE1 4.07Å; K632-Y738 HydrophobicContact CD-CE2 4.32Å; K632-Y738 PolarHBondContact NZ-O 2.74Å; M633-Y738 WeakPolarHBondContact CG-OH 3.48Å; V636-Y738 HydrophobicContact CG2-CD2 3.64Å; V636-Y738 HydrophobicContact CG2-CE2 3.6Å; F653-Y738 WeakPolarHBondContact O-CB 3.47Å; F653-Y738 PolarHBondContact O-N 3.06Å; M659-Y738 HydrophobicContact CE-CD1 4.49Å; M659-Y738 HydrophobicContact CE-CE1 3.61Å; M659-Y738 HydrophobicContact CE-CE2 4.26Å; M659-Y738 VanDerWaalsContact CE-CZ 3.47Å; M659-Y738 VanDerWaalsContact CE-OH 3.31Å; M659-Y738 WeakPolarHBondContact CE-OH 3.46Å; M659-Y738 HydrophobicContact CG-CD1 3.86Å; M659-Y738 HydrophobicContact CG-CE1 3.68Å; M659-Y738 HydrophobicContact SD-CD1 4.43Å; M659-Y738 HydrophobicContact SD-CE1 3.64Å; L663-Y738 HydrophobicContact CD1-CD2 4.43Å; L663-Y738 HydrophobicContact CD1-CG 4.38Å; L663-Y738 HydrophobicContact CD2-CD2 4.23Å; L663-Y738 HydrophobicContact CD2-CE2 4.09Å; Y738-L768 HydrophobicContact CD2-CD1 3.83Å; Y738-L768 HydrophobicContact CE2-CD1 4.17Å
739	D	90.9	Very high	87.6	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.074	C	C	.	.	S	Bend	trans	-138.6	125.8	176.7	69.7	-55.9	0	0	0	111.8	R582 N586 S654 Q655	R582-D739 IonicContact CZ-OD2 3.65Å; R582-D739 IonicContact NH1-OD2 2.71Å; R582-D739 PolarHBondContact NH1-OD2 2.82Å; N586-D739 WeakPolarHBondContact OD1-CB 3.41Å; S654-D739 WeakPolarHBondContact CA-OD1 3.15Å; S654-D739 VanDerWaalsContact CB-OD1 3.3Å; S654-D739 WeakPolarHBondContact CB-OD1 3Å; S654-D739 PolarHBondContact OG-OD1 3.03Å; Q655-D739 VanDerWaalsContact CB-OD2 3.29Å; Q655-D739 WeakPolarHBondContact CB-OD2 3.46Å; Q655-D739 PolarHBondContact N-OD1 2.91Å
740	P	86.6	Confident	87.5	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.074	C	C	.	.			trans	-71	149.7	-174.4	29.5	-36.3	0	0	0	112.7	L769 I778	P740-L769 HydrophobicContact CB-CD2 4.48Å; P740-L769 HydrophobicContact CG-CD2 3.83Å; P740-I778 HydrophobicContact CB-CG2 4.38Å; P740-I778 HydrophobicContact CG-CG2 4.18Å
741	D	87.3	Confident	87.6	Confident	19 Å²	19	14.1 Å²	14.1	10%	0.102	7%	0.068	C	C	.	.			trans	-77	162.6	169.2	-147.9	-38.3	0	0	0	112	Q655 N743 T746 D747 I778 Q782	Q655-D741 PolarHBondContact NE2-OD2 3.17Å; D741-N743 PolarHBondContact O-N 2.88Å; D741-T746 WeakPolarHBondContact CB-OG1 3.31Å; D741-T746 WeakPolarHBondContact OD2-CB 3.5Å; D741-T746 PolarHBondContact OD2-OG1 3.28Å; D741-D747 WeakPolarHBondContact CB-OD1 3.42Å; D741-D747 PolarHBondContact N-OD1 3.32Å; D741-I778 WeakPolarHBondContact O-CG2 3.45Å; D741-Q782 PolarHBondContact O-NE2 3.48Å
742	W	83.4	Confident	87.6	Confident	81 Å²	81	13.4 Å²	13.4	31%	0.307	6%	0.062	S	C	.	.	S	Bend	trans	-74.2	-3	165.2	-70.8	85.5	0	0	0	112.8	L578 I778 K785 L810	L578-W742 HydrophobicContact CB-CZ2 4.44Å; L578-W742 HydrophobicContact CD1-CH2 4.14Å; L578-W742 HydrophobicContact CD1-CZ2 4.15Å; W742-I778 HydrophobicContact CD2-CD1 4.39Å; W742-I778 HydrophobicContact CD2-CG1 4.01Å; W742-I778 HydrophobicContact CE3-CG1 4.07Å; W742-I778 HydrophobicContact CH2-CD1 4.21Å; W742-I778 HydrophobicContact CH2-CG1 3.63Å; W742-I778 HydrophobicContact CZ2-CD1 3.62Å; W742-I778 HydrophobicContact CZ2-CG1 3.55Å; W742-I778 HydrophobicContact CZ3-CG1 3.88Å; W742-K785 PolarHBondContact O-NZ 2.97Å; W742-L810 HydrophobicContact CH2-CD2 4.44Å
743	N	82.1	Confident	87.2	Confident	21 Å²	21	14.2 Å²	14.2	11%	0.112	7%	0.065	C	C	.	.			trans	-123.8	114.9	-177.2	-176.3	13.2	0	0	0	110.8	Q460 D741 T745 T746	Q460-N743 PolarHBondContact OE1-ND2 3.48Å; D741-N743 PolarHBondContact O-N 2.88Å; N743-T745 PolarHBondContact O-N 2.81Å; N743-T745 VanDerWaalsContact O-N 3.09Å; N743-T745 PolarHBondContact OD1-N 3.12Å; N743-T745 PolarHBondContact OD1-OG1 3.21Å; N743-T746 PolarHBondContact O-N 3.4Å; N743-T746 PolarHBondContact O-OG1 3.01Å
744	P	84	Confident	86.9	Confident	6 Å²	6	14 Å²	14	4%	0.039	6%	0.064	C	C	.	.	H	α-helix	trans	-60.6	-24.8	179.8	25.3	-34.6	0	0	0	113	L748 Q782 K785	P744-L748 WeakPolarHBondContact O-CB 3.41Å; P744-L748 PolarHBondContact O-N 3.31Å; P744-Q782 HydrophobicContact CB-CB 4.1Å; P744-Q782 HydrophobicContact CB-CG 4.44Å; P744-K785 HydrophobicContact CG-CB 3.98Å
745	T	82	Confident	86.6	Confident	6 Å²	6	14 Å²	14	4%	0.037	6%	0.064	C	C	.	.	H	α-helix	trans	-68.3	-35.8	-177.6	-49.8	0	0	0	0	113.5	S457 Q460 N743 L748 Q749	S457-T745 WeakPolarHBondContact OG-CG2 3.5Å; Q460-T745 HydrophobicContact CG-CG2 4.14Å; N743-T745 PolarHBondContact O-N 2.81Å; N743-T745 VanDerWaalsContact O-N 3.09Å; N743-T745 PolarHBondContact OD1-N 3.12Å; N743-T745 PolarHBondContact OD1-OG1 3.21Å; T745-L748 PolarHBondContact O-N 2.76Å; T745-Q749 HydrophobicContact CG2-CG 4.46Å; T745-Q749 WeakPolarHBondContact O-CB 3.49Å; T745-Q749 VanDerWaalsContact O-CG 3.28Å; T745-Q749 WeakPolarHBondContact O-CG 3.44Å; T745-Q749 PolarHBondContact O-N 2.79Å
746	T	83.4	Confident	86.1	Confident	23 Å²	23	16.6 Å²	16.6	14%	0.141	7%	0.074	C	C	.	.	H	α-helix	trans	-72.4	-42.1	179.8	36	0	0	0	0	111.1	D741 N743 L748 Q749 A750	D741-T746 WeakPolarHBondContact CB-OG1 3.31Å; D741-T746 WeakPolarHBondContact OD2-CB 3.5Å; D741-T746 PolarHBondContact OD2-OG1 3.28Å; N743-T746 PolarHBondContact O-N 3.4Å; N743-T746 PolarHBondContact O-OG1 3.01Å; T746-L748 VanDerWaalsContact C-N 3.3Å; T746-L748 PolarHBondContact O-N 3.18Å; T746-Q749 PolarHBondContact O-N 2.9Å; T746-A750 PolarHBondContact O-N 3.34Å
747	D	86.5	Confident	85.5	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-61.7	-37	170.7	-72.2	11.1	0	0	0	111.7	I737 D741 R751 R767 Q782	I737-D747 HydrophobicContact CD1-CB 4.33Å; D741-D747 WeakPolarHBondContact CB-OD1 3.42Å; D741-D747 PolarHBondContact N-OD1 3.32Å; D747-R751 VanDerWaalsContact O-CG 3.29Å; D747-R751 WeakPolarHBondContact O-CG 3.09Å; D747-R751 PolarHBondContact O-N 3.16Å; D747-R751 VanDerWaalsContact O-N 3.17Å; D747-R751 PolarHBondContact O-NE 3.17Å; D747-R767 IonicContact OD2-CZ 2.77Å; D747-R767 IonicContact OD2-NH1 2.88Å; D747-R767 PolarHBondContact OD2-NH1 3.11Å; D747-R767 IonicContact OD2-NH2 2.76Å; D747-Q782 PolarHBondContact OD2-NE2 3.1Å
748	L	84.4	Confident	84.9	Confident	45 Å²	45	22.5 Å²	22.5	24%	0.236	12%	0.12	C	C	.	.	H	α-helix	trans	-64.6	-50.3	172.7	-175.4	61.6	0	0	0	111.3	P744 T745 T746 A750 R751 E752	P744-L748 WeakPolarHBondContact O-CB 3.41Å; P744-L748 PolarHBondContact O-N 3.31Å; T745-L748 PolarHBondContact O-N 2.76Å; T746-L748 VanDerWaalsContact C-N 3.3Å; T746-L748 PolarHBondContact O-N 3.18Å; L748-A750 PolarHBondContact O-N 2.91Å; L748-R751 VanDerWaalsContact CA-NH2 3.27Å; L748-R751 PolarHBondContact O-N 3.38Å; L748-R751 VanDerWaalsContact O-N 3.15Å; L748-E752 HydrophobicContact CD1-CG 3.97Å; L748-E752 HydrophobicContact CG-CG 4.24Å; L748-E752 WeakPolarHBondContact O-CG 3.25Å; L748-E752 PolarHBondContact O-N 3.27Å
749	Q	84.3	Confident	84.5	Confident	5 Å²	5	23.2 Å²	23.2	2%	0.023	12%	0.123	C	C	.	.	H	α-helix	trans	-56.8	-37.7	179.4	-74.2	170	-1.8	0	0	112.5	M301 H430 T745 T746 R753	M301-Q749 HydrophobicContact CE-CB 3.98Å; M301-Q749 HydrophobicContact CE-CG 3.83Å; M301-Q749 HydrophobicContact SD-CB 4.2Å; M301-Q749 HydrophobicContact SD-CG 3.67Å; H430-Q749 PolarHBondContact CE1-NE2 2.94Å; T745-Q749 HydrophobicContact CG2-CG 4.46Å; T745-Q749 WeakPolarHBondContact O-CB 3.49Å; T745-Q749 VanDerWaalsContact O-CG 3.28Å; T745-Q749 WeakPolarHBondContact O-CG 3.44Å; T745-Q749 PolarHBondContact O-N 2.79Å; T746-Q749 PolarHBondContact O-N 2.9Å; Q749-R753 VanDerWaalsContact O-CD 3.25Å; Q749-R753 WeakPolarHBondContact O-CD 3.5Å; Q749-R753 VanDerWaalsContact O-CG 3.24Å; Q749-R753 WeakPolarHBondContact O-CG 3.49Å; Q749-R753 PolarHBondContact O-NE 3.24Å
750	A	83.4	Confident	84.2	Confident	1 Å²	1	28 Å²	28	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-66.9	-47.7	175.7	0	0	0	0	0	112.6	F653 T746 L748 E752 R753	F653-A750 HydrophobicContact CD1-CB 4.16Å; F653-A750 HydrophobicContact CD2-CB 4.21Å; F653-A750 HydrophobicContact CE1-CB 3.97Å; F653-A750 HydrophobicContact CE2-CB 4.02Å; F653-A750 HydrophobicContact CG-CB 4.27Å; F653-A750 HydrophobicContact CZ-CB 3.9Å; T746-A750 PolarHBondContact O-N 3.34Å; L748-A750 PolarHBondContact O-N 2.91Å; A750-E752 VanDerWaalsContact C-N 3.34Å; A750-E752 PolarHBondContact O-N 3.36Å; A750-R753 PolarHBondContact O-N 3.07Å
751	R	86.9	Confident	84.2	Confident	28 Å²	28	32 Å²	32	11%	0.106	17%	0.172	C	C	.	.	H	α-helix	trans	-57.4	-44.2	176.3	-72.8	172.6	-70	169.4	-1.9	112	E540 I737 D747 L748 R753 A754 I765	E540-R751 VanDerWaalsContact CD-NH1 3.29Å; E540-R751 IonicContact OE1-CZ 3.85Å; E540-R751 IonicContact OE1-NH1 2.83Å; E540-R751 PolarHBondContact OE1-NH1 2.85Å; E540-R751 VanDerWaalsContact OE1-NH1 3.1Å; E540-R751 IonicContact OE2-CZ 3.27Å; E540-R751 IonicContact OE2-NH1 3.68Å; E540-R751 PolarHBondContact OE2-NH1 3.04Å; I737-R751 HydrophobicContact CD1-CG 4.1Å; D747-R751 VanDerWaalsContact O-CG 3.29Å; D747-R751 WeakPolarHBondContact O-CG 3.09Å; D747-R751 PolarHBondContact O-N 3.16Å; D747-R751 VanDerWaalsContact O-N 3.17Å; D747-R751 PolarHBondContact O-NE 3.17Å; L748-R751 VanDerWaalsContact CA-NH2 3.27Å; L748-R751 PolarHBondContact O-N 3.38Å; L748-R751 VanDerWaalsContact O-N 3.15Å; R751-R753 PolarHBondContact O-N 3.3Å; R751-A754 PolarHBondContact O-N 2.98Å; R751-I765 HydrophobicContact CB-CD1 4Å; R751-I765 HydrophobicContact CG-CD1 3.91Å; R751-I765 HydrophobicContact CG-CG1 4.28Å; R751-I765 HydrophobicContact CG-CG2 3.81Å
752	E	85.1	Confident	84.4	Confident	6 Å²	6	35.5 Å²	35.5	3%	0.028	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-4	-178.5	-61.9	-51.8	120.2	0	0	114.8	M301 K528 K538 L748 A750	M301-E752 HydrophobicContact CB-CB 3.89Å; M301-E752 HydrophobicContact CB-CG 4.17Å; M301-E752 HydrophobicContact CE-CB 4.16Å; M301-E752 HydrophobicContact SD-CB 4.12Å; M301-E752 HydrophobicContact SD-CG 4.31Å; K528-E752 IonicContact NZ-OE2 2.74Å; K528-E752 PolarHBondContact NZ-OE2 3.38Å; K538-E752 IonicContact NZ-OE1 2.69Å; K538-E752 PolarHBondContact NZ-OE1 2.99Å; L748-E752 HydrophobicContact CD1-CG 3.97Å; L748-E752 HydrophobicContact CG-CG 4.24Å; L748-E752 WeakPolarHBondContact O-CG 3.25Å; L748-E752 PolarHBondContact O-N 3.27Å; A750-E752 VanDerWaalsContact C-N 3.34Å; A750-E752 PolarHBondContact O-N 3.36Å
753	R	82	Confident	84.8	Confident	18 Å²	18	31.7 Å²	31.7	7%	0.068	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-25.9	174.1	-62.2	-29.2	-178.4	170.4	-11.7	113.7	E428 G723 G724 G726 V727 L729 Q749 A750 R751	E428-R753 IonicContact OE1-NH2 3.66Å; G723-R753 WeakPolarHBondContact O-CG 3.44Å; G723-R753 PolarHBondContact O-NE 3.04Å; G724-R753 PolarHBondContact O-NH2 3.48Å; G726-R753 VanDerWaalsContact CA-CZ 3.43Å; V727-R753 VanDerWaalsContact O-CB 3.27Å; V727-R753 WeakPolarHBondContact O-CB 3.25Å; V727-R753 WeakPolarHBondContact O-CD 3.25Å; V727-R753 VanDerWaalsContact O-CG 3.25Å; V727-R753 WeakPolarHBondContact O-CG 3.24Å; L729-R753 PolarHBondContact N-O 3.31Å; Q749-R753 VanDerWaalsContact O-CD 3.25Å; Q749-R753 WeakPolarHBondContact O-CD 3.5Å; Q749-R753 VanDerWaalsContact O-CG 3.24Å; Q749-R753 WeakPolarHBondContact O-CG 3.49Å; Q749-R753 PolarHBondContact O-NE 3.24Å; A750-R753 PolarHBondContact O-N 3.07Å; R751-R753 PolarHBondContact O-N 3.3Å
754	A	85.5	Confident	85.3	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-41.1	174.5	0	0	0	0	0	112	L651 V735 R751 R756 Q759 V763	L651-A754 HydrophobicContact CD1-CB 4.03Å; V735-A754 HydrophobicContact CG2-CB 3.77Å; R751-A754 PolarHBondContact O-N 2.98Å; A754-R756 VanDerWaalsContact C-N 3.35Å; A754-R756 PolarHBondContact O-N 3.39Å; A754-R756 VanDerWaalsContact O-N 3.15Å; A754-Q759 PolarHBondContact O-NE2 3.43Å; A754-V763 HydrophobicContact CB-CG1 4.37Å
755	W	86.8	Confident	85.7	Confident	34 Å²	34	31.2 Å²	31.2	13%	0.129	17%	0.173	C	C	.	.	S	Bend	trans	-90.1	65.5	-179.6	-166.9	61.1	0	0	0	111.7	K528 L535 P536 K538 V763	K528-W755 HydrophobicContact CD-CE3 3.96Å; K528-W755 HydrophobicContact CD-CH2 3.71Å; K528-W755 HydrophobicContact CD-CZ3 3.35Å; K528-W755 VanDerWaalsContact NZ-CZ3 3.33Å; K528-W755 PolarHBondContact NZ-O 2.72Å; L535-W755 HydrophobicContact CB-CZ2 4.21Å; L535-W755 HydrophobicContact CD1-CH2 4.49Å; L535-W755 HydrophobicContact CD1-CZ2 4.11Å; P536-W755 PolarHBondContact O-NE1 2.82Å; K538-W755 HydrophobicContact CB-CD2 3.9Å; K538-W755 HydrophobicContact CB-CE3 4.37Å; K538-W755 HydrophobicContact CB-CG 4.26Å; K538-W755 HydrophobicContact CB-CH2 4.44Å; K538-W755 HydrophobicContact CB-CZ2 3.96Å; K538-W755 HydrophobicContact CD-CD2 3.54Å; K538-W755 HydrophobicContact CD-CE3 3.25Å; K538-W755 HydrophobicContact CD-CG 4.1Å; K538-W755 HydrophobicContact CD-CH2 4.21Å; K538-W755 HydrophobicContact CD-CZ2 4.42Å; K538-W755 HydrophobicContact CD-CZ3 3.63Å; K538-W755 HydrophobicContact CG-CD2 4.27Å; K538-W755 HydrophobicContact CG-CE3 4.41Å; W755-V763 HydrophobicContact CB-CB 4.47Å; W755-V763 HydrophobicContact CB-CG1 4.5Å; W755-V763 HydrophobicContact CB-CG2 4.29Å; W755-V763 HydrophobicContact CG-CG2 4.48Å
756	R	83.5	Confident	86.3	Confident	54 Å²	54	32.2 Å²	32.2	20%	0.204	18%	0.177	C	C	.	.	S	Bend	trans	-113.8	158.6	176	-175.7	171	175.4	153.1	2.7	110.3	N728 T730 A754 G758 Q759	N728-R756 VanDerWaalsContact OD1-CD 3.25Å; N728-R756 WeakPolarHBondContact OD1-CD 3.45Å; N728-R756 VanDerWaalsContact OD1-CZ 3.27Å; N728-R756 PolarHBondContact OD1-NE 3.02Å; N728-R756 PolarHBondContact OD1-NH1 3.46Å; T730-R756 HydrophobicContact CG2-CB 3.96Å; A754-R756 VanDerWaalsContact C-N 3.35Å; A754-R756 PolarHBondContact O-N 3.39Å; A754-R756 VanDerWaalsContact O-N 3.15Å; R756-G758 PolarHBondContact O-N 3.17Å; R756-Q759 VanDerWaalsContact O-CB 3.27Å; R756-Q759 WeakPolarHBondContact O-CB 3.16Å; R756-Q759 PolarHBondContact O-N 2.87Å
757	I	81.3	Confident	86.7	Confident	61 Å²	61	31.1 Å²	31.1	31%	0.313	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.5	130.3	171	-53	176.1	0	0	0	109.1	F275 G302 I533 L535	F275-I757 HydrophobicContact CE2-CD1 4.39Å; G302-I757 WeakPolarHBondContact O-CD1 3Å; I533-I757 HydrophobicContact CD1-CD1 3.95Å; I533-I757 HydrophobicContact CD1-CG1 4.48Å; I533-I757 HydrophobicContact CG2-CG1 4.43Å; L535-I757 HydrophobicContact CD2-CG1 4.33Å
758	G	79.4	Confident	87	Confident	64 Å²	64	31.1 Å²	31.1	66%	0.66	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	99.5	-6.1	-170.5	0	0	0	0	0	114.8	R756	R756-G758 PolarHBondContact O-N 3.17Å
759	Q	85.4	Confident	87.3	Confident	15 Å²	15	29 Å²	29	7%	0.07	16%	0.159	C	C	.	.			trans	-74.9	133.6	164.1	177.5	58.2	-87.1	0	0	110.3	P536 T730 A732 A754 R756 R761 V763	P536-Q759 VanDerWaalsContact CD-O 3.31Å; P536-Q759 WeakPolarHBondContact CD-O 3.39Å; P536-Q759 HydrophobicContact CG-CB 4.33Å; P536-Q759 HydrophobicContact CG-CG 3.74Å; T730-Q759 PolarHBondContact O-NE2 2.86Å; T730-Q759 PolarHBondContact O-OE1 3.41Å; A732-Q759 PolarHBondContact O-NE2 2.91Å; A754-Q759 PolarHBondContact O-NE2 3.43Å; R756-Q759 VanDerWaalsContact O-CB 3.27Å; R756-Q759 WeakPolarHBondContact O-CB 3.16Å; R756-Q759 PolarHBondContact O-N 2.87Å; Q759-R761 VanDerWaalsContact CG-O 3.31Å; Q759-R761 WeakPolarHBondContact CG-O 3.42Å; Q759-R761 PolarHBondContact OE1-O 2.78Å; Q759-V763 HydrophobicContact CG-CG2 3.76Å
760	S	84.1	Confident	87.4	Confident	99 Å²	99	28.7 Å²	28.7	69%	0.692	16%	0.157	S	C	*	.			trans	-119.2	-4.3	179.9	59.4	0	0	0	0	114.6
761	R	88.3	Confident	87.3	Confident	86 Å²	86	29 Å²	29	33%	0.325	16%	0.16	S	C	.	.	S	Bend	trans	-112.7	146.4	176.1	-72	177.6	158.9	-168.4	-8.5	111.2	P536 G647 N733 Q759 V763	P536-R761 WeakPolarHBondContact CG-O 3.32Å; G647-R761 PolarHBondContact O-NH1 2.93Å; N733-R761 HydrophobicContact CB-CB 3.78Å; Q759-R761 VanDerWaalsContact CG-O 3.31Å; Q759-R761 WeakPolarHBondContact CG-O 3.42Å; Q759-R761 PolarHBondContact OE1-O 2.78Å; R761-V763 PolarHBondContact O-N 3.19Å
762	D	90.9	Very high	86.7	Confident	92 Å²	92	28.1 Å²	28.1	49%	0.492	16%	0.159	S	C	.	.			trans	-62.7	130.3	175.2	-61	-41.6	0	0	0	111.9	P536 A537 R734	P536-D762 WeakPolarHBondContact CB-OD1 3.46Å; A537-D762 HydrophobicContact CB-CB 4.42Å; A537-D762 WeakPolarHBondContact CB-OD1 3.38Å; A537-D762 PolarHBondContact N-OD1 3.43Å; A537-D762 WeakPolarHBondContact O-CA 3.41Å; R734-D762 PolarHBondContact NH1-O 2.88Å
763	V	91.1	Very high	86.8	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	107.9	-172.5	-176.4	0	0	0	0	109.7	A537 K538 S539 V735 A754 W755 Q759 R761 I765	A537-V763 PolarHBondContact O-N 2.84Å; K538-V763 WeakPolarHBondContact CA-O 3.37Å; S539-V763 PolarHBondContact N-O 3.12Å; V735-V763 HydrophobicContact CG2-CG1 4.22Å; A754-V763 HydrophobicContact CB-CG1 4.37Å; W755-V763 HydrophobicContact CB-CB 4.47Å; W755-V763 HydrophobicContact CB-CG1 4.5Å; W755-V763 HydrophobicContact CB-CG2 4.29Å; W755-V763 HydrophobicContact CG-CG2 4.48Å; Q759-V763 HydrophobicContact CG-CG2 3.76Å; R761-V763 PolarHBondContact O-N 3.19Å; V763-I765 HydrophobicContact CG1-CG1 4.34Å
764	V	93.6	Very high	87	Confident	17 Å²	17	27 Å²	27	10%	0.103	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	127.8	174.4	-169.7	0	0	0	0	109.4	Q541 N733 V735 Y766	Q541-V764 HydrophobicContact CG-CG1 4.47Å; N733-V764 PolarHBondContact O-N 2.9Å; V735-V764 PolarHBondContact N-O 2.91Å; V764-Y766 HydrophobicContact CB-CE2 3.76Å; V764-Y766 HydrophobicContact CG1-CD2 4.16Å; V764-Y766 HydrophobicContact CG1-CE1 4.19Å; V764-Y766 HydrophobicContact CG1-CE2 3.41Å; V764-Y766 VanDerWaalsContact CG1-CE2 3.41Å; V764-Y766 VanDerWaalsContact CG1-CZ 3.44Å; V764-Y766 WeakPolarHBondContact CG1-OH 3.4Å
765	I	92	Very high	87.1	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.3	-177.9	-62.7	155.9	0	0	0	108.6	K538 S539 E540 Q541 V735 R751 V763	K538-I765 HydrophobicContact CD-CD1 4.06Å; K538-I765 HydrophobicContact CG-CD1 3.91Å; S539-I765 PolarHBondContact O-N 2.73Å; E540-I765 CarbonylContact C-O 3.55Å; E540-I765 WeakPolarHBondContact CA-O 3.33Å; E540-I765 HydrophobicContact CB-CB 4.29Å; E540-I765 HydrophobicContact CG-CB 4.26Å; E540-I765 HydrophobicContact CG-CG2 4.01Å; Q541-I765 PolarHBondContact N-O 3.48Å; V735-I765 HydrophobicContact CB-CG1 4.12Å; V735-I765 CarbonylContact O-C 3.53Å; V735-I765 WeakPolarHBondContact O-CA 3.29Å; R751-I765 HydrophobicContact CB-CD1 4Å; R751-I765 HydrophobicContact CG-CD1 3.91Å; R751-I765 HydrophobicContact CG-CG1 4.28Å; R751-I765 HydrophobicContact CG-CG2 3.81Å; V763-I765 HydrophobicContact CG1-CG1 4.34Å
766	Y	93.3	Very high	87	Confident	27 Å²	27	25.5 Å²	25.5	11%	0.106	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132.2	179.6	-61.9	-93	0	0	0	109.8	Q541 L543 W643 V735 L736 I737 V764	Q541-Y766 HydrophobicContact CB-CD1 4.25Å; Q541-Y766 HydrophobicContact CB-CE1 4.49Å; Q541-Y766 WeakPolarHBondContact O-CA 3.22Å; L543-Y766 HydrophobicContact CD1-CD1 3.9Å; L543-Y766 HydrophobicContact CG-CD1 4.31Å; W643-Y766 AromaticContact CH2-CD2 3.64Å; W643-Y766 HydrophobicContact CH2-CD2 3.64Å; W643-Y766 AromaticContact CH2-CE2 4Å; W643-Y766 HydrophobicContact CH2-CE2 4Å; W643-Y766 HydrophobicContact CH2-CG 4.06Å; W643-Y766 HydrophobicContact CZ2-CD1 4.26Å; W643-Y766 AromaticContact CZ2-CD2 3.42Å; W643-Y766 HydrophobicContact CZ2-CD2 3.42Å; W643-Y766 VanDerWaalsContact CZ2-CD2 3.42Å; W643-Y766 HydrophobicContact CZ2-CE1 4.14Å; W643-Y766 AromaticContact CZ2-CE2 3.3Å; W643-Y766 HydrophobicContact CZ2-CE2 3.3Å; W643-Y766 AromaticContact CZ2-CG 3.91Å; W643-Y766 HydrophobicContact CZ2-CG 3.91Å; W643-Y766 AromaticContact CZ2-CZ 3.67Å; V735-Y766 PolarHBondContact O-N 3.14Å; L736-Y766 WeakPolarHBondContact CA-O 3.5Å; I737-Y766 PolarHBondContact N-O 3.44Å; V764-Y766 HydrophobicContact CB-CE2 3.76Å; V764-Y766 HydrophobicContact CG1-CD2 4.16Å; V764-Y766 HydrophobicContact CG1-CE1 4.19Å; V764-Y766 HydrophobicContact CG1-CE2 3.41Å; V764-Y766 VanDerWaalsContact CG1-CE2 3.41Å; V764-Y766 VanDerWaalsContact CG1-CZ 3.44Å; V764-Y766 WeakPolarHBondContact CG1-OH 3.4Å
767	R	92.1	Very high	87	Confident	1 Å²	1	23.4 Å²	23.4	0%	0.004	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	115.5	177.7	178.1	-176.7	-59.7	-77.6	-6.8	109.3	E540 Q541 L543 D747 L769	E540-R767 IonicContact OE1-CZ 2.73Å; E540-R767 IonicContact OE1-NE 2.69Å; E540-R767 PolarHBondContact OE1-NE 2.97Å; E540-R767 IonicContact OE1-NH2 3.35Å; E540-R767 PolarHBondContact OE1-NH2 3.3Å; Q541-R767 PolarHBondContact O-N 3.39Å; L543-R767 PolarHBondContact N-O 3.43Å; D747-R767 IonicContact OD2-CZ 2.77Å; D747-R767 IonicContact OD2-NH1 2.88Å; D747-R767 PolarHBondContact OD2-NH1 3.11Å; D747-R767 IonicContact OD2-NH2 2.76Å; R767-L769 HydrophobicContact CG-CD2 4.15Å; R767-L769 HydrophobicContact CG-CG 4.22Å
768	L	92.6	Very high	87.2	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	121.3	175.5	-53.8	-174.9	0	0	0	109.9	L543 K632 V635 V636 L736 I737 Y738	L543-L768 HydrophobicContact CB-CD2 3.98Å; L543-L768 HydrophobicContact CD1-CD2 3.89Å; L543-L768 HydrophobicContact CG-CD2 4.45Å; K632-L768 HydrophobicContact CB-CD1 4.45Å; K632-L768 HydrophobicContact CD-CB 4.35Å; K632-L768 HydrophobicContact CG-CD1 4.49Å; V635-L768 HydrophobicContact CG1-CD2 4.04Å; V636-L768 HydrophobicContact CG2-CD1 3.74Å; L736-L768 HydrophobicContact CD1-CD1 4.25Å; L736-L768 HydrophobicContact CD1-CD2 4.04Å; L736-L768 HydrophobicContact CD1-CG 3.9Å; I737-L768 PolarHBondContact O-N 3.12Å; Y738-L768 HydrophobicContact CD2-CD1 3.83Å; Y738-L768 HydrophobicContact CE2-CD1 4.17Å
769	L	90.7	Very high	87.5	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143.2	170.2	-58.6	-179.5	0	0	0	109	V542 L543 F544 C545 P740 R767 E775 Y779	V542-L769 HydrophobicContact CG1-CD1 3.49Å; V542-L769 VanDerWaalsContact CG1-CD1 3.49Å; V542-L769 HydrophobicContact CG1-CG 3.95Å; L543-L769 PolarHBondContact O-N 3.43Å; F544-L769 WeakPolarHBondContact CA-O 3.16Å; F544-L769 HydrophobicContact CD1-CB 4.46Å; F544-L769 HydrophobicContact CE1-CD1 4.18Å; C545-L769 PolarHBondContact N-O 3.1Å; P740-L769 HydrophobicContact CB-CD2 4.48Å; P740-L769 HydrophobicContact CG-CD2 3.83Å; R767-L769 HydrophobicContact CG-CD2 4.15Å; R767-L769 HydrophobicContact CG-CG 4.22Å; L769-E775 HydrophobicContact CD2-CB 4.42Å; L769-Y779 HydrophobicContact CD1-CD1 3.6Å; L769-Y779 HydrophobicContact CD1-CD2 4.36Å; L769-Y779 HydrophobicContact CD1-CE1 4.25Å; L769-Y779 HydrophobicContact CD1-CG 3.66Å
770	T	87.9	Confident	87.3	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	127.4	169.1	42.8	0	0	0	0	112.7	C545 L547 C585 K632 T773 E775	C545-T770 HydrophobicContact CB-CG2 4.08Å; C545-T770 WeakPolarHBondContact O-CA 3.32Å; L547-T770 HydrophobicContact CD2-CG2 3.78Å; C585-T770 HydrophobicContact CB-CG2 4.45Å; C585-T770 WeakPolarHBondContact CB-OG1 3.25Å; C585-T770 PolarHBondContact SG-OG1 2.97Å; C585-T770 VanDerWaalsContact SG-OG1 3.37Å; K632-T770 HydrophobicContact CG-CG2 4.18Å; T770-T773 PolarHBondContact O-N 3.43Å; T770-T773 PolarHBondContact O-OG1 3.01Å; T770-T773 WeakPolarHBondContact OG1-CG2 3.18Å; T770-T773 PolarHBondContact OG1-OG1 3.43Å; T770-E775 PolarHBondContact N-OE2 2.61Å; T770-E775 VanDerWaalsContact N-OE2 3.11Å; T770-E775 PolarHBondContact OG1-OE2 2.75Å
771	S	81.5	Confident	87.1	Confident	8 Å²	8	18.1 Å²	18.1	6%	0.056	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	141.5	-175.1	44.2	0	0	0	0	113	C545 T773 E816	C545-S771 PolarHBondContact O-N 3.17Å; S771-T773 WeakPolarHBondContact O-CG2 3.49Å; S771-T773 PolarHBondContact O-N 3.42Å; S771-E816 VanDerWaalsContact CB-OE1 3.32Å; S771-E816 WeakPolarHBondContact CB-OE1 3.48Å; S771-E816 PolarHBondContact OG-OE1 2.61Å
772	G	74.1	Confident	86.9	Confident	9 Å²	9	14.4 Å²	14.4	9%	0.093	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.2	-3.9	-179.4	0	0	0	0	0	115	E776 F813	G772-E776 PolarHBondContact N-OE2 3.48Å; G772-F813 WeakPolarHBondContact O-CD2 3.22Å
773	T	85.9	Confident	86.4	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.062	C	C	.	.	S	Bend	trans	-94	176.2	-172.4	74.6	0	0	0	0	114.1	L547 Y555 T770 S771 E775 E776 F813	L547-T773 HydrophobicContact CD1-CG2 3.92Å; L547-T773 HydrophobicContact CD2-CG2 4.18Å; L547-T773 HydrophobicContact CG-CG2 4.1Å; Y555-T773 HydrophobicContact CE2-CG2 4.25Å; Y555-T773 WeakPolarHBondContact OH-CA 3.41Å; T770-T773 PolarHBondContact O-N 3.43Å; T770-T773 PolarHBondContact O-OG1 3.01Å; T770-T773 WeakPolarHBondContact OG1-CG2 3.18Å; T770-T773 PolarHBondContact OG1-OG1 3.43Å; S771-T773 WeakPolarHBondContact O-CG2 3.49Å; S771-T773 PolarHBondContact O-N 3.42Å; T773-E775 PolarHBondContact O-N 3.19Å; T773-E775 VanDerWaalsContact O-N 3.1Å; T773-E775 PolarHBondContact OG1-N 3.05Å; T773-E776 PolarHBondContact O-N 3.42Å; T773-F813 HydrophobicContact CG2-CE2 4.3Å
774	I	87	Confident	85.6	Confident	1 Å²	1	14.6 Å²	14.6	1%	0.005	7%	0.068	C	C	.	.	H	α-helix	trans	-48.9	-30.4	167.4	-169.6	173.9	0	0	0	114.2	Y555 L578 L581 R582 K777 I778	Y555-I774 PolarHBondContact OH-N 2.67Å; L578-I774 HydrophobicContact CB-CD1 3.78Å; L578-I774 HydrophobicContact CD2-CD1 3.55Å; L578-I774 HydrophobicContact CG-CD1 4.23Å; L578-I774 WeakPolarHBondContact O-CD1 3.12Å; L581-I774 HydrophobicContact CB-CB 4.41Å; L581-I774 HydrophobicContact CB-CD1 4.08Å; L581-I774 HydrophobicContact CB-CG2 3.96Å; L581-I774 HydrophobicContact CD1-CD1 4.28Å; R582-I774 HydrophobicContact CB-CG2 4.43Å; I774-K777 CarbonylContact O-C 3.58Å; I774-K777 PolarHBondContact O-N 3.02Å; I774-I778 HydrophobicContact CD1-CD1 4.5Å; I774-I778 HydrophobicContact CG1-CD1 4.05Å; I774-I778 HydrophobicContact CG1-CG1 4.34Å; I774-I778 VanDerWaalsContact O-CG1 3.3Å; I774-I778 WeakPolarHBondContact O-CG1 3.37Å; I774-I778 PolarHBondContact O-N 2.85Å
775	E	88.3	Confident	84.8	Confident	0 Å²	0	16 Å²	16	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-72.9	-40.6	-173.3	-60.2	-162	138.5	0	0	113.5	C585 K632 L769 T770 T773 K777 I778 Y779	C585-E775 HydrophobicContact CB-CG 4.13Å; K632-E775 WeakPolarHBondContact CE-OE2 3.42Å; K632-E775 IonicContact NZ-OE1 3.27Å; K632-E775 PolarHBondContact NZ-OE1 2.82Å; K632-E775 IonicContact NZ-OE2 3.83Å; K632-E775 PolarHBondContact NZ-OE2 2.78Å; L769-E775 HydrophobicContact CD2-CB 4.42Å; T770-E775 PolarHBondContact N-OE2 2.61Å; T770-E775 VanDerWaalsContact N-OE2 3.11Å; T770-E775 PolarHBondContact OG1-OE2 2.75Å; T773-E775 PolarHBondContact O-N 3.19Å; T773-E775 VanDerWaalsContact O-N 3.1Å; T773-E775 PolarHBondContact OG1-N 3.05Å; E775-K777 PolarHBondContact O-N 3.16Å; E775-I778 WeakPolarHBondContact O-CB 3.41Å; E775-I778 PolarHBondContact O-N 3.45Å; E775-Y779 PolarHBondContact O-N 3.11Å
776	E	84.3	Confident	84.1	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-56.7	-43.1	169.9	177.8	145.4	-133.2	0	0	110.2	G772 T773 I778 Y779 H780 T824	G772-E776 PolarHBondContact N-OE2 3.48Å; T773-E776 PolarHBondContact O-N 3.42Å; E776-I778 PolarHBondContact O-N 2.86Å; E776-Y779 WeakPolarHBondContact O-CA 3.48Å; E776-Y779 WeakPolarHBondContact O-CB 3.47Å; E776-Y779 PolarHBondContact O-N 3.39Å; E776-Y779 VanDerWaalsContact O-N 3.08Å; E776-H780 WeakPolarHBondContact CG-NE2 3.44Å; E776-H780 PolarHBondContact O-CD2 2.83Å; E776-H780 VanDerWaalsContact O-CD2 3.23Å; E776-H780 PolarHBondContact O-N 2.89Å; E776-T824 WeakPolarHBondContact CG-OG1 3.46Å; E776-T824 WeakPolarHBondContact OE1-CB 3.49Å; E776-T824 PolarHBondContact OE1-N 3.24Å; E776-T824 PolarHBondContact OE1-OG1 3Å
777	K	82.2	Confident	83.3	Confident	11 Å²	11	18 Å²	18	5%	0.048	8%	0.083	C	C	.	.	H	α-helix	trans	-75.2	-24.3	-179.5	-55	-176.1	179.4	-177.5	0	112.7	I774 E775 R781 E809 L810 T812 E814	I774-K777 CarbonylContact O-C 3.58Å; I774-K777 PolarHBondContact O-N 3.02Å; E775-K777 PolarHBondContact O-N 3.16Å; K777-R781 WeakPolarHBondContact O-CG 3.41Å; K777-R781 PolarHBondContact O-N 3.24Å; K777-E809 WeakPolarHBondContact CD-O 3.5Å; K777-E809 PolarHBondContact NZ-O 2.99Å; K777-E809 VanDerWaalsContact NZ-O 3.13Å; K777-L810 HydrophobicContact CB-CD2 4.07Å; K777-T812 PolarHBondContact NZ-O 3.01Å; K777-E814 IonicContact NZ-OE1 3.22Å; K777-E814 PolarHBondContact NZ-OE1 3.21Å
778	I	86	Confident	82.4	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-68.6	-44.1	164.2	-72.2	165	0	0	0	110.4	P740 D741 W742 I774 E775 E776 R781 Q782	P740-I778 HydrophobicContact CB-CG2 4.38Å; P740-I778 HydrophobicContact CG-CG2 4.18Å; D741-I778 WeakPolarHBondContact O-CG2 3.45Å; W742-I778 HydrophobicContact CD2-CD1 4.39Å; W742-I778 HydrophobicContact CD2-CG1 4.01Å; W742-I778 HydrophobicContact CE3-CG1 4.07Å; W742-I778 HydrophobicContact CH2-CD1 4.21Å; W742-I778 HydrophobicContact CH2-CG1 3.63Å; W742-I778 HydrophobicContact CZ2-CD1 3.62Å; W742-I778 HydrophobicContact CZ2-CG1 3.55Å; W742-I778 HydrophobicContact CZ3-CG1 3.88Å; I774-I778 HydrophobicContact CD1-CD1 4.5Å; I774-I778 HydrophobicContact CG1-CD1 4.05Å; I774-I778 HydrophobicContact CG1-CG1 4.34Å; I774-I778 VanDerWaalsContact O-CG1 3.3Å; I774-I778 WeakPolarHBondContact O-CG1 3.37Å; I774-I778 PolarHBondContact O-N 2.85Å; E775-I778 WeakPolarHBondContact O-CB 3.41Å; E775-I778 PolarHBondContact O-N 3.45Å; E776-I778 PolarHBondContact O-N 2.86Å; I778-R781 CarbonylContact O-C 3.39Å; I778-R781 WeakPolarHBondContact O-CB 3.49Å; I778-R781 PolarHBondContact O-N 2.83Å; I778-R781 VanDerWaalsContact O-N 3.16Å; I778-Q782 PolarHBondContact O-N 2.77Å
779	Y	86.1	Confident	81.6	Confident	39 Å²	39	19.6 Å²	19.6	15%	0.153	9%	0.092	C	C	.	.	H	α-helix	trans	-64.4	-43.1	179.7	-178.3	-118.2	0	0	0	112.4	V542 L769 E775 E776 R781 Q782 I783 T824	V542-Y779 HydrophobicContact CG2-CE1 4.47Å; L769-Y779 HydrophobicContact CD1-CD1 3.6Å; L769-Y779 HydrophobicContact CD1-CD2 4.36Å; L769-Y779 HydrophobicContact CD1-CE1 4.25Å; L769-Y779 HydrophobicContact CD1-CG 3.66Å; E775-Y779 PolarHBondContact O-N 3.11Å; E776-Y779 WeakPolarHBondContact O-CA 3.48Å; E776-Y779 WeakPolarHBondContact O-CB 3.47Å; E776-Y779 PolarHBondContact O-N 3.39Å; E776-Y779 VanDerWaalsContact O-N 3.08Å; Y779-R781 VanDerWaalsContact C-N 3.26Å; Y779-R781 PolarHBondContact O-N 2.94Å; Y779-Q782 WeakPolarHBondContact O-CA 3.46Å; Y779-Q782 VanDerWaalsContact O-CB 3.31Å; Y779-Q782 WeakPolarHBondContact O-CB 3.33Å; Y779-Q782 PolarHBondContact O-N 3.25Å; Y779-I783 HydrophobicContact CD1-CD1 4.04Å; Y779-I783 HydrophobicContact CE1-CD1 3.7Å; Y779-I783 HydrophobicContact CE2-CD1 4.47Å; Y779-I783 WeakPolarHBondContact O-CG1 3.42Å; Y779-I783 PolarHBondContact O-N 3.09Å; Y779-T824 HydrophobicContact CD1-CG2 4.15Å; Y779-T824 HydrophobicContact CE1-CG2 3.88Å
780	H	80.8	Confident	80.9	Confident	21 Å²	21	21 Å²	21	10%	0.097	10%	0.099	C	C	.	.	H	α-helix	trans	-57	-38.9	170.8	-65.5	-39.9	0	0	0	112.7	E776 I783 F784 F802 T824 Y827	E776-H780 WeakPolarHBondContact CG-NE2 3.44Å; E776-H780 PolarHBondContact O-CD2 2.83Å; E776-H780 VanDerWaalsContact O-CD2 3.23Å; E776-H780 PolarHBondContact O-N 2.89Å; H780-I783 PolarHBondContact O-N 3.23Å; H780-F784 PolarHBondContact O-N 3.33Å; H780-F802 HydrophobicContact CB-CE1 4.34Å; H780-F802 WeakPolarHBondContact O-CE1 3.48Å; H780-T824 PolarHBondContact CE1-OG1 2.92Å; H780-T824 PolarHBondContact NE2-OG1 2.77Å; H780-Y827 AromaticContact CE1-CD2 3.31Å; H780-Y827 WeakPolarHBondContact CE1-CD2 3.43Å; H780-Y827 AromaticContact CE1-CE2 3.7Å; H780-Y827 AromaticContact NE2-CD2 3.57Å; H780-Y827 AromaticContact NE2-CE2 3.52Å
781	R	80.4	Confident	80.1	Confident	66 Å²	66	21.2 Å²	21.2	25%	0.249	10%	0.1	C	C	.	.	H	α-helix	trans	-72.2	-28.1	175.1	-71.3	175.5	175.8	-140.7	-1.2	113.4	K777 I778 Y779 K785	K777-R781 WeakPolarHBondContact O-CG 3.41Å; K777-R781 PolarHBondContact O-N 3.24Å; I778-R781 CarbonylContact O-C 3.39Å; I778-R781 WeakPolarHBondContact O-CB 3.49Å; I778-R781 PolarHBondContact O-N 2.83Å; I778-R781 VanDerWaalsContact O-N 3.16Å; Y779-R781 VanDerWaalsContact C-N 3.26Å; Y779-R781 PolarHBondContact O-N 2.94Å; R781-K785 WeakPolarHBondContact O-CG 3.27Å; R781-K785 PolarHBondContact O-N 3.06Å
782	Q	83.5	Confident	79.8	Confident	8 Å²	8	21.2 Å²	21.2	4%	0.037	10%	0.099	C	C	.	.	H	α-helix	trans	-63.1	-47.7	167	-71.7	-167.9	-17.5	0	0	110.8	D741 P744 D747 I778 Y779 F784 K785 Q786	D741-Q782 PolarHBondContact O-NE2 3.48Å; P744-Q782 HydrophobicContact CB-CB 4.1Å; P744-Q782 HydrophobicContact CB-CG 4.44Å; D747-Q782 PolarHBondContact OD2-NE2 3.1Å; I778-Q782 PolarHBondContact O-N 2.77Å; Y779-Q782 WeakPolarHBondContact O-CA 3.46Å; Y779-Q782 VanDerWaalsContact O-CB 3.31Å; Y779-Q782 WeakPolarHBondContact O-CB 3.33Å; Y779-Q782 PolarHBondContact O-N 3.25Å; Q782-F784 PolarHBondContact O-N 3.07Å; Q782-K785 PolarHBondContact O-N 2.99Å; Q782-Q786 PolarHBondContact O-N 3.04Å; Q782-Q786 VanDerWaalsContact O-N 3.08Å
783	I	79.9	Confident	79.7	Confident	68 Å²	68	22.4 Å²	22.4	35%	0.349	10%	0.104	S	C	.	.	H	α-helix	trans	-60.4	-46.2	179.9	-64.7	167.3	0	0	0	110.8	Y779 H780 K785 Q786 F787 F802	Y779-I783 HydrophobicContact CD1-CD1 4.04Å; Y779-I783 HydrophobicContact CE1-CD1 3.7Å; Y779-I783 HydrophobicContact CE2-CD1 4.47Å; Y779-I783 WeakPolarHBondContact O-CG1 3.42Å; Y779-I783 PolarHBondContact O-N 3.09Å; H780-I783 PolarHBondContact O-N 3.23Å; I783-K785 VanDerWaalsContact C-N 3.33Å; I783-K785 PolarHBondContact O-N 3.42Å; I783-Q786 PolarHBondContact O-N 2.89Å; I783-Q786 VanDerWaalsContact O-N 3.17Å; I783-F787 WeakPolarHBondContact O-CB 3.19Å; I783-F787 PolarHBondContact O-N 3.12Å; I783-F802 HydrophobicContact CB-CZ 4.27Å; I783-F802 HydrophobicContact CG2-CE2 4.4Å; I783-F802 HydrophobicContact CG2-CZ 3.96Å
784	F	75.2	Confident	79.1	Confident	28 Å²	28	27.1 Å²	27.1	12%	0.123	12%	0.124	C	C	.	.	H	α-helix	trans	-58.2	-40.2	178	178.4	-118.8	0	0	0	113.4	Y497 H780 Q782 F787 L788 F802	Y497-F784 HydrophobicContact CE1-CZ 4.04Å; H780-F784 PolarHBondContact O-N 3.33Å; Q782-F784 PolarHBondContact O-N 3.07Å; F784-F787 HydrophobicContact CD2-CD1 4.5Å; F784-F787 WeakPolarHBondContact O-CB 3.41Å; F784-F787 PolarHBondContact O-N 3Å; F784-L788 HydrophobicContact CD1-CD1 4.3Å; F784-L788 HydrophobicContact CE1-CD1 3.79Å; F784-L788 HydrophobicContact CE1-CG 4.47Å; F784-L788 HydrophobicContact CE2-CD1 4.41Å; F784-L788 HydrophobicContact CE2-CD2 4.36Å; F784-L788 HydrophobicContact CE2-CG 4.24Å; F784-L788 HydrophobicContact CZ-CD1 3.86Å; F784-L788 HydrophobicContact CZ-CD2 4.29Å; F784-L788 HydrophobicContact CZ-CG 4.17Å; F784-L788 WeakPolarHBondContact O-CG 3.39Å; F784-L788 PolarHBondContact O-N 3.35Å; F784-F802 HydrophobicContact CB-CD1 4.18Å; F784-F802 HydrophobicContact CB-CD2 4.04Å; F784-F802 HydrophobicContact CB-CE1 4.08Å; F784-F802 HydrophobicContact CB-CE2 3.93Å; F784-F802 HydrophobicContact CB-CG 4.16Å; F784-F802 HydrophobicContact CB-CZ 3.95Å; F784-F802 HydrophobicContact CD2-CB 3.96Å; F784-F802 AromaticContact CD2-CD2 3.45Å; F784-F802 HydrophobicContact CD2-CD2 3.45Å; F784-F802 VanDerWaalsContact CD2-CD2 3.45Å; F784-F802 HydrophobicContact CD2-CE2 4.08Å; F784-F802 AromaticContact CD2-CG 3.71Å; F784-F802 HydrophobicContact CD2-CG 3.71Å; F784-F802 HydrophobicContact CE2-CB 4.24Å; F784-F802 HydrophobicContact CE2-CD2 4.33Å; F784-F802 HydrophobicContact CE2-CG 4.46Å; F784-F802 HydrophobicContact CG-CD2 4.15Å; F784-F802 HydrophobicContact CG-CE2 4.5Å; F784-F802 HydrophobicContact CG-CG 4.18Å
785	K	77.6	Confident	78.1	Confident	47 Å²	47	32.2 Å²	32.2	20%	0.204	15%	0.151	C	C	.	.	H	α-helix	trans	-67.4	-40.5	176	-70.1	170.6	175.8	-164	0	112.5	N461 W742 P744 R781 Q782 I783 F787 L788 T789	N461-K785 WeakPolarHBondContact OD1-CD 3.24Å; N461-K785 VanDerWaalsContact OD1-CE 3.32Å; N461-K785 WeakPolarHBondContact OD1-CE 3.28Å; N461-K785 PolarHBondContact OD1-NZ 3.35Å; W742-K785 PolarHBondContact O-NZ 2.97Å; P744-K785 HydrophobicContact CG-CB 3.98Å; R781-K785 WeakPolarHBondContact O-CG 3.27Å; R781-K785 PolarHBondContact O-N 3.06Å; Q782-K785 PolarHBondContact O-N 2.99Å; I783-K785 VanDerWaalsContact C-N 3.33Å; I783-K785 PolarHBondContact O-N 3.42Å; K785-F787 VanDerWaalsContact C-N 3.31Å; K785-L788 PolarHBondContact O-N 3.35Å; K785-T789 PolarHBondContact O-N 3.22Å; K785-T789 VanDerWaalsContact O-N 3.14Å; K785-T789 PolarHBondContact O-OG1 3.18Å
786	Q	77.3	Confident	77	Confident	60 Å²	60	32.8 Å²	32.8	28%	0.28	16%	0.155	S	C	.	.	H	α-helix	trans	-66.3	-36.3	175.1	-172	58	64.2	0	0	111.5	Q782 I783 T789 N790	Q782-Q786 PolarHBondContact O-N 3.04Å; Q782-Q786 VanDerWaalsContact O-N 3.08Å; I783-Q786 PolarHBondContact O-N 2.89Å; I783-Q786 VanDerWaalsContact O-N 3.17Å; Q786-T789 WeakPolarHBondContact O-CB 3.41Å; Q786-T789 PolarHBondContact O-N 2.83Å; Q786-N790 PolarHBondContact NE2-OD1 3.42Å; Q786-N790 WeakPolarHBondContact O-CB 3.48Å; Q786-N790 PolarHBondContact O-N 3.37Å; Q786-N790 PolarHBondContact O-ND2 2.88Å; Q786-N790 PolarHBondContact O-OD1 2.58Å
787	F	75.2	Confident	75.8	Confident	10 Å²	10	42.3 Å²	42.3	4%	0.044	19%	0.191	C	C	.	.	H	α-helix	trans	-62.4	-50.3	173.5	171.2	-93.3	0	0	0	112.3	I783 F784 K785 T789 N790 R791 Q798 Q799	I783-F787 WeakPolarHBondContact O-CB 3.19Å; I783-F787 PolarHBondContact O-N 3.12Å; F784-F787 HydrophobicContact CD2-CD1 4.5Å; F784-F787 WeakPolarHBondContact O-CB 3.41Å; F784-F787 PolarHBondContact O-N 3Å; K785-F787 VanDerWaalsContact C-N 3.31Å; F787-T789 VanDerWaalsContact C-N 3.26Å; F787-T789 PolarHBondContact O-N 2.8Å; F787-N790 PolarHBondContact O-N 3.45Å; F787-N790 VanDerWaalsContact O-N 3.09Å; F787-R791 PolarHBondContact O-N 3.05Å; F787-Q798 HydrophobicContact CD2-CB 4.35Å; F787-Q798 HydrophobicContact CD2-CG 4.04Å; F787-Q798 HydrophobicContact CE2-CB 3.59Å; F787-Q798 HydrophobicContact CE2-CG 3.61Å; F787-Q798 HydrophobicContact CZ-CB 4.25Å; F787-Q798 WeakPolarHBondContact CZ-O 3.33Å; F787-Q799 WeakPolarHBondContact CE2-O 3.39Å; F787-Q799 WeakPolarHBondContact CZ-O 3.35Å
788	L	73.4	Confident	74.9	Confident	26 Å²	26	45.2 Å²	45.2	14%	0.136	21%	0.205	C	C	.	.	H	α-helix	trans	-55.3	-43.6	175.3	-72	173.5	0	0	0	111.5	F784 K785 R791 I792	F784-L788 HydrophobicContact CD1-CD1 4.3Å; F784-L788 HydrophobicContact CE1-CD1 3.79Å; F784-L788 HydrophobicContact CE1-CG 4.47Å; F784-L788 HydrophobicContact CE2-CD1 4.41Å; F784-L788 HydrophobicContact CE2-CD2 4.36Å; F784-L788 HydrophobicContact CE2-CG 4.24Å; F784-L788 HydrophobicContact CZ-CD1 3.86Å; F784-L788 HydrophobicContact CZ-CD2 4.29Å; F784-L788 HydrophobicContact CZ-CG 4.17Å; F784-L788 WeakPolarHBondContact O-CG 3.39Å; F784-L788 PolarHBondContact O-N 3.35Å; K785-L788 PolarHBondContact O-N 3.35Å; L788-R791 PolarHBondContact O-N 3.28Å; L788-I792 WeakPolarHBondContact O-CD1 3.33Å; L788-I792 PolarHBondContact O-N 3.35Å
789	T	75.6	Confident	73.4	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.043	24%	0.235	C	C	.	.	H	α-helix	trans	-62.5	-42.3	176.2	-61.1	0	0	0	0	112.4	I459 K785 Q786 F787 L793	I459-T789 HydrophobicContact CB-CG2 4.07Å; K785-T789 PolarHBondContact O-N 3.22Å; K785-T789 VanDerWaalsContact O-N 3.14Å; K785-T789 PolarHBondContact O-OG1 3.18Å; Q786-T789 WeakPolarHBondContact O-CB 3.41Å; Q786-T789 PolarHBondContact O-N 2.83Å; F787-T789 VanDerWaalsContact C-N 3.26Å; F787-T789 PolarHBondContact O-N 2.8Å; T789-L793 HydrophobicContact CG2-CD1 4.14Å; T789-L793 WeakPolarHBondContact O-CB 3.41Å; T789-L793 PolarHBondContact O-N 3.3Å; T789-L793 VanDerWaalsContact O-N 3.12Å
790	N	75.9	Confident	72	Confident	30 Å²	30	53.9 Å²	53.9	16%	0.16	24%	0.243	C	C	.	.	H	α-helix	trans	-71.3	-31.5	179.1	-71.9	-12.8	0	0	0	112.8	Q786 F787 I792 K794 N795	Q786-N790 PolarHBondContact NE2-OD1 3.42Å; Q786-N790 WeakPolarHBondContact O-CB 3.48Å; Q786-N790 PolarHBondContact O-N 3.37Å; Q786-N790 PolarHBondContact O-ND2 2.88Å; Q786-N790 PolarHBondContact O-OD1 2.58Å; F787-N790 PolarHBondContact O-N 3.45Å; F787-N790 VanDerWaalsContact O-N 3.09Å; N790-I792 VanDerWaalsContact C-N 3.34Å; N790-I792 PolarHBondContact O-N 2.88Å; N790-K794 CarbonylContact O-C 3.54Å; N790-K794 WeakPolarHBondContact O-CA 3.13Å; N790-K794 WeakPolarHBondContact O-CB 3.31Å; N790-K794 PolarHBondContact O-N 2.77Å; N790-N795 PolarHBondContact O-N 3.1Å
791	R	72.7	Confident	70.8	Confident	5 Å²	5	59.1 Å²	59.1	2%	0.019	27%	0.266	C	S	.	.	H	α-helix	trans	-63	-40	175.8	-168.2	-176.6	-175.3	-172.1	11	112.1	I492 G495 F787 L788 N795 P796	I492-R791 PolarHBondContact O-NH1 3.36Å; G495-R791 VanDerWaalsContact C-NH1 3.33Å; G495-R791 PolarHBondContact O-NH1 3.23Å; G495-R791 PolarHBondContact O-NH2 2.97Å; F787-R791 PolarHBondContact O-N 3.05Å; L788-R791 PolarHBondContact O-N 3.28Å; R791-N795 CarbonylContact O-C 3.6Å; R791-P796 PolarHBondContact NE-O 3.28Å; R791-P796 WeakPolarHBondContact O-CA 3.31Å
792	I	73.6	Confident	69.6	Low	7 Å²	7	58.1 Å²	58.1	4%	0.036	26%	0.263	C	S	.	.	H	α-helix	trans	-78	-43.1	-179.4	-58.9	153.3	0	0	0	111.2	I459 L463 L466 L788 N790	I459-I792 HydrophobicContact CD1-CB 4.22Å; I459-I792 HydrophobicContact CD1-CD1 3.91Å; I459-I792 HydrophobicContact CD1-CG2 4.07Å; L463-I792 HydrophobicContact CD1-CD1 4.23Å; L463-I792 HydrophobicContact CD2-CD1 3.58Å; L463-I792 HydrophobicContact CD2-CG1 4.39Å; L463-I792 HydrophobicContact CG-CD1 3.86Å; L466-I792 HydrophobicContact CD2-CG2 4.48Å; L788-I792 WeakPolarHBondContact O-CD1 3.33Å; L788-I792 PolarHBondContact O-N 3.35Å; N790-I792 VanDerWaalsContact C-N 3.34Å; N790-I792 PolarHBondContact O-N 2.88Å
793	L	73.5	Confident	68.1	Low	35 Å²	35	64.5 Å²	64.5	18%	0.183	29%	0.291	C	S	.	.	H	α-helix	trans	-105.4	-2.2	-167.8	-60.2	177.6	0	0	0	115.4	P458 I459 L523 T789	P458-L793 HydrophobicContact CG-CD1 3.87Å; I459-L793 HydrophobicContact CD1-CD1 3.72Å; I459-L793 HydrophobicContact CD1-CD2 4.27Å; I459-L793 HydrophobicContact CD1-CG 3.84Å; I459-L793 HydrophobicContact CG1-CD1 4.05Å; L523-L793 HydrophobicContact CD2-CD2 3.89Å; T789-L793 HydrophobicContact CG2-CD1 4.14Å; T789-L793 WeakPolarHBondContact O-CB 3.41Å; T789-L793 PolarHBondContact O-N 3.3Å; T789-L793 VanDerWaalsContact O-N 3.12Å
794	K	71.7	Confident	66.9	Low	98 Å²	98	64.7 Å²	64.7	43%	0.426	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.1	-82.8	172.1	-59.2	-167.5	179.7	-159.9	0	110.3	L527 N790	L527-K794 VanDerWaalsContact CD1-NZ 3.3Å; N790-K794 CarbonylContact O-C 3.54Å; N790-K794 WeakPolarHBondContact O-CA 3.13Å; N790-K794 WeakPolarHBondContact O-CB 3.31Å; N790-K794 PolarHBondContact O-N 2.77Å
795	N	67.6	Low	65.8	Low	108 Å²	108	67.9 Å²	67.9	58%	0.578	31%	0.314	S	S	*	.			trans	-122.9	98.2	-164.7	-71	-1.9	0	0	0	111.1	N790 R791 R797 Q798	N790-N795 PolarHBondContact O-N 3.1Å; R791-N795 CarbonylContact O-C 3.6Å; N795-R797 PolarHBondContact O-N 2.72Å; N795-Q798 PolarHBondContact O-N 2.67Å; N795-Q798 VanDerWaalsContact O-N 3.1Å
796	P	63.6	Low	64.8	Low	12 Å²	12	69.2 Å²	69.2	8%	0.078	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-13	-177.7	20.3	-29.7	0	0	0	115.2	Y509 A512 R791	Y509-P796 HydrophobicContact CD2-CB 3.83Å; Y509-P796 HydrophobicContact CD2-CG 4.24Å; Y509-P796 HydrophobicContact CE2-CB 3.99Å; Y509-P796 HydrophobicContact CE2-CG 3.87Å; A512-P796 HydrophobicContact CB-CB 4.16Å; R791-P796 PolarHBondContact NE-O 3.28Å; R791-P796 WeakPolarHBondContact O-CA 3.31Å
797	R	59.2	Low	63.8	Low	201 Å²	201	70.3 Å²	70.3	76%	0.758	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	5	174.1	-62.7	-169.6	172.1	179	-5.9	115.4	Y509 N795	Y509-R797 HydrophobicContact CD2-CG 3.9Å; Y509-R797 HydrophobicContact CE2-CG 3.46Å; Y509-R797 VanDerWaalsContact CE2-CG 3.46Å; N795-R797 PolarHBondContact O-N 2.72Å
798	Q	64	Low	62.9	Low	73 Å²	73	74.6 Å²	74.6	34%	0.341	35%	0.35	S	S	.	.			trans	-59.2	139.5	-175.3	-153.4	-175.9	-15.2	0	0	112.3	F787 N795	F787-Q798 HydrophobicContact CD2-CB 4.35Å; F787-Q798 HydrophobicContact CD2-CG 4.04Å; F787-Q798 HydrophobicContact CE2-CB 3.59Å; F787-Q798 HydrophobicContact CE2-CG 3.61Å; F787-Q798 HydrophobicContact CZ-CB 4.25Å; F787-Q798 WeakPolarHBondContact CZ-O 3.33Å; N795-Q798 PolarHBondContact O-N 2.67Å; N795-Q798 VanDerWaalsContact O-N 3.1Å
799	Q	55.7	Low	62.5	Low	137 Å²	137	76.8 Å²	76.8	64%	0.64	36%	0.36	S	S	*	.			trans	-68.3	150.9	-169	-67.7	-171.1	9.7	0	0	114.8	F787 F801	F787-Q799 WeakPolarHBondContact CE2-O 3.39Å; F787-Q799 WeakPolarHBondContact CZ-O 3.35Å; Q799-F801 HydrophobicContact CB-CE1 4.41Å; Q799-F801 HydrophobicContact CB-CE2 3.73Å; Q799-F801 HydrophobicContact CB-CZ 3.62Å; Q799-F801 VanDerWaalsContact O-CD2 3.29Å; Q799-F801 WeakPolarHBondContact O-CD2 3.46Å; Q799-F801 WeakPolarHBondContact O-CE2 3.34Å
800	R	56.4	Low	61.8	Low	84 Å²	84	76.8 Å²	76.8	32%	0.317	36%	0.36	S	S	.	.			trans	-102.5	102	-169	-65.2	171.4	-75.4	128.5	-5.5	112.2	G495 G496 Y497 A500	G495-R800 WeakPolarHBondContact O-CD 3.23Å; G496-R800 WeakPolarHBondContact O-CG 3.41Å; Y497-R800 PolarHBondContact O-NH1 3.23Å; A500-R800 PolarHBondContact O-NH1 3.13Å
801	F	55.3	Low	61	Low	131 Å²	131	76.4 Å²	76.4	58%	0.575	36%	0.358	S	S	*	.			trans	-96.1	-23.4	-174.3	-59.6	-76.2	0	0	0	115.4	Q799	Q799-F801 HydrophobicContact CB-CE1 4.41Å; Q799-F801 HydrophobicContact CB-CE2 3.73Å; Q799-F801 HydrophobicContact CB-CZ 3.62Å; Q799-F801 VanDerWaalsContact O-CD2 3.29Å; Q799-F801 WeakPolarHBondContact O-CD2 3.46Å; Q799-F801 WeakPolarHBondContact O-CE2 3.34Å
802	F	53.8	Low	60.6	Low	45 Å²	45	79.2 Å²	79.2	20%	0.197	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-96.6	134.3	-164	-64.8	-87.2	0	0	0	114.3	A498 H780 I783 F784	A498-F802 WeakPolarHBondContact CB-O 3.49Å; A498-F802 PolarHBondContact N-O 3.3Å; H780-F802 HydrophobicContact CB-CE1 4.34Å; H780-F802 WeakPolarHBondContact O-CE1 3.48Å; I783-F802 HydrophobicContact CB-CZ 4.27Å; I783-F802 HydrophobicContact CG2-CE2 4.4Å; I783-F802 HydrophobicContact CG2-CZ 3.96Å; F784-F802 HydrophobicContact CB-CD1 4.18Å; F784-F802 HydrophobicContact CB-CD2 4.04Å; F784-F802 HydrophobicContact CB-CE1 4.08Å; F784-F802 HydrophobicContact CB-CE2 3.93Å; F784-F802 HydrophobicContact CB-CG 4.16Å; F784-F802 HydrophobicContact CB-CZ 3.95Å; F784-F802 HydrophobicContact CD2-CB 3.96Å; F784-F802 AromaticContact CD2-CD2 3.45Å; F784-F802 HydrophobicContact CD2-CD2 3.45Å; F784-F802 VanDerWaalsContact CD2-CD2 3.45Å; F784-F802 HydrophobicContact CD2-CE2 4.08Å; F784-F802 AromaticContact CD2-CG 3.71Å; F784-F802 HydrophobicContact CD2-CG 3.71Å; F784-F802 HydrophobicContact CE2-CB 4.24Å; F784-F802 HydrophobicContact CE2-CD2 4.33Å; F784-F802 HydrophobicContact CE2-CG 4.46Å; F784-F802 HydrophobicContact CG-CD2 4.15Å; F784-F802 HydrophobicContact CG-CE2 4.5Å; F784-F802 HydrophobicContact CG-CG 4.18Å
803	K	53	Low	59.9	Low	142 Å²	142	80.4 Å²	80.4	62%	0.617	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-69.9	169.8	168.8	-61.8	165.1	-168.9	154.5	0	110.2
804	T	54.3	Low	59.3	Low	73 Å²	73	82.3 Å²	82.3	45%	0.448	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-77.4	141.9	178.4	-53.1	0	0	0	0	110.7	D806	T804-D806 PolarHBondContact O-N 3.07Å
805	N	53.4	Low	58.4	Low	94 Å²	94	79.8 Å²	79.8	50%	0.503	38%	0.38	S	S	.	.			trans	-49.2	105	-174.5	-56.9	-35.7	0	0	0	114.3
806	D	56.5	Low	57.5	Low	75 Å²	75	77.6 Å²	77.6	40%	0.401	37%	0.366	S	S	.	.			trans	-103	135.6	163.9	-86.6	-46.4	0	0	0	110.9	T804 Q808 E809	T804-D806 PolarHBondContact O-N 3.07Å; D806-Q808 VanDerWaalsContact C-N 3.26Å; D806-E809 HydrophobicContact CB-CB 4.35Å
807	L	55.7	Low	56.6	Low	83 Å²	83	82 Å²	82	44%	0.435	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-22	172.3	-76	171.4	0	0	0	112.1	I574 L810	I574-L807 HydrophobicContact CD1-CD1 3.82Å; I574-L807 HydrophobicContact CD1-CD2 4.24Å; L807-L810 HydrophobicContact CD2-CD1 4.39Å
808	Q	56.9	Low	55.8	Low	100 Å²	100	79.4 Å²	79.4	47%	0.467	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-43.9	176.5	-63.6	-178.8	-9.5	0	0	110.3	L568 D806 L810 L811 T812	L568-Q808 HydrophobicContact CD2-CG 4.1Å; D806-Q808 VanDerWaalsContact C-N 3.26Å; Q808-L810 VanDerWaalsContact C-N 3.26Å; Q808-L810 PolarHBondContact O-N 3.46Å; Q808-L811 CarbonylContact O-C 3.53Å; Q808-L811 PolarHBondContact O-N 3.11Å; Q808-T812 PolarHBondContact O-N 2.92Å; Q808-T812 PolarHBondContact O-OG1 2.86Å; Q808-T812 VanDerWaalsContact O-OG1 3.07Å
809	E	64.5	Low	54.7	Low	73 Å²	73	79 Å²	79	34%	0.341	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-40.7	176.8	-168.8	178.7	-116	0	0	112.7	K777 D806 L811	K777-E809 WeakPolarHBondContact CD-O 3.5Å; K777-E809 PolarHBondContact NZ-O 2.99Å; K777-E809 VanDerWaalsContact NZ-O 3.13Å; D806-E809 HydrophobicContact CB-CB 4.35Å; E809-L811 VanDerWaalsContact C-N 3.3Å; E809-L811 PolarHBondContact O-N 3.12Å
810	L	61.1	Low	54	Low	7 Å²	7	81.8 Å²	81.8	4%	0.037	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-23.6	175.8	-79.7	-175.8	0	0	0	115.1	L578 W742 K777 L807 Q808	L578-L810 HydrophobicContact CD2-CD1 4.45Å; W742-L810 HydrophobicContact CH2-CD2 4.44Å; K777-L810 HydrophobicContact CB-CD2 4.07Å; L807-L810 HydrophobicContact CD2-CD1 4.39Å; Q808-L810 VanDerWaalsContact C-N 3.26Å; Q808-L810 PolarHBondContact O-N 3.46Å
811	L	58.7	Low	53.5	Low	22 Å²	22	80.5 Å²	80.5	12%	0.115	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-6.7	-172.7	-64.1	176.6	0	0	0	112.6	L559 L568 L578 L581 Q808 E809	L559-L811 WeakPolarHBondContact CD1-O 3.32Å; L559-L811 HydrophobicContact CD2-CD2 4.48Å; L559-L811 WeakPolarHBondContact CD2-O 3.49Å; L568-L811 HydrophobicContact CD2-CD1 3.88Å; L568-L811 HydrophobicContact CG-CD1 4.18Å; L578-L811 HydrophobicContact CD2-CD2 4.15Å; L581-L811 HydrophobicContact CD1-CD2 3.83Å; Q808-L811 CarbonylContact O-C 3.53Å; Q808-L811 PolarHBondContact O-N 3.11Å; E809-L811 VanDerWaalsContact C-N 3.3Å; E809-L811 PolarHBondContact O-N 3.12Å
812	T	63.2	Low	53.2	Low	63 Å²	63	76 Å²	76	39%	0.387	39%	0.393	S	S	.	.			trans	-67.7	128.1	165.4	-46.5	0	0	0	0	109.9	K777 Q808 E814	K777-T812 PolarHBondContact NZ-O 3.01Å; Q808-T812 PolarHBondContact O-N 2.92Å; Q808-T812 PolarHBondContact O-OG1 2.86Å; Q808-T812 VanDerWaalsContact O-OG1 3.07Å; T812-E814 HydrophobicContact CG2-CG 4.01Å
813	F	60.3	Low	53	Low	32 Å²	32	75.7 Å²	75.7	14%	0.14	39%	0.392	C	S	.	.			trans	-95.4	139.6	159.3	-170.9	-134.8	0	0	0	108.8	L547 Q552 Y555 R556 L559 G772 T773 D815	L547-F813 HydrophobicContact CD1-CE2 4.1Å; L547-F813 HydrophobicContact CD1-CZ 4.01Å; Q552-F813 HydrophobicContact CG-CE1 3.9Å; Q552-F813 HydrophobicContact CG-CZ 4.07Å; Y555-F813 HydrophobicContact CD1-CB 4.19Å; Y555-F813 HydrophobicContact CD1-CD1 4.16Å; Y555-F813 AromaticContact CD1-CD2 3.75Å; Y555-F813 HydrophobicContact CD1-CD2 3.75Å; Y555-F813 HydrophobicContact CD1-CE1 4.47Å; Y555-F813 HydrophobicContact CD1-CE2 4.13Å; Y555-F813 AromaticContact CD1-CG 3.79Å; Y555-F813 HydrophobicContact CD1-CG 3.79Å; Y555-F813 HydrophobicContact CD1-CZ 4.48Å; Y555-F813 HydrophobicContact CE1-CB 3.89Å; Y555-F813 AromaticContact CE1-CD2 3.48Å; Y555-F813 HydrophobicContact CE1-CD2 3.48Å; Y555-F813 VanDerWaalsContact CE1-CD2 3.48Å; Y555-F813 HydrophobicContact CE1-CE2 4.15Å; Y555-F813 AromaticContact CE1-CG 3.75Å; Y555-F813 HydrophobicContact CE1-CG 3.75Å; R556-F813 HydrophobicContact CG-CD1 4.07Å; R556-F813 HydrophobicContact CG-CE1 4.21Å; L559-F813 HydrophobicContact CD1-CB 3.57Å; G772-F813 WeakPolarHBondContact O-CD2 3.22Å; T773-F813 HydrophobicContact CG2-CE2 4.3Å; F813-D815 WeakPolarHBondContact CD1-OD2 3.3Å; F813-D815 WeakPolarHBondContact CE1-OD1 3.28Å
814	E	59.3	Low	52.8	Low	75 Å²	75	69.1 Å²	69.1	35%	0.35	36%	0.364	S	S	.	.			trans	-119.6	107.3	178.4	-72.3	165.5	-127.1	0	0	106.9	K777 T812	K777-E814 IonicContact NZ-OE1 3.22Å; K777-E814 PolarHBondContact NZ-OE1 3.21Å; T812-E814 HydrophobicContact CG2-CG 4.01Å
815	D	53.9	Low	52.4	Low	46 Å²	46	66.9 Å²	66.9	25%	0.246	35%	0.353	C	S	.	.			trans	-78.7	135.5	-177.5	-82.8	-76.5	0	0	0	110.5	Q552 R556 F813 S817	Q552-D815 PolarHBondContact NE2-OD1 3.4Å; R556-D815 IonicContact CZ-OD1 3.18Å; R556-D815 IonicContact CZ-OD2 3.86Å; R556-D815 IonicContact NE-OD1 3.9Å; R556-D815 PolarHBondContact NE-OD1 3.09Å; R556-D815 IonicContact NE-OD2 2.71Å; R556-D815 PolarHBondContact NE-OD2 3.1Å; R556-D815 IonicContact NH2-OD1 2.62Å; R556-D815 PolarHBondContact NH2-OD1 2.94Å; R556-D815 IonicContact NH2-OD2 2.77Å; R556-D815 PolarHBondContact NH2-OD2 3.32Å; F813-D815 WeakPolarHBondContact CD1-OD2 3.3Å; F813-D815 WeakPolarHBondContact CE1-OD1 3.28Å; D815-S817 PolarHBondContact O-N 3.46Å
816	E	49.5	Very low	51.8	Low	62 Å²	62	65.5 Å²	65.5	29%	0.29	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-70.9	12.8	-168.5	-66.5	-169.4	-164.8	0	0	115.7	R546 S771 D818 I819	R546-E816 IonicContact CZ-OE2 3.43Å; R546-E816 IonicContact NE-OE1 2.71Å; R546-E816 IonicContact NE-OE2 3.1Å; R546-E816 PolarHBondContact NE-OE2 2.94Å; R546-E816 IonicContact NH2-OE2 3.62Å; R546-E816 PolarHBondContact NH2-OE2 3.46Å; S771-E816 VanDerWaalsContact CB-OE1 3.32Å; S771-E816 WeakPolarHBondContact CB-OE1 3.48Å; S771-E816 PolarHBondContact OG-OE1 2.61Å; E816-D818 PolarHBondContact O-N 2.96Å; E816-I819 PolarHBondContact O-N 3.49Å
817	S	44.2	Very low	51.1	Low	103 Å²	103	67.3 Å²	67.3	72%	0.72	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-61.9	-26.4	-177.9	51.3	0	0	0	0	114.3	D815	D815-S817 PolarHBondContact O-N 3.46Å
818	D	41.6	Very low	50.5	Low	148 Å²	148	70 Å²	70	79%	0.791	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-115.4	3.2	-175.6	-65.5	-74.9	0	0	0	113.9	E816	E816-D818 PolarHBondContact O-N 2.96Å
819	I	40.7	Very low	49.4	Very low	64 Å²	64	73 Å²	73	33%	0.328	37%	0.372	S	S	.	.			trans	-137.6	105.5	-167.2	-35.1	-178.5	0	0	0	113.2	E816 I821 L826	E816-I819 PolarHBondContact O-N 3.49Å; I819-I821 WeakPolarHBondContact CG2-O 3.41Å; I819-I821 PolarHBondContact O-N 3.25Å; I819-L826 HydrophobicContact CG2-CD1 3.97Å
820	Q	41.6	Very low	48	Very low	196 Å²	196	73 Å²	73	92%	0.916	38%	0.381	S	S	*	.	S	Bend	trans	-73.7	-5.8	175.9	-66	-176.3	-7.2	0	0	114.7
821	I	46.2	Very low	46.9	Very low	57 Å²	57	80.9 Å²	80.9	29%	0.292	42%	0.417	S	S	.	.	S	Bend	trans	-138.6	116.8	-170.1	-55.8	178.9	0	0	0	108.4	I819 A825 L826	I819-I821 WeakPolarHBondContact CG2-O 3.41Å; I819-I821 PolarHBondContact O-N 3.25Å; I821-A825 HydrophobicContact CG2-CB 3.46Å; I821-A825 VanDerWaalsContact CG2-CB 3.46Å; I821-L826 HydrophobicContact CB-CD2 4.02Å; I821-L826 HydrophobicContact CB-CG 4.06Å; I821-L826 HydrophobicContact CD1-CD2 4.37Å; I821-L826 HydrophobicContact CG2-CD2 3.97Å; I821-L826 HydrophobicContact CG2-CG 3.85Å
822	P	48.9	Very low	45.4	Very low	35 Å²	35	82.3 Å²	82.3	23%	0.227	44%	0.438	C	S	.	.			trans	-52.4	154.4	179.2	-29.3	35.1	0	0	0	113.8	F544 T824 A825 L826	F544-P822 HydrophobicContact CB-CG 4.3Å; F544-P822 HydrophobicContact CD1-CB 4.15Å; F544-P822 HydrophobicContact CD1-CG 4.47Å; F544-P822 HydrophobicContact CE1-CB 4.49Å; F544-P822 HydrophobicContact CG-CB 4.34Å; F544-P822 HydrophobicContact CG-CG 4.18Å; P822-T824 VanDerWaalsContact C-N 3.25Å; P822-T824 PolarHBondContact O-N 3.3Å; P822-T824 VanDerWaalsContact O-N 3.16Å; P822-A825 HydrophobicContact CB-CB 4.33Å; P822-A825 CarbonylContact O-C 3.53Å; P822-A825 WeakPolarHBondContact O-CA 3.27Å; P822-A825 WeakPolarHBondContact O-CB 3.46Å; P822-A825 PolarHBondContact O-N 3.39Å; P822-L826 PolarHBondContact O-N 3.08Å
823	E	48.8	Very low	43.8	Very low	40 Å²	40	87.7 Å²	87.7	19%	0.187	46%	0.46	C	S	.	.	H	α-helix	trans	-52.7	-44.1	-176.6	-146.4	-160.9	152.7	0	0	111.2	A825 L826 Y827	E823-A825 PolarHBondContact O-N 2.76Å; E823-L826 WeakPolarHBondContact O-CB 3.38Å; E823-L826 PolarHBondContact O-N 3.36Å; E823-Y827 HydrophobicContact CB-CE2 4.28Å; E823-Y827 HydrophobicContact CG-CD2 4.26Å; E823-Y827 HydrophobicContact CG-CE2 3.6Å; E823-Y827 WeakPolarHBondContact O-CD2 3.36Å; E823-Y827 PolarHBondContact O-N 3.01Å; E823-Y827 WeakPolarHBondContact OE1-CE2 3.49Å; E823-Y827 VanDerWaalsContact OE1-CZ 3.26Å; E823-Y827 PolarHBondContact OE1-OH 3.4Å
824	T	49.8	Very low	42.1	Very low	4 Å²	4	89.4 Å²	89.4	3%	0.025	49%	0.487	C	S	.	.	H	α-helix	trans	-64.1	-35.5	174.7	-55.9	0	0	0	0	113.8	F544 E776 Y779 H780 P822 Y827 L828	F544-T824 HydrophobicContact CE1-CG2 4.11Å; F544-T824 HydrophobicContact CZ-CG2 3.65Å; E776-T824 WeakPolarHBondContact CG-OG1 3.46Å; E776-T824 WeakPolarHBondContact OE1-CB 3.49Å; E776-T824 PolarHBondContact OE1-N 3.24Å; E776-T824 PolarHBondContact OE1-OG1 3Å; Y779-T824 HydrophobicContact CD1-CG2 4.15Å; Y779-T824 HydrophobicContact CE1-CG2 3.88Å; H780-T824 PolarHBondContact CE1-OG1 2.92Å; H780-T824 PolarHBondContact NE2-OG1 2.77Å; P822-T824 VanDerWaalsContact C-N 3.25Å; P822-T824 PolarHBondContact O-N 3.3Å; P822-T824 VanDerWaalsContact O-N 3.16Å; T824-Y827 PolarHBondContact O-N 3.37Å; T824-L828 HydrophobicContact CG2-CD1 4.22Å; T824-L828 WeakPolarHBondContact O-CG 3.33Å; T824-L828 PolarHBondContact O-N 3.01Å; T824-L828 VanDerWaalsContact O-N 3.11Å
825	A	45.6	Very low	40.7	Very low	25 Å²	25	95 Å²	95	21%	0.207	51%	0.513	C	S	.	.	H	α-helix	trans	-75.2	-29.5	176.8	0	0	0	0	0	111.4	I821 P822 E823 L828 K829	I821-A825 HydrophobicContact CG2-CB 3.46Å; I821-A825 VanDerWaalsContact CG2-CB 3.46Å; P822-A825 HydrophobicContact CB-CB 4.33Å; P822-A825 CarbonylContact O-C 3.53Å; P822-A825 WeakPolarHBondContact O-CA 3.27Å; P822-A825 WeakPolarHBondContact O-CB 3.46Å; P822-A825 PolarHBondContact O-N 3.39Å; E823-A825 PolarHBondContact O-N 2.76Å; A825-L828 PolarHBondContact O-N 3.18Å; A825-K829 WeakPolarHBondContact O-CB 3.48Å; A825-K829 PolarHBondContact O-N 3.48Å
826	L	39.8	Very low	39.3	Very low	66 Å²	66	98.7 Å²	98.7	35%	0.346	54%	0.537	S	S	.	.	H	α-helix	trans	-64.5	-49.7	164.6	-70.1	169.2	0	0	0	110.2	I819 I821 P822 E823 L828 K829 S830	I819-L826 HydrophobicContact CG2-CD1 3.97Å; I821-L826 HydrophobicContact CB-CD2 4.02Å; I821-L826 HydrophobicContact CB-CG 4.06Å; I821-L826 HydrophobicContact CD1-CD2 4.37Å; I821-L826 HydrophobicContact CG2-CD2 3.97Å; I821-L826 HydrophobicContact CG2-CG 3.85Å; P822-L826 PolarHBondContact O-N 3.08Å; E823-L826 WeakPolarHBondContact O-CB 3.38Å; E823-L826 PolarHBondContact O-N 3.36Å; L826-L828 PolarHBondContact O-N 3.12Å; L826-K829 PolarHBondContact O-N 2.74Å; L826-S830 WeakPolarHBondContact O-CB 3.45Å; L826-S830 PolarHBondContact O-N 3.05Å; L826-S830 PolarHBondContact O-OG 2.92Å; L826-S830 VanDerWaalsContact O-OG 3.11Å
827	Y	43.4	Very low	38.3	Very low	112 Å²	112	103.6 Å²	103.6	44%	0.439	56%	0.564	S	S	.	*	H	α-helix	trans	-58.6	-12.8	174.2	-70.7	-62.8	0	0	0	114.8	H780 E823 T824	H780-Y827 AromaticContact CE1-CD2 3.31Å; H780-Y827 WeakPolarHBondContact CE1-CD2 3.43Å; H780-Y827 AromaticContact CE1-CE2 3.7Å; H780-Y827 AromaticContact NE2-CD2 3.57Å; H780-Y827 AromaticContact NE2-CE2 3.52Å; E823-Y827 HydrophobicContact CB-CE2 4.28Å; E823-Y827 HydrophobicContact CG-CD2 4.26Å; E823-Y827 HydrophobicContact CG-CE2 3.6Å; E823-Y827 WeakPolarHBondContact O-CD2 3.36Å; E823-Y827 PolarHBondContact O-N 3.01Å; E823-Y827 WeakPolarHBondContact OE1-CE2 3.49Å; E823-Y827 VanDerWaalsContact OE1-CZ 3.26Å; E823-Y827 PolarHBondContact OE1-OH 3.4Å; T824-Y827 PolarHBondContact O-N 3.37Å
828	L	41.9	Very low	37.4	Very low	140 Å²	140	102.8 Å²	102.8	73%	0.733	56%	0.555	S	S	*	*	H	α-helix	trans	-105	-11.2	174.6	-71.6	168.2	0	0	0	114.3	T824 A825 L826	T824-L828 HydrophobicContact CG2-CD1 4.22Å; T824-L828 WeakPolarHBondContact O-CG 3.33Å; T824-L828 PolarHBondContact O-N 3.01Å; T824-L828 VanDerWaalsContact O-N 3.11Å; A825-L828 PolarHBondContact O-N 3.18Å; L826-L828 PolarHBondContact O-N 3.12Å
829	K	33.8	Very low	36.7	Very low	162 Å²	162	101.8 Å²	101.8	70%	0.704	55%	0.55	S	S	*	.	H	α-helix	trans	-118.2	-15	177.7	-89.7	-170.5	168.8	-172.9	0	114.7	A825 L826 E831	A825-K829 WeakPolarHBondContact O-CB 3.48Å; A825-K829 PolarHBondContact O-N 3.48Å; L826-K829 PolarHBondContact O-N 2.74Å; K829-E831 VanDerWaalsContact C-N 3.26Å; K829-E831 PolarHBondContact O-N 2.88Å
830	S	36.6	Very low	36.3	Very low	73 Å²	73	104.3 Å²	104.3	51%	0.51	57%	0.573	S	S	.	*			trans	-81.4	63.3	-165.2	71.6	0	0	0	0	113.9	L826 G832	L826-S830 WeakPolarHBondContact O-CB 3.45Å; L826-S830 PolarHBondContact O-N 3.05Å; L826-S830 PolarHBondContact O-OG 2.92Å; L826-S830 VanDerWaalsContact O-OG 3.11Å; S830-G832 PolarHBondContact O-N 2.83Å
831	E	36.5	Very low	35.7	Very low	174 Å²	174	102.4 Å²	102.4	81%	0.813	57%	0.568	S	S	*	*	S	Bend	trans	-73.6	63.7	152.7	-63.7	-169.3	137.4	0	0	109.4	K829	K829-E831 VanDerWaalsContact C-N 3.26Å; K829-E831 PolarHBondContact O-N 2.88Å
832	G	28.6	Very low	35.3	Very low	52 Å²	52	105.6 Å²	105.6	54%	0.536	59%	0.591	S	S	.	*	S	Bend	trans	168.5	160.8	-178.3	0	0	0	0	0	116.4	S830	S830-G832 PolarHBondContact O-N 2.83Å
833	M	28.5	Very low	34.6	Very low	176 Å²	176	113.4 Å²	113.4	87%	0.867	62%	0.624	S	S	*	*			trans	-54.6	154.6	-178.5	-82.5	77.5	68.6	0	0	115.3
834	G	25.4	Very low	34.1	Very low	68 Å²	68	112.9 Å²	112.9	70%	0.701	62%	0.623	S	S	*	*			trans	-129.7	174	164.1	0	0	0	0	0	112.3
835	H	30.4	Very low	34	Very low	193 Å²	193	120.6 Å²	120.6	89%	0.894	65%	0.651	S	S	*	*			trans	-140.8	-166.8	179.9	-96.9	-74.8	0	0	0	112.6
836	T	23.9	Very low	33.8	Very low	122 Å²	122	123.1 Å²	123.1	75%	0.748	66%	0.658	S	S	*	*			trans	-145.8	143.4	-163	-47.9	0	0	0	0	110.8
837	L	28.3	Very low	34.4	Very low	166 Å²	166	122.8 Å²	122.8	87%	0.869	66%	0.656	S	S	*	*			trans	-169.2	-172.7	150.3	-101.8	159	0	0	0	111.3
838	T	25.8	Very low	34.7	Very low	86 Å²	86	122 Å²	122	53%	0.528	66%	0.659	S	S	.	*			trans	-148.6	140	-136.5	52.4	0	0	0	0	118
839	N	26.1	Very low	35.2	Very low	126 Å²	126	120.5 Å²	120.5	67%	0.674	65%	0.651	S	S	*	*			trans	47.1	124.1	145.7	-65.6	105.1	0	0	0	120.9	K910	N839-K910 PolarHBondContact OD1-NZ 2.79Å
840	S	32.4	Very low	35.9	Very low	117 Å²	117	115.5 Å²	115.5	82%	0.818	64%	0.64	S	S	*	*			trans	-131.1	179.3	134.6	68.5	0	0	0	0	110
841	L	29.2	Very low	36.3	Very low	156 Å²	156	118.8 Å²	118.8	82%	0.817	65%	0.645	S	S	*	*			trans	-141.6	142.6	-172.6	-75.7	164.8	0	0	0	111.1
842	T	37.9	Very low	36.7	Very low	125 Å²	125	118.9 Å²	118.9	77%	0.767	64%	0.643	S	S	*	*			trans	-138	166.4	165.2	47.5	0	0	0	0	110.8
843	E	34.3	Very low	37.7	Very low	198 Å²	198	125 Å²	125	93%	0.925	66%	0.657	S	S	*	*			trans	-86.7	156.9	-163.3	-57.4	-165.3	128.5	0	0	114.8
844	N	37	Very low	38.3	Very low	30 Å²	30	124.7 Å²	124.7	16%	0.16	65%	0.651	C	S	.	*			trans	-117.2	130.9	-164.8	-128.9	-98.5	0	0	0	115	E560	E560-N844 WeakPolarHBondContact CB-ND2 3.25Å; E560-N844 WeakPolarHBondContact CB-OD1 3.43Å; E560-N844 PolarHBondContact OE1-ND2 2.91Å; E560-N844 PolarHBondContact OE2-ND2 2.89Å
845	R	48.5	Very low	38.6	Very low	165 Å²	165	127.8 Å²	127.8	62%	0.623	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-30.3	-166.5	-152.6	172.8	-173.4	172.4	1.5	113.8	D847 I848 L849	R845-D847 VanDerWaalsContact C-N 3.31Å; R845-D847 PolarHBondContact O-N 3.32Å; R845-I848 WeakPolarHBondContact O-CB 3.3Å; R845-I848 PolarHBondContact O-N 3.44Å; R845-I848 VanDerWaalsContact O-N 3.13Å; R845-L849 PolarHBondContact O-N 2.85Å
846	F	42.4	Very low	38.6	Very low	79 Å²	79	125.7 Å²	125.7	35%	0.346	65%	0.647	S	S	.	*	H	α-helix	trans	-62.1	-33.7	177.5	-74.7	-44.8	0	0	0	113.6	E557 I848 L849 A850	E557-F846 HydrophobicContact CB-CD2 4.36Å; E557-F846 HydrophobicContact CB-CE2 3.74Å; E557-F846 HydrophobicContact CB-CZ 4.4Å; E557-F846 VanDerWaalsContact CD-CE2 3.44Å; E557-F846 VanDerWaalsContact CD-CZ 3.4Å; E557-F846 HydrophobicContact CG-CD2 3.66Å; E557-F846 HydrophobicContact CG-CE2 3.35Å; E557-F846 HydrophobicContact CG-CG 4.47Å; E557-F846 HydrophobicContact CG-CZ 3.9Å; E557-F846 WeakPolarHBondContact O-CD2 3.36Å; E557-F846 WeakPolarHBondContact O-CE2 3.45Å; E557-F846 WeakPolarHBondContact OE2-CZ 3.33Å; F846-I848 PolarHBondContact O-N 3.37Å; F846-L849 PolarHBondContact O-N 3.36Å; F846-A850 WeakPolarHBondContact O-CB 3.35Å; F846-A850 PolarHBondContact O-N 2.94Å
847	D	50.9	Low	38.9	Very low	58 Å²	58	125.6 Å²	125.6	31%	0.31	65%	0.648	S	S	.	*	H	α-helix	trans	-69.9	-16.8	178.6	-75.9	-36.7	0	0	0	112.3	K565 R845 K851	K565-D847 IonicContact NZ-OD2 2.69Å; K565-D847 PolarHBondContact NZ-OD2 2.99Å; K565-D847 VanDerWaalsContact NZ-OD2 3.12Å; R845-D847 VanDerWaalsContact C-N 3.31Å; R845-D847 PolarHBondContact O-N 3.32Å; D847-K851 WeakPolarHBondContact O-CD 3.48Å; D847-K851 VanDerWaalsContact O-CG 3.29Å; D847-K851 WeakPolarHBondContact O-CG 3.45Å; D847-K851 PolarHBondContact O-N 3.47Å
848	I	50.4	Low	39	Very low	96 Å²	96	125.1 Å²	125.1	49%	0.492	65%	0.646	S	S	.	*	H	α-helix	trans	-79.3	-45.1	172.8	-54.4	176.1	0	0	0	110.6	R845 F846 A850 K851 K852	R845-I848 WeakPolarHBondContact O-CB 3.3Å; R845-I848 PolarHBondContact O-N 3.44Å; R845-I848 VanDerWaalsContact O-N 3.13Å; F846-I848 PolarHBondContact O-N 3.37Å; I848-A850 VanDerWaalsContact C-N 3.34Å; I848-K851 PolarHBondContact O-N 2.65Å; I848-K852 PolarHBondContact O-N 3.44Å; I848-K852 VanDerWaalsContact O-N 3.09Å
849	L	53.1	Low	39.2	Very low	108 Å²	108	129.6 Å²	129.6	57%	0.565	66%	0.661	S	S	*	*	H	α-helix	trans	-67.2	-35.2	177.1	-67.6	173	0	0	0	111.9	R845 F846 K851	R845-L849 PolarHBondContact O-N 2.85Å; F846-L849 PolarHBondContact O-N 3.36Å; L849-K851 VanDerWaalsContact C-N 3.32Å; L849-K851 PolarHBondContact O-N 2.81Å
850	A	48.6	Very low	39.4	Very low	57 Å²	57	129.1 Å²	129.1	47%	0.471	67%	0.668	S	S	.	*	H	α-helix	trans	-69.9	-23.9	175.3	0	0	0	0	0	114	F846 I848	F846-A850 WeakPolarHBondContact O-CB 3.35Å; F846-A850 PolarHBondContact O-N 2.94Å; I848-A850 VanDerWaalsContact C-N 3.34Å
851	K	43.7	Very low	39.2	Very low	143 Å²	143	132.6 Å²	132.6	62%	0.622	67%	0.668	S	S	*	*	H	α-helix	trans	-82.3	-44.4	173.6	-76.3	173.9	-179	177.2	0	112.2	D847 I848 L849 Q853 K854	D847-K851 WeakPolarHBondContact O-CD 3.48Å; D847-K851 VanDerWaalsContact O-CG 3.29Å; D847-K851 WeakPolarHBondContact O-CG 3.45Å; D847-K851 PolarHBondContact O-N 3.47Å; I848-K851 PolarHBondContact O-N 2.65Å; L849-K851 VanDerWaalsContact C-N 3.32Å; L849-K851 PolarHBondContact O-N 2.81Å; K851-Q853 PolarHBondContact O-N 3.05Å; K851-K854 PolarHBondContact O-N 3.15Å
852	K	45.8	Very low	39	Very low	176 Å²	176	130.8 Å²	130.8	77%	0.765	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-6.5	178.4	-73.7	-168.5	174.9	-171.5	0	115.2	I848	I848-K852 PolarHBondContact O-N 3.44Å; I848-K852 VanDerWaalsContact O-N 3.09Å
853	Q	48.4	Very low	38.6	Very low	180 Å²	180	129.3 Å²	129.3	84%	0.841	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	10.8	171.9	-65.4	-170.3	-6.4	0	0	114.5	K851	K851-Q853 PolarHBondContact O-N 3.05Å
854	K	41.2	Very low	38.4	Very low	169 Å²	169	127.3 Å²	127.3	74%	0.735	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.5	-26.9	-179.2	-96.6	-179.4	173.5	175.6	0	115.8	K851 N856	K851-K854 PolarHBondContact O-N 3.15Å; K854-N856 PolarHBondContact O-N 3.11Å
855	D	32.4	Very low	38	Very low	133 Å²	133	132.7 Å²	132.7	71%	0.711	68%	0.679	S	S	*	*			trans	-92.6	76.1	-174	-59.1	-38.5	0	0	0	111.3
856	N	29.8	Very low	37.1	Very low	149 Å²	149	130.5 Å²	130.5	80%	0.797	68%	0.68	S	S	*	*			trans	-168	95.6	158.5	-110.2	-36.8	0	0	0	112	K854	K854-N856 PolarHBondContact O-N 3.11Å
857	P	30.7	Very low	36.5	Very low	120 Å²	120	131.9 Å²	131.9	78%	0.779	70%	0.695	S	S	*	*			trans	-132.9	133	136.3	17.9	1.9	0	0	0	112.1
858	L	30.3	Very low	35.6	Very low	157 Å²	157	135.9 Å²	135.9	82%	0.822	72%	0.716	S	S	*	*			trans	-73.9	144	174	-53.3	97.3	0	0	0	111.2
859	Q	29.8	Very low	34.8	Very low	179 Å²	179	138.8 Å²	138.8	84%	0.836	73%	0.731	S	S	*	*				164.2	150.3	114.1	-88.6	179.7	12	0	0	113.1
860	S	30.5	Very low	33.8	Very low	117 Å²	117	137.9 Å²	137.9	82%	0.818	73%	0.734	S	S	*	*			trans	69.3	151.6	163.8	76.9	0	0	0	0	118.5
861	K	28.4	Very low	32.7	Very low	190 Å²	190	140.1 Å²	140.1	83%	0.826	75%	0.746	S	S	*	*			cis	-172.7	139.7	-42.7	-121.7	-178.5	179.2	-175.7	0	108
862	S	25.2	Very low	32.2	Very low	117 Å²	117	136.9 Å²	136.9	82%	0.818	75%	0.754	S	S	*	*			trans	62.1	156.2	170.8	24.3	0	0	0	0	116.4
863	S	29.2	Very low	31.3	Very low	94 Å²	94	133 Å²	133	66%	0.657	75%	0.749	S	S	*	*			cis	-154.2	152.1	6.2	46.4	0	0	0	0	112.7
864	H	30.2	Very low	30.5	Very low	156 Å²	156	131.3 Å²	131.3	72%	0.722	75%	0.745	S	S	*	*			trans	67.8	116.4	150.3	-68.3	-9.3	0	0	0	117.8
865	M	28.7	Very low	30.1	Very low	144 Å²	144	128.3 Å²	128.3	71%	0.709	74%	0.741	S	S	*	*				103.7	142.1	77.3	-79.6	-138.5	-163.5	0	0	109.5
866	N	29.6	Very low	29.9	Very low	118 Å²	118	129.5 Å²	129.5	63%	0.631	74%	0.742	S	S	*	*			cis	-163.1	153.9	-10.2	-121	24.4	0	0	0	107.9
867	T	30.2	Very low	30	Very low	108 Å²	108	128.7 Å²	128.7	66%	0.663	74%	0.738	S	S	*	*			trans	55.9	150.2	153	59.2	0	0	0	0	119.6
868	D	30.5	Very low	30.1	Very low	142 Å²	142	129.7 Å²	129.7	76%	0.759	74%	0.737	S	S	*	*			cis	-167.7	-177.2	-18.7	-91.4	-21.4	0	0	0	105.1
869	I	33.8	Very low	30.1	Very low	158 Å²	158	128.8 Å²	128.8	81%	0.81	73%	0.733	S	S	*	*			cis	-142.4	-125.7	13.9	-156.9	164.3	0	0	0	112.6
870	S	31.8	Very low	30	Very low	89 Å²	89	127 Å²	127	62%	0.622	72%	0.724	S	S	*	*			trans	-127.6	-178.3	-165.3	81.1	0	0	0	0	110.4
871	S	27.3	Very low	29.9	Very low	103 Å²	103	128.2 Å²	128.2	72%	0.72	72%	0.715	S	S	*	*			cis	-176.5	139.6	-12.2	33.7	0	0	0	0	111.2
872	G	32	Very low	29.8	Very low	76 Å²	76	126.7 Å²	126.7	78%	0.784	71%	0.711	S	S	*	*			trans	67.6	174	157	0	0	0	0	0	117.5
873	S	27.6	Very low	30	Very low	94 Å²	94	128.9 Å²	128.9	66%	0.657	71%	0.708	S	S	*	*			cis	-166.9	160.8	-28.5	54	0	0	0	0	108.9
874	D	31.5	Very low	30.2	Very low	144 Å²	144	130.8 Å²	130.8	77%	0.77	71%	0.711	S	S	*	*			trans	67.7	161.9	162	-39.1	-47.1	0	0	0	115.2
875	V	32.2	Very low	30.3	Very low	106 Å²	106	129.8 Å²	129.8	64%	0.642	71%	0.707	S	S	*	*			cis	-164.6	154	-19.1	121.8	0	0	0	0	109.3
876	E	28.8	Very low	30.5	Very low	158 Å²	158	126.1 Å²	126.1	74%	0.738	71%	0.705	S	S	*	*			trans	57.3	133.7	157.3	-75.3	149.8	-157	0	0	124.2
877	D	31.6	Very low	30.6	Very low	132 Å²	132	127.9 Å²	127.9	71%	0.706	71%	0.707	S	S	*	*				79.4	141.9	128.2	-57.8	-2.9	0	0	0	127.7
878	D	32.6	Very low	30.6	Very low	141 Å²	141	131.8 Å²	131.8	75%	0.754	72%	0.715	S	S	*	*			trans	66	115.9	144.2	-63.3	-0	0	0	0	126.8
879	D	31	Very low	30.4	Very low	139 Å²	139	132.2 Å²	132.2	74%	0.743	71%	0.713	S	S	*	*				56.9	124.8	123.8	-72.8	-3.1	0	0	0	126.8
880	E	27	Very low	30.2	Very low	140 Å²	140	131.1 Å²	131.1	65%	0.654	70%	0.702	S	S	*	*			trans	73.3	141.7	132.2	-70.8	-160.2	132.3	0	0	125.6
881	K	28.9	Very low	30	Very low	144 Å²	144	133.7 Å²	133.7	63%	0.626	70%	0.704	S	S	*	*			trans	80.9	123.9	145.8	-75.2	159.9	-177.8	146.8	0	123.3
882	E	27.1	Very low	29.9	Very low	158 Å²	158	134 Å²	134	74%	0.738	70%	0.702	S	S	*	*				52.8	152.9	120.6	-64.7	165.3	166.8	0	0	119.8
883	E	28.3	Very low	29.7	Very low	163 Å²	163	138.9 Å²	138.9	76%	0.762	70%	0.704	S	S	*	*			cis	-162.9	172.8	12.3	-140.3	170.4	-173.8	0	0	114
884	D	33.5	Very low	29.7	Very low	133 Å²	133	138.8 Å²	138.8	71%	0.711	71%	0.709	S	S	*	*			trans	98.5	144.6	136.2	-123.7	-0.8	0	0	0	128.7
885	E	32.6	Very low	29.5	Very low	136 Å²	136	137.1 Å²	137.1	64%	0.636	71%	0.708	S	S	*	*			trans	39.7	141.2	162.2	-63.4	-123	124.6	0	0	124.9	K887	E885-K887 IonicContact OE1-NZ 2.61Å; E885-K887 PolarHBondContact OE1-NZ 2.69Å; E885-K887 IonicContact OE2-NZ 2.65Å; E885-K887 PolarHBondContact OE2-NZ 2.8Å
886	G	32.1	Very low	29.4	Very low	66 Å²	66	138 Å²	138	68%	0.68	71%	0.714	S	S	*	*			cis	165.1	167.3	-10.1	0	0	0	0	0	118.7
887	K	31.4	Very low	29.5	Very low	155 Å²	155	137.9 Å²	137.9	67%	0.674	72%	0.718	S	S	*	*			trans	92	120.7	149.3	-65.1	-179.5	168	92.8	0	123.6	E885	E885-K887 IonicContact OE1-NZ 2.61Å; E885-K887 PolarHBondContact OE1-NZ 2.69Å; E885-K887 IonicContact OE2-NZ 2.65Å; E885-K887 PolarHBondContact OE2-NZ 2.8Å
888	K	30.7	Very low	29.4	Very low	190 Å²	190	138.7 Å²	138.7	83%	0.826	72%	0.723	S	S	*	*			trans	88.9	138.7	154.6	-63.1	176.1	-179.2	178.4	0	121.5
889	E	26.1	Very low	29.1	Very low	152 Å²	152	139.1 Å²	139.1	71%	0.71	73%	0.725	S	S	*	*			cis	-170.2	157.8	-35.5	-133.3	175.9	-103.1	0	0	112.7
890	K	30.6	Very low	29.1	Very low	135 Å²	135	141.3 Å²	141.3	59%	0.587	73%	0.728	S	S	*	*			trans	78.9	115.7	155.7	-67.5	-176.1	162.3	-73.3	0	123.3
891	E	26.8	Very low	29.1	Very low	143 Å²	143	140.6 Å²	140.6	67%	0.668	73%	0.733	S	S	*	*				61.5	135.2	122	-67.1	146.8	-153.1	0	0	120.8
892	T	26.7	Very low	29.2	Very low	110 Å²	110	140.7 Å²	140.7	68%	0.675	74%	0.741	S	S	*	*			cis	-161.4	154.2	-9.2	7.3	0	0	0	0	112.3
893	E	25.9	Very low	29.3	Very low	178 Å²	178	138.8 Å²	138.8	83%	0.832	74%	0.74	S	S	*	*			trans	59.8	120.6	144	-72.1	167.5	-144.1	0	0	125.4
894	A	27.7	Very low	29.4	Very low	91 Å²	91	136.8 Å²	136.8	75%	0.752	74%	0.741	S	S	*	*				94.9	121.2	126.1	0	0	0	0	0	123.9
895	S	28.2	Very low	29.1	Very low	109 Å²	109	137.8 Å²	137.8	76%	0.762	75%	0.746	S	S	*	*			trans	78.4	104.2	148.7	61.7	0	0	0	0	123.2
896	V	30.1	Very low	29.2	Very low	125 Å²	125	137 Å²	137	76%	0.758	75%	0.746	S	S	*	*				53.1	94.7	124.8	-174	0	0	0	0	118.7
897	D	30	Very low	29.4	Very low	155 Å²	155	138.7 Å²	138.7	83%	0.829	75%	0.747	S	S	*	*				-179	135.2	91.4	-112.1	-25.4	0	0	0	111.2
898	D	29.9	Very low	29.8	Very low	149 Å²	149	137.4 Å²	137.4	80%	0.797	75%	0.748	S	S	*	*			trans	-83.7	137.8	-162.4	-93.1	-53.1	0	0	0	116.3
899	N	27.7	Very low	30.4	Very low	150 Å²	150	135.8 Å²	135.8	80%	0.802	74%	0.741	S	S	*	*			trans	-146.4	83.8	170.2	-99.8	-84.5	0	0	0	111.7
900	F	30.9	Very low	31.2	Very low	185 Å²	185	134.1 Å²	134.1	81%	0.811	73%	0.731	S	S	*	*			trans	-83.1	123.6	174.9	-119.4	-85.5	0	0	0	112
901	T	25.2	Very low	31.8	Very low	125 Å²	125	131.3 Å²	131.3	77%	0.767	73%	0.729	S	S	*	*			trans	-104.8	139.4	175.9	48.5	0	0	0	0	111.2
902	N	30.9	Very low	33.2	Very low	146 Å²	146	131.8 Å²	131.8	78%	0.781	73%	0.729	S	S	*	*			trans	-140.5	148.1	176.5	-108.7	-48.4	0	0	0	113
903	T	29.6	Very low	34.4	Very low	119 Å²	119	135.1 Å²	135.1	73%	0.73	73%	0.729	S	S	*	*			trans	-78.4	132.8	-153.8	-40.1	0	0	0	0	115.1
904	P	30.1	Very low	35.7	Very low	120 Å²	120	130.6 Å²	130.6	78%	0.779	71%	0.713	S	S	*	*			trans	-94.2	118.2	-177.1	34	-33.3	0	0	0	114.6
905	L	27.4	Very low	37.2	Very low	155 Å²	155	130.7 Å²	130.7	81%	0.812	70%	0.698	S	S	*	*			trans	-147	73.6	-179.5	-105	170.7	0	0	0	114.7
906	N	36.1	Very low	38.8	Very low	118 Å²	118	131.6 Å²	131.6	63%	0.631	69%	0.69	S	S	*	*			trans	-172.5	7.4	157.4	-109.2	-57.6	0	0	0	117.6	D908	N906-D908 PolarHBondContact O-N 3.04Å
907	S	35.9	Very low	40.1	Very low	102 Å²	102	129.2 Å²	129.2	71%	0.713	67%	0.673	S	S	*	*	H	α-helix	trans	-58	-37.2	-168	48.8	0	0	0	0	116.1	K909 K910 S911	S907-K909 VanDerWaalsContact C-N 3.28Å; S907-K909 PolarHBondContact O-N 2.82Å; S907-K910 PolarHBondContact O-N 2.92Å; S907-S911 PolarHBondContact O-N 3.32Å
908	D	40.3	Very low	41.6	Very low	128 Å²	128	129.7 Å²	129.7	68%	0.684	66%	0.663	S	S	*	*	H	α-helix	trans	-58.2	-31.5	-174.5	-92	-10.2	0	0	0	114.8	N906 K912	N906-D908 PolarHBondContact O-N 3.04Å; D908-K912 PolarHBondContact O-N 2.83Å
909	K	43.5	Very low	43.2	Very low	157 Å²	157	128.4 Å²	128.4	68%	0.683	65%	0.652	S	S	*	*	H	α-helix	trans	-70.6	-39.4	179.7	-72.1	177.3	-177.5	165	0	111.8	S907 R913	S907-K909 VanDerWaalsContact C-N 3.28Å; S907-K909 PolarHBondContact O-N 2.82Å; K909-R913 PolarHBondContact O-N 3.1Å
910	K	42.1	Very low	44.7	Very low	117 Å²	117	126 Å²	126	51%	0.509	64%	0.639	S	S	.	*	H	α-helix	trans	-66.9	-42.1	-179.6	-146.2	172.4	-175.9	179	0	110	N839 S907 R913 T914	N839-K910 PolarHBondContact OD1-NZ 2.79Å; S907-K910 PolarHBondContact O-N 2.92Å; K910-R913 PolarHBondContact O-N 3.2Å; K910-T914 PolarHBondContact O-N 3.11Å; K910-T914 PolarHBondContact O-OG1 3.36Å
911	S	43.8	Very low	45.8	Very low	75 Å²	75	118.6 Å²	118.6	52%	0.524	61%	0.612	S	S	.	*	H	α-helix	trans	-60.7	-43.3	176.3	-176.7	0	0	0	0	113.9	S907 R913 T914 E915	S907-S911 PolarHBondContact O-N 3.32Å; S911-R913 PolarHBondContact O-N 3.38Å; S911-T914 PolarHBondContact O-OG1 3.22Å; S911-E915 PolarHBondContact O-N 2.93Å; S911-E915 VanDerWaalsContact O-N 3.15Å
912	K	54.8	Low	47.5	Very low	154 Å²	154	118.4 Å²	118.4	67%	0.67	60%	0.6	S	S	*	*	H	α-helix	trans	-63.7	-39.6	174.5	-77.9	-178.7	177.4	175.7	0	112.7	D908 Q916	D908-K912 PolarHBondContact O-N 2.83Å; K912-Q916 WeakPolarHBondContact O-CB 3.4Å; K912-Q916 WeakPolarHBondContact O-CG 3.3Å; K912-Q916 PolarHBondContact O-N 3.04Å
913	R	52	Low	48.9	Very low	180 Å²	180	113.9 Å²	113.9	68%	0.679	58%	0.575	S	S	*	*	H	α-helix	trans	-69.2	-39.4	-179.8	-170.5	171.4	178.7	140.3	-2.9	112	K909 K910 S911 Q916 L917	K909-R913 PolarHBondContact O-N 3.1Å; K910-R913 PolarHBondContact O-N 3.2Å; S911-R913 PolarHBondContact O-N 3.38Å; R913-Q916 PolarHBondContact O-N 3.29Å; R913-L917 HydrophobicContact CG-CD1 4.29Å; R913-L917 VanDerWaalsContact O-CG 3.29Å; R913-L917 WeakPolarHBondContact O-CG 3.48Å; R913-L917 PolarHBondContact O-N 3.24Å
914	T	53.4	Low	50.2	Low	82 Å²	82	112 Å²	112	50%	0.503	56%	0.559	S	S	.	*	H	α-helix	trans	-66.1	-41.5	175.3	51.7	0	0	0	0	111.9	K910 S911 L917 R918	K910-T914 PolarHBondContact O-N 3.11Å; K910-T914 PolarHBondContact O-OG1 3.36Å; S911-T914 PolarHBondContact O-OG1 3.22Å; T914-L917 PolarHBondContact O-N 2.84Å; T914-R918 WeakPolarHBondContact O-CB 3.42Å; T914-R918 PolarHBondContact O-N 2.98Å
915	E	59.7	Low	51.6	Low	94 Å²	94	109.2 Å²	109.2	44%	0.439	54%	0.543	S	S	.	.	H	α-helix	trans	-67.7	-35.9	176.9	-170.6	62.7	-168.6	0	0	112.4	S911 R918 Q919	S911-E915 PolarHBondContact O-N 2.93Å; S911-E915 VanDerWaalsContact O-N 3.15Å; E915-R918 PolarHBondContact O-N 3.36Å; E915-Q919 WeakPolarHBondContact O-CG 3.49Å; E915-Q919 PolarHBondContact O-N 3.03Å
916	Q	61.5	Low	53.2	Low	128 Å²	128	107.4 Å²	107.4	60%	0.598	53%	0.525	S	S	*	.	H	α-helix	trans	-62.2	-45.6	171	-77.6	175.1	-37.1	0	0	112.3	K912 R913 R918 Q919 L920	K912-Q916 WeakPolarHBondContact O-CB 3.4Å; K912-Q916 WeakPolarHBondContact O-CG 3.3Å; K912-Q916 PolarHBondContact O-N 3.04Å; R913-Q916 PolarHBondContact O-N 3.29Å; Q916-R918 VanDerWaalsContact C-N 3.29Å; Q916-R918 PolarHBondContact O-N 3.06Å; Q916-Q919 PolarHBondContact O-N 2.9Å; Q916-L920 PolarHBondContact O-N 2.77Å
917	L	58.1	Low	54	Low	75 Å²	75	108.3 Å²	108.3	39%	0.393	52%	0.519	S	S	.	.	H	α-helix	trans	-61.3	-38.4	174.5	-72.3	166.8	0	0	0	111.5	R913 T914 Q919 L920 A921	R913-L917 HydrophobicContact CG-CD1 4.29Å; R913-L917 VanDerWaalsContact O-CG 3.29Å; R913-L917 WeakPolarHBondContact O-CG 3.48Å; R913-L917 PolarHBondContact O-N 3.24Å; T914-L917 PolarHBondContact O-N 2.84Å; L917-Q919 VanDerWaalsContact C-N 3.33Å; L917-Q919 PolarHBondContact O-N 2.86Å; L917-L920 WeakPolarHBondContact O-CB 3.35Å; L917-L920 PolarHBondContact O-N 3.02Å; L917-A921 WeakPolarHBondContact O-CB 3.19Å; L917-A921 PolarHBondContact O-N 3.22Å
918	R	60.8	Low	54.8	Low	164 Å²	164	107.7 Å²	107.7	62%	0.619	51%	0.507	S	S	*	.	H	α-helix	trans	-68.7	-28	177.6	-152.6	177.4	-157.3	177.5	8.3	113.4	T914 E915 Q916 K922	T914-R918 WeakPolarHBondContact O-CB 3.42Å; T914-R918 PolarHBondContact O-N 2.98Å; E915-R918 PolarHBondContact O-N 3.36Å; Q916-R918 VanDerWaalsContact C-N 3.29Å; Q916-R918 PolarHBondContact O-N 3.06Å; R918-K922 WeakPolarHBondContact O-CG 3.34Å; R918-K922 PolarHBondContact O-N 3Å
919	Q	64.7	Low	55.2	Low	123 Å²	123	104.6 Å²	104.6	58%	0.575	50%	0.5	S	S	*	.	H	α-helix	trans	-72.8	-43.6	168.3	-72.9	-174.5	-23.5	0	0	111.5	E915 Q916 L917 K922 E923	E915-Q919 WeakPolarHBondContact O-CG 3.49Å; E915-Q919 PolarHBondContact O-N 3.03Å; Q916-Q919 PolarHBondContact O-N 2.9Å; L917-Q919 VanDerWaalsContact C-N 3.33Å; L917-Q919 PolarHBondContact O-N 2.86Å; Q919-K922 PolarHBondContact O-N 2.94Å; Q919-E923 PolarHBondContact O-N 3.41Å
920	L	58	Low	55.5	Low	100 Å²	100	100.6 Å²	100.6	52%	0.524	48%	0.483	S	S	.	.	H	α-helix	trans	-60.2	-44.5	175.4	-106.2	166.8	0	0	0	112.4	Q916 L917 K922 E923 I924	Q916-L920 PolarHBondContact O-N 2.77Å; L917-L920 WeakPolarHBondContact O-CB 3.35Å; L917-L920 PolarHBondContact O-N 3.02Å; L920-K922 VanDerWaalsContact C-N 3.31Å; L920-K922 PolarHBondContact O-N 3.1Å; L920-E923 PolarHBondContact O-N 3.48Å; L920-I924 HydrophobicContact CD2-CD1 4.26Å; L920-I924 WeakPolarHBondContact O-CB 3.47Å; L920-I924 VanDerWaalsContact O-CG1 3.31Å; L920-I924 WeakPolarHBondContact O-CG1 3.18Å; L920-I924 PolarHBondContact O-N 3.29Å
921	A	53.9	Low	55.4	Low	29 Å²	29	99.8 Å²	99.8	24%	0.24	48%	0.481	C	S	.	.	H	α-helix	trans	-61.1	-37.2	177	0	0	0	0	0	112.6	L917 S925	L917-A921 WeakPolarHBondContact O-CB 3.19Å; L917-A921 PolarHBondContact O-N 3.22Å; A921-S925 VanDerWaalsContact O-CB 3.31Å; A921-S925 WeakPolarHBondContact O-CB 3.41Å; A921-S925 PolarHBondContact O-N 2.92Å; A921-S925 PolarHBondContact O-OG 3.46Å
922	K	61.4	Low	55	Low	120 Å²	120	101.3 Å²	101.3	52%	0.522	49%	0.491	S	S	.	.	H	α-helix	trans	-68.2	-42.4	173.5	-76.2	176.1	178.5	176.5	0	112.5	R918 Q919 L920 S925 R926	R918-K922 WeakPolarHBondContact O-CG 3.34Å; R918-K922 PolarHBondContact O-N 3Å; Q919-K922 PolarHBondContact O-N 2.94Å; L920-K922 VanDerWaalsContact C-N 3.31Å; L920-K922 PolarHBondContact O-N 3.1Å; K922-S925 PolarHBondContact O-N 3.23Å; K922-R926 WeakPolarHBondContact O-CB 3.28Å; K922-R926 PolarHBondContact O-N 2.79Å
923	E	59.5	Low	54.3	Low	52 Å²	52	98.1 Å²	98.1	24%	0.243	49%	0.488	C	S	.	.	H	α-helix	trans	-67.3	-38.4	176.9	177.1	62.8	-177.8	0	0	111.9	Q919 L920 R926 R927	Q919-E923 PolarHBondContact O-N 3.41Å; L920-E923 PolarHBondContact O-N 3.48Å; E923-R926 VanDerWaalsContact CD-NH2 3.26Å; E923-R926 PolarHBondContact O-N 3.44Å; E923-R926 IonicContact OE1-CZ 2.75Å; E923-R926 IonicContact OE1-NH2 3.94Å; E923-R926 PolarHBondContact OE1-NH2 3.48Å; E923-R926 IonicContact OE2-CZ 2.7Å; E923-R926 VanDerWaalsContact OE2-CZ 3.27Å; E923-R926 IonicContact OE2-NE 3.77Å; E923-R926 PolarHBondContact OE2-NE 3.01Å; E923-R926 IonicContact OE2-NH2 3.19Å; E923-R926 PolarHBondContact OE2-NH2 3Å; E923-R927 WeakPolarHBondContact O-CB 3.37Å; E923-R927 WeakPolarHBondContact O-CG 3.41Å; E923-R927 PolarHBondContact O-N 3.46Å; E923-R927 IonicContact OE1-CZ 2.76Å; E923-R927 VanDerWaalsContact OE1-CZ 3.24Å; E923-R927 IonicContact OE1-NE 2.68Å; E923-R927 PolarHBondContact OE1-NE 2.92Å; E923-R927 IonicContact OE1-NH2 3.12Å; E923-R927 PolarHBondContact OE1-NH2 2.91Å
924	I	57.3	Low	53.6	Low	80 Å²	80	95.4 Å²	95.4	41%	0.41	49%	0.487	S	S	.	.	H	α-helix	trans	-66.3	-43.2	172.7	-68.8	165.9	0	0	0	110.6	L920 R926 R927 I928	L920-I924 HydrophobicContact CD2-CD1 4.26Å; L920-I924 WeakPolarHBondContact O-CB 3.47Å; L920-I924 VanDerWaalsContact O-CG1 3.31Å; L920-I924 WeakPolarHBondContact O-CG1 3.18Å; L920-I924 PolarHBondContact O-N 3.29Å; I924-R926 VanDerWaalsContact C-N 3.31Å; I924-R926 PolarHBondContact O-N 3.01Å; I924-R927 PolarHBondContact O-N 3.05Å; I924-I928 HydrophobicContact CG2-CD1 3.77Å; I924-I928 HydrophobicContact CG2-CG1 4.39Å; I924-I928 WeakPolarHBondContact O-CB 3.12Å; I924-I928 VanDerWaalsContact O-CG1 3.3Å; I924-I928 WeakPolarHBondContact O-CG1 3.42Å; I924-I928 PolarHBondContact O-N 3.36Å
925	S	59.8	Low	52.6	Low	61 Å²	61	98.4 Å²	98.4	43%	0.427	49%	0.493	S	S	.	.	H	α-helix	trans	-61.3	-39.8	175.2	-61.6	0	0	0	0	112.1	A921 K922 I928 A929	A921-S925 VanDerWaalsContact O-CB 3.31Å; A921-S925 WeakPolarHBondContact O-CB 3.41Å; A921-S925 PolarHBondContact O-N 2.92Å; A921-S925 PolarHBondContact O-OG 3.46Å; K922-S925 PolarHBondContact O-N 3.23Å; S925-I928 PolarHBondContact O-N 2.96Å; S925-A929 PolarHBondContact O-N 3.08Å; S925-A929 VanDerWaalsContact O-N 3.09Å
926	R	61	Low	51.3	Low	117 Å²	117	100.5 Å²	100.5	44%	0.442	51%	0.507	S	S	.	.	H	α-helix	trans	-63.2	-48.9	173.7	-175.5	177.3	74.7	94	-2.2	111.1	K922 E923 I924 I928 A929 E930	K922-R926 WeakPolarHBondContact O-CB 3.28Å; K922-R926 PolarHBondContact O-N 2.79Å; E923-R926 VanDerWaalsContact CD-NH2 3.26Å; E923-R926 PolarHBondContact O-N 3.44Å; E923-R926 IonicContact OE1-CZ 2.75Å; E923-R926 IonicContact OE1-NH2 3.94Å; E923-R926 PolarHBondContact OE1-NH2 3.48Å; E923-R926 IonicContact OE2-CZ 2.7Å; E923-R926 VanDerWaalsContact OE2-CZ 3.27Å; E923-R926 IonicContact OE2-NE 3.77Å; E923-R926 PolarHBondContact OE2-NE 3.01Å; E923-R926 IonicContact OE2-NH2 3.19Å; E923-R926 PolarHBondContact OE2-NH2 3Å; I924-R926 VanDerWaalsContact C-N 3.31Å; I924-R926 PolarHBondContact O-N 3.01Å; R926-I928 VanDerWaalsContact C-N 3.32Å; R926-I928 PolarHBondContact O-N 3.2Å; R926-A929 WeakPolarHBondContact O-CB 3.32Å; R926-A929 PolarHBondContact O-N 2.92Å; R926-A929 VanDerWaalsContact O-N 3.08Å; R926-E930 WeakPolarHBondContact CD-OE1 3.22Å; R926-E930 HydrophobicContact CG-CG 4.45Å; R926-E930 WeakPolarHBondContact CG-OE1 3.02Å; R926-E930 IonicContact CZ-OE1 2.67Å; R926-E930 IonicContact CZ-OE2 3.76Å; R926-E930 IonicContact NE-OE1 3.88Å; R926-E930 VanDerWaalsContact NH1-CD 3.31Å; R926-E930 IonicContact NH1-OE1 2.71Å; R926-E930 PolarHBondContact NH1-OE1 3.43Å; R926-E930 IonicContact NH1-OE2 3.91Å; R926-E930 PolarHBondContact NH1-OE2 3.12Å; R926-E930 VanDerWaalsContact NH1-OE2 3.13Å; R926-E930 WeakPolarHBondContact O-CG 3.41Å; R926-E930 PolarHBondContact O-N 3.36Å
927	R	53.3	Low	49.8	Very low	136 Å²	136	100.9 Å²	100.9	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-63.1	-33.4	176.3	-72.2	177.5	-167.3	-157.1	2.5	113.3	E923 I924 A929 E930 E931	E923-R927 WeakPolarHBondContact O-CB 3.37Å; E923-R927 WeakPolarHBondContact O-CG 3.41Å; E923-R927 PolarHBondContact O-N 3.46Å; E923-R927 IonicContact OE1-CZ 2.76Å; E923-R927 VanDerWaalsContact OE1-CZ 3.24Å; E923-R927 IonicContact OE1-NE 2.68Å; E923-R927 PolarHBondContact OE1-NE 2.92Å; E923-R927 IonicContact OE1-NH2 3.12Å; E923-R927 PolarHBondContact OE1-NH2 2.91Å; I924-R927 PolarHBondContact O-N 3.05Å; R927-A929 VanDerWaalsContact C-N 3.35Å; R927-E930 PolarHBondContact O-N 3.05Å; R927-E931 WeakPolarHBondContact O-CB 3.5Å; R927-E931 WeakPolarHBondContact O-CG 3.5Å; R927-E931 PolarHBondContact O-N 3.19Å
928	I	51.5	Low	48.3	Very low	90 Å²	90	102.3 Å²	102.3	46%	0.462	53%	0.527	S	S	.	.	H	α-helix	trans	-68.6	-35.3	173.4	-70.6	167.3	0	0	0	110.9	I924 S925 R926 C932	I924-I928 HydrophobicContact CG2-CD1 3.77Å; I924-I928 HydrophobicContact CG2-CG1 4.39Å; I924-I928 WeakPolarHBondContact O-CB 3.12Å; I924-I928 VanDerWaalsContact O-CG1 3.3Å; I924-I928 WeakPolarHBondContact O-CG1 3.42Å; I924-I928 PolarHBondContact O-N 3.36Å; S925-I928 PolarHBondContact O-N 2.96Å; R926-I928 VanDerWaalsContact C-N 3.32Å; R926-I928 PolarHBondContact O-N 3.2Å; I928-C932 WeakPolarHBondContact O-CB 3.35Å; I928-C932 PolarHBondContact O-N 3.33Å; I928-C932 PolarHBondContact O-SG 3.2Å
929	A	50.3	Low	46.7	Very low	63 Å²	63	100.5 Å²	100.5	52%	0.521	53%	0.534	S	S	.	.	H	α-helix	trans	-68.9	-41.3	172	0	0	0	0	0	112.1	S925 R926 R927 C932 S933	S925-A929 PolarHBondContact O-N 3.08Å; S925-A929 VanDerWaalsContact O-N 3.09Å; R926-A929 WeakPolarHBondContact O-CB 3.32Å; R926-A929 PolarHBondContact O-N 2.92Å; R926-A929 VanDerWaalsContact O-N 3.08Å; R927-A929 VanDerWaalsContact C-N 3.35Å; A929-C932 WeakPolarHBondContact O-CB 3.35Å; A929-C932 PolarHBondContact O-N 3.38Å; A929-S933 PolarHBondContact O-N 3.2Å; A929-S933 PolarHBondContact O-OG 3.29Å
930	E	48.5	Very low	45	Very low	73 Å²	73	99.4 Å²	99.4	34%	0.341	53%	0.529	S	S	.	.	H	α-helix	trans	-71.6	-34.1	178.3	-69.8	165.2	178.3	0	0	112.5	R926 R927 C932 S933 N934	R926-E930 WeakPolarHBondContact CD-OE1 3.22Å; R926-E930 HydrophobicContact CG-CG 4.45Å; R926-E930 WeakPolarHBondContact CG-OE1 3.02Å; R926-E930 IonicContact CZ-OE1 2.67Å; R926-E930 IonicContact CZ-OE2 3.76Å; R926-E930 IonicContact NE-OE1 3.88Å; R926-E930 VanDerWaalsContact NH1-CD 3.31Å; R926-E930 IonicContact NH1-OE1 2.71Å; R926-E930 PolarHBondContact NH1-OE1 3.43Å; R926-E930 IonicContact NH1-OE2 3.91Å; R926-E930 PolarHBondContact NH1-OE2 3.12Å; R926-E930 VanDerWaalsContact NH1-OE2 3.13Å; R926-E930 WeakPolarHBondContact O-CG 3.41Å; R926-E930 PolarHBondContact O-N 3.36Å; R927-E930 PolarHBondContact O-N 3.05Å; E930-C932 VanDerWaalsContact C-N 3.34Å; E930-S933 PolarHBondContact O-N 2.67Å; E930-S933 PolarHBondContact O-OG 2.83Å; E930-S933 VanDerWaalsContact O-OG 3.07Å; E930-N934 WeakPolarHBondContact O-CB 3.47Å; E930-N934 PolarHBondContact O-N 3.43Å; E930-N934 PolarHBondContact O-ND2 2.85Å
931	E	39.5	Very low	43.5	Very low	99 Å²	99	98 Å²	98	46%	0.463	53%	0.527	S	S	.	.	H	α-helix	trans	-72.4	-26.4	170	-80.8	-174.4	-148.4	0	0	112.3	R927 S933 K935	R927-E931 WeakPolarHBondContact O-CB 3.5Å; R927-E931 WeakPolarHBondContact O-CG 3.5Å; R927-E931 PolarHBondContact O-N 3.19Å; E931-S933 PolarHBondContact O-N 3.07Å; E931-K935 WeakPolarHBondContact O-CB 3.32Å; E931-K935 VanDerWaalsContact O-CD 3.28Å; E931-K935 WeakPolarHBondContact O-CD 3.4Å; E931-K935 WeakPolarHBondContact O-CG 3.1Å; E931-K935 WeakPolarHBondContact OE2-CE 3.46Å; E931-K935 IonicContact OE2-NZ 2.66Å; E931-K935 PolarHBondContact OE2-NZ 3.18Å
932	C	37.1	Very low	42.3	Very low	108 Å²	108	100.2 Å²	100.2	73%	0.73	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-9.9	170.6	-74.8	0	0	0	0	113.2	I928 A929 E930	I928-C932 WeakPolarHBondContact O-CB 3.35Å; I928-C932 PolarHBondContact O-N 3.33Å; I928-C932 PolarHBondContact O-SG 3.2Å; A929-C932 WeakPolarHBondContact O-CB 3.35Å; A929-C932 PolarHBondContact O-N 3.38Å; E930-C932 VanDerWaalsContact C-N 3.34Å
933	S	40.2	Very low	40.6	Very low	86 Å²	86	98.5 Å²	98.5	60%	0.601	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	-11.9	174.9	56.8	0	0	0	0	114.7	A929 E930 E931	A929-S933 PolarHBondContact O-N 3.2Å; A929-S933 PolarHBondContact O-OG 3.29Å; E930-S933 PolarHBondContact O-N 2.67Å; E930-S933 PolarHBondContact O-OG 2.83Å; E930-S933 VanDerWaalsContact O-OG 3.07Å; E931-S933 PolarHBondContact O-N 3.07Å
934	N	36.9	Very low	39.1	Very low	123 Å²	123	102.5 Å²	102.5	66%	0.658	55%	0.554	S	S	*	*	S	Bend	trans	-118.1	29.1	-178.8	-67.5	-77.6	0	0	0	114	E930	E930-N934 WeakPolarHBondContact O-CB 3.47Å; E930-N934 PolarHBondContact O-N 3.43Å; E930-N934 PolarHBondContact O-ND2 2.85Å
935	K	32	Very low	37.7	Very low	146 Å²	146	105.7 Å²	105.7	64%	0.635	57%	0.567	S	S	*	*			trans	-105.9	43.4	178.7	-84	178.2	-174.2	167	0	114.7	E931	E931-K935 WeakPolarHBondContact O-CB 3.32Å; E931-K935 VanDerWaalsContact O-CD 3.28Å; E931-K935 WeakPolarHBondContact O-CD 3.4Å; E931-K935 WeakPolarHBondContact O-CG 3.1Å; E931-K935 WeakPolarHBondContact OE2-CE 3.46Å; E931-K935 IonicContact OE2-NZ 2.66Å; E931-K935 PolarHBondContact OE2-NZ 3.18Å
936	D	33.1	Very low	36	Very low	138 Å²	138	106.5 Å²	106.5	74%	0.738	57%	0.573	S	S	*	*	S	Bend	trans	-101.5	137.4	152.1	-75.8	-50.7	0	0	0	109.1
937	N	29.6	Very low	34.3	Very low	136 Å²	136	107.9 Å²	107.9	73%	0.727	59%	0.589	S	S	*	*	S	Bend	trans	72.8	106.2	-171.7	-43.3	-80.4	0	0	0	115.5
938	P	26.5	Very low	33.1	Very low	104 Å²	104	109.3 Å²	109.3	68%	0.675	60%	0.601	S	S	*	*			trans	-90.9	145.9	164.8	35.5	-31	0	0	0	111.9
939	V	27.2	Very low	32	Very low	127 Å²	127	111.4 Å²	111.4	77%	0.77	61%	0.612	S	S	*	*			trans	-174.2	163.1	148.4	133.5	0	0	0	0	112
940	E	27.9	Very low	30.9	Very low	100 Å²	100	114.2 Å²	114.2	47%	0.467	62%	0.623	S	S	.	*			trans	-51.3	175.3	-178.1	-67.5	102.7	-162.8	0	0	119.1	F1209	E940-F1209 HydrophobicContact CG-CB 4.4Å; E940-F1209 WeakPolarHBondContact OE2-CB 3.47Å
941	S	27.1	Very low	29.9	Very low	70 Å²	70	115.7 Å²	115.7	49%	0.49	64%	0.642	S	S	.	*			cis	-174.7	157.3	-34.7	70.1	0	0	0	0	112.6	W1211	S941-W1211 WeakPolarHBondContact OG-CB 3.42Å
942	V	28.2	Very low	29.2	Very low	75 Å²	75	118 Å²	118	46%	0.455	66%	0.657	S	S	.	*			trans	45.2	109.2	158	-96.4	0	0	0	0	124.3	W1211	V942-W1211 HydrophobicContact CB-CD2 3.98Å; V942-W1211 HydrophobicContact CB-CE3 3.69Å; V942-W1211 HydrophobicContact CB-CH2 4.03Å; V942-W1211 HydrophobicContact CB-CZ2 4.35Å; V942-W1211 HydrophobicContact CB-CZ3 3.69Å; V942-W1211 HydrophobicContact CG1-CZ3 4.32Å; V942-W1211 HydrophobicContact CG2-CB 3.84Å; V942-W1211 HydrophobicContact CG2-CD2 3.41Å; V942-W1211 VanDerWaalsContact CG2-CD2 3.41Å; V942-W1211 HydrophobicContact CG2-CE3 3.28Å; V942-W1211 HydrophobicContact CG2-CG 3.7Å; V942-W1211 HydrophobicContact CG2-CH2 4.49Å; V942-W1211 HydrophobicContact CG2-CZ3 3.84Å; V942-W1211 VanDerWaalsContact O-CE2 3.24Å; V942-W1211 WeakPolarHBondContact O-CH2 3.42Å; V942-W1211 WeakPolarHBondContact O-CZ2 3.41Å
943	T	26.1	Very low	28.8	Very low	84 Å²	84	122.8 Å²	122.8	52%	0.515	67%	0.665	S	S	.	*				52.6	158.1	118.1	65.7	0	0	0	0	127.3	W1211 R1213	T943-W1211 WeakPolarHBondContact O-CH2 3.38Å; T943-W1211 VanDerWaalsContact O-CZ2 3.3Å; T943-W1211 WeakPolarHBondContact O-CZ2 3.46Å; T943-W1211 WeakPolarHBondContact OG1-CH2 3.41Å; T943-R1213 PolarHBondContact OG1-NH2 3.01Å
944	K	28.4	Very low	28.2	Very low	137 Å²	137	126.7 Å²	126.7	60%	0.596	67%	0.674	S	S	*	*			trans	80	152.1	160.7	-75.1	-166.1	171.6	-162.7	0	115.5
945	Q	27.8	Very low	27.7	Very low	146 Å²	146	128.5 Å²	128.5	68%	0.682	68%	0.683	S	S	*	*			cis	-147.7	134.1	1.1	-119.1	166	-77.9	0	0	107.8
946	S	24.7	Very low	27.3	Very low	79 Å²	79	129.1 Å²	129.1	55%	0.552	69%	0.693	S	S	*	*				77.4	135.6	86.4	78.7	0	0	0	0	117.4
947	N	25	Very low	26.9	Very low	146 Å²	146	127.6 Å²	127.6	78%	0.781	69%	0.693	S	S	*	*			trans	71.5	146.3	172.3	-42.7	-9.3	0	0	0	112.1
948	E	28	Very low	26.9	Very low	165 Å²	165	133 Å²	133	77%	0.771	70%	0.703	S	S	*	*			cis	-150.9	169.3	22.9	-75.4	-172.3	175.7	0	0	109.1
949	I	28.5	Very low	26.8	Very low	135 Å²	135	137.7 Å²	137.7	69%	0.692	71%	0.713	S	S	*	*			cis	-156.7	-166.8	-10.2	-113	170.7	0	0	0	109.7
950	T	25.9	Very low	26.8	Very low	122 Å²	122	143.2 Å²	143.2	75%	0.748	72%	0.72	S	S	*	*			trans	-37	145	174.4	59.9	0	0	0	0	117.3
951	S	27.5	Very low	26.7	Very low	104 Å²	104	147.9 Å²	147.9	73%	0.727	74%	0.739	S	S	*	*				-176.1	146.9	63.9	47.3	0	0	0	0	115.9
952	N	25.4	Very low	26.7	Very low	148 Å²	148	149.2 Å²	149.2	79%	0.791	75%	0.748	S	S	*	*			trans	7.7	122.6	153.3	-55	-20.5	0	0	0	121.4
953	K	29	Very low	26.7	Very low	207 Å²	207	152.2 Å²	152.2	90%	0.9	76%	0.761	S	S	*	*				-171.8	143.6	94.8	-98.9	167.9	-175.5	174.6	0	113.5
954	H	26.3	Very low	26.8	Very low	168 Å²	168	154.1 Å²	154.1	78%	0.778	77%	0.767	S	S	*	*			trans	-76	146.7	167.9	-86	-127.1	0	0	0	111.3
955	N	26.6	Very low	27.1	Very low	161 Å²	161	157 Å²	157	86%	0.861	78%	0.78	S	S	*	*				-172	154.6	110.2	-99.7	-35.1	0	0	0	113.6
956	L	23.7	Very low	27.2	Very low	160 Å²	160	150.9 Å²	150.9	84%	0.838	76%	0.756	S	S	*	*			trans	-96.8	141.7	178.2	-63.6	88.1	0	0	0	111.2
957	S	26.4	Very low	27.8	Very low	105 Å²	105	151.6 Å²	151.6	73%	0.734	76%	0.757	S	S	*	*			trans	-149.7	124.7	155.5	73.1	0	0	0	0	115.7
958	R	28.4	Very low	28.3	Very low	249 Å²	249	152.4 Å²	152.4	94%	0.94	75%	0.749	S	S	*	*			trans	61.7	105.1	136.4	-65.4	175.3	176	154.3	-0.2	120.2
959	K	24.6	Very low	28.6	Very low	203 Å²	203	149.7 Å²	149.7	88%	0.883	74%	0.744	S	S	*	*			trans	-28.2	142.7	150	-55.5	167.4	177.6	175.3	0	115
960	R	27.5	Very low	29.1	Very low	243 Å²	243	150.6 Å²	150.6	92%	0.917	75%	0.75	S	S	*	*				-168.9	120.8	121.2	-104.7	166.2	-169.2	-162.1	3.6	114.4
961	K	26.3	Very low	29.8	Very low	199 Å²	199	147.2 Å²	147.2	87%	0.865	74%	0.739	S	S	*	*			trans	41	151.1	146.2	-64.1	-169.4	173.1	-172.6	0	123.8
962	S	26.5	Very low	30.4	Very low	97 Å²	97	150.4 Å²	150.4	68%	0.678	74%	0.74	S	S	*	*			trans	83.4	114.1	148.6	21	0	0	0	0	121.7
963	D	28	Very low	30.8	Very low	138 Å²	138	150.9 Å²	150.9	74%	0.738	73%	0.731	S	S	*	*				101.5	111	126.4	-60	-0.6	0	0	0	123.5
964	I	29.1	Very low	31.3	Very low	125 Å²	125	147.7 Å²	147.7	64%	0.641	72%	0.722	S	S	*	*			trans	56.4	99.3	135.6	-50.6	169.7	0	0	0	117.3
965	K	33.4	Very low	31.6	Very low	198 Å²	198	148 Å²	148	86%	0.861	72%	0.721	S	S	*	*			trans	-113.7	100.3	172.6	-69.2	-178.4	179.8	177.6	0	112.7
966	G	31.4	Very low	32	Very low	17 Å²	17	147 Å²	147	18%	0.175	72%	0.715	C	S	.	*	P	Polyproline II helix	trans	-86.6	149.1	161.8	0	0	0	0	0	112.3	R973	G966-R973 PolarHBondContact O-NH1 2.89Å
967	T	36.1	Very low	32.4	Very low	94 Å²	94	145.9 Å²	145.9	58%	0.577	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-71.2	153.3	174	32.5	0	0	0	0	112.6
968	R	36.1	Very low	32.6	Very low	163 Å²	163	145.6 Å²	145.6	62%	0.615	72%	0.718	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94	148.3	173.3	-70.3	174.3	117.7	146.1	-2.7	110.5	G971 R973	R968-G971 VanDerWaalsContact CZ-O 3.32Å; R968-G971 PolarHBondContact NE-O 3.41Å; R968-G971 PolarHBondContact NH2-O 3.3Å; R968-R973 HydrophobicContact CG-CG 3.68Å
969	V	34.1	Very low	32.7	Very low	108 Å²	108	142.9 Å²	142.9	66%	0.655	71%	0.713	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-134.5	138.5	158.7	-178.6	0	0	0	0	105	G971 K972	V969-G971 PolarHBondContact O-N 3.49Å; V969-K972 PolarHBondContact O-N 3.39Å
970	D	38.6	Very low	32.9	Very low	154 Å²	154	142.3 Å²	142.3	82%	0.824	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	46.4	51.9	177.6	-50.9	-24	0	0	0	114.4	K972	D970-K972 PolarHBondContact O-N 2.79Å
971	G	40.3	Very low	32.9	Very low	51 Å²	51	134.7 Å²	134.7	53%	0.526	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	72.9	-33.1	176.3	0	0	0	0	0	115.9	R968 V969	R968-G971 VanDerWaalsContact CZ-O 3.32Å; R968-G971 PolarHBondContact NE-O 3.41Å; R968-G971 PolarHBondContact NH2-O 3.3Å; V969-G971 PolarHBondContact O-N 3.49Å
972	K	39.6	Very low	32.8	Very low	171 Å²	171	133.9 Å²	133.9	74%	0.743	69%	0.688	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.8	150.3	-176.5	-68.2	176.6	-180	173.7	0	111.7	V969 D970	V969-K972 PolarHBondContact O-N 3.39Å; D970-K972 PolarHBondContact O-N 2.79Å
973	R	34.6	Very low	33.1	Very low	158 Å²	158	136.7 Å²	136.7	60%	0.596	69%	0.685	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.6	129.7	171	-76.4	-172.7	-174.9	-98.1	14.7	109.1	G966 R968	G966-R973 PolarHBondContact O-NH1 2.89Å; R968-R973 HydrophobicContact CG-CG 3.68Å
974	I	39.6	Very low	33.3	Very low	140 Å²	140	136.8 Å²	136.8	72%	0.718	69%	0.686	S	S	*	*			trans	-110.3	136.4	166	-57.7	177.5	0	0	0	107.5
975	K	33	Very low	33.1	Very low	173 Å²	173	136 Å²	136	75%	0.752	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-80.5	121.4	175.5	-72.7	-176.7	178	179.7	0	109.2
976	L	35.7	Very low	33.1	Very low	142 Å²	142	130.1 Å²	130.1	74%	0.743	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-75.1	123.8	169.1	-73.2	170	0	0	0	109.5
977	V	32.2	Very low	32.9	Very low	135 Å²	135	138.7 Å²	138.7	82%	0.818	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-87.9	120.6	167.4	176.3	0	0	0	0	107.8
978	A	29.5	Very low	32.6	Very low	99 Å²	99	138 Å²	138	82%	0.818	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-92.8	125.5	172.4	0	0	0	0	0	110.1
979	K	30.6	Very low	32.3	Very low	193 Å²	193	139 Å²	139	84%	0.839	74%	0.743	S	S	*	*			trans	-133.6	129.5	156.4	-88.4	-167.1	171.1	-173.4	0	108.8
980	Q	27.9	Very low	31.9	Very low	191 Å²	191	141.5 Å²	141.5	89%	0.893	75%	0.752	S	S	*	*			trans	-76.6	143.6	164.4	-62.1	159.5	-61.9	0	0	108.4
981	C	29.3	Very low	31.5	Very low	82 Å²	82	141.4 Å²	141.4	55%	0.554	75%	0.751	S	S	*	*			trans	-151	142.3	151.5	-104.1	0	0	0	0	108.7	I1068	C981-I1068 VanDerWaalsContact SG-CD1 3.59Å
982	R	24.3	Very low	30.8	Very low	182 Å²	182	144.3 Å²	144.3	69%	0.687	76%	0.762	S	S	*	*			trans	-83.7	155.7	169.4	-61.4	170.2	177.3	154.7	-5.9	108.7
983	Y	31	Very low	30.4	Very low	157 Å²	157	144.1 Å²	144.1	62%	0.616	77%	0.769	S	S	*	*			trans	-138.9	149.9	153	-83.6	-71	0	0	0	108.8	A1064	Y983-A1064 VanDerWaalsContact OH-CB 3.24Å; Y983-A1064 WeakPolarHBondContact OH-CB 3.33Å
984	D	32.5	Very low	30	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	77%	0.774	S	S	*	*			trans	-98.3	169.9	-156.6	-52.6	-76	0	0	0	113.3
985	V	26.3	Very low	29.5	Very low	108 Å²	108	145.2 Å²	145.2	66%	0.655	78%	0.779	S	S	*	*			trans	-73.2	146.4	172.5	-179.7	0	0	0	0	109.5
986	G	31.4	Very low	29.3	Very low	74 Å²	74	143.4 Å²	143.4	76%	0.763	78%	0.778	S	S	*	*			trans	-153.3	116.7	176.4	0	0	0	0	0	111.9
987	E	27.5	Very low	29	Very low	198 Å²	198	144.4 Å²	144.4	93%	0.925	78%	0.779	S	S	*	*			trans	-77.8	163.6	-178.6	-57.9	170.3	123.8	0	0	112.4
988	G	31.3	Very low	28.9	Very low	80 Å²	80	145.4 Å²	145.4	83%	0.825	78%	0.779	S	S	*	*			trans	-171.8	105.3	171.8	0	0	0	0	0	112.4
989	M	29.2	Very low	28.9	Very low	184 Å²	184	145 Å²	145	91%	0.906	78%	0.776	S	S	*	*			trans	-79	156.7	-179.2	-73.1	-179.3	167.3	0	0	113.5
990	D	26.6	Very low	28.7	Very low	159 Å²	159	144.6 Å²	144.6	85%	0.85	78%	0.777	S	S	*	*			trans	-64.9	135.7	162.1	-61.4	-72.6	0	0	0	111.9
991	I	29.8	Very low	29	Very low	153 Å²	153	140.3 Å²	140.3	79%	0.785	77%	0.765	S	S	*	*			trans	-138.7	124.8	142.2	-80.4	105	0	0	0	108.2
992	S	24.6	Very low	29	Very low	111 Å²	111	141.8 Å²	141.8	78%	0.776	77%	0.772	S	S	*	*			trans	-86.5	133.4	168.9	58.8	0	0	0	0	111.1
993	L	30.8	Very low	29.1	Very low	168 Å²	168	142.5 Å²	142.5	88%	0.88	78%	0.78	S	S	*	*			trans	-145.1	157.8	155.4	-106.6	170.8	0	0	0	110.3
994	S	27.5	Very low	28.9	Very low	101 Å²	101	138.7 Å²	138.7	71%	0.706	78%	0.781	S	S	*	*			trans	-107.7	161.7	-161.6	58.4	0	0	0	0	113.4
995	R	29	Very low	28.7	Very low	219 Å²	219	138 Å²	138	83%	0.826	78%	0.782	S	S	*	*				164.8	135.8	105.3	-159	167.1	-159.1	155.2	1.8	112
996	N	27.5	Very low	28.9	Very low	135 Å²	135	137.3 Å²	137.3	72%	0.722	78%	0.782	S	S	*	*			trans	9.2	142	154.6	-41	-4.6	0	0	0	118.3
997	Q	30.2	Very low	28.8	Very low	163 Å²	163	136.8 Å²	136.8	76%	0.762	77%	0.767	S	S	*	*				-166.4	155.6	57.3	-74.1	-178.8	13	0	0	113
998	L	29.3	Very low	28.9	Very low	156 Å²	156	131.9 Å²	131.9	82%	0.817	75%	0.747	S	S	*	*			trans	45.5	140.6	140.9	-59	167.1	0	0	0	121
999	A	30	Very low	29.1	Very low	92 Å²	92	131 Å²	131	76%	0.76	73%	0.725	S	S	*	*			cis	-162.7	164.9	-10.9	0	0	0	0	0	111.2
1000	E	26.7	Very low	29.3	Very low	183 Å²	183	128.2 Å²	128.2	86%	0.855	71%	0.71	S	S	*	*			trans	-98.3	-171.8	172.5	-122.5	-173.4	-141.7	0	0	110
1001	P	33.8	Very low	29.7	Very low	101 Å²	101	125.3 Å²	125.3	66%	0.656	70%	0.695	S	S	*	*			cis	-139.4	-162.6	-16.7	25.9	0.2	0	0	0	115.2
1002	V	28.9	Very low	30.1	Very low	114 Å²	114	124.9 Å²	124.9	69%	0.691	69%	0.694	S	S	*	*			trans	112.3	111.6	144.8	-172.8	0	0	0	0	120.2
1003	K	26.2	Very low	30.4	Very low	196 Å²	196	125.7 Å²	125.7	85%	0.852	69%	0.69	S	S	*	*			trans	25.7	155.6	132.1	-38.1	171.8	-170.7	170.3	0	120.7
1004	A	27.2	Very low	30.6	Very low	78 Å²	78	126.4 Å²	126.4	65%	0.645	69%	0.686	S	S	*	*			cis	-163.3	173.3	23	0	0	0	0	0	114.5
1005	T	29	Very low	31.1	Very low	124 Å²	124	128.6 Å²	128.6	76%	0.761	69%	0.688	S	S	*	*			trans	45.9	111.6	145.6	46.6	0	0	0	0	120.9
1006	S	29.6	Very low	31.5	Very low	95 Å²	95	126 Å²	126	66%	0.664	69%	0.686	S	S	*	*				86.5	135.7	72.8	70	0	0	0	0	114.7
1007	S	29.7	Very low	31.7	Very low	63 Å²	63	124.5 Å²	124.5	44%	0.441	69%	0.686	S	S	.	*			cis	-178.8	154.5	4.8	45.5	0	0	0	0	115.1	Q1034	S1007-Q1034 CarbonylContact C-O 3.53Å; S1007-Q1034 PolarHBondContact O-N 3.49Å
1008	N	30.8	Very low	31.9	Very low	94 Å²	94	122.3 Å²	122.3	50%	0.503	68%	0.683	S	S	.	*			trans	71.5	153.3	155.2	-63.4	-11.3	0	0	0	117.3	K1033 Q1034 D1035	N1008-K1033 CarbonylContact O-C 3.53Å; N1008-K1033 WeakPolarHBondContact O-CA 3.5Å; N1008-Q1034 CarbonylContact O-C 3.59Å; N1008-Q1034 WeakPolarHBondContact O-CA 3.39Å; N1008-Q1034 PolarHBondContact O-N 3.41Å; N1008-D1035 PolarHBondContact O-N 3.33Å
1009	T	34	Very low	32.1	Very low	61 Å²	61	122.6 Å²	122.6	37%	0.374	68%	0.684	S	S	.	*			cis	-166.1	176.1	-22.1	34.6	0	0	0	0	105.2	K1033	T1009-K1033 WeakPolarHBondContact O-CD 3.26Å; T1009-K1033 VanDerWaalsContact O-CE 3.25Å; T1009-K1033 WeakPolarHBondContact O-CE 3.4Å; T1009-K1033 WeakPolarHBondContact O-CG 3.36Å
1010	E	33.3	Very low	32	Very low	126 Å²	126	124.1 Å²	124.1	59%	0.589	68%	0.684	S	S	*	*			cis	-116.6	-95.4	9.5	-60.6	157.4	92.3	0	0	110.3	K1033 Y1036	E1010-K1033 WeakPolarHBondContact OE2-CE 3.1Å; E1010-K1033 IonicContact OE2-NZ 3.85Å; E1010-K1033 PolarHBondContact OE2-NZ 2.77Å; E1010-Y1036 PolarHBondContact O-OH 3.06Å
1011	D	34.8	Very low	32	Very low	99 Å²	99	120.5 Å²	120.5	53%	0.529	68%	0.679	S	S	.	*			cis	-153	175.3	-5.1	-84.3	-78.6	0	0	0	107.3	K1033	D1011-K1033 IonicContact OD1-NZ 2.79Å; D1011-K1033 PolarHBondContact OD1-NZ 2.77Å; D1011-K1033 IonicContact OD2-NZ 2.81Å; D1011-K1033 PolarHBondContact OD2-NZ 3.35Å
1012	D	40	Very low	31.7	Very low	143 Å²	143	121.2 Å²	121.2	77%	0.765	69%	0.687	S	S	*	*			trans	55.3	91.4	168.4	-89.5	-28.2	0	0	0	123.5
1013	N	30.8	Very low	31.5	Very low	128 Å²	128	122.2 Å²	122.2	68%	0.684	70%	0.697	S	S	*	*				57.2	98.8	112.4	-72.5	-49	0	0	0	122.6
1014	F	34.8	Very low	31.4	Very low	183 Å²	183	118.2 Å²	118.2	80%	0.803	69%	0.694	S	S	*	*	S	Bend	trans	-156.7	-34.5	132.5	-168.8	-114.9	0	0	0	113.3	S1017	F1014-S1017 PolarHBondContact O-OG 2.92Å
1015	I	38	Very low	31.5	Very low	147 Å²	147	120 Å²	120	75%	0.754	70%	0.701	S	S	*	*	S	Bend	trans	-94.5	-8.9	-165.8	-68.8	177.8	0	0	0	114.4	S1017	I1015-S1017 PolarHBondContact O-N 3.48Å
1016	Q	36.1	Very low	31.5	Very low	166 Å²	166	118.8 Å²	118.8	78%	0.776	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-77.3	-12.7	-178.6	-88.8	179.1	-33.5	0	0	115.5	V1018	Q1016-V1018 VanDerWaalsContact C-N 3.33Å; Q1016-V1018 PolarHBondContact O-N 3.42Å
1017	S	32	Very low	31.4	Very low	103 Å²	103	120.9 Å²	120.9	72%	0.72	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-78.8	-4.5	-171.9	53.5	0	0	0	0	115.9	F1014 I1015	F1014-S1017 PolarHBondContact O-OG 2.92Å; I1015-S1017 PolarHBondContact O-N 3.48Å
1018	V	35	Very low	31.3	Very low	117 Å²	117	129 Å²	129	71%	0.709	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-111.5	-15.7	-166.3	-178.6	0	0	0	0	114.2	Q1016	Q1016-V1018 VanDerWaalsContact C-N 3.33Å; Q1016-V1018 PolarHBondContact O-N 3.42Å
1019	L	32.7	Very low	31	Very low	161 Å²	161	132.2 Å²	132.2	84%	0.843	74%	0.741	S	S	*	*	S	Bend	trans	-129.8	12.5	-168.1	-72.8	176.4	0	0	0	116.2
1020	V	28.9	Very low	30.7	Very low	125 Å²	125	134 Å²	134	76%	0.758	76%	0.756	S	S	*	*			trans	-128.9	114.2	172.4	-175.7	0	0	0	0	111.1
1021	S	27.5	Very low	30.5	Very low	107 Å²	107	135.1 Å²	135.1	75%	0.748	76%	0.764	S	S	*	*			trans	-152.4	142.5	161.8	-77.4	0	0	0	0	108.3
1022	S	27.2	Very low	30.3	Very low	116 Å²	116	136.4 Å²	136.4	81%	0.811	77%	0.771	S	S	*	*	S	Bend	trans	51.2	80	178.7	53.5	0	0	0	0	116.7
1023	C	24.7	Very low	29.7	Very low	134 Å²	134	134.1 Å²	134.1	91%	0.905	75%	0.754	S	S	*	*				-168	137.5	108.3	-102	0	0	0	0	110.7
1024	S	24.4	Very low	29.6	Very low	113 Å²	113	135.7 Å²	135.7	79%	0.79	76%	0.757	S	S	*	*			trans	-106	167.3	-166.4	-53.2	0	0	0	0	113.5
1025	S	29.1	Very low	29.4	Very low	115 Å²	115	132.9 Å²	132.9	80%	0.804	75%	0.751	S	S	*	*			trans	87.5	138.4	166.3	-44.8	0	0	0	0	117
1026	S	28.2	Very low	28.9	Very low	98 Å²	98	132.9 Å²	132.9	69%	0.685	74%	0.742	S	S	*	*			cis	-162.8	146.9	-18.8	-94	0	0	0	0	109.7
1027	N	27	Very low	28.9	Very low	140 Å²	140	129.6 Å²	129.6	75%	0.749	74%	0.738	S	S	*	*			trans	46.2	112.6	155.8	-56.6	-9.4	0	0	0	119.7
1028	Y	28.3	Very low	29.2	Very low	234 Å²	234	129.4 Å²	129.4	92%	0.918	73%	0.732	S	S	*	*				-172.3	113.2	106.5	-103.2	-71.5	0	0	0	110.2
1029	L	24.5	Very low	29.4	Very low	161 Å²	161	128.1 Å²	128.1	84%	0.843	73%	0.725	S	S	*	*			trans	-102.5	157.8	171.3	-91.7	80	0	0	0	110.5
1030	S	26.9	Very low	29.6	Very low	99 Å²	99	124.4 Å²	124.4	69%	0.692	71%	0.712	S	S	*	*				163.9	161.6	115.1	52.3	0	0	0	0	113
1031	I	29.2	Very low	30.4	Very low	148 Å²	148	120.5 Å²	120.5	76%	0.759	69%	0.69	S	S	*	*			trans	70	123.1	161.9	-65.2	155.4	0	0	0	115.1
1032	N	31.2	Very low	31.1	Very low	126 Å²	126	122.2 Å²	122.2	67%	0.674	69%	0.685	S	S	*	*			cis	-151	166.4	2.3	-112.8	1.9	0	0	0	112.1
1033	K	27.5	Very low	31.9	Very low	96 Å²	96	124.8 Å²	124.8	42%	0.417	68%	0.681	S	S	.	*			trans	-112.3	138	175.1	-66.5	-176.5	169.1	-166.4	0	111.8	N1008 T1009 E1010 D1011	N1008-K1033 CarbonylContact O-C 3.53Å; N1008-K1033 WeakPolarHBondContact O-CA 3.5Å; T1009-K1033 WeakPolarHBondContact O-CD 3.26Å; T1009-K1033 VanDerWaalsContact O-CE 3.25Å; T1009-K1033 WeakPolarHBondContact O-CE 3.4Å; T1009-K1033 WeakPolarHBondContact O-CG 3.36Å; E1010-K1033 WeakPolarHBondContact OE2-CE 3.1Å; E1010-K1033 IonicContact OE2-NZ 3.85Å; E1010-K1033 PolarHBondContact OE2-NZ 2.77Å; D1011-K1033 IonicContact OD1-NZ 2.79Å; D1011-K1033 PolarHBondContact OD1-NZ 2.77Å; D1011-K1033 IonicContact OD2-NZ 2.81Å; D1011-K1033 PolarHBondContact OD2-NZ 3.35Å
1034	Q	28.2	Very low	33.2	Very low	160 Å²	160	124.9 Å²	124.9	75%	0.748	67%	0.668	S	S	*	*			trans	-169.3	108.5	144.6	-109.6	167.7	-3.7	0	0	111.9	S1007 N1008	S1007-Q1034 CarbonylContact C-O 3.53Å; S1007-Q1034 PolarHBondContact O-N 3.49Å; N1008-Q1034 CarbonylContact O-C 3.59Å; N1008-Q1034 WeakPolarHBondContact O-CA 3.39Å; N1008-Q1034 PolarHBondContact O-N 3.41Å
1035	D	30.4	Very low	34.8	Very low	124 Å²	124	125.2 Å²	125.2	66%	0.663	66%	0.655	S	S	*	*			trans	162.5	117.4	135.9	-90.6	-15	0	0	0	112.7	N1008	N1008-D1035 PolarHBondContact O-N 3.33Å
1036	Y	28.7	Very low	36.1	Very low	147 Å²	147	128.6 Å²	128.6	58%	0.576	65%	0.651	S	S	*	*			trans	-142.9	98.6	174.2	-109.8	-82.4	0	0	0	110.8	E1010 V1039	E1010-Y1036 PolarHBondContact O-OH 3.06Å; Y1036-V1039 HydrophobicContact CD1-CG2 4.11Å; Y1036-V1039 HydrophobicContact CE1-CG2 3.97Å
1037	S	35.2	Very low	38.1	Very low	98 Å²	98	127.6 Å²	127.6	69%	0.685	64%	0.644	S	S	*	*	S	Bend	trans	-149.5	-25.6	176	63.9	0	0	0	0	114.9
1038	T	38.3	Very low	40.3	Very low	98 Å²	98	126.5 Å²	126.5	60%	0.601	64%	0.636	S	S	*	*	S	Bend	trans	-94.3	-4	-168	-3.7	0	0	0	0	115.3
1039	V	39.4	Very low	42.3	Very low	90 Å²	90	119.2 Å²	119.2	55%	0.545	62%	0.615	S	S	.	*	H	α-helix	trans	-75.8	-26.7	-167.4	-178	0	0	0	0	113.4	Y1036 K1043	Y1036-V1039 HydrophobicContact CD1-CG2 4.11Å; Y1036-V1039 HydrophobicContact CE1-CG2 3.97Å; V1039-K1043 PolarHBondContact O-N 3.22Å
1040	S	36.7	Very low	44.5	Very low	83 Å²	83	115.2 Å²	115.2	58%	0.58	60%	0.595	S	S	*	*	H	α-helix	trans	-59.7	-55.5	178.1	48.2	0	0	0	0	112.4	F1042 K1043 E1044	S1040-F1042 VanDerWaalsContact C-N 3.25Å; S1040-F1042 PolarHBondContact O-N 3.13Å; S1040-K1043 WeakPolarHBondContact O-CB 3.42Å; S1040-K1043 PolarHBondContact O-N 2.69Å; S1040-E1044 PolarHBondContact O-N 3.11Å
1041	S	46	Very low	47	Very low	43 Å²	43	114 Å²	114	30%	0.301	58%	0.578	S	S	.	*	H	α-helix	trans	-61	-31.1	-177.7	-173.1	0	0	0	0	113.1	K1045	S1041-K1045 WeakPolarHBondContact O-CB 3.42Å; S1041-K1045 VanDerWaalsContact O-CG 3.3Å; S1041-K1045 WeakPolarHBondContact O-CG 3.33Å; S1041-K1045 PolarHBondContact O-N 3.1Å; S1041-K1045 PolarHBondContact OG-NZ 3.22Å
1042	F	41.9	Very low	49.3	Very low	143 Å²	143	111.1 Å²	111.1	63%	0.627	56%	0.564	S	S	*	*	H	α-helix	trans	-72.9	-29.2	175.1	-89.5	-78	0	0	0	113.3	S1040 R1046	S1040-F1042 VanDerWaalsContact C-N 3.25Å; S1040-F1042 PolarHBondContact O-N 3.13Å; F1042-R1046 VanDerWaalsContact O-CB 3.26Å; F1042-R1046 WeakPolarHBondContact O-CB 3.48Å; F1042-R1046 PolarHBondContact O-N 2.78Å
1043	K	44.8	Very low	51.3	Low	170 Å²	170	109.1 Å²	109.1	74%	0.739	56%	0.557	S	S	*	*	H	α-helix	trans	-71.2	-41.5	174.9	-154.5	173.1	-174.2	177.8	0	110.8	V1039 S1040 S1047	V1039-K1043 PolarHBondContact O-N 3.22Å; S1040-K1043 WeakPolarHBondContact O-CB 3.42Å; S1040-K1043 PolarHBondContact O-N 2.69Å; K1043-S1047 WeakPolarHBondContact O-CB 3.34Å; K1043-S1047 PolarHBondContact O-N 2.72Å
1044	E	51.2	Low	53.8	Low	137 Å²	137	111.5 Å²	111.5	64%	0.64	56%	0.563	S	S	*	*	H	α-helix	trans	-63.4	-53.5	172.2	-67	178.5	136.7	0	0	112	S1040 R1046 S1047 M1048	S1040-E1044 PolarHBondContact O-N 3.11Å; E1044-R1046 PolarHBondContact O-N 2.67Å; E1044-S1047 CarbonylContact O-C 3.56Å; E1044-S1047 WeakPolarHBondContact O-CA 3.45Å; E1044-S1047 WeakPolarHBondContact O-CB 3.36Å; E1044-S1047 PolarHBondContact O-N 2.92Å; E1044-M1048 PolarHBondContact O-N 3.29Å
1045	K	59.1	Low	56.4	Low	119 Å²	119	107.9 Å²	107.9	52%	0.517	55%	0.549	S	S	.	.	H	α-helix	trans	-58.1	-36	179.4	-76.6	170.2	177.9	164	0	112.7	S1041 M1048 V1049	S1041-K1045 WeakPolarHBondContact O-CB 3.42Å; S1041-K1045 VanDerWaalsContact O-CG 3.3Å; S1041-K1045 WeakPolarHBondContact O-CG 3.33Å; S1041-K1045 PolarHBondContact O-N 3.1Å; S1041-K1045 PolarHBondContact OG-NZ 3.22Å; K1045-M1048 PolarHBondContact O-N 3.44Å; K1045-V1049 WeakPolarHBondContact O-CG2 3.48Å; K1045-V1049 PolarHBondContact O-N 3.27Å
1046	R	55.6	Low	58.6	Low	186 Å²	186	106 Å²	106	70%	0.702	54%	0.536	S	S	*	.	H	α-helix	trans	-72.2	-40.2	175	-165.2	168.6	-171.7	159.4	1.8	112.2	F1042 E1044 M1048 V1049 D1050	F1042-R1046 VanDerWaalsContact O-CB 3.26Å; F1042-R1046 WeakPolarHBondContact O-CB 3.48Å; F1042-R1046 PolarHBondContact O-N 2.78Å; E1044-R1046 PolarHBondContact O-N 2.67Å; R1046-M1048 PolarHBondContact O-N 3.46Å; R1046-V1049 PolarHBondContact O-N 2.79Å; R1046-D1050 VanDerWaalsContact O-CB 3.31Å; R1046-D1050 WeakPolarHBondContact O-CB 3.25Å; R1046-D1050 VanDerWaalsContact O-CG 3.29Å; R1046-D1050 PolarHBondContact O-N 2.91Å
1047	S	70.4	Confident	60.9	Low	77 Å²	77	101.9 Å²	101.9	54%	0.538	53%	0.532	S	S	.	.	H	α-helix	trans	-61.5	-33.3	171.2	-169.7	0	0	0	0	112.5	K1043 E1044 Q1051	K1043-S1047 WeakPolarHBondContact O-CB 3.34Å; K1043-S1047 PolarHBondContact O-N 2.72Å; E1044-S1047 CarbonylContact O-C 3.56Å; E1044-S1047 WeakPolarHBondContact O-CA 3.45Å; E1044-S1047 WeakPolarHBondContact O-CB 3.36Å; E1044-S1047 PolarHBondContact O-N 2.92Å; S1047-Q1051 VanDerWaalsContact O-CB 3.31Å; S1047-Q1051 WeakPolarHBondContact O-CB 3.49Å; S1047-Q1051 PolarHBondContact O-N 3.09Å; S1047-Q1051 VanDerWaalsContact O-N 3.08Å
1048	M	72.1	Confident	63.1	Low	118 Å²	118	99.1 Å²	99.1	58%	0.581	51%	0.513	S	S	*	.	H	α-helix	trans	-69.2	-49.8	176.7	-153	176	88.5	0	0	110.5	E1044 K1045 R1046 D1050 Q1051 D1052	E1044-M1048 PolarHBondContact O-N 3.29Å; K1045-M1048 PolarHBondContact O-N 3.44Å; R1046-M1048 PolarHBondContact O-N 3.46Å; M1048-D1050 PolarHBondContact O-N 3.29Å; M1048-Q1051 CarbonylContact O-C 3.57Å; M1048-Q1051 WeakPolarHBondContact O-CA 3.36Å; M1048-Q1051 WeakPolarHBondContact O-CB 3.48Å; M1048-Q1051 PolarHBondContact O-N 3.48Å; M1048-D1052 VanDerWaalsContact O-CG 3.28Å; M1048-D1052 PolarHBondContact O-N 2.97Å
1049	V	70.5	Confident	65.4	Low	81 Å²	81	100.2 Å²	100.2	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-62.7	-38.9	175.1	172.7	0	0	0	0	112.6	K1045 R1046 Q1051 T1053	K1045-V1049 WeakPolarHBondContact O-CG2 3.48Å; K1045-V1049 PolarHBondContact O-N 3.27Å; R1046-V1049 PolarHBondContact O-N 2.79Å; V1049-Q1051 PolarHBondContact O-N 2.88Å; V1049-T1053 HydrophobicContact CG1-CG2 4.41Å; V1049-T1053 WeakPolarHBondContact O-CB 3.25Å; V1049-T1053 VanDerWaalsContact O-CG2 3.32Å; V1049-T1053 WeakPolarHBondContact O-CG2 3.33Å; V1049-T1053 PolarHBondContact O-N 2.95Å; V1049-T1053 PolarHBondContact O-OG1 3.41Å
1050	D	72	Confident	67.2	Low	77 Å²	77	99.4 Å²	99.4	41%	0.412	50%	0.501	S	S	.	.	H	α-helix	trans	-69.9	-14.2	174.7	-72.3	-18	0	0	0	112.6	R1046 M1048 R1054	R1046-D1050 VanDerWaalsContact O-CB 3.31Å; R1046-D1050 WeakPolarHBondContact O-CB 3.25Å; R1046-D1050 VanDerWaalsContact O-CG 3.29Å; R1046-D1050 PolarHBondContact O-N 2.91Å; M1048-D1050 PolarHBondContact O-N 3.29Å; D1050-R1054 WeakPolarHBondContact O-CB 3.27Å; D1050-R1054 VanDerWaalsContact O-CZ 3.23Å; D1050-R1054 PolarHBondContact O-NH1 2.88Å; D1050-R1054 PolarHBondContact O-NH2 3.37Å
1051	Q	78.7	Confident	69.1	Low	73 Å²	73	98.3 Å²	98.3	34%	0.341	50%	0.497	S	S	.	.	H	α-helix	trans	-94.2	-46.6	172	-174.8	58.5	26.2	0	0	111.6	S1047 M1048 V1049 T1053 R1054 D1055	S1047-Q1051 VanDerWaalsContact O-CB 3.31Å; S1047-Q1051 WeakPolarHBondContact O-CB 3.49Å; S1047-Q1051 PolarHBondContact O-N 3.09Å; S1047-Q1051 VanDerWaalsContact O-N 3.08Å; M1048-Q1051 CarbonylContact O-C 3.57Å; M1048-Q1051 WeakPolarHBondContact O-CA 3.36Å; M1048-Q1051 WeakPolarHBondContact O-CB 3.48Å; M1048-Q1051 PolarHBondContact O-N 3.48Å; V1049-Q1051 PolarHBondContact O-N 2.88Å; Q1051-T1053 VanDerWaalsContact C-N 3.29Å; Q1051-T1053 PolarHBondContact O-N 2.96Å; Q1051-R1054 CarbonylContact O-C 3.56Å; Q1051-R1054 WeakPolarHBondContact O-CA 3.41Å; Q1051-R1054 WeakPolarHBondContact O-CB 3.37Å; Q1051-R1054 PolarHBondContact O-N 2.85Å; Q1051-D1055 VanDerWaalsContact NE2-CG 3.27Å; Q1051-D1055 PolarHBondContact NE2-OD1 3.13Å; Q1051-D1055 PolarHBondContact NE2-OD2 3.35Å; Q1051-D1055 PolarHBondContact O-N 3.27Å
1052	D	77.9	Confident	70.9	Confident	87 Å²	87	103 Å²	103	47%	0.465	51%	0.512	S	S	.	.	H	α-helix	trans	-54.8	-44.7	174.8	-65.8	-30.4	0	0	0	111.1	M1048 R1054 D1055 E1056	M1048-D1052 VanDerWaalsContact O-CG 3.28Å; M1048-D1052 PolarHBondContact O-N 2.97Å; D1052-R1054 VanDerWaalsContact C-N 3.3Å; D1052-R1054 PolarHBondContact O-N 2.95Å; D1052-D1055 PolarHBondContact O-N 3.34Å; D1052-E1056 WeakPolarHBondContact O-CB 3.27Å; D1052-E1056 PolarHBondContact O-N 3.2Å
1053	T	73.9	Confident	72.7	Confident	85 Å²	85	100.6 Å²	100.6	52%	0.521	50%	0.503	S	S	.	.	H	α-helix	trans	-68.6	-27.6	176.4	53.3	0	0	0	0	113.2	V1049 Q1051 A1057	V1049-T1053 HydrophobicContact CG1-CG2 4.41Å; V1049-T1053 WeakPolarHBondContact O-CB 3.25Å; V1049-T1053 VanDerWaalsContact O-CG2 3.32Å; V1049-T1053 WeakPolarHBondContact O-CG2 3.33Å; V1049-T1053 PolarHBondContact O-N 2.95Å; V1049-T1053 PolarHBondContact O-OG1 3.41Å; Q1051-T1053 VanDerWaalsContact C-N 3.29Å; Q1051-T1053 PolarHBondContact O-N 2.96Å; T1053-A1057 VanDerWaalsContact O-CB 3.25Å; T1053-A1057 WeakPolarHBondContact O-CB 3.17Å; T1053-A1057 PolarHBondContact O-N 3.15Å; T1053-A1057 VanDerWaalsContact O-N 3.11Å
1054	R	78.9	Confident	74.1	Confident	146 Å²	146	93.5 Å²	93.5	55%	0.551	48%	0.476	S	S	*	.	H	α-helix	trans	-77.4	-37.8	175.4	-174.1	-178.6	-64	118.7	7.1	111.5	D1050 Q1051 D1052 S1058	D1050-R1054 WeakPolarHBondContact O-CB 3.27Å; D1050-R1054 VanDerWaalsContact O-CZ 3.23Å; D1050-R1054 PolarHBondContact O-NH1 2.88Å; D1050-R1054 PolarHBondContact O-NH2 3.37Å; Q1051-R1054 CarbonylContact O-C 3.56Å; Q1051-R1054 WeakPolarHBondContact O-CA 3.41Å; Q1051-R1054 WeakPolarHBondContact O-CB 3.37Å; Q1051-R1054 PolarHBondContact O-N 2.85Å; D1052-R1054 VanDerWaalsContact C-N 3.3Å; D1052-R1054 PolarHBondContact O-N 2.95Å; R1054-S1058 WeakPolarHBondContact O-CB 3.46Å; R1054-S1058 PolarHBondContact O-N 3.06Å
1055	D	82.6	Confident	75.4	Confident	83 Å²	83	91.7 Å²	91.7	44%	0.444	47%	0.47	S	S	.	.	H	α-helix	trans	-77.1	-34.9	177.3	-76	-32.3	0	0	0	112.4	Q1051 D1052 S1058 R1059	Q1051-D1055 VanDerWaalsContact NE2-CG 3.27Å; Q1051-D1055 PolarHBondContact NE2-OD1 3.13Å; Q1051-D1055 PolarHBondContact NE2-OD2 3.35Å; Q1051-D1055 PolarHBondContact O-N 3.27Å; D1052-D1055 PolarHBondContact O-N 3.34Å; D1055-S1058 CarbonylContact O-C 3.57Å; D1055-S1058 WeakPolarHBondContact O-CA 3.25Å; D1055-S1058 VanDerWaalsContact O-CB 3.3Å; D1055-S1058 WeakPolarHBondContact O-CB 3.42Å; D1055-S1058 PolarHBondContact O-N 3.35Å; D1055-R1059 WeakPolarHBondContact O-CB 3.49Å; D1055-R1059 PolarHBondContact O-N 2.83Å
1056	E	76.8	Confident	76.4	Confident	86 Å²	86	92.7 Å²	92.7	40%	0.402	47%	0.474	S	S	.	.	H	α-helix	trans	-66.8	-40.9	169.1	-179.6	56.9	-164	0	0	111.3	D1052 S1058 R1059 V1060	D1052-E1056 WeakPolarHBondContact O-CB 3.27Å; D1052-E1056 PolarHBondContact O-N 3.2Å; E1056-S1058 VanDerWaalsContact C-N 3.26Å; E1056-S1058 PolarHBondContact O-N 3.19Å; E1056-R1059 WeakPolarHBondContact O-CB 3.4Å; E1056-R1059 PolarHBondContact O-N 3.3Å; E1056-R1059 VanDerWaalsContact O-N 3.14Å; E1056-R1059 IonicContact OE1-CZ 3.07Å; E1056-R1059 IonicContact OE1-NE 2.59Å; E1056-R1059 PolarHBondContact OE1-NE 3.03Å; E1056-R1059 IonicContact OE1-NH2 3.24Å; E1056-R1059 PolarHBondContact OE1-NH2 2.91Å; E1056-R1059 WeakPolarHBondContact OE2-CD 3.2Å; E1056-R1059 IonicContact OE2-CZ 2.88Å; E1056-R1059 IonicContact OE2-NE 2.66Å; E1056-R1059 PolarHBondContact OE2-NE 3.38Å; E1056-R1059 IonicContact OE2-NH2 3.67Å; E1056-V1060 HydrophobicContact CG-CG2 4.49Å; E1056-V1060 WeakPolarHBondContact O-CG2 3.41Å; E1056-V1060 PolarHBondContact O-N 2.67Å; E1056-V1060 WeakPolarHBondContact OE1-CG2 3.39Å
1057	A	77.1	Confident	77.3	Confident	60 Å²	60	86.9 Å²	86.9	50%	0.496	46%	0.458	S	S	.	.	H	α-helix	trans	-60.5	-36.2	170.6	0	0	0	0	0	112.1	T1053 A1061	T1053-A1057 VanDerWaalsContact O-CB 3.25Å; T1053-A1057 WeakPolarHBondContact O-CB 3.17Å; T1053-A1057 PolarHBondContact O-N 3.15Å; T1053-A1057 VanDerWaalsContact O-N 3.11Å; A1057-A1061 WeakPolarHBondContact O-CB 3.14Å; A1057-A1061 PolarHBondContact O-N 2.76Å
1058	S	80.6	Confident	77.4	Confident	40 Å²	40	86 Å²	86	28%	0.28	45%	0.446	S	S	.	.	H	α-helix	trans	-67.2	-39.8	172.9	-170.3	0	0	0	0	112.1	R1054 D1055 E1056 K1062	R1054-S1058 WeakPolarHBondContact O-CB 3.46Å; R1054-S1058 PolarHBondContact O-N 3.06Å; D1055-S1058 CarbonylContact O-C 3.57Å; D1055-S1058 WeakPolarHBondContact O-CA 3.25Å; D1055-S1058 VanDerWaalsContact O-CB 3.3Å; D1055-S1058 WeakPolarHBondContact O-CB 3.42Å; D1055-S1058 PolarHBondContact O-N 3.35Å; E1056-S1058 VanDerWaalsContact C-N 3.26Å; E1056-S1058 PolarHBondContact O-N 3.19Å; S1058-K1062 WeakPolarHBondContact O-CB 3.48Å; S1058-K1062 WeakPolarHBondContact O-CD 3.49Å; S1058-K1062 WeakPolarHBondContact O-CG 3.25Å; S1058-K1062 PolarHBondContact O-N 3Å; S1058-K1062 WeakPolarHBondContact OG-CE 3.37Å; S1058-K1062 PolarHBondContact OG-NZ 3.15Å
1059	R	86.6	Confident	77.5	Confident	120 Å²	120	85.8 Å²	85.8	45%	0.453	44%	0.444	S	S	.	.	H	α-helix	trans	-64	-52.7	176	-164.5	-170.6	71.4	70.9	8.5	110.7	D1055 E1056 A1061 K1062 E1063	D1055-R1059 WeakPolarHBondContact O-CB 3.49Å; D1055-R1059 PolarHBondContact O-N 2.83Å; E1056-R1059 WeakPolarHBondContact O-CB 3.4Å; E1056-R1059 PolarHBondContact O-N 3.3Å; E1056-R1059 VanDerWaalsContact O-N 3.14Å; E1056-R1059 IonicContact OE1-CZ 3.07Å; E1056-R1059 IonicContact OE1-NE 2.59Å; E1056-R1059 PolarHBondContact OE1-NE 3.03Å; E1056-R1059 IonicContact OE1-NH2 3.24Å; E1056-R1059 PolarHBondContact OE1-NH2 2.91Å; E1056-R1059 WeakPolarHBondContact OE2-CD 3.2Å; E1056-R1059 IonicContact OE2-CZ 2.88Å; E1056-R1059 IonicContact OE2-NE 2.66Å; E1056-R1059 PolarHBondContact OE2-NE 3.38Å; E1056-R1059 IonicContact OE2-NH2 3.67Å; R1059-A1061 VanDerWaalsContact C-N 3.34Å; R1059-A1061 PolarHBondContact O-N 3.02Å; R1059-K1062 PolarHBondContact O-N 3.32Å; R1059-E1063 IonicContact CZ-OE2 2.94Å; R1059-E1063 IonicContact NH1-OE2 3.83Å; R1059-E1063 PolarHBondContact NH1-OE2 2.83Å; R1059-E1063 IonicContact NH2-OE2 3.89Å; R1059-E1063 WeakPolarHBondContact O-CB 3.29Å; R1059-E1063 PolarHBondContact O-N 2.87Å
1060	V	78.1	Confident	77.7	Confident	73 Å²	73	88.3 Å²	88.3	44%	0.442	45%	0.448	S	S	.	.	H	α-helix	trans	-61.1	-40.4	177	173.9	0	0	0	0	111.2	E1056 E1063 A1064	E1056-V1060 HydrophobicContact CG-CG2 4.49Å; E1056-V1060 WeakPolarHBondContact O-CG2 3.41Å; E1056-V1060 PolarHBondContact O-N 2.67Å; E1056-V1060 WeakPolarHBondContact OE1-CG2 3.39Å; V1060-E1063 PolarHBondContact O-N 2.8Å; V1060-A1064 WeakPolarHBondContact O-CB 3.41Å; V1060-A1064 PolarHBondContact O-N 2.93Å
1061	A	77.4	Confident	77.3	Confident	60 Å²	60	89.9 Å²	89.9	50%	0.496	45%	0.451	S	S	.	.	H	α-helix	trans	-64.8	-42	175.4	0	0	0	0	0	112.7	A1057 R1059 L1065	A1057-A1061 WeakPolarHBondContact O-CB 3.14Å; A1057-A1061 PolarHBondContact O-N 2.76Å; R1059-A1061 VanDerWaalsContact C-N 3.34Å; R1059-A1061 PolarHBondContact O-N 3.02Å; A1061-L1065 VanDerWaalsContact O-CB 3.29Å; A1061-L1065 WeakPolarHBondContact O-CB 3.22Å; A1061-L1065 PolarHBondContact O-N 3.44Å
1062	K	82.6	Confident	76.8	Confident	142 Å²	142	92.3 Å²	92.3	62%	0.617	46%	0.462	S	S	*	.	H	α-helix	trans	-64.5	-42.5	174.4	-73.7	163.7	-174.6	166.1	0	111.5	S1058 R1059 L1065 K1066	S1058-K1062 WeakPolarHBondContact O-CB 3.48Å; S1058-K1062 WeakPolarHBondContact O-CD 3.49Å; S1058-K1062 WeakPolarHBondContact O-CG 3.25Å; S1058-K1062 PolarHBondContact O-N 3Å; S1058-K1062 WeakPolarHBondContact OG-CE 3.37Å; S1058-K1062 PolarHBondContact OG-NZ 3.15Å; R1059-K1062 PolarHBondContact O-N 3.32Å; K1062-L1065 PolarHBondContact O-N 3.45Å; K1062-K1066 VanDerWaalsContact O-CB 3.31Å; K1062-K1066 WeakPolarHBondContact O-CB 3.22Å; K1062-K1066 PolarHBondContact O-N 3.38Å
1063	E	79.5	Confident	76.2	Confident	92 Å²	92	95.4 Å²	95.4	43%	0.43	47%	0.472	S	S	.	.	H	α-helix	trans	-67.4	-44.5	179.3	-177.2	152.9	-138.4	0	0	111.9	R1059 V1060 L1065 K1066 N1067	R1059-E1063 IonicContact CZ-OE2 2.94Å; R1059-E1063 IonicContact NH1-OE2 3.83Å; R1059-E1063 PolarHBondContact NH1-OE2 2.83Å; R1059-E1063 IonicContact NH2-OE2 3.89Å; R1059-E1063 WeakPolarHBondContact O-CB 3.29Å; R1059-E1063 PolarHBondContact O-N 2.87Å; V1060-E1063 PolarHBondContact O-N 2.8Å; E1063-L1065 VanDerWaalsContact C-N 3.33Å; E1063-L1065 PolarHBondContact O-N 3.28Å; E1063-K1066 PolarHBondContact O-N 2.85Å; E1063-N1067 WeakPolarHBondContact O-CB 3.4Å; E1063-N1067 PolarHBondContact O-N 3.32Å
1064	A	74.2	Confident	75.4	Confident	21 Å²	21	94.4 Å²	94.4	17%	0.174	47%	0.469	C	S	.	.	H	α-helix	trans	-56.9	-45.3	170.2	0	0	0	0	0	111.7	Y983 V1060 K1066 N1067 I1068	Y983-A1064 VanDerWaalsContact OH-CB 3.24Å; Y983-A1064 WeakPolarHBondContact OH-CB 3.33Å; V1060-A1064 WeakPolarHBondContact O-CB 3.41Å; V1060-A1064 PolarHBondContact O-N 2.93Å; A1064-K1066 PolarHBondContact O-N 2.74Å; A1064-N1067 PolarHBondContact O-N 2.78Å; A1064-I1068 WeakPolarHBondContact O-CB 3.44Å; A1064-I1068 VanDerWaalsContact O-CG1 3.23Å; A1064-I1068 WeakPolarHBondContact O-CG1 3.32Å; A1064-I1068 PolarHBondContact O-N 2.89Å
1065	L	79	Confident	73.8	Confident	99 Å²	99	91.4 Å²	91.4	52%	0.518	46%	0.463	S	S	.	.	H	α-helix	trans	-67.3	-36.2	178.6	-162.2	132.1	0	0	0	112.4	A1061 K1062 E1063 I1068 Q1069	A1061-L1065 VanDerWaalsContact O-CB 3.29Å; A1061-L1065 WeakPolarHBondContact O-CB 3.22Å; A1061-L1065 PolarHBondContact O-N 3.44Å; K1062-L1065 PolarHBondContact O-N 3.45Å; E1063-L1065 VanDerWaalsContact C-N 3.33Å; E1063-L1065 PolarHBondContact O-N 3.28Å; L1065-I1068 PolarHBondContact O-N 3.42Å; L1065-Q1069 WeakPolarHBondContact O-CB 3.36Å; L1065-Q1069 VanDerWaalsContact O-CG 3.3Å; L1065-Q1069 WeakPolarHBondContact O-CG 3.43Å; L1065-Q1069 PolarHBondContact O-N 2.79Å
1066	K	80.2	Confident	72	Confident	140 Å²	140	92.2 Å²	92.2	61%	0.609	47%	0.465	S	S	*	.	H	α-helix	trans	-67.3	-37.4	173.9	-159.8	174.7	-171.7	-179.8	0	111.6	K1062 E1063 A1064 Q1069 K1070	K1062-K1066 VanDerWaalsContact O-CB 3.31Å; K1062-K1066 WeakPolarHBondContact O-CB 3.22Å; K1062-K1066 PolarHBondContact O-N 3.38Å; E1063-K1066 PolarHBondContact O-N 2.85Å; A1064-K1066 PolarHBondContact O-N 2.74Å; K1066-Q1069 PolarHBondContact O-N 3.19Å; K1066-K1070 PolarHBondContact O-N 2.73Å
1067	N	74.3	Confident	70.7	Confident	65 Å²	65	92.4 Å²	92.4	35%	0.348	47%	0.467	S	S	.	.	H	α-helix	trans	-73.4	-37.1	174.7	-73.4	-16.3	0	0	0	112.2	E1063 A1064 Q1069 K1070 F1071	E1063-N1067 WeakPolarHBondContact O-CB 3.4Å; E1063-N1067 PolarHBondContact O-N 3.32Å; A1064-N1067 PolarHBondContact O-N 2.78Å; N1067-Q1069 VanDerWaalsContact C-N 3.33Å; N1067-Q1069 PolarHBondContact O-N 2.97Å; N1067-K1070 WeakPolarHBondContact O-CB 3.4Å; N1067-K1070 PolarHBondContact O-N 3.27Å; N1067-F1071 WeakPolarHBondContact O-CB 3.39Å; N1067-F1071 PolarHBondContact O-N 3.12Å
1068	I	72.9	Confident	69.1	Low	59 Å²	59	96.6 Å²	96.6	30%	0.303	47%	0.474	S	S	.	.	H	α-helix	trans	-62.2	-40.4	169.7	-69.6	163.8	0	0	0	110.9	C981 A1064 L1065 F1071 H1072	C981-I1068 VanDerWaalsContact SG-CD1 3.59Å; A1064-I1068 WeakPolarHBondContact O-CB 3.44Å; A1064-I1068 VanDerWaalsContact O-CG1 3.23Å; A1064-I1068 WeakPolarHBondContact O-CG1 3.32Å; A1064-I1068 PolarHBondContact O-N 2.89Å; L1065-I1068 PolarHBondContact O-N 3.42Å; I1068-F1071 PolarHBondContact O-N 3.17Å; I1068-H1072 WeakPolarHBondContact O-CB 3.44Å; I1068-H1072 PolarHBondContact O-N 2.59Å
1069	Q	74.3	Confident	66.9	Low	112 Å²	112	98.3 Å²	98.3	52%	0.523	49%	0.485	S	S	.	.	H	α-helix	trans	-66.8	-39.5	174.3	-76.5	176.7	-5.1	0	0	112.7	L1065 K1066 N1067 H1072 K1073	L1065-Q1069 WeakPolarHBondContact O-CB 3.36Å; L1065-Q1069 VanDerWaalsContact O-CG 3.3Å; L1065-Q1069 WeakPolarHBondContact O-CG 3.43Å; L1065-Q1069 PolarHBondContact O-N 2.79Å; K1066-Q1069 PolarHBondContact O-N 3.19Å; N1067-Q1069 VanDerWaalsContact C-N 3.33Å; N1067-Q1069 PolarHBondContact O-N 2.97Å; Q1069-H1072 PolarHBondContact O-N 3.26Å; Q1069-K1073 WeakPolarHBondContact O-CG 3.21Å; Q1069-K1073 PolarHBondContact O-N 2.96Å
1070	K	74.8	Confident	64.7	Low	134 Å²	134	97.7 Å²	97.7	58%	0.583	49%	0.486	S	S	*	.	H	α-helix	trans	-58	-51.5	168.9	-79.5	-179	174.3	179.8	0	110.6	K1066 N1067 H1072 K1073 S1074	K1066-K1070 PolarHBondContact O-N 2.73Å; N1067-K1070 WeakPolarHBondContact O-CB 3.4Å; N1067-K1070 PolarHBondContact O-N 3.27Å; K1070-H1072 VanDerWaalsContact C-N 3.32Å; K1070-H1072 PolarHBondContact O-N 2.93Å; K1070-K1073 PolarHBondContact O-N 2.66Å; K1070-K1073 VanDerWaalsContact O-N 3.09Å; K1070-S1074 PolarHBondContact O-N 2.96Å; K1070-S1074 PolarHBondContact O-OG 2.73Å
1071	F	63.4	Low	62.9	Low	110 Å²	110	99.3 Å²	99.3	48%	0.482	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-37.8	-178.6	-131.5	-70.9	0	0	0	112.4	N1067 I1068 N1075	N1067-F1071 WeakPolarHBondContact O-CB 3.39Å; N1067-F1071 PolarHBondContact O-N 3.12Å; I1068-F1071 PolarHBondContact O-N 3.17Å; F1071-N1075 VanDerWaalsContact O-CB 3.29Å; F1071-N1075 WeakPolarHBondContact O-CB 3.31Å; F1071-N1075 PolarHBondContact O-N 3.42Å
1072	H	67.4	Low	61	Low	124 Å²	124	99.1 Å²	99.1	57%	0.574	48%	0.484	S	S	*	.	H	α-helix	trans	-64.7	-42.9	172.3	-105.4	-82.6	0	0	0	112.4	I1068 Q1069 K1070 E1076	I1068-H1072 WeakPolarHBondContact O-CB 3.44Å; I1068-H1072 PolarHBondContact O-N 2.59Å; Q1069-H1072 PolarHBondContact O-N 3.26Å; K1070-H1072 VanDerWaalsContact C-N 3.32Å; K1070-H1072 PolarHBondContact O-N 2.93Å; H1072-E1076 WeakPolarHBondContact O-CB 3.41Å; H1072-E1076 PolarHBondContact O-N 2.62Å
1073	K	65.7	Low	58.8	Low	152 Å²	152	99 Å²	99	66%	0.661	48%	0.483	S	S	*	.	H	α-helix	trans	-64.8	-45	174.9	-75	-174.3	175.1	-171.2	0	112	Q1069 K1070 E1076 I1077	Q1069-K1073 WeakPolarHBondContact O-CG 3.21Å; Q1069-K1073 PolarHBondContact O-N 2.96Å; K1070-K1073 PolarHBondContact O-N 2.66Å; K1070-K1073 VanDerWaalsContact O-N 3.09Å; K1073-E1076 PolarHBondContact O-N 3.31Å; K1073-I1077 WeakPolarHBondContact O-CB 3.35Å; K1073-I1077 WeakPolarHBondContact O-CD1 3.46Å; K1073-I1077 VanDerWaalsContact O-CG1 3.24Å; K1073-I1077 WeakPolarHBondContact O-CG1 3.38Å; K1073-I1077 PolarHBondContact O-N 3.2Å
1074	S	56.7	Low	56.9	Low	65 Å²	65	100.8 Å²	100.8	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-64.9	-39	177.7	-62	0	0	0	0	112.8	K1070 I1077 K1078	K1070-S1074 PolarHBondContact O-N 2.96Å; K1070-S1074 PolarHBondContact O-OG 2.73Å; S1074-I1077 PolarHBondContact O-N 2.87Å; S1074-K1078 PolarHBondContact O-N 3.29Å
1075	N	45.5	Very low	55	Low	82 Å²	82	107.4 Å²	107.4	44%	0.439	52%	0.519	S	S	.	.	H	α-helix	trans	-71.4	-36.4	172.8	-78.1	-2.9	0	0	0	112	F1071 I1077 C1079	F1071-N1075 VanDerWaalsContact O-CB 3.29Å; F1071-N1075 WeakPolarHBondContact O-CB 3.31Å; F1071-N1075 PolarHBondContact O-N 3.42Å; N1075-I1077 VanDerWaalsContact C-N 3.32Å; N1075-I1077 PolarHBondContact O-N 3.18Å; N1075-C1079 WeakPolarHBondContact O-CB 3.15Å; N1075-C1079 PolarHBondContact O-N 3.34Å; N1075-C1079 PolarHBondContact O-SG 3.49Å
1076	E	44.5	Very low	52.9	Low	101 Å²	101	108.8 Å²	108.8	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-65.7	-33.8	172.7	-88.9	-165.4	-143.9	0	0	112.8	H1072 K1073 K1080	H1072-E1076 WeakPolarHBondContact O-CB 3.41Å; H1072-E1076 PolarHBondContact O-N 2.62Å; K1073-E1076 PolarHBondContact O-N 3.31Å; E1076-K1080 WeakPolarHBondContact O-CB 3.46Å; E1076-K1080 WeakPolarHBondContact O-CD 3.24Å; E1076-K1080 WeakPolarHBondContact O-CG 3.47Å; E1076-K1080 PolarHBondContact O-N 2.95Å; E1076-K1080 VanDerWaalsContact O-N 3.08Å; E1076-K1080 IonicContact OE2-NZ 3.36Å; E1076-K1080 PolarHBondContact OE2-NZ 3.26Å
1077	I	50.1	Low	50.8	Low	89 Å²	89	108.7 Å²	108.7	46%	0.456	53%	0.527	S	S	.	.	H	α-helix	trans	-68.3	-54.5	175	-71.5	163.4	0	0	0	109.3	K1073 S1074 N1075 C1079 K1080 E1081	K1073-I1077 WeakPolarHBondContact O-CB 3.35Å; K1073-I1077 WeakPolarHBondContact O-CD1 3.46Å; K1073-I1077 VanDerWaalsContact O-CG1 3.24Å; K1073-I1077 WeakPolarHBondContact O-CG1 3.38Å; K1073-I1077 PolarHBondContact O-N 3.2Å; S1074-I1077 PolarHBondContact O-N 2.87Å; N1075-I1077 VanDerWaalsContact C-N 3.32Å; N1075-I1077 PolarHBondContact O-N 3.18Å; I1077-C1079 VanDerWaalsContact C-N 3.3Å; I1077-C1079 PolarHBondContact O-N 2.92Å; I1077-K1080 WeakPolarHBondContact O-CA 3.29Å; I1077-K1080 PolarHBondContact O-N 3.13Å; I1077-E1081 HydrophobicContact CG2-CG 4.47Å; I1077-E1081 WeakPolarHBondContact CG2-OE1 3.48Å; I1077-E1081 WeakPolarHBondContact O-CG 3.22Å; I1077-E1081 PolarHBondContact O-N 3.45Å
1078	K	43.1	Very low	48.9	Very low	149 Å²	149	113.2 Å²	113.2	65%	0.648	55%	0.545	S	S	*	.	H	α-helix	trans	-61.7	-33.5	177.7	-71.8	-166.8	171.1	-166.4	0	113.7	S1074 K1080 E1081 S1082	S1074-K1078 PolarHBondContact O-N 3.29Å; K1078-K1080 VanDerWaalsContact C-N 3.33Å; K1078-E1081 WeakPolarHBondContact CA-OE2 3.43Å; K1078-S1082 WeakPolarHBondContact O-CB 3.39Å; K1078-S1082 PolarHBondContact O-N 2.77Å; K1078-S1082 PolarHBondContact O-OG 2.71Å; K1078-S1082 VanDerWaalsContact O-OG 3.08Å
1079	C	34.4	Very low	47	Very low	76 Å²	76	120.6 Å²	120.6	51%	0.514	58%	0.575	S	S	.	*	H	α-helix	trans	-81.4	-3.3	173.3	-66.4	0	0	0	0	114.5	N1075 I1077 F1083	N1075-C1079 WeakPolarHBondContact O-CB 3.15Å; N1075-C1079 PolarHBondContact O-N 3.34Å; N1075-C1079 PolarHBondContact O-SG 3.49Å; I1077-C1079 VanDerWaalsContact C-N 3.3Å; I1077-C1079 PolarHBondContact O-N 2.92Å; C1079-F1083 WeakPolarHBondContact O-CB 2.97Å; C1079-F1083 WeakPolarHBondContact O-CD2 3.28Å
1080	K	40.8	Very low	44.9	Very low	107 Å²	107	119.1 Å²	119.1	47%	0.465	58%	0.583	S	S	.	*	H	α-helix	trans	-97	-42.1	167.7	-76.6	164.2	-165.2	165.4	0	110.5	E1076 I1077 K1078 F1083 Q1084	E1076-K1080 WeakPolarHBondContact O-CB 3.46Å; E1076-K1080 WeakPolarHBondContact O-CD 3.24Å; E1076-K1080 WeakPolarHBondContact O-CG 3.47Å; E1076-K1080 PolarHBondContact O-N 2.95Å; E1076-K1080 VanDerWaalsContact O-N 3.08Å; E1076-K1080 IonicContact OE2-NZ 3.36Å; E1076-K1080 PolarHBondContact OE2-NZ 3.26Å; I1077-K1080 WeakPolarHBondContact O-CA 3.29Å; I1077-K1080 PolarHBondContact O-N 3.13Å; K1078-K1080 VanDerWaalsContact C-N 3.33Å; K1080-F1083 CarbonylContact O-C 3.56Å; K1080-F1083 PolarHBondContact O-N 3.44Å; K1080-F1083 VanDerWaalsContact O-N 3.11Å; K1080-Q1084 WeakPolarHBondContact O-CG 3.38Å; K1080-Q1084 PolarHBondContact O-N 3.48Å
1081	E	39.3	Very low	42.7	Very low	107 Å²	107	120.3 Å²	120.3	50%	0.5	59%	0.588	S	S	.	*	H	α-helix	trans	-56	-54.6	172.1	-69.3	160.5	167.9	0	0	110.7	I1077 K1078 F1083 Q1084 E1085	I1077-E1081 HydrophobicContact CG2-CG 4.47Å; I1077-E1081 WeakPolarHBondContact CG2-OE1 3.48Å; I1077-E1081 WeakPolarHBondContact O-CG 3.22Å; I1077-E1081 PolarHBondContact O-N 3.45Å; K1078-E1081 WeakPolarHBondContact CA-OE2 3.43Å; E1081-F1083 PolarHBondContact O-N 3.22Å; E1081-F1083 VanDerWaalsContact O-N 3.07Å; E1081-Q1084 PolarHBondContact O-N 3.08Å; E1081-E1085 PolarHBondContact O-N 2.62Å
1082	S	38.4	Very low	41.1	Very low	55 Å²	55	122.3 Å²	122.3	39%	0.385	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.7	-12.4	177.6	74.9	0	0	0	0	114.7	K1078 N1086	K1078-S1082 WeakPolarHBondContact O-CB 3.39Å; K1078-S1082 PolarHBondContact O-N 2.77Å; K1078-S1082 PolarHBondContact O-OG 2.71Å; K1078-S1082 VanDerWaalsContact O-OG 3.08Å; S1082-N1086 PolarHBondContact O-ND2 3.44Å
1083	F	37.2	Very low	39.3	Very low	140 Å²	140	127.9 Å²	127.9	61%	0.614	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-3.4	173.7	-105.1	-86.9	0	0	0	113.7	C1079 K1080 E1081 K1087	C1079-F1083 WeakPolarHBondContact O-CB 2.97Å; C1079-F1083 WeakPolarHBondContact O-CD2 3.28Å; K1080-F1083 CarbonylContact O-C 3.56Å; K1080-F1083 PolarHBondContact O-N 3.44Å; K1080-F1083 VanDerWaalsContact O-N 3.11Å; E1081-F1083 PolarHBondContact O-N 3.22Å; E1081-F1083 VanDerWaalsContact O-N 3.07Å; F1083-K1087 WeakPolarHBondContact O-CD 3.19Å
1084	Q	37.7	Very low	37.6	Very low	130 Å²	130	129.5 Å²	129.5	61%	0.607	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	-40	175.2	-78.7	175.4	-124	0	0	111.6	K1080 E1081 N1086 K1087	K1080-Q1084 WeakPolarHBondContact O-CG 3.38Å; K1080-Q1084 PolarHBondContact O-N 3.48Å; E1081-Q1084 PolarHBondContact O-N 3.08Å; Q1084-N1086 VanDerWaalsContact C-N 3.28Å; Q1084-N1086 PolarHBondContact O-N 3.36Å; Q1084-K1087 WeakPolarHBondContact O-CB 3.38Å; Q1084-K1087 PolarHBondContact O-N 3.23Å
1085	E	35.8	Very low	36.2	Very low	160 Å²	160	131.9 Å²	131.9	75%	0.748	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-61.7	-36.2	172.8	-65.3	-177.7	124.3	0	0	112.2	E1081 K1087	E1081-E1085 PolarHBondContact O-N 2.62Å; E1085-K1087 PolarHBondContact O-N 3.19Å
1086	N	35.4	Very low	35.5	Very low	128 Å²	128	133.2 Å²	133.2	68%	0.684	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-76.7	7	174.3	-75.9	-67.5	0	0	0	114.6	S1082 Q1084	S1082-N1086 PolarHBondContact O-ND2 3.44Å; Q1084-N1086 VanDerWaalsContact C-N 3.28Å; Q1084-N1086 PolarHBondContact O-N 3.36Å
1087	K	34.6	Very low	34.7	Very low	138 Å²	138	137.2 Å²	137.2	60%	0.6	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-106.7	-6.4	-179	-102	179	-178.8	170.2	0	115.6	F1083 Q1084 E1085	F1083-K1087 WeakPolarHBondContact O-CD 3.19Å; Q1084-K1087 WeakPolarHBondContact O-CB 3.38Å; Q1084-K1087 PolarHBondContact O-N 3.23Å; E1085-K1087 PolarHBondContact O-N 3.19Å
1088	E	34.5	Very low	33.8	Very low	159 Å²	159	139.6 Å²	139.6	74%	0.743	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-24.3	179.9	-57.7	-150.5	116.2	0	0	113.6	A1090	E1088-A1090 PolarHBondContact O-N 2.88Å
1089	K	32.7	Very low	33.1	Very low	214 Å²	214	139.7 Å²	139.7	93%	0.93	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	15.3	172.1	-70.8	-173.5	175.6	179.3	0	114.9
1090	A	29.9	Very low	32.9	Very low	82 Å²	82	144.7 Å²	144.7	68%	0.678	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.9	31.8	179.4	0	0	0	0	0	113.9	E1088	E1088-A1090 PolarHBondContact O-N 2.88Å
1091	K	29.5	Very low	32.3	Very low	159 Å²	159	144.9 Å²	144.9	69%	0.691	71%	0.707	S	S	*	*			trans	-124.9	60.2	177.1	-75.7	-176.7	179.7	168.8	0	113.6
1092	N	29.8	Very low	31.7	Very low	152 Å²	152	145.7 Å²	145.7	81%	0.813	72%	0.715	S	S	*	*	S	Bend	trans	-170.6	158.9	148.4	-100.2	-36.2	0	0	0	111.5
1093	R	30.6	Very low	31.3	Very low	241 Å²	241	149.7 Å²	149.7	91%	0.909	73%	0.727	S	S	*	*			trans	53.6	81.7	-175.9	-55.5	178.1	-178.7	-179.9	-0.1	113
1094	K	29.1	Very low	30.8	Very low	186 Å²	186	150.5 Å²	150.5	81%	0.809	73%	0.733	S	S	*	*			cis	66.7	112.7	31.2	-120.2	-173.4	-172.3	-177.7	0	114.1
1095	S	27.2	Very low	30.2	Very low	115 Å²	115	150.8 Å²	150.8	80%	0.804	74%	0.738	S	S	*	*			trans	61.8	151.7	165.5	41.2	0	0	0	0	116.7
1096	S	30.5	Very low	29.6	Very low	109 Å²	109	147.2 Å²	147.2	76%	0.762	73%	0.731	S	S	*	*			cis	-165.2	168.4	11	10.1	0	0	0	0	108.7
1097	K	28.7	Very low	29.2	Very low	186 Å²	186	151 Å²	151	81%	0.809	74%	0.737	S	S	*	*			cis	177.8	-166.2	-14	-168.4	174.1	-173.9	179.1	0	105.1
1098	I	30.6	Very low	28.9	Very low	139 Å²	139	150 Å²	150	71%	0.713	75%	0.747	S	S	*	*			trans	73.7	132.9	155.8	-69.2	163.6	0	0	0	115.9
1099	K	28.7	Very low	28.5	Very low	150 Å²	150	150.1 Å²	150.1	65%	0.652	75%	0.752	S	S	*	*			cis	-157.4	145.3	-5.6	-111.4	175.7	-171.5	177.1	0	112.4
1100	Y	30.3	Very low	28.2	Very low	182 Å²	182	145.1 Å²	145.1	71%	0.714	74%	0.744	S	S	*	*			trans	61.5	126.6	138.3	-63.5	-32.2	0	0	0	126.1
1101	T	28	Very low	28	Very low	110 Å²	110	146 Å²	146	68%	0.675	75%	0.745	S	S	*	*				64.7	150.4	126.2	65.3	0	0	0	0	121.6
1102	N	27.2	Very low	27.9	Very low	125 Å²	125	145.7 Å²	145.7	67%	0.668	75%	0.751	S	S	*	*			cis	-159.3	156.7	-9	-113.2	-3.8	0	0	0	112.4
1103	H	28.8	Very low	28	Very low	138 Å²	138	147.6 Å²	147.6	64%	0.639	75%	0.752	S	S	*	*			trans	47.9	133.4	146.3	-74.3	-64.5	0	0	0	124
1104	Q	27.4	Very low	27.9	Very low	158 Å²	158	140.7 Å²	140.7	74%	0.738	74%	0.741	S	S	*	*				70.7	147.1	128.9	-70.2	173.6	-38.6	0	0	121
1105	D	24.4	Very low	27.8	Very low	136 Å²	136	139 Å²	139	73%	0.727	74%	0.74	S	S	*	*			cis	-162.9	170.7	-30.5	-136	-37	0	0	0	111.6
1106	S	24.4	Very low	27.7	Very low	84 Å²	84	142 Å²	142	59%	0.587	74%	0.739	S	S	*	*			trans	76.8	157.3	148.9	78.3	0	0	0	0	123
1107	Y	25.5	Very low	27.6	Very low	208 Å²	208	144 Å²	144	82%	0.816	73%	0.734	S	S	*	*			trans	58.8	87.3	163.5	-55.7	-63.6	0	0	0	122.7
1108	S	28.7	Very low	27.3	Very low	117 Å²	117	140 Å²	140	82%	0.818	73%	0.726	S	S	*	*				-169.6	108.8	126.4	27.9	0	0	0	0	109.7
1109	L	26	Very low	27.2	Very low	161 Å²	161	140.8 Å²	140.8	84%	0.843	73%	0.726	S	S	*	*				72.9	134.6	71.4	-85.1	165.1	0	0	0	116.5
1110	S	27.4	Very low	27.1	Very low	109 Å²	109	141.4 Å²	141.4	76%	0.762	73%	0.729	S	S	*	*			trans	62.8	111.6	-169.1	71.1	0	0	0	0	115.5
1111	S	25.9	Very low	26.8	Very low	100 Å²	100	140.6 Å²	140.6	70%	0.699	73%	0.733	S	S	*	*			cis	83.5	138.7	27.1	97.9	0	0	0	0	114.4
1112	N	26.9	Very low	26.6	Very low	153 Å²	153	140.1 Å²	140.1	82%	0.818	74%	0.735	S	S	*	*			cis	-164.8	177.1	-5.2	-128.2	-24.9	0	0	0	112.4
1113	K	30.7	Very low	26.7	Very low	192 Å²	192	140 Å²	140	84%	0.835	74%	0.738	S	S	*	*			trans	79.2	140.1	172.8	-54.4	179.2	-179.4	179	0	117.2
1114	S	29.2	Very low	26.5	Very low	96 Å²	96	138.1 Å²	138.1	67%	0.671	74%	0.74	S	S	*	*			cis	-167.2	120.7	-19.3	48	0	0	0	0	114.5
1115	L	26.7	Very low	26.6	Very low	152 Å²	152	134.9 Å²	134.9	80%	0.796	74%	0.736	S	S	*	*				63.4	129.9	127.2	-65	164.8	0	0	0	124.6
1116	K	26.6	Very low	26.7	Very low	177 Å²	177	133.9 Å²	133.9	77%	0.77	74%	0.739	S	S	*	*			trans	63.5	165.6	150.1	-63.4	-174.6	178.3	-179.8	0	116.8
1117	F	27.5	Very low	27.2	Very low	150 Å²	150	134.7 Å²	134.7	66%	0.658	74%	0.742	S	S	*	*			cis	-150.4	160.6	-17.6	-124.2	-143.9	0	0	0	105.7
1118	T	23	Very low	27.3	Very low	104 Å²	104	132 Å²	132	64%	0.638	74%	0.74	S	S	*	*			cis	81.5	132.7	15.7	64.4	0	0	0	0	118.9
1119	Q	27.1	Very low	27.1	Very low	155 Å²	155	134.5 Å²	134.5	72%	0.724	74%	0.737	S	S	*	*			trans	72.8	148	-174.2	-52.9	-166	20.5	0	0	115.2
1120	K	26.7	Very low	27.3	Very low	162 Å²	162	138.5 Å²	138.5	70%	0.704	74%	0.741	S	S	*	*			cis	-159.2	178.3	-15.8	-116.1	177.8	-178.1	178.6	0	109.2
1121	M	24.2	Very low	27.2	Very low	165 Å²	165	140.4 Å²	140.4	81%	0.813	74%	0.738	S	S	*	*			trans	0.2	148.1	150.1	-69.6	154.1	167.6	0	0	119.4
1122	S	25.1	Very low	27.3	Very low	101 Å²	101	142.6 Å²	142.6	71%	0.706	74%	0.74	S	S	*	*			cis	179.1	-171.4	-1.4	49.7	0	0	0	0	110.7
1123	V	28.2	Very low	27.3	Very low	121 Å²	121	140 Å²	140	73%	0.733	73%	0.73	S	S	*	*			trans	75.1	97.4	155	177.1	0	0	0	0	119.1
1124	S	25.8	Very low	27.2	Very low	99 Å²	99	139.5 Å²	139.5	69%	0.692	73%	0.73	S	S	*	*				60.6	156.9	129.4	81	0	0	0	0	126.2
1125	S	28.6	Very low	27.3	Very low	91 Å²	91	141.5 Å²	141.5	64%	0.636	73%	0.732	S	S	*	*			trans	67.6	79.1	136.4	61.6	0	0	0	0	121.9
1126	S	26.8	Very low	27.5	Very low	115 Å²	115	139.8 Å²	139.8	80%	0.804	73%	0.728	S	S	*	*				59.9	-162.7	119.3	61	0	0	0	0	118.2
1127	P	34.4	Very low	27.8	Very low	100 Å²	100	136.8 Å²	136.8	65%	0.649	72%	0.716	S	S	*	*				-128.9	160.1	-102.2	40.1	-22.8	0	0	0	117
1128	I	27.7	Very low	28.2	Very low	151 Å²	151	135.9 Å²	135.9	77%	0.774	71%	0.714	S	S	*	*			trans	71	158.4	161.4	-63.1	159.2	0	0	0	115.1
1129	F	24.5	Very low	28.9	Very low	171 Å²	171	135.1 Å²	135.1	75%	0.75	71%	0.706	S	S	*	*			trans	60.4	88.6	-178.6	-84.2	-71.1	0	0	0	118.5
1130	R	29.7	Very low	29.7	Very low	245 Å²	245	134.7 Å²	134.7	93%	0.925	70%	0.702	S	S	*	*			trans	-175	99.9	147.1	-97.4	161	-159.8	-170	5.6	104.8
1131	Q	26.8	Very low	30.3	Very low	148 Å²	148	131.2 Å²	131.2	69%	0.692	69%	0.69	S	S	*	*			cis	59.4	118.6	42.7	-130.7	-172.1	11	0	0	111.6
1132	I	27.8	Very low	31	Very low	147 Å²	147	127 Å²	127	75%	0.754	67%	0.67	S	S	*	*			trans	70.2	118.8	163.2	-61.8	163.3	0	0	0	117.1
1133	T	26.2	Very low	32	Very low	99 Å²	99	125.1 Å²	125.1	61%	0.607	65%	0.653	S	S	*	*			trans	-4	134.5	161.8	55.3	0	0	0	0	121.1
1134	Q	29.2	Very low	32.9	Very low	180 Å²	180	126.3 Å²	126.3	84%	0.841	65%	0.65	S	S	*	*				-162.5	130.8	114.1	-94.7	143.4	25	0	0	107.7
1135	I	30.3	Very low	33.3	Very low	138 Å²	138	127.5 Å²	127.5	71%	0.708	65%	0.646	S	S	*	*				78.7	150	55	-61.4	166.4	0	0	0	111.2
1136	V	32.2	Very low	34	Very low	116 Å²	116	126.5 Å²	126.5	70%	0.703	64%	0.636	S	S	*	*	S	Bend	trans	76	114	-170.6	-168.3	0	0	0	0	113.9
1137	H	31.3	Very low	34.6	Very low	115 Å²	115	124.4 Å²	124.4	53%	0.532	62%	0.616	S	S	.	*			cis	-109.9	115.8	-10.9	-83.8	-79.3	0	0	0	109.7	D1139 K1140	H1137-D1139 VanDerWaalsContact C-N 3.27Å; H1137-D1139 IonicContact CE1-OD2 3.44Å; H1137-D1139 IonicContact CG-OD2 3.58Å; H1137-D1139 IonicContact ND1-OD2 2.8Å; H1137-D1139 PolarHBondContact ND1-OD2 3.35Å; H1137-K1140 HydrophobicContact CB-CB 3.65Å
1138	H	36.1	Very low	34.9	Very low	130 Å²	130	124 Å²	124	60%	0.602	61%	0.614	S	S	*	*	H	α-helix	trans	-70.7	-35.1	162.5	-151.4	-17.6	0	0	0	109.7	K1140 L1141 L1142	H1138-K1140 VanDerWaalsContact C-N 3.25Å; H1138-K1140 PolarHBondContact O-N 3.49Å; H1138-L1141 PolarHBondContact O-N 3.44Å; H1138-L1141 VanDerWaalsContact O-N 3.16Å; H1138-L1142 WeakPolarHBondContact O-CG 3.48Å; H1138-L1142 PolarHBondContact O-N 2.91Å
1139	D	38.9	Very low	35.9	Very low	88 Å²	88	123.7 Å²	123.7	47%	0.471	61%	0.614	S	S	.	*	H	α-helix	trans	-53.1	-37.2	177.9	-26.4	-60.5	0	0	0	112.8	H1137 L1142 D1143	H1137-D1139 VanDerWaalsContact C-N 3.27Å; H1137-D1139 IonicContact CE1-OD2 3.44Å; H1137-D1139 IonicContact CG-OD2 3.58Å; H1137-D1139 IonicContact ND1-OD2 2.8Å; H1137-D1139 PolarHBondContact ND1-OD2 3.35Å; D1139-L1142 CarbonylContact O-C 3.58Å; D1139-L1142 WeakPolarHBondContact O-CB 3.48Å; D1139-L1142 PolarHBondContact O-N 3.04Å; D1139-D1143 WeakPolarHBondContact O-CB 3.43Å; D1139-D1143 PolarHBondContact O-N 2.95Å
1140	K	42.8	Very low	36.9	Very low	146 Å²	146	123.3 Å²	123.3	64%	0.635	61%	0.614	S	S	*	*	H	α-helix	trans	-81	-27.8	-176.7	-159.1	166.3	-167.7	165.5	0	113.2	H1137 H1138 E1144	H1137-K1140 HydrophobicContact CB-CB 3.65Å; H1138-K1140 VanDerWaalsContact C-N 3.25Å; H1138-K1140 PolarHBondContact O-N 3.49Å; K1140-E1144 PolarHBondContact O-N 3.1Å
1141	L	39.6	Very low	37.4	Very low	90 Å²	90	116.4 Å²	116.4	47%	0.471	59%	0.594	S	S	.	*	H	α-helix	trans	-75.5	-33.5	167.1	-164.5	82.1	0	0	0	110.3	H1138 M1145	H1138-L1141 PolarHBondContact O-N 3.44Å; H1138-L1141 VanDerWaalsContact O-N 3.16Å; L1141-M1145 HydrophobicContact CD2-CE 4.04Å; L1141-M1145 HydrophobicContact CG-CE 4.05Å; L1141-M1145 WeakPolarHBondContact O-CG 3.31Å; L1141-M1145 PolarHBondContact O-N 3Å; L1141-M1145 VanDerWaalsContact O-N 3.17Å
1142	L	40.2	Very low	37.9	Very low	75 Å²	75	114 Å²	114	39%	0.393	59%	0.586	S	S	.	*	H	α-helix	trans	-63.7	-50.6	170.6	-73.5	163.9	0	0	0	110	H1138 D1139 E1144 M1145 T1146	H1138-L1142 WeakPolarHBondContact O-CG 3.48Å; H1138-L1142 PolarHBondContact O-N 2.91Å; D1139-L1142 CarbonylContact O-C 3.58Å; D1139-L1142 WeakPolarHBondContact O-CB 3.48Å; D1139-L1142 PolarHBondContact O-N 3.04Å; L1142-E1144 PolarHBondContact O-N 3.16Å; L1142-M1145 CarbonylContact O-C 3.57Å; L1142-M1145 WeakPolarHBondContact O-CA 3.4Å; L1142-M1145 PolarHBondContact O-N 3.21Å; L1142-T1146 WeakPolarHBondContact O-CB 3.49Å; L1142-T1146 WeakPolarHBondContact O-CG2 3.18Å; L1142-T1146 PolarHBondContact O-N 3.13Å; L1142-T1146 PolarHBondContact O-OG1 3.03Å
1143	D	45.7	Very low	39.1	Very low	63 Å²	63	110.5 Å²	110.5	34%	0.337	58%	0.575	S	S	.	*	H	α-helix	trans	-59.1	-28	177	-71.9	-23	0	0	0	113.9	D1139 T1146 N1147 H1271	D1139-D1143 WeakPolarHBondContact O-CB 3.43Å; D1139-D1143 PolarHBondContact O-N 2.95Å; D1143-T1146 WeakPolarHBondContact CA-OG1 3.39Å; D1143-N1147 WeakPolarHBondContact O-CB 3.48Å; D1143-N1147 PolarHBondContact O-N 3.39Å; D1143-N1147 PolarHBondContact O-ND2 3.17Å; D1143-N1147 VanDerWaalsContact O-ND2 3.16Å; D1143-H1271 IonicContact OD1-CE1 2.91Å; D1143-H1271 PolarHBondContact OD1-CE1 3.49Å
1144	E	45.9	Very low	40.3	Very low	146 Å²	146	108 Å²	108	68%	0.682	56%	0.561	S	S	*	*	H	α-helix	trans	-77.1	-25.9	170.5	-77.1	-170.2	154.6	0	0	112.9	K1140 L1142	K1140-E1144 PolarHBondContact O-N 3.1Å; L1142-E1144 PolarHBondContact O-N 3.16Å
1145	M	34.9	Very low	41.6	Very low	123 Å²	123	106.5 Å²	106.5	61%	0.606	55%	0.553	S	S	*	*	H	α-helix	trans	-99.4	-24.9	-179.8	-67.9	-170.8	-59	0	0	114.7	L1141 L1142 N1147	L1141-M1145 HydrophobicContact CD2-CE 4.04Å; L1141-M1145 HydrophobicContact CG-CE 4.05Å; L1141-M1145 WeakPolarHBondContact O-CG 3.31Å; L1141-M1145 PolarHBondContact O-N 3Å; L1141-M1145 VanDerWaalsContact O-N 3.17Å; L1142-M1145 CarbonylContact O-C 3.57Å; L1142-M1145 WeakPolarHBondContact O-CA 3.4Å; L1142-M1145 PolarHBondContact O-N 3.21Å; M1145-N1147 VanDerWaalsContact C-N 3.31Å
1146	T	42.9	Very low	43	Very low	70 Å²	70	103.2 Å²	103.2	43%	0.429	54%	0.536	S	S	.	.	S	Bend	trans	-88.3	-4.1	172.4	60.7	0	0	0	0	111.7	L1142 D1143 P1148	L1142-T1146 WeakPolarHBondContact O-CB 3.49Å; L1142-T1146 WeakPolarHBondContact O-CG2 3.18Å; L1142-T1146 PolarHBondContact O-N 3.13Å; L1142-T1146 PolarHBondContact O-OG1 3.03Å; D1143-T1146 WeakPolarHBondContact CA-OG1 3.39Å; T1146-P1148 VanDerWaalsContact O-CD 3.26Å; T1146-P1148 WeakPolarHBondContact O-CD 3.46Å
1147	N	39.1	Very low	44.6	Very low	71 Å²	71	103 Å²	103	38%	0.38	53%	0.528	S	S	.	.			trans	-56.8	108	-179.8	-145.4	-63.3	0	0	0	110.3	D1143 M1145 N1149 H1150	D1143-N1147 WeakPolarHBondContact O-CB 3.48Å; D1143-N1147 PolarHBondContact O-N 3.39Å; D1143-N1147 PolarHBondContact O-ND2 3.17Å; D1143-N1147 VanDerWaalsContact O-ND2 3.16Å; M1145-N1147 VanDerWaalsContact C-N 3.31Å; N1147-N1149 PolarHBondContact O-N 2.99Å; N1147-H1150 PolarHBondContact O-N 3.45Å
1148	P	40.8	Very low	46.5	Very low	93 Å²	93	102 Å²	102	60%	0.604	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-19.5	-165.7	25.3	-34.6	0	0	0	112.8	T1146 H1150	T1146-P1148 VanDerWaalsContact O-CD 3.26Å; T1146-P1148 WeakPolarHBondContact O-CD 3.46Å; P1148-H1150 VanDerWaalsContact C-N 3.33Å
1149	N	48.3	Very low	48.1	Very low	144 Å²	144	98.2 Å²	98.2	77%	0.77	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-3.9	178.9	-65.4	-42.4	0	0	0	114.3	N1147	N1147-N1149 PolarHBondContact O-N 2.99Å
1150	H	46.8	Very low	49.7	Very low	163 Å²	163	94.1 Å²	94.1	76%	0.755	50%	0.495	S	S	*	.	S	Bend	trans	-127.4	9.7	-171.9	-140	-55.4	0	0	0	115.2	N1147 P1148 D1152	N1147-H1150 PolarHBondContact O-N 3.45Å; P1148-H1150 VanDerWaalsContact C-N 3.33Å; H1150-D1152 PolarHBondContact O-N 2.81Å
1151	I	38.9	Very low	51.2	Low	99 Å²	99	88.8 Å²	88.8	51%	0.508	47%	0.474	S	S	.	.			trans	-64.8	120.4	179	-58.8	174.5	0	0	0	110.4	S1153	I1151-S1153 PolarHBondContact O-N 2.95Å
1152	D	37.8	Very low	52.9	Low	97 Å²	97	93 Å²	93	52%	0.519	48%	0.483	S	S	.	.			trans	-70.4	121.9	172	-179.8	8	0	0	0	110.6	H1150 S1154 F1155	H1150-D1152 PolarHBondContact O-N 2.81Å; D1152-S1154 PolarHBondContact O-N 3.45Å; D1152-S1154 PolarHBondContact OD1-N 3.48Å; D1152-S1154 WeakPolarHBondContact OD2-CB 3.27Å; D1152-S1154 PolarHBondContact OD2-OG 3.04Å; D1152-F1155 WeakPolarHBondContact O-CB 3.43Å; D1152-F1155 PolarHBondContact O-N 3.14Å
1153	S	53.6	Low	54.5	Low	74 Å²	74	90.1 Å²	90.1	52%	0.517	47%	0.468	S	S	.	.	H	α-helix	trans	-54.5	-21.2	175.9	64.1	0	0	0	0	114.9	I1151 F1155 Q1157	I1151-S1153 PolarHBondContact O-N 2.95Å; S1153-F1155 VanDerWaalsContact C-N 3.27Å; S1153-F1155 PolarHBondContact O-N 3.04Å; S1153-Q1157 PolarHBondContact O-N 2.83Å
1154	S	51.6	Low	55.8	Low	47 Å²	47	87.1 Å²	87.1	33%	0.329	45%	0.452	S	S	.	.	H	α-helix	trans	-61.7	-34.7	172.7	78.8	0	0	0	0	112.5	D1152 Q1157 L1158	D1152-S1154 PolarHBondContact O-N 3.45Å; D1152-S1154 PolarHBondContact OD1-N 3.48Å; D1152-S1154 WeakPolarHBondContact OD2-CB 3.27Å; D1152-S1154 PolarHBondContact OD2-OG 3.04Å; S1154-Q1157 PolarHBondContact O-N 3.12Å; S1154-L1158 PolarHBondContact O-N 3.43Å
1155	F	55.1	Low	57.3	Low	149 Å²	149	82.4 Å²	82.4	65%	0.654	43%	0.431	S	S	*	.	H	α-helix	trans	-74.8	-43.3	-173.1	-133.4	-86.4	0	0	0	111.8	D1152 S1153 Q1157 L1158 A1159	D1152-F1155 WeakPolarHBondContact O-CB 3.43Å; D1152-F1155 PolarHBondContact O-N 3.14Å; S1153-F1155 VanDerWaalsContact C-N 3.27Å; S1153-F1155 PolarHBondContact O-N 3.04Å; F1155-Q1157 PolarHBondContact O-N 2.86Å; F1155-L1158 PolarHBondContact O-N 3.28Å; F1155-A1159 PolarHBondContact O-N 2.96Å
1156	D	60.8	Low	59.2	Low	69 Å²	69	81.6 Å²	81.6	37%	0.369	43%	0.425	S	S	.	.	H	α-helix	trans	-57	-39.5	169.8	-80.9	-26.8	0	0	0	111.6	A1159 A1160 R1342	D1156-A1159 PolarHBondContact O-N 3.05Å; D1156-A1160 WeakPolarHBondContact O-CB 3.45Å; D1156-A1160 PolarHBondContact O-N 3.13Å; D1156-R1342 VanDerWaalsContact CB-NH1 3.32Å; D1156-R1342 VanDerWaalsContact CG-NH1 3.28Å; D1156-R1342 IonicContact OD2-CZ 3.77Å; D1156-R1342 IonicContact OD2-NH1 3.87Å; D1156-R1342 PolarHBondContact OD2-NH1 3.06Å
1157	Q	66.7	Low	60.4	Low	111 Å²	111	78.2 Å²	78.2	52%	0.519	40%	0.404	S	S	.	.	H	α-helix	trans	-73.2	-32.6	-179.9	-163.7	169.3	24.1	0	0	112	S1153 S1154 F1155 N1161	S1153-Q1157 PolarHBondContact O-N 2.83Å; S1154-Q1157 PolarHBondContact O-N 3.12Å; F1155-Q1157 PolarHBondContact O-N 2.86Å; Q1157-N1161 WeakPolarHBondContact O-CB 3.37Å; Q1157-N1161 PolarHBondContact O-N 3.45Å; Q1157-N1161 VanDerWaalsContact O-N 3.13Å; Q1157-N1161 PolarHBondContact O-ND2 3.17Å
1158	L	70.1	Confident	61.9	Low	94 Å²	94	75.4 Å²	75.4	49%	0.492	39%	0.389	S	S	.	.	H	α-helix	trans	-67.6	-43.2	169.9	-96.9	163	0	0	0	112.1	S1154 F1155 N1161 R1162	S1154-L1158 PolarHBondContact O-N 3.43Å; F1155-L1158 PolarHBondContact O-N 3.28Å; L1158-N1161 PolarHBondContact O-N 2.94Å; L1158-R1162 WeakPolarHBondContact O-CG 3.37Å; L1158-R1162 PolarHBondContact O-N 3.06Å
1159	A	70.2	Confident	63.4	Low	51 Å²	51	74.7 Å²	74.7	42%	0.421	38%	0.379	S	S	.	.	H	α-helix	trans	-61.2	-49	175.6	0	0	0	0	0	111.6	F1155 D1156 N1161 R1162 L1163	F1155-A1159 PolarHBondContact O-N 2.96Å; D1156-A1159 PolarHBondContact O-N 3.05Å; A1159-N1161 VanDerWaalsContact C-N 3.33Å; A1159-N1161 PolarHBondContact O-N 3.12Å; A1159-R1162 PolarHBondContact O-N 2.98Å; A1159-R1162 VanDerWaalsContact O-N 3.12Å; A1159-L1163 PolarHBondContact O-N 2.83Å
1160	A	71.7	Confident	64.3	Low	1 Å²	1	69 Å²	69	1%	0.008	35%	0.352	C	S	.	.	H	α-helix	trans	-59.7	-38.9	177.1	0	0	0	0	0	113.1	D1156 A1164 S1346	D1156-A1160 WeakPolarHBondContact O-CB 3.45Å; D1156-A1160 PolarHBondContact O-N 3.13Å; A1160-A1164 VanDerWaalsContact O-CB 3.3Å; A1160-A1164 WeakPolarHBondContact O-CB 3.44Å; A1160-A1164 PolarHBondContact O-N 3.25Å; A1160-A1164 VanDerWaalsContact O-N 3.08Å; A1160-S1346 WeakPolarHBondContact CB-OG 3.27Å
1161	N	75.5	Confident	65	Low	34 Å²	34	62.3 Å²	62.3	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-70	-34.8	174.6	-83.3	-68.2	0	0	0	113.2	Q1157 L1158 A1159 N1165 Q1350	Q1157-N1161 WeakPolarHBondContact O-CB 3.37Å; Q1157-N1161 PolarHBondContact O-N 3.45Å; Q1157-N1161 VanDerWaalsContact O-N 3.13Å; Q1157-N1161 PolarHBondContact O-ND2 3.17Å; L1158-N1161 PolarHBondContact O-N 2.94Å; A1159-N1161 VanDerWaalsContact C-N 3.33Å; A1159-N1161 PolarHBondContact O-N 3.12Å; N1161-N1165 WeakPolarHBondContact O-CB 3.41Å; N1161-N1165 PolarHBondContact O-N 2.84Å; N1161-N1165 VanDerWaalsContact O-N 3.11Å; N1161-Q1350 PolarHBondContact OD1-NE2 2.79Å
1162	R	75.2	Confident	66.3	Low	180 Å²	180	61 Å²	61	68%	0.679	31%	0.313	S	S	*	.	H	α-helix	trans	-67.3	-45.7	175.3	-79.3	176.8	169.5	176.4	-3.2	111.7	L1158 A1159 N1165 K1166	L1158-R1162 WeakPolarHBondContact O-CG 3.37Å; L1158-R1162 PolarHBondContact O-N 3.06Å; A1159-R1162 PolarHBondContact O-N 2.98Å; A1159-R1162 VanDerWaalsContact O-N 3.12Å; R1162-N1165 PolarHBondContact O-N 2.84Å; R1162-K1166 PolarHBondContact O-N 3.01Å
1163	L	73.3	Confident	67.8	Low	14 Å²	14	61.1 Å²	61.1	7%	0.073	31%	0.311	C	S	.	.	H	α-helix	trans	-63.9	-46.1	178.3	-154.9	95.5	0	0	0	111.2	A1159 N1165 K1166 A1167 L1283 M1287	A1159-L1163 PolarHBondContact O-N 2.83Å; L1163-N1165 VanDerWaalsContact C-N 3.31Å; L1163-N1165 PolarHBondContact O-N 2.96Å; L1163-K1166 PolarHBondContact O-N 2.86Å; L1163-A1167 PolarHBondContact O-N 3.49Å; L1163-A1167 VanDerWaalsContact O-N 3.08Å; L1163-L1283 HydrophobicContact CD1-CB 4.41Å; L1163-L1283 HydrophobicContact CD2-CB 4.22Å; L1163-L1283 HydrophobicContact CD2-CD2 4.39Å; L1163-M1287 HydrophobicContact CD2-CB 4.35Å; L1163-M1287 HydrophobicContact CD2-SD 4.2Å
1164	A	72.6	Confident	68.1	Low	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-58	-41.2	176.1	0	0	0	0	0	112.5	A1160 I1168 L1347 Q1350	A1160-A1164 VanDerWaalsContact O-CB 3.3Å; A1160-A1164 WeakPolarHBondContact O-CB 3.44Å; A1160-A1164 PolarHBondContact O-N 3.25Å; A1160-A1164 VanDerWaalsContact O-N 3.08Å; A1164-I1168 WeakPolarHBondContact O-CD1 3.4Å; A1164-I1168 VanDerWaalsContact O-CG1 3.27Å; A1164-I1168 WeakPolarHBondContact O-CG1 3.48Å; A1164-I1168 PolarHBondContact O-N 3.17Å; A1164-I1168 VanDerWaalsContact O-N 3.12Å; A1164-L1347 HydrophobicContact CB-CD1 4.37Å; A1164-Q1350 HydrophobicContact CB-CG 4.4Å
1165	N	76.6	Confident	68.3	Low	46 Å²	46	63.7 Å²	63.7	25%	0.246	31%	0.314	C	S	.	.	H	α-helix	trans	-71.4	-39.3	176.5	-93.1	-46.3	0	0	0	113.5	N1161 R1162 L1163 A1167 I1168 I1169 Q1350 R1354	N1161-N1165 WeakPolarHBondContact O-CB 3.41Å; N1161-N1165 PolarHBondContact O-N 2.84Å; N1161-N1165 VanDerWaalsContact O-N 3.11Å; R1162-N1165 PolarHBondContact O-N 2.84Å; L1163-N1165 VanDerWaalsContact C-N 3.31Å; L1163-N1165 PolarHBondContact O-N 2.96Å; N1165-A1167 VanDerWaalsContact C-N 3.34Å; N1165-A1167 PolarHBondContact O-N 2.85Å; N1165-I1168 PolarHBondContact O-N 2.86Å; N1165-I1169 WeakPolarHBondContact O-CD1 3.27Å; N1165-I1169 VanDerWaalsContact O-CG1 3.25Å; N1165-I1169 WeakPolarHBondContact O-CG1 3.42Å; N1165-I1169 PolarHBondContact O-N 3.3Å; N1165-Q1350 PolarHBondContact ND2-NE2 3.04Å; N1165-Q1350 PolarHBondContact ND2-OE1 3.08Å; N1165-Q1350 PolarHBondContact OD1-OE1 3.29Å; N1165-R1354 PolarHBondContact OD1-NH1 3.26Å
1166	K	74.9	Confident	68.4	Low	106 Å²	106	62.9 Å²	62.9	46%	0.461	31%	0.31	S	S	.	.	H	α-helix	trans	-53.9	-51.1	172.6	-82.8	-173.6	177.1	-176.9	0	110.7	R1162 L1163 I1169 A1170 D1280	R1162-K1166 PolarHBondContact O-N 3.01Å; L1163-K1166 PolarHBondContact O-N 2.86Å; K1166-I1169 PolarHBondContact O-N 2.87Å; K1166-A1170 PolarHBondContact O-N 2.88Å; K1166-D1280 IonicContact NZ-OD2 2.71Å; K1166-D1280 PolarHBondContact NZ-OD2 3.34Å
1167	A	69	Low	68.2	Low	0 Å²	0	67.4 Å²	67.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-69.2	-37.3	-175.8	0	0	0	0	0	113.8	L1163 N1165 A1170 L1171 M1287 Q1288	L1163-A1167 PolarHBondContact O-N 3.49Å; L1163-A1167 VanDerWaalsContact O-N 3.08Å; N1165-A1167 VanDerWaalsContact C-N 3.34Å; N1165-A1167 PolarHBondContact O-N 2.85Å; A1167-A1170 PolarHBondContact O-N 2.91Å; A1167-L1171 PolarHBondContact O-N 3.04Å; A1167-M1287 HydrophobicContact CB-CE 3.32Å; A1167-Q1288 HydrophobicContact CB-CG 4.11Å
1168	I	69.7	Low	67.2	Low	12 Å²	12	70.6 Å²	70.6	6%	0.062	33%	0.33	C	S	.	.	H	α-helix	trans	-66.2	-38.8	174.3	-65.6	166.1	0	0	0	110.9	A1164 N1165 L1171 E1172 L1347 Q1350 L1351	A1164-I1168 WeakPolarHBondContact O-CD1 3.4Å; A1164-I1168 VanDerWaalsContact O-CG1 3.27Å; A1164-I1168 WeakPolarHBondContact O-CG1 3.48Å; A1164-I1168 PolarHBondContact O-N 3.17Å; A1164-I1168 VanDerWaalsContact O-N 3.12Å; N1165-I1168 PolarHBondContact O-N 2.86Å; I1168-L1171 PolarHBondContact O-N 3.42Å; I1168-E1172 PolarHBondContact O-N 3.18Å; I1168-L1347 HydrophobicContact CD1-CD1 3.84Å; I1168-L1347 HydrophobicContact CG1-CD1 3.89Å; I1168-Q1350 HydrophobicContact CD1-CB 3.69Å; I1168-L1351 HydrophobicContact CD1-CD2 4.43Å; I1168-L1351 HydrophobicContact CD1-CG 4.21Å
1169	I	72.5	Confident	66	Low	77 Å²	77	73.2 Å²	73.2	40%	0.395	34%	0.34	S	S	.	.	H	α-helix	trans	-63	-47.4	175.4	-69.1	164.6	0	0	0	110.6	N1165 K1166 L1171 E1172 E1173	N1165-I1169 WeakPolarHBondContact O-CD1 3.27Å; N1165-I1169 VanDerWaalsContact O-CG1 3.25Å; N1165-I1169 WeakPolarHBondContact O-CG1 3.42Å; N1165-I1169 PolarHBondContact O-N 3.3Å; K1166-I1169 PolarHBondContact O-N 2.87Å; I1169-L1171 VanDerWaalsContact C-N 3.31Å; I1169-L1171 PolarHBondContact O-N 3.43Å; I1169-E1172 PolarHBondContact O-N 3.05Å; I1169-E1172 VanDerWaalsContact O-N 3.13Å; I1169-E1173 PolarHBondContact O-N 3.49Å
1170	A	67.3	Low	65	Low	25 Å²	25	78.9 Å²	78.9	21%	0.207	36%	0.357	C	S	.	.	H	α-helix	trans	-59.1	-40.3	178.5	0	0	0	0	0	112.5	K1166 A1167 E1173 E1174	K1166-A1170 PolarHBondContact O-N 2.88Å; A1167-A1170 PolarHBondContact O-N 2.91Å; A1170-E1173 PolarHBondContact O-N 2.98Å; A1170-E1174 PolarHBondContact O-N 3.38Å
1171	L	62.2	Low	63.8	Low	22 Å²	22	83.7 Å²	83.7	12%	0.115	39%	0.389	C	S	.	.	H	α-helix	trans	-70.7	-35	174.7	-89.3	164.9	0	0	0	113.5	A1167 I1168 I1169 E1173 E1174 V1175 C1291 I1295	A1167-L1171 PolarHBondContact O-N 3.04Å; I1168-L1171 PolarHBondContact O-N 3.42Å; I1169-L1171 VanDerWaalsContact C-N 3.31Å; I1169-L1171 PolarHBondContact O-N 3.43Å; L1171-E1173 VanDerWaalsContact C-N 3.25Å; L1171-E1173 PolarHBondContact O-N 2.86Å; L1171-E1174 PolarHBondContact O-N 3.45Å; L1171-V1175 WeakPolarHBondContact O-CB 3.32Å; L1171-V1175 VanDerWaalsContact O-CG2 3.27Å; L1171-V1175 WeakPolarHBondContact O-CG2 3.49Å; L1171-V1175 PolarHBondContact O-N 3.33Å; L1171-C1291 HydrophobicContact CD1-CB 3.22Å; L1171-I1295 HydrophobicContact CD1-CD1 4.44Å
1172	E	65.5	Low	61.9	Low	71 Å²	71	86.3 Å²	86.3	33%	0.332	40%	0.404	S	S	.	.	H	α-helix	trans	-65.1	-30	171.5	-78.4	-177.4	162.7	0	0	112.2	I1168 I1169 K1176 R1354	I1168-E1172 PolarHBondContact O-N 3.18Å; I1169-E1172 PolarHBondContact O-N 3.05Å; I1169-E1172 VanDerWaalsContact O-N 3.13Å; E1172-K1176 WeakPolarHBondContact O-CB 3.31Å; E1172-K1176 WeakPolarHBondContact O-CD 3.49Å; E1172-K1176 WeakPolarHBondContact O-CG 3.42Å; E1172-K1176 PolarHBondContact O-N 3.18Å; E1172-K1176 VanDerWaalsContact O-N 3.15Å; E1172-R1354 VanDerWaalsContact CD-NE 3.26Å; E1172-R1354 WeakPolarHBondContact OE1-CD 3.43Å; E1172-R1354 IonicContact OE1-CZ 3.53Å; E1172-R1354 IonicContact OE1-NE 3.1Å; E1172-R1354 PolarHBondContact OE1-NE 3.07Å; E1172-R1354 IonicContact OE1-NH2 2.72Å; E1172-R1354 IonicContact OE2-CZ 3.68Å; E1172-R1354 IonicContact OE2-NE 2.78Å; E1172-R1354 PolarHBondContact OE2-NE 3.43Å; E1172-R1354 IonicContact OE2-NH2 3.2Å; E1172-R1354 PolarHBondContact OE2-NH2 3.27Å
1173	E	69	Low	59.8	Low	101 Å²	101	86.4 Å²	86.4	47%	0.472	41%	0.409	S	S	.	.	H	α-helix	trans	-74.9	-42.3	172.9	-70.8	-176.6	176.1	0	0	112.7	I1169 A1170 L1171 K1176 R1177	I1169-E1173 PolarHBondContact O-N 3.49Å; A1170-E1173 PolarHBondContact O-N 2.98Å; L1171-E1173 VanDerWaalsContact C-N 3.25Å; L1171-E1173 PolarHBondContact O-N 2.86Å; E1173-K1176 PolarHBondContact O-N 3.45Å; E1173-R1177 WeakPolarHBondContact O-CG 3.4Å; E1173-R1177 PolarHBondContact O-N 2.95Å
1174	E	60.8	Low	57.6	Low	103 Å²	103	96.7 Å²	96.7	48%	0.481	45%	0.447	S	S	.	.	H	α-helix	trans	-62.7	-45.2	173.1	-75.5	-165.7	124.8	0	0	112.3	A1170 L1171 K1176 R1177 W1178	A1170-E1174 PolarHBondContact O-N 3.38Å; L1171-E1174 PolarHBondContact O-N 3.45Å; E1174-K1176 VanDerWaalsContact C-N 3.32Å; E1174-K1176 PolarHBondContact O-N 2.94Å; E1174-R1177 PolarHBondContact O-N 2.88Å; E1174-W1178 PolarHBondContact O-N 3.05Å
1175	V	55	Low	55.4	Low	71 Å²	71	101.1 Å²	101.1	43%	0.43	48%	0.478	S	S	.	.	H	α-helix	trans	-63.7	-38.1	177.7	171	0	0	0	0	111.1	L1171 W1178 Q1179	L1171-V1175 WeakPolarHBondContact O-CB 3.32Å; L1171-V1175 VanDerWaalsContact O-CG2 3.27Å; L1171-V1175 WeakPolarHBondContact O-CG2 3.49Å; L1171-V1175 PolarHBondContact O-N 3.33Å; V1175-W1178 PolarHBondContact O-N 3.07Å; V1175-Q1179 HydrophobicContact CG1-CG 4.41Å; V1175-Q1179 WeakPolarHBondContact O-CB 3.25Å; V1175-Q1179 WeakPolarHBondContact O-CG 3.46Å; V1175-Q1179 PolarHBondContact O-N 2.83Å
1176	K	58.4	Low	53	Low	132 Å²	132	108.6 Å²	108.6	57%	0.574	51%	0.509	S	S	*	.	H	α-helix	trans	-63.8	-43	173.2	-81.3	171.8	-179.4	173.5	0	112.5	E1172 E1173 E1174 W1178 Q1179 Q1180	E1172-K1176 WeakPolarHBondContact O-CB 3.31Å; E1172-K1176 WeakPolarHBondContact O-CD 3.49Å; E1172-K1176 WeakPolarHBondContact O-CG 3.42Å; E1172-K1176 PolarHBondContact O-N 3.18Å; E1172-K1176 VanDerWaalsContact O-N 3.15Å; E1173-K1176 PolarHBondContact O-N 3.45Å; E1174-K1176 VanDerWaalsContact C-N 3.32Å; E1174-K1176 PolarHBondContact O-N 2.94Å; K1176-W1178 VanDerWaalsContact C-N 3.35Å; K1176-Q1179 PolarHBondContact O-N 2.73Å; K1176-Q1180 WeakPolarHBondContact O-CG 3.39Å; K1176-Q1180 PolarHBondContact O-N 3.35Å; K1176-Q1180 VanDerWaalsContact O-N 3.1Å
1177	R	55.2	Low	50.6	Low	164 Å²	164	108.2 Å²	108.2	62%	0.619	52%	0.52	S	S	*	.	H	α-helix	trans	-60	-45.5	173.5	-74	175.9	178.6	149.4	4.1	110.9	E1173 E1174 Q1179 Q1180 C1181	E1173-R1177 WeakPolarHBondContact O-CG 3.4Å; E1173-R1177 PolarHBondContact O-N 2.95Å; E1174-R1177 PolarHBondContact O-N 2.88Å; R1177-Q1179 PolarHBondContact O-N 3.44Å; R1177-Q1180 PolarHBondContact O-N 3.41Å; R1177-C1181 PolarHBondContact O-N 3.33Å; R1177-C1181 PolarHBondContact O-SG 3.15Å; R1177-C1181 VanDerWaalsContact O-SG 3.38Å
1178	W	46	Very low	48.6	Very low	179 Å²	179	116.6 Å²	116.6	68%	0.678	56%	0.558	S	S	*	*	H	α-helix	trans	-62.1	-43.5	177.3	-112.4	88	0	0	0	113.3	E1174 V1175 K1176 Q1180 C1181 N1182	E1174-W1178 PolarHBondContact O-N 3.05Å; V1175-W1178 PolarHBondContact O-N 3.07Å; K1176-W1178 VanDerWaalsContact C-N 3.35Å; W1178-Q1180 VanDerWaalsContact C-N 3.26Å; W1178-Q1180 PolarHBondContact O-N 3.3Å; W1178-C1181 PolarHBondContact O-N 3.46Å; W1178-C1181 VanDerWaalsContact O-N 3.12Å; W1178-N1182 HydrophobicContact CE3-CB 4.4Å; W1178-N1182 HydrophobicContact CZ3-CB 4.37Å; W1178-N1182 VanDerWaalsContact CZ3-ND2 3.32Å; W1178-N1182 WeakPolarHBondContact CZ3-ND2 3.37Å; W1178-N1182 PolarHBondContact O-N 3.31Å
1179	Q	44.8	Very low	46.7	Very low	149 Å²	149	122.5 Å²	122.5	70%	0.696	60%	0.596	S	S	*	*	H	α-helix	trans	-68	-22.1	177.2	-75.1	-171.3	-39.9	0	0	113.7	V1175 K1176 R1177	V1175-Q1179 HydrophobicContact CG1-CG 4.41Å; V1175-Q1179 WeakPolarHBondContact O-CB 3.25Å; V1175-Q1179 WeakPolarHBondContact O-CG 3.46Å; V1175-Q1179 PolarHBondContact O-N 2.83Å; K1176-Q1179 PolarHBondContact O-N 2.73Å; R1177-Q1179 PolarHBondContact O-N 3.44Å
1180	Q	50.6	Low	44.5	Very low	170 Å²	170	123.3 Å²	123.3	79%	0.794	61%	0.613	S	S	*	*	H	α-helix	trans	-82	-15.7	172.3	-74.2	-178.5	-32.5	0	0	113.4	K1176 R1177 W1178	K1176-Q1180 WeakPolarHBondContact O-CG 3.39Å; K1176-Q1180 PolarHBondContact O-N 3.35Å; K1176-Q1180 VanDerWaalsContact O-N 3.1Å; R1177-Q1180 PolarHBondContact O-N 3.41Å; W1178-Q1180 VanDerWaalsContact C-N 3.26Å; W1178-Q1180 PolarHBondContact O-N 3.3Å
1181	C	46	Very low	42.5	Very low	101 Å²	101	130.9 Å²	130.9	68%	0.682	65%	0.645	S	S	*	*	H	α-helix	trans	-103.5	-10.9	-175.3	-69	0	0	0	0	115.1	R1177 W1178	R1177-C1181 PolarHBondContact O-N 3.33Å; R1177-C1181 PolarHBondContact O-SG 3.15Å; R1177-C1181 VanDerWaalsContact O-SG 3.38Å; W1178-C1181 PolarHBondContact O-N 3.46Å; W1178-C1181 VanDerWaalsContact O-N 3.12Å
1182	N	35	Very low	41	Very low	90 Å²	90	137.2 Å²	137.2	48%	0.481	68%	0.677	S	S	.	*	S	Bend	trans	-143.2	151.1	-170.2	-101.3	-41.8	0	0	0	115.5	W1178	W1178-N1182 HydrophobicContact CE3-CB 4.4Å; W1178-N1182 HydrophobicContact CZ3-CB 4.37Å; W1178-N1182 VanDerWaalsContact CZ3-ND2 3.32Å; W1178-N1182 WeakPolarHBondContact CZ3-ND2 3.37Å; W1178-N1182 PolarHBondContact O-N 3.31Å
1183	F	30.9	Very low	39.1	Very low	181 Å²	181	139.5 Å²	139.5	79%	0.794	70%	0.696	S	S	*	*			trans	67.2	83.6	176.6	-80.1	-85.5	0	0	0	119.1
1184	R	27.3	Very low	37.1	Very low	231 Å²	231	141.4 Å²	141.4	87%	0.872	71%	0.705	S	S	*	*			trans	-63.3	159.9	130.3	-67.3	175.3	171.3	175.4	-4	109.7
1185	S	26.1	Very low	35.5	Very low	92 Å²	92	146.6 Å²	146.6	64%	0.643	72%	0.72	S	S	*	*			trans	55.4	111.9	177	59.1	0	0	0	0	115.4
1186	F	26.6	Very low	34.2	Very low	203 Å²	203	154.1 Å²	154.1	89%	0.89	74%	0.741	S	S	*	*				-159.3	154.9	73.4	-135.1	-98.4	0	0	0	112.4
1187	S	24.3	Very low	32.6	Very low	99 Å²	99	152.7 Å²	152.7	69%	0.692	75%	0.748	S	S	*	*			trans	-153.5	144.1	167.1	63.5	0	0	0	0	110.9
1188	Q	26.7	Very low	31.3	Very low	175 Å²	175	151.5 Å²	151.5	82%	0.818	76%	0.758	S	S	*	*			trans	160.5	164.4	155.8	-91.9	164.9	14.2	0	0	111.1
1189	T	30	Very low	30.5	Very low	137 Å²	137	149.5 Å²	149.5	84%	0.84	76%	0.76	S	S	*	*			trans	62.4	117	176.7	66.5	0	0	0	0	116.3
1190	A	26.4	Very low	29.6	Very low	93 Å²	93	152.7 Å²	152.7	77%	0.769	77%	0.767	S	S	*	*			cis	100.5	123.8	-0.8	0	0	0	0	0	119.2
1191	E	24.9	Very low	28.9	Very low	185 Å²	185	149.9 Å²	149.9	86%	0.864	76%	0.764	S	S	*	*			trans	82.1	161.4	151.7	-61.5	-169	166.3	0	0	123.7
1192	I	31.1	Very low	27.9	Very low	154 Å²	154	155.2 Å²	155.2	79%	0.79	78%	0.776	S	S	*	*			trans	71.6	110.5	173.1	-44.1	-179.1	0	0	0	115.7
1193	T	25.8	Very low	27.5	Very low	120 Å²	120	153.4 Å²	153.4	74%	0.736	78%	0.778	S	S	*	*			cis	105	119.2	12.8	-50.2	0	0	0	0	115.1
1194	Q	27.1	Very low	27.4	Very low	140 Å²	140	154.2 Å²	154.2	65%	0.654	78%	0.784	S	S	*	*			trans	134.2	140.6	144	-73.2	-163.2	27	0	0	117.6
1195	R	28.2	Very low	27.5	Very low	213 Å²	213	148.2 Å²	148.2	80%	0.804	78%	0.784	S	S	*	*			trans	67.2	157.7	157.9	-64.6	159.4	-153.8	-148.3	5.6	118.4
1196	R	26.1	Very low	27.6	Very low	228 Å²	228	152.6 Å²	152.6	86%	0.86	79%	0.792	S	S	*	*			cis	-167.7	121.4	-43.4	-125	-176.2	-174.3	178.5	1.7	108.8
1197	S	25.1	Very low	27.6	Very low	103 Å²	103	149.1 Å²	149.1	72%	0.72	78%	0.783	S	S	*	*			trans	26.7	131.6	145.3	58.8	0	0	0	0	122.9
1198	V	28.4	Very low	27.8	Very low	139 Å²	139	153.5 Å²	153.5	84%	0.842	78%	0.784	S	S	*	*			trans	-161.4	150.8	140.9	132.7	0	0	0	0	113.5
1199	L	28.2	Very low	27.7	Very low	136 Å²	136	153.5 Å²	153.5	71%	0.712	78%	0.781	S	S	*	*			trans	-26	130.3	-176.9	-74.7	86.5	0	0	0	125
1200	Y	27.1	Very low	27.7	Very low	217 Å²	217	153.1 Å²	153.1	85%	0.851	77%	0.773	S	S	*	*				63.4	163.5	109.7	-74.3	-49.9	0	0	0	124.3
1201	P	35.6	Very low	27.6	Very low	111 Å²	111	153.8 Å²	153.8	72%	0.721	76%	0.756	S	S	*	*			trans	-133.4	175.6	-136.3	45.7	-29.5	0	0	0	118.5
1202	F	24.6	Very low	28	Very low	213 Å²	213	150.2 Å²	150.2	93%	0.934	74%	0.743	S	S	*	*			trans	-132.7	161.1	160.1	-133	-109.5	0	0	0	107.6
1203	G	27.7	Very low	28.1	Very low	52 Å²	52	148 Å²	148	54%	0.536	73%	0.725	S	S	.	*			cis	142.7	98.8	1.7	0	0	0	0	0	110.4
1204	Q	27.6	Very low	28.7	Very low	197 Å²	197	147.7 Å²	147.7	92%	0.921	72%	0.718	S	S	*	*			trans	20.9	112.8	168.9	-54.6	-175.2	25.5	0	0	120.1
1205	A	29.2	Very low	28.9	Very low	105 Å²	105	145.3 Å²	145.3	87%	0.868	71%	0.707	S	S	*	*			trans	-142.4	158.2	155.2	0	0	0	0	0	111.3
1206	K	28.1	Very low	29.3	Very low	185 Å²	185	140.4 Å²	140.4	80%	0.804	71%	0.706	S	S	*	*			trans	-120	142.6	-169	-66.3	168	-178.8	162.5	0	112.5
1207	N	27.1	Very low	30	Very low	130 Å²	130	135.6 Å²	135.6	70%	0.695	70%	0.702	S	S	*	*			trans	42.5	132.5	136.5	-66.3	-29.3	0	0	0	121.7
1208	R	28.6	Very low	30.4	Very low	191 Å²	191	133.6 Å²	133.6	72%	0.721	69%	0.688	S	S	*	*			trans	77.4	129.7	153.3	-57.4	148.9	176.4	-179.1	-4	117.5	L1210	R1208-L1210 HydrophobicContact CB-CD1 4.47Å; R1208-L1210 HydrophobicContact CB-CG 3.91Å; R1208-L1210 PolarHBondContact O-N 2.79Å
1209	F	25	Very low	30.6	Very low	174 Å²	174	131.9 Å²	131.9	76%	0.763	68%	0.681	S	S	*	*			trans	-62.2	110.4	135.2	-80.4	-94.8	0	0	0	107.8	E940	E940-F1209 HydrophobicContact CG-CB 4.4Å; E940-F1209 WeakPolarHBondContact OE2-CB 3.47Å
1210	L	29.3	Very low	30.9	Very low	129 Å²	129	128 Å²	128	68%	0.675	67%	0.674	S	S	*	*			trans	-99.7	110.1	169.3	-91.4	165.6	0	0	0	109	R1208 N1212	R1208-L1210 HydrophobicContact CB-CD1 4.47Å; R1208-L1210 HydrophobicContact CB-CG 3.91Å; R1208-L1210 PolarHBondContact O-N 2.79Å; L1210-N1212 PolarHBondContact O-N 3.4Å; L1210-N1212 VanDerWaalsContact O-N 3.12Å
1211	W	25.6	Very low	31.2	Very low	107 Å²	107	125 Å²	125	41%	0.405	66%	0.662	S	S	.	*			trans	-64.3	108.3	171.1	-176.6	89	0	0	0	109.8	S941 V942 T943 R1213	S941-W1211 WeakPolarHBondContact OG-CB 3.42Å; V942-W1211 HydrophobicContact CB-CD2 3.98Å; V942-W1211 HydrophobicContact CB-CE3 3.69Å; V942-W1211 HydrophobicContact CB-CH2 4.03Å; V942-W1211 HydrophobicContact CB-CZ2 4.35Å; V942-W1211 HydrophobicContact CB-CZ3 3.69Å; V942-W1211 HydrophobicContact CG1-CZ3 4.32Å; V942-W1211 HydrophobicContact CG2-CB 3.84Å; V942-W1211 HydrophobicContact CG2-CD2 3.41Å; V942-W1211 VanDerWaalsContact CG2-CD2 3.41Å; V942-W1211 HydrophobicContact CG2-CE3 3.28Å; V942-W1211 HydrophobicContact CG2-CG 3.7Å; V942-W1211 HydrophobicContact CG2-CH2 4.49Å; V942-W1211 HydrophobicContact CG2-CZ3 3.84Å; V942-W1211 VanDerWaalsContact O-CE2 3.24Å; V942-W1211 WeakPolarHBondContact O-CH2 3.42Å; V942-W1211 WeakPolarHBondContact O-CZ2 3.41Å; T943-W1211 WeakPolarHBondContact O-CH2 3.38Å; T943-W1211 VanDerWaalsContact O-CZ2 3.3Å; T943-W1211 WeakPolarHBondContact O-CZ2 3.46Å; T943-W1211 WeakPolarHBondContact OG1-CH2 3.41Å; W1211-R1213 HydrophobicContact CE3-CB 4.07Å; W1211-R1213 HydrophobicContact CE3-CG 4.48Å; W1211-R1213 HydrophobicContact CH2-CB 4.03Å; W1211-R1213 HydrophobicContact CH2-CG 3.58Å; W1211-R1213 HydrophobicContact CZ3-CB 3.57Å; W1211-R1213 HydrophobicContact CZ3-CG 3.53Å; W1211-R1213 VanDerWaalsContact CZ3-NE 3.28Å
1212	N	31.7	Very low	31.3	Very low	110 Å²	110	125.1 Å²	125.1	59%	0.588	66%	0.656	S	S	*	*			trans	-88.5	135.3	172.6	-170.3	3.9	0	0	0	109.7	L1210 N1214	L1210-N1212 PolarHBondContact O-N 3.4Å; L1210-N1212 VanDerWaalsContact O-N 3.12Å; N1212-N1214 PolarHBondContact OD1-N 2.74Å
1213	R	33.6	Very low	31.7	Very low	109 Å²	109	121.7 Å²	121.7	41%	0.411	64%	0.643	S	S	.	*	S	Bend	trans	-99.7	-9	-168.9	-168.3	179.6	-122.2	172.3	2.6	113.6	T943 W1211	T943-R1213 PolarHBondContact OG1-NH2 3.01Å; W1211-R1213 HydrophobicContact CE3-CB 4.07Å; W1211-R1213 HydrophobicContact CE3-CG 4.48Å; W1211-R1213 HydrophobicContact CH2-CB 4.03Å; W1211-R1213 HydrophobicContact CH2-CG 3.58Å; W1211-R1213 HydrophobicContact CZ3-CB 3.57Å; W1211-R1213 HydrophobicContact CZ3-CG 3.53Å; W1211-R1213 VanDerWaalsContact CZ3-NE 3.28Å
1214	N	37.7	Very low	31.8	Very low	112 Å²	112	126.7 Å²	126.7	60%	0.599	66%	0.656	S	S	*	*			trans	-119.3	14.6	-163.8	-64.4	15.8	0	0	0	114	N1212 S1216 T1217	N1212-N1214 PolarHBondContact OD1-N 2.74Å; N1214-S1216 PolarHBondContact O-N 3.01Å; N1214-T1217 PolarHBondContact O-OG1 3.42Å
1215	E	32.2	Very low	32.3	Very low	91 Å²	91	123 Å²	123	43%	0.425	64%	0.642	S	S	.	*	G	3₁₀ helix	trans	-68.3	-15.5	-179.4	-112	175.9	-158.5	0	0	113.7	T1217 S1218 R1249	E1215-T1217 PolarHBondContact O-N 3.43Å; E1215-S1218 PolarHBondContact O-N 3.21Å; E1215-S1218 PolarHBondContact O-OG 3.47Å; E1215-R1249 IonicContact OE1-CZ 2.64Å; E1215-R1249 IonicContact OE1-NH1 3.56Å; E1215-R1249 PolarHBondContact OE1-NH1 3.14Å; E1215-R1249 IonicContact OE1-NH2 3.65Å; E1215-R1249 PolarHBondContact OE1-NH2 3.15Å; E1215-R1249 IonicContact OE2-CZ 3.1Å; E1215-R1249 IonicContact OE2-NH1 3.96Å; E1215-R1249 PolarHBondContact OE2-NH1 3.31Å; E1215-R1249 IonicContact OE2-NH2 2.65Å; E1215-R1249 PolarHBondContact OE2-NH2 3.14Å
1216	S	37.5	Very low	32.6	Very low	109 Å²	109	124.8 Å²	124.8	76%	0.762	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-69.2	12.3	-179.8	65.2	0	0	0	0	115.5	N1214	N1214-S1216 PolarHBondContact O-N 3.01Å
1217	T	40.2	Very low	32.7	Very low	128 Å²	128	123.7 Å²	123.7	79%	0.785	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-129.1	15.9	176	63	0	0	0	0	112.5	N1214 E1215	N1214-T1217 PolarHBondContact O-OG1 3.42Å; E1215-T1217 PolarHBondContact O-N 3.43Å
1218	S	34	Very low	32.7	Very low	60 Å²	60	122.4 Å²	122.4	42%	0.42	63%	0.633	S	S	.	*			trans	-92.4	126.6	177	61.5	0	0	0	0	111.5	E1215 G1220 Y1221	E1215-S1218 PolarHBondContact O-N 3.21Å; E1215-S1218 PolarHBondContact O-OG 3.47Å; S1218-G1220 VanDerWaalsContact C-N 3.3Å; S1218-G1220 PolarHBondContact O-N 3.22Å; S1218-Y1221 PolarHBondContact O-N 3.39Å
1219	C	32.1	Very low	32.7	Very low	103 Å²	103	118.1 Å²	118.1	70%	0.696	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-37.3	-167.8	-166.5	0	0	0	0	113.9	Y1221 I1222	C1219-Y1221 PolarHBondContact O-N 2.71Å; C1219-Y1221 VanDerWaalsContact O-N 3.13Å; C1219-I1222 PolarHBondContact O-N 2.81Å
1220	G	35.1	Very low	32.8	Very low	56 Å²	56	116.7 Å²	116.7	58%	0.577	63%	0.633	S	S	*	*	H	α-helix	trans	-65.2	-16.1	-175.2	0	0	0	0	0	116.2	S1218	S1218-G1220 VanDerWaalsContact C-N 3.3Å; S1218-G1220 PolarHBondContact O-N 3.22Å
1221	Y	32.8	Very low	32.8	Very low	153 Å²	153	119.3 Å²	119.3	60%	0.6	64%	0.639	S	S	*	*	H	α-helix	trans	-80.4	-24.7	179	-169.9	-107	0	0	0	113.3	S1218 C1219 L1225	S1218-Y1221 PolarHBondContact O-N 3.39Å; C1219-Y1221 PolarHBondContact O-N 2.71Å; C1219-Y1221 VanDerWaalsContact O-N 3.13Å; Y1221-L1225 HydrophobicContact CE1-CD1 4.44Å
1222	I	37.8	Very low	32.9	Very low	113 Å²	113	120.9 Å²	120.9	58%	0.579	66%	0.656	S	S	*	*	H	α-helix	trans	-78.2	-37.9	-176.6	-64.4	176	0	0	0	111	C1219 L1224 L1225	C1219-I1222 PolarHBondContact O-N 2.81Å; I1222-L1224 VanDerWaalsContact C-N 3.33Å; I1222-L1224 PolarHBondContact O-N 3.25Å; I1222-L1225 PolarHBondContact O-N 2.97Å
1223	Q	32.7	Very low	32.4	Very low	142 Å²	142	121 Å²	121	66%	0.664	66%	0.664	S	S	*	*	H	α-helix	trans	-71.7	-25.6	-170.9	-157	140.9	9.1	0	0	113.9	L1225	Q1223-L1225 VanDerWaalsContact C-N 3.29Å; Q1223-L1225 PolarHBondContact O-N 3.1Å
1224	L	31.1	Very low	32.2	Very low	157 Å²	157	120.7 Å²	120.7	82%	0.822	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-3.1	-179.1	-105.5	164.7	0	0	0	114.7	I1222	I1222-L1224 VanDerWaalsContact C-N 3.33Å; I1222-L1224 PolarHBondContact O-N 3.25Å
1225	L	37.1	Very low	31.9	Very low	119 Å²	119	122.5 Å²	122.5	62%	0.623	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	2.5	180	-82.5	165.2	0	0	0	114	Y1221 I1222 Q1223	Y1221-L1225 HydrophobicContact CE1-CD1 4.44Å; I1222-L1225 PolarHBondContact O-N 2.97Å; Q1223-L1225 VanDerWaalsContact C-N 3.29Å; Q1223-L1225 PolarHBondContact O-N 3.1Å
1226	Q	36.4	Very low	31.5	Very low	142 Å²	142	127.7 Å²	127.7	66%	0.664	72%	0.715	S	S	*	*	S	Bend	trans	-120.1	-10.4	-172	-63.9	-167.2	-68.8	0	0	115.7
1227	M	29.3	Very low	31.1	Very low	162 Å²	162	128.9 Å²	128.9	80%	0.798	71%	0.706	S	S	*	*			trans	-103.7	97.1	-176.7	-61.1	-82.2	72.3	0	0	111.2
1228	S	27.7	Very low	30.7	Very low	103 Å²	103	127.3 Å²	127.3	72%	0.72	71%	0.706	S	S	*	*			trans	-91.1	150.9	157.6	-58.6	0	0	0	0	108.8
1229	S	27.6	Very low	30.4	Very low	102 Å²	102	132.8 Å²	132.8	71%	0.713	72%	0.719	S	S	*	*	S	Bend	trans	62.1	119.1	175.6	34.5	0	0	0	0	117.7
1230	D	27.4	Very low	30.2	Very low	143 Å²	143	134.4 Å²	134.4	77%	0.765	72%	0.721	S	S	*	*			trans	79.1	155.7	141.2	-46.2	-21.7	0	0	0	122.4
1231	F	28.9	Very low	29.7	Very low	184 Å²	184	139.3 Å²	139.3	81%	0.807	73%	0.728	S	S	*	*			trans	74.2	91	168.6	-71.3	-76.7	0	0	0	122.6
1232	D	27.7	Very low	29.3	Very low	140 Å²	140	139.8 Å²	139.8	75%	0.749	74%	0.742	S	S	*	*				37.5	114.7	121.8	-65.9	-31.9	0	0	0	123.2
1233	C	22	Very low	28.8	Very low	114 Å²	114	138.9 Å²	138.9	77%	0.77	75%	0.745	S	S	*	*				26.2	112.6	124.1	-163.4	0	0	0	0	120.1
1234	S	29	Very low	28.5	Very low	101 Å²	101	137 Å²	137	71%	0.706	75%	0.754	S	S	*	*				169	122.1	100.9	50	0	0	0	0	114.5
1235	T	31.8	Very low	28.3	Very low	150 Å²	150	136.4 Å²	136.4	92%	0.92	75%	0.752	S	S	*	*			trans	175.2	135.5	137.8	23.9	0	0	0	0	110
1236	K	24.1	Very low	27.9	Very low	200 Å²	200	138.6 Å²	138.6	87%	0.87	76%	0.763	S	S	*	*			trans	-125.1	169	174.5	-76.6	-177.1	177.5	176.8	0	109.5
1237	K	28.9	Very low	27.5	Very low	134 Å²	134	138.6 Å²	138.6	58%	0.583	76%	0.763	S	S	*	*			trans	93	76.1	161.2	-55.5	-170.3	173.6	-170.5	0	118.4	Y1239 Y1408	K1237-Y1239 HydrophobicContact CG-CE2 4.49Å; K1237-Y1408 WeakPolarHBondContact CE-O 3.34Å; K1237-Y1408 PolarHBondContact NZ-O 2.66Å
1238	A	31.7	Very low	27.4	Very low	95 Å²	95	137.3 Å²	137.3	79%	0.785	76%	0.764	S	S	*	*				-150.4	108	129.7	0	0	0	0	0	105.8
1239	Y	27.6	Very low	27.4	Very low	176 Å²	176	140 Å²	140	69%	0.69	76%	0.758	S	S	*	*				49	119.1	60.6	-72.5	-91.6	0	0	0	112.7	K1237	K1237-Y1239 HydrophobicContact CG-CE2 4.49Å
1240	N	27.7	Very low	27.4	Very low	136 Å²	136	144.6 Å²	144.6	73%	0.727	77%	0.766	S	S	*	*			cis	-158.2	-177.3	-11.3	-144.2	7.1	0	0	0	110.4
1241	E	24.6	Very low	27.5	Very low	159 Å²	159	140.9 Å²	140.9	74%	0.743	75%	0.751	S	S	*	*	S	Bend	trans	75.3	156.4	173.6	-50.4	-177.4	177.4	0	0	116.4
1242	N	25.2	Very low	28	Very low	164 Å²	164	136.4 Å²	136.4	88%	0.877	74%	0.743	S	S	*	*	S	Bend	trans	64.7	46.5	171.6	-58.8	-51.8	0	0	0	119.8
1243	S	27.5	Very low	28.5	Very low	93 Å²	93	134.6 Å²	134.6	65%	0.65	73%	0.73	S	S	*	*			trans	-146.4	29.7	171.8	59.2	0	0	0	0	117.8	N1245	S1243-N1245 PolarHBondContact O-N 3.43Å
1244	A	26	Very low	29.1	Very low	104 Å²	104	134.3 Å²	134.3	86%	0.86	72%	0.72	S	S	*	*			trans	-79.1	53.1	176.4	0	0	0	0	0	114.5
1245	N	26.5	Very low	29.8	Very low	144 Å²	144	134.1 Å²	134.1	77%	0.77	71%	0.711	S	S	*	*			trans	-157.1	50.6	176.5	-99.5	-42.2	0	0	0	112.8	S1243	S1243-N1245 PolarHBondContact O-N 3.43Å
1246	L	28.6	Very low	30.1	Very low	165 Å²	165	131.2 Å²	131.2	86%	0.864	69%	0.689	S	S	*	*			trans	-89.8	111.3	176.2	-96	158.3	0	0	0	111.6
1247	H	27.9	Very low	30.6	Very low	141 Å²	141	125 Å²	125	65%	0.653	67%	0.67	S	S	*	*			trans	-79.3	128.1	-178.5	-66.4	-98.1	0	0	0	112.5	R1249	H1247-R1249 HydrophobicContact CB-CG 3.86Å; H1247-R1249 PolarHBondContact O-N 2.81Å; H1247-R1249 VanDerWaalsContact O-N 3.1Å
1248	V	27.2	Very low	30.9	Very low	136 Å²	136	123.7 Å²	123.7	82%	0.824	67%	0.669	S	S	*	*			trans	-79	87.5	157.9	-176.9	0	0	0	0	108.5
1249	R	27.9	Very low	31.3	Very low	159 Å²	159	123.7 Å²	123.7	60%	0.6	66%	0.655	S	S	*	*			trans	-82.5	109.8	173.7	-65.5	-176.1	-179.2	-179.7	1.1	109.6	E1215 H1247 S1251	E1215-R1249 IonicContact OE1-CZ 2.64Å; E1215-R1249 IonicContact OE1-NH1 3.56Å; E1215-R1249 PolarHBondContact OE1-NH1 3.14Å; E1215-R1249 IonicContact OE1-NH2 3.65Å; E1215-R1249 PolarHBondContact OE1-NH2 3.15Å; E1215-R1249 IonicContact OE2-CZ 3.1Å; E1215-R1249 IonicContact OE2-NH1 3.96Å; E1215-R1249 PolarHBondContact OE2-NH1 3.31Å; E1215-R1249 IonicContact OE2-NH2 2.65Å; E1215-R1249 PolarHBondContact OE2-NH2 3.14Å; H1247-R1249 HydrophobicContact CB-CG 3.86Å; H1247-R1249 PolarHBondContact O-N 2.81Å; H1247-R1249 VanDerWaalsContact O-N 3.1Å; R1249-S1251 PolarHBondContact O-N 3.33Å
1250	F	26.4	Very low	31.7	Very low	198 Å²	198	123.6 Å²	123.6	87%	0.868	65%	0.653	S	S	*	*			trans	-62	123.4	165.3	-88.7	-86.1	0	0	0	109.7	S1252	F1250-S1252 PolarHBondContact O-N 3.11Å
1251	S	30.7	Very low	32.2	Very low	66 Å²	66	121.2 Å²	121.2	46%	0.462	65%	0.648	S	S	.	*			trans	-69.8	128.3	176.8	61.4	0	0	0	0	110.4	R1249 E1253 L1254	R1249-S1251 PolarHBondContact O-N 3.33Å; S1251-E1253 PolarHBondContact O-N 3.45Å; S1251-L1254 PolarHBondContact O-N 2.93Å; S1251-L1254 WeakPolarHBondContact OG-CB 3.39Å; S1251-L1254 PolarHBondContact OG-N 3.41Å
1252	S	39.1	Very low	32.6	Very low	89 Å²	89	123.1 Å²	123.1	62%	0.622	65%	0.648	S	S	*	*	H	α-helix	trans	-58	-28.7	169.4	48.1	0	0	0	0	111.2	F1250 L1255 L1256	F1250-S1252 PolarHBondContact O-N 3.11Å; S1252-L1255 PolarHBondContact O-N 2.85Å; S1252-L1256 WeakPolarHBondContact O-CB 3.46Å; S1252-L1256 VanDerWaalsContact O-CG 3.25Å; S1252-L1256 WeakPolarHBondContact O-CG 3.44Å; S1252-L1256 PolarHBondContact O-N 2.94Å
1253	E	37.4	Very low	33.1	Very low	102 Å²	102	123.9 Å²	123.9	48%	0.477	64%	0.643	S	S	.	*	H	α-helix	trans	-70	-36.2	-179.5	-165.4	161.6	-128.7	0	0	113.9	S1251 L1255 L1256 S1257	S1251-E1253 PolarHBondContact O-N 3.45Å; E1253-L1255 VanDerWaalsContact C-N 3.33Å; E1253-L1256 CarbonylContact O-C 3.52Å; E1253-L1256 PolarHBondContact O-N 3.34Å; E1253-S1257 VanDerWaalsContact O-CB 3.25Å; E1253-S1257 WeakPolarHBondContact O-CB 3.39Å; E1253-S1257 PolarHBondContact O-N 2.89Å
1254	L	36.4	Very low	33.3	Very low	109 Å²	109	126.3 Å²	126.3	57%	0.571	65%	0.648	S	S	*	*	H	α-helix	trans	-69.2	-35.9	174.8	-165.1	149.5	0	0	0	110.8	S1251 S1257 L1258	S1251-L1254 PolarHBondContact O-N 2.93Å; S1251-L1254 WeakPolarHBondContact OG-CB 3.39Å; S1251-L1254 PolarHBondContact OG-N 3.41Å; L1254-S1257 PolarHBondContact O-N 3.02Å; L1254-L1258 HydrophobicContact CD2-CD1 3.81Å; L1254-L1258 HydrophobicContact CD2-CG 4.4Å; L1254-L1258 WeakPolarHBondContact O-CG 3.4Å; L1254-L1258 PolarHBondContact O-N 3.3Å
1255	L	43.1	Very low	33.4	Very low	97 Å²	97	129 Å²	129	51%	0.508	65%	0.647	S	S	.	*	H	α-helix	trans	-66.2	-40.8	171.4	-157.4	96.6	0	0	0	112	S1252 E1253 I1259	S1252-L1255 PolarHBondContact O-N 2.85Å; E1253-L1255 VanDerWaalsContact C-N 3.33Å; L1255-I1259 HydrophobicContact CD2-CD1 4.36Å; L1255-I1259 WeakPolarHBondContact O-CD1 3.49Å; L1255-I1259 VanDerWaalsContact O-CG1 3.26Å; L1255-I1259 WeakPolarHBondContact O-CG1 3.47Å; L1255-I1259 PolarHBondContact O-N 2.88Å; L1255-I1259 VanDerWaalsContact O-N 3.13Å
1256	L	36.9	Very low	33.6	Very low	89 Å²	89	130.5 Å²	130.5	47%	0.466	65%	0.649	S	S	.	*	H	α-helix	trans	-70.7	-31	176	-75.4	166.4	0	0	0	112.5	S1252 E1253 I1259 R1260	S1252-L1256 WeakPolarHBondContact O-CB 3.46Å; S1252-L1256 VanDerWaalsContact O-CG 3.25Å; S1252-L1256 WeakPolarHBondContact O-CG 3.44Å; S1252-L1256 PolarHBondContact O-N 2.94Å; E1253-L1256 CarbonylContact O-C 3.52Å; E1253-L1256 PolarHBondContact O-N 3.34Å; L1256-I1259 CarbonylContact O-C 3.44Å; L1256-I1259 PolarHBondContact O-N 3.12Å; L1256-R1260 WeakPolarHBondContact O-CB 3.41Å; L1256-R1260 WeakPolarHBondContact O-CG 3.26Å; L1256-R1260 PolarHBondContact O-N 3.15Å
1257	S	35.1	Very low	33.7	Very low	68 Å²	68	130.1 Å²	130.1	48%	0.476	64%	0.642	S	S	.	*	H	α-helix	trans	-67.8	-45.6	173.5	-171.3	0	0	0	0	110.7	E1253 L1254 I1259 R1260 S1261	E1253-S1257 VanDerWaalsContact O-CB 3.25Å; E1253-S1257 WeakPolarHBondContact O-CB 3.39Å; E1253-S1257 PolarHBondContact O-N 2.89Å; L1254-S1257 PolarHBondContact O-N 3.02Å; S1257-I1259 PolarHBondContact O-N 3.27Å; S1257-R1260 PolarHBondContact O-N 2.91Å; S1257-R1260 VanDerWaalsContact O-N 3.13Å; S1257-S1261 PolarHBondContact O-N 3.16Å; S1257-S1261 PolarHBondContact O-OG 3.42Å
1258	L	36.4	Very low	33.8	Very low	107 Å²	107	129.5 Å²	129.5	56%	0.56	64%	0.644	S	S	*	*	H	α-helix	trans	-61.9	-20.2	170.5	-73.4	170.6	0	0	0	114.1	L1254	L1254-L1258 HydrophobicContact CD2-CD1 3.81Å; L1254-L1258 HydrophobicContact CD2-CG 4.4Å; L1254-L1258 WeakPolarHBondContact O-CG 3.4Å; L1254-L1258 PolarHBondContact O-N 3.3Å
1259	I	39	Very low	33.9	Very low	95 Å²	95	132 Å²	132	49%	0.487	65%	0.646	S	S	.	*	H	α-helix	trans	-88.5	-37.1	172.8	-70.6	164.5	0	0	0	111.3	L1255 L1256 S1257	L1255-I1259 HydrophobicContact CD2-CD1 4.36Å; L1255-I1259 WeakPolarHBondContact O-CD1 3.49Å; L1255-I1259 VanDerWaalsContact O-CG1 3.26Å; L1255-I1259 WeakPolarHBondContact O-CG1 3.47Å; L1255-I1259 PolarHBondContact O-N 2.88Å; L1255-I1259 VanDerWaalsContact O-N 3.13Å; L1256-I1259 CarbonylContact O-C 3.44Å; L1256-I1259 PolarHBondContact O-N 3.12Å; S1257-I1259 PolarHBondContact O-N 3.27Å
1260	R	35.8	Very low	33.9	Very low	174 Å²	174	129.4 Å²	129.4	66%	0.657	64%	0.644	S	S	*	*	H	α-helix	trans	-67.2	-48.2	176.4	-82	174.9	166.8	154.4	-5	111.9	L1256 S1257 R1262 K1263	L1256-R1260 WeakPolarHBondContact O-CB 3.41Å; L1256-R1260 WeakPolarHBondContact O-CG 3.26Å; L1256-R1260 PolarHBondContact O-N 3.15Å; S1257-R1260 PolarHBondContact O-N 2.91Å; S1257-R1260 VanDerWaalsContact O-N 3.13Å; R1260-R1262 PolarHBondContact O-N 3.27Å; R1260-R1262 VanDerWaalsContact O-N 3.11Å; R1260-K1263 PolarHBondContact O-N 3.23Å
1261	S	37.8	Very low	34.1	Very low	87 Å²	87	127 Å²	127	61%	0.608	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-16.6	-177.8	59.1	0	0	0	0	114.1	S1257	S1257-S1261 PolarHBondContact O-N 3.16Å; S1257-S1261 PolarHBondContact O-OG 3.42Å
1262	R	34.1	Very low	34.1	Very low	198 Å²	198	130 Å²	130	75%	0.747	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	9.8	179.6	-137.5	174	-173.3	135.6	1.6	114.5	R1260	R1260-R1262 PolarHBondContact O-N 3.27Å; R1260-R1262 VanDerWaalsContact O-N 3.11Å
1263	K	34.9	Very low	33.5	Very low	180 Å²	180	131.1 Å²	131.1	78%	0.783	66%	0.664	S	S	*	*	S	Bend	trans	-118.9	20.7	-166.4	-144.5	-169.9	-179.7	-168.3	0	115.8	R1260	R1260-K1263 PolarHBondContact O-N 3.23Å
1264	I	31.6	Very low	33.1	Very low	145 Å²	145	131.2 Å²	131.2	74%	0.744	68%	0.675	S	S	*	*	S	Bend	trans	-111.6	-13.9	-167.1	-73.2	176.5	0	0	0	114.9
1265	L	29.4	Very low	32.8	Very low	159 Å²	159	130.9 Å²	130.9	83%	0.832	68%	0.683	S	S	*	*	S	Bend	trans	-122.5	146.7	-176	-78.3	168.7	0	0	0	114.7
1266	H	30.3	Very low	32.3	Very low	177 Å²	177	131.8 Å²	131.8	82%	0.819	69%	0.692	S	S	*	*			trans	62.1	92	179.2	-81	-72.5	0	0	0	118.6
1267	H	30.4	Very low	32.1	Very low	156 Å²	156	136.3 Å²	136.3	72%	0.722	71%	0.711	S	S	*	*			trans	-83.6	175.7	145.2	-136.2	-99.5	0	0	0	110.4
1268	D	29.5	Very low	32.7	Very low	128 Å²	128	136.9 Å²	136.9	68%	0.684	72%	0.715	S	S	*	*			trans	81.8	152.9	158.4	-56.6	-24.4	0	0	0	122.2
1269	H	29.4	Very low	33.1	Very low	189 Å²	189	135.8 Å²	135.8	88%	0.875	71%	0.712	S	S	*	*			trans	74.3	127.6	177.9	-70.5	-79.2	0	0	0	120.8
1270	L	28.8	Very low	33.6	Very low	105 Å²	105	135 Å²	135	55%	0.55	71%	0.709	S	S	.	*			trans	-113.9	170.2	179.2	-82.1	155.3	0	0	0	110.3
1271	H	29.4	Very low	34.6	Very low	146 Å²	146	130 Å²	130	68%	0.676	70%	0.701	S	S	*	*			trans	65.4	96.6	162.8	-42.1	-65.7	0	0	0	118.5	D1143	D1143-H1271 IonicContact OD1-CE1 2.91Å; D1143-H1271 PolarHBondContact OD1-CE1 3.49Å
1272	S	30.7	Very low	35.5	Very low	131 Å²	131	132.5 Å²	132.5	92%	0.916	71%	0.705	S	S	*	*				-155	157.9	129.6	60.5	0	0	0	0	110.1
1273	S	27.5	Very low	36.7	Very low	111 Å²	111	124.7 Å²	124.7	78%	0.776	68%	0.678	S	S	*	*			trans	-107	169.6	-171.3	52.6	0	0	0	0	113.4
1274	S	28.1	Very low	38	Very low	104 Å²	104	118 Å²	118	73%	0.727	65%	0.65	S	S	*	*			trans	79.1	158.7	169.9	79.9	0	0	0	0	118.7
1275	S	30.2	Very low	39.7	Very low	103 Å²	103	116.7 Å²	116.7	72%	0.72	64%	0.641	S	S	*	*			trans	54.3	77.8	177.5	60.1	0	0	0	0	117.9
1276	T	33.7	Very low	41.4	Very low	115 Å²	115	110.9 Å²	110.9	71%	0.706	61%	0.614	S	S	*	*			trans	-106.4	-8.1	175.2	48.2	0	0	0	0	115.7	S1278	T1276-S1278 PolarHBondContact O-N 3.48Å
1277	E	33.1	Very low	43.1	Very low	185 Å²	185	102.8 Å²	102.8	86%	0.864	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-22.3	-171.4	-62.9	-169.5	137.8	0	0	114.6
1278	S	47.2	Very low	44.7	Very low	79 Å²	79	97.4 Å²	97.4	55%	0.552	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-32.7	177.6	55.3	0	0	0	0	113.4	T1276 D1280 S1281	T1276-S1278 PolarHBondContact O-N 3.48Å; S1278-D1280 PolarHBondContact O-N 3.05Å; S1278-S1281 WeakPolarHBondContact O-CB 3.44Å; S1278-S1281 PolarHBondContact O-N 2.93Å; S1278-S1281 PolarHBondContact O-OG 3.47Å
1279	V	45.1	Very low	46.4	Very low	84 Å²	84	99.5 Å²	99.5	51%	0.509	55%	0.55	S	S	.	.	H	α-helix	trans	-69.7	-35.8	-168	-174.4	0	0	0	0	112.5	S1281	V1279-S1281 PolarHBondContact O-N 2.67Å
1280	D	48.2	Very low	48.1	Very low	78 Å²	78	91.1 Å²	91.1	42%	0.417	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-28.2	178.7	-130.1	46.2	0	0	0	111.3	K1166 S1278 N1284	K1166-D1280 IonicContact NZ-OD2 2.71Å; K1166-D1280 PolarHBondContact NZ-OD2 3.34Å; S1278-D1280 PolarHBondContact O-N 3.05Å; D1280-N1284 WeakPolarHBondContact O-CB 3.38Å; D1280-N1284 PolarHBondContact O-N 2.99Å
1281	S	56.6	Low	49.5	Very low	71 Å²	71	86.5 Å²	86.5	50%	0.497	49%	0.488	S	S	.	.	H	α-helix	trans	-71.9	-44.6	-177.3	76	0	0	0	0	113.6	S1278 V1279 L1283 N1284 H1285	S1278-S1281 WeakPolarHBondContact O-CB 3.44Å; S1278-S1281 PolarHBondContact O-N 2.93Å; S1278-S1281 PolarHBondContact O-OG 3.47Å; V1279-S1281 PolarHBondContact O-N 2.67Å; S1281-L1283 VanDerWaalsContact C-N 3.33Å; S1281-L1283 PolarHBondContact O-N 2.94Å; S1281-N1284 WeakPolarHBondContact O-CB 3.36Å; S1281-N1284 PolarHBondContact O-N 3.2Å; S1281-H1285 PolarHBondContact O-N 2.87Å
1282	M	56.6	Low	50.9	Low	138 Å²	138	81.8 Å²	81.8	68%	0.68	47%	0.474	S	S	*	.	H	α-helix	trans	-65.8	-36.9	177.1	-76.8	-173.5	70.2	0	0	111.8	H1285 S1286	M1282-H1285 PolarHBondContact O-N 3.31Å; M1282-S1286 WeakPolarHBondContact O-CB 3.3Å; M1282-S1286 PolarHBondContact O-N 2.92Å; M1282-S1286 PolarHBondContact O-OG 3.31Å
1283	L	59.9	Low	52.2	Low	35 Å²	35	78.5 Å²	78.5	18%	0.183	44%	0.444	C	S	.	.	H	α-helix	trans	-67.5	-39.1	173.6	-96.5	166.2	0	0	0	111.7	L1163 S1281 S1286 M1287	L1163-L1283 HydrophobicContact CD1-CB 4.41Å; L1163-L1283 HydrophobicContact CD2-CB 4.22Å; L1163-L1283 HydrophobicContact CD2-CD2 4.39Å; S1281-L1283 VanDerWaalsContact C-N 3.33Å; S1281-L1283 PolarHBondContact O-N 2.94Å; L1283-S1286 PolarHBondContact O-OG 3.46Å; L1283-M1287 WeakPolarHBondContact O-CB 3.43Å; L1283-M1287 PolarHBondContact O-N 3.45Å; L1283-M1287 VanDerWaalsContact O-N 3.07Å
1284	N	63.4	Low	53.6	Low	38 Å²	38	73.6 Å²	73.6	20%	0.203	41%	0.409	C	S	.	.	H	α-helix	trans	-61	-50.3	172.1	-126.3	13.3	0	0	0	111.2	D1280 S1281 M1287 Q1288	D1280-N1284 WeakPolarHBondContact O-CB 3.38Å; D1280-N1284 PolarHBondContact O-N 2.99Å; S1281-N1284 WeakPolarHBondContact O-CB 3.36Å; S1281-N1284 PolarHBondContact O-N 3.2Å; N1284-M1287 PolarHBondContact O-N 2.98Å; N1284-Q1288 WeakPolarHBondContact O-CB 3.35Å; N1284-Q1288 VanDerWaalsContact O-CG 3.3Å; N1284-Q1288 WeakPolarHBondContact O-CG 3.5Å; N1284-Q1288 PolarHBondContact O-N 3.24Å; N1284-Q1288 PolarHBondContact O-OE1 2.98Å
1285	H	66.5	Low	54.8	Low	119 Å²	119	73.5 Å²	73.5	55%	0.551	40%	0.4	S	S	*	.	H	α-helix	trans	-66.6	-42.9	-176.1	-169.8	-19.9	0	0	0	112.6	S1281 M1282 Q1288 R1289	S1281-H1285 PolarHBondContact O-N 2.87Å; M1282-H1285 PolarHBondContact O-N 3.31Å; H1285-Q1288 PolarHBondContact O-N 3.47Å; H1285-R1289 WeakPolarHBondContact O-CB 3.46Å; H1285-R1289 PolarHBondContact O-N 3.2Å
1286	S	64.7	Low	55.9	Low	37 Å²	37	78.6 Å²	78.6	26%	0.259	40%	0.403	S	S	.	.	H	α-helix	trans	-65.2	-39.1	176.5	52.6	0	0	0	0	111.8	M1282 L1283 R1289 L1290	M1282-S1286 WeakPolarHBondContact O-CB 3.3Å; M1282-S1286 PolarHBondContact O-N 2.92Å; M1282-S1286 PolarHBondContact O-OG 3.31Å; L1283-S1286 PolarHBondContact O-OG 3.46Å; S1286-R1289 WeakPolarHBondContact O-CB 3.48Å; S1286-R1289 PolarHBondContact O-N 3.24Å; S1286-L1290 PolarHBondContact O-N 3.02Å
1287	M	66.4	Low	56.7	Low	6 Å²	6	74.4 Å²	74.4	3%	0.03	38%	0.377	C	S	.	.	H	α-helix	trans	-76.3	-29.6	178.1	-144.8	-132.7	69.2	0	0	112.6	L1163 A1167 L1283 N1284 C1291 I1339 L1347	L1163-M1287 HydrophobicContact CD2-CB 4.35Å; L1163-M1287 HydrophobicContact CD2-SD 4.2Å; A1167-M1287 HydrophobicContact CB-CE 3.32Å; L1283-M1287 WeakPolarHBondContact O-CB 3.43Å; L1283-M1287 PolarHBondContact O-N 3.45Å; L1283-M1287 VanDerWaalsContact O-N 3.07Å; N1284-M1287 PolarHBondContact O-N 2.98Å; M1287-C1291 VanDerWaalsContact CE-SG 3.53Å; M1287-C1291 PolarHBondContact O-N 3.48Å; M1287-C1291 PolarHBondContact O-SG 3.08Å; M1287-I1339 HydrophobicContact CB-CD1 4.25Å; M1287-I1339 HydrophobicContact CG-CD1 4.24Å; M1287-L1347 HydrophobicContact CE-CD1 3.62Å
1288	Q	64.8	Low	57.5	Low	44 Å²	44	71 Å²	71	21%	0.206	36%	0.364	C	S	.	.	H	α-helix	trans	-62.1	-42.3	164.8	-79.2	173.1	-67.6	0	0	111.6	A1167 N1284 H1285 C1291 A1292	A1167-Q1288 HydrophobicContact CB-CG 4.11Å; N1284-Q1288 WeakPolarHBondContact O-CB 3.35Å; N1284-Q1288 VanDerWaalsContact O-CG 3.3Å; N1284-Q1288 WeakPolarHBondContact O-CG 3.5Å; N1284-Q1288 PolarHBondContact O-N 3.24Å; N1284-Q1288 PolarHBondContact O-OE1 2.98Å; H1285-Q1288 PolarHBondContact O-N 3.47Å; Q1288-C1291 CarbonylContact O-C 3.57Å; Q1288-C1291 WeakPolarHBondContact O-CB 3.17Å; Q1288-C1291 PolarHBondContact O-N 3.08Å; Q1288-A1292 WeakPolarHBondContact O-CB 3.44Å; Q1288-A1292 PolarHBondContact O-N 3.29Å
1289	R	64.8	Low	57.5	Low	171 Å²	171	70.3 Å²	70.3	65%	0.645	37%	0.37	S	S	*	.	H	α-helix	trans	-63	-43.5	177.8	-156.4	173.7	-168.8	158.9	1	111.1	H1285 S1286 C1291 A1292 E1293	H1285-R1289 WeakPolarHBondContact O-CB 3.46Å; H1285-R1289 PolarHBondContact O-N 3.2Å; S1286-R1289 WeakPolarHBondContact O-CB 3.48Å; S1286-R1289 PolarHBondContact O-N 3.24Å; R1289-C1291 PolarHBondContact O-N 3.31Å; R1289-A1292 WeakPolarHBondContact O-CB 3.21Å; R1289-A1292 PolarHBondContact O-N 3.44Å; R1289-A1292 VanDerWaalsContact O-N 3.14Å; R1289-E1293 PolarHBondContact O-N 3.04Å
1290	L	63.8	Low	57.2	Low	13 Å²	13	68.3 Å²	68.3	7%	0.068	37%	0.366	C	S	.	.	H	α-helix	trans	-63.6	-38.9	173.9	-152.7	165.6	0	0	0	111.7	S1286 L1294 I1316 I1339 F1344	S1286-L1290 PolarHBondContact O-N 3.02Å; L1290-L1294 HydrophobicContact CD2-CD1 3.62Å; L1290-L1294 HydrophobicContact CD2-CG 4.12Å; L1290-L1294 WeakPolarHBondContact O-CB 3.45Å; L1290-L1294 WeakPolarHBondContact O-CG 3.46Å; L1290-L1294 PolarHBondContact O-N 3.01Å; L1290-I1316 HydrophobicContact CD1-CG2 4.29Å; L1290-I1316 HydrophobicContact CD2-CG2 4.32Å; L1290-I1316 HydrophobicContact CG-CG2 3.8Å; L1290-I1339 HydrophobicContact CB-CD1 4.45Å; L1290-I1339 HydrophobicContact CD1-CD1 3.72Å; L1290-I1339 HydrophobicContact CD1-CG2 4.1Å; L1290-F1344 HydrophobicContact CD2-CD2 4.46Å
1291	C	59.9	Low	56.6	Low	8 Å²	8	70.2 Å²	70.2	5%	0.054	39%	0.386	C	S	.	.	H	α-helix	trans	-63.5	-40.7	170	-73.6	0	0	0	0	113.2	L1171 M1287 Q1288 R1289 L1294 I1295 L1347	L1171-C1291 HydrophobicContact CD1-CB 3.22Å; M1287-C1291 VanDerWaalsContact CE-SG 3.53Å; M1287-C1291 PolarHBondContact O-N 3.48Å; M1287-C1291 PolarHBondContact O-SG 3.08Å; Q1288-C1291 CarbonylContact O-C 3.57Å; Q1288-C1291 WeakPolarHBondContact O-CB 3.17Å; Q1288-C1291 PolarHBondContact O-N 3.08Å; R1289-C1291 PolarHBondContact O-N 3.31Å; C1291-L1294 WeakPolarHBondContact O-CB 3.17Å; C1291-L1294 PolarHBondContact O-N 3.07Å; C1291-I1295 VanDerWaalsContact O-CG1 3.28Å; C1291-I1295 WeakPolarHBondContact O-CG1 3.42Å; C1291-I1295 PolarHBondContact O-N 3.17Å; C1291-L1347 WeakPolarHBondContact SG-CD1 3.49Å
1292	A	57.8	Low	55.5	Low	47 Å²	47	72.7 Å²	72.7	39%	0.388	39%	0.393	S	S	.	.	H	α-helix	trans	-65.3	-42.1	178.7	0	0	0	0	0	111	Q1288 R1289 I1295 R1296	Q1288-A1292 WeakPolarHBondContact O-CB 3.44Å; Q1288-A1292 PolarHBondContact O-N 3.29Å; R1289-A1292 WeakPolarHBondContact O-CB 3.21Å; R1289-A1292 PolarHBondContact O-N 3.44Å; R1289-A1292 VanDerWaalsContact O-N 3.14Å; A1292-I1295 PolarHBondContact O-N 2.96Å; A1292-R1296 WeakPolarHBondContact O-CB 3.39Å; A1292-R1296 PolarHBondContact O-N 3.24Å
1293	E	58.7	Low	54.8	Low	63 Å²	63	69.5 Å²	69.5	29%	0.294	38%	0.382	S	S	.	.	H	α-helix	trans	-66.7	-38.4	172.5	-72.3	-158.8	102.1	0	0	113.4	R1289 I1295 R1296 T1297 I1316	R1289-E1293 PolarHBondContact O-N 3.04Å; E1293-I1295 VanDerWaalsContact C-N 3.32Å; E1293-I1295 PolarHBondContact O-N 3.37Å; E1293-R1296 PolarHBondContact O-N 3.44Å; E1293-T1297 WeakPolarHBondContact O-CB 3.39Å; E1293-T1297 WeakPolarHBondContact O-CG2 3.38Å; E1293-T1297 PolarHBondContact O-N 3.2Å; E1293-T1297 PolarHBondContact O-OG1 2.9Å; E1293-I1316 HydrophobicContact CB-CD1 4.48Å
1294	L	56.6	Low	53.8	Low	8 Å²	8	70.2 Å²	70.2	4%	0.042	39%	0.388	C	S	.	.	H	α-helix	trans	-58.2	-44.6	170.8	-91	165.2	0	0	0	111.7	L1290 C1291 R1296 T1297 L1298 F1313 F1344 L1347	L1290-L1294 HydrophobicContact CD2-CD1 3.62Å; L1290-L1294 HydrophobicContact CD2-CG 4.12Å; L1290-L1294 WeakPolarHBondContact O-CB 3.45Å; L1290-L1294 WeakPolarHBondContact O-CG 3.46Å; L1290-L1294 PolarHBondContact O-N 3.01Å; C1291-L1294 WeakPolarHBondContact O-CB 3.17Å; C1291-L1294 PolarHBondContact O-N 3.07Å; L1294-R1296 VanDerWaalsContact C-N 3.33Å; L1294-T1297 WeakPolarHBondContact CA-OG1 3.39Å; L1294-T1297 PolarHBondContact O-OG1 2.94Å; L1294-L1298 HydrophobicContact CD2-CD1 4.47Å; L1294-L1298 WeakPolarHBondContact O-CB 3.3Å; L1294-L1298 WeakPolarHBondContact O-CD1 3.43Å; L1294-L1298 WeakPolarHBondContact O-CG 3.5Å; L1294-L1298 PolarHBondContact O-N 3.25Å; L1294-F1313 HydrophobicContact CD2-CE1 3.56Å; L1294-F1313 HydrophobicContact CD2-CZ 3.59Å; L1294-F1313 HydrophobicContact CG-CE1 4.23Å; L1294-F1344 HydrophobicContact CD1-CE2 4.28Å; L1294-L1347 HydrophobicContact CD1-CD2 3.37Å
1295	I	53.4	Low	52.6	Low	102 Å²	102	71.5 Å²	71.5	52%	0.523	40%	0.397	S	S	.	.	H	α-helix	trans	-68.1	-35.6	176.4	-68.4	164	0	0	0	110.6	L1171 C1291 A1292 E1293 G1299	L1171-I1295 HydrophobicContact CD1-CD1 4.44Å; C1291-I1295 VanDerWaalsContact O-CG1 3.28Å; C1291-I1295 WeakPolarHBondContact O-CG1 3.42Å; C1291-I1295 PolarHBondContact O-N 3.17Å; A1292-I1295 PolarHBondContact O-N 2.96Å; E1293-I1295 VanDerWaalsContact C-N 3.32Å; E1293-I1295 PolarHBondContact O-N 3.37Å; I1295-G1299 WeakPolarHBondContact O-CA 3.47Å; I1295-G1299 PolarHBondContact O-N 3.36Å
1296	R	52.6	Low	51.3	Low	210 Å²	210	70.7 Å²	70.7	79%	0.792	41%	0.405	S	S	*	.	H	α-helix	trans	-72.4	-36.5	179.1	-151.3	176	-168.9	108	-0.8	112.9	A1292 E1293 L1294 G1300	A1292-R1296 WeakPolarHBondContact O-CB 3.39Å; A1292-R1296 PolarHBondContact O-N 3.24Å; E1293-R1296 PolarHBondContact O-N 3.44Å; L1294-R1296 VanDerWaalsContact C-N 3.33Å; R1296-G1300 PolarHBondContact O-N 3.08Å; R1296-G1300 VanDerWaalsContact O-N 3.15Å
1297	T	51.6	Low	50.2	Low	26 Å²	26	76.2 Å²	76.2	16%	0.16	43%	0.426	C	S	.	.	H	α-helix	trans	-77.4	-39.6	176.1	48.4	0	0	0	0	112.1	E1293 L1294 G1299 V1304	E1293-T1297 WeakPolarHBondContact O-CB 3.39Å; E1293-T1297 WeakPolarHBondContact O-CG2 3.38Å; E1293-T1297 PolarHBondContact O-N 3.2Å; E1293-T1297 PolarHBondContact O-OG1 2.9Å; L1294-T1297 WeakPolarHBondContact CA-OG1 3.39Å; L1294-T1297 PolarHBondContact O-OG1 2.94Å; T1297-G1299 VanDerWaalsContact C-N 3.33Å; T1297-V1304 WeakPolarHBondContact O-CG2 3.31Å
1298	L	48.4	Very low	49.3	Very low	113 Å²	113	81.1 Å²	81.1	59%	0.592	45%	0.445	S	S	*	.	H	α-helix	trans	-75	-19.8	173.4	-66	170.7	0	0	0	113.6	L1294	L1294-L1298 HydrophobicContact CD2-CD1 4.47Å; L1294-L1298 WeakPolarHBondContact O-CB 3.3Å; L1294-L1298 WeakPolarHBondContact O-CD1 3.43Å; L1294-L1298 WeakPolarHBondContact O-CG 3.5Å; L1294-L1298 PolarHBondContact O-N 3.25Å
1299	G	47.6	Very low	48.6	Very low	65 Å²	65	81.2 Å²	81.2	67%	0.67	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-0.7	175	0	0	0	0	0	114.7	I1295 T1297	I1295-G1299 WeakPolarHBondContact O-CA 3.47Å; I1295-G1299 PolarHBondContact O-N 3.36Å; T1297-G1299 VanDerWaalsContact C-N 3.33Å
1300	G	39	Very low	47.6	Very low	42 Å²	42	75.9 Å²	75.9	43%	0.433	44%	0.44	S	S	.	.	S	Bend	trans	-72.6	149.5	176.5	0	0	0	0	0	112.2	R1296 N1302	R1296-G1300 PolarHBondContact O-N 3.08Å; R1296-G1300 VanDerWaalsContact O-N 3.15Å; G1300-N1302 PolarHBondContact O-N 3.36Å; G1300-N1302 VanDerWaalsContact O-N 3.13Å
1301	S	35.8	Very low	46.8	Very low	119 Å²	119	80.1 Å²	80.1	83%	0.832	47%	0.466	S	S	*	.	S	Bend	trans	-68.2	-6.7	-178.3	51.9	0	0	0	0	115.5
1302	N	34.4	Very low	46.5	Very low	122 Å²	122	82.2 Å²	82.2	65%	0.652	47%	0.474	S	S	*	.	S	Bend	trans	-105.4	146.5	-165.6	-62.7	5.2	0	0	0	110.8	G1300 V1304	G1300-N1302 PolarHBondContact O-N 3.36Å; G1300-N1302 VanDerWaalsContact O-N 3.13Å; N1302-V1304 WeakPolarHBondContact O-CG2 3.03Å; N1302-V1304 PolarHBondContact O-N 2.88Å
1303	T	39.9	Very low	46.3	Very low	72 Å²	72	82 Å²	82	44%	0.442	47%	0.465	S	S	.	.			trans	-68.4	99.3	-170.5	46.2	0	0	0	0	113	T1305 L1389 L1393	T1303-T1305 PolarHBondContact O-N 3.3Å; T1303-L1389 HydrophobicContact CG2-CD2 3.86Å; T1303-L1393 HydrophobicContact CG2-CD1 4.46Å; T1303-L1393 HydrophobicContact CG2-CD2 3.99Å; T1303-L1393 HydrophobicContact CG2-CG 4.14Å
1304	V	39.7	Very low	45.9	Very low	50 Å²	50	85.9 Å²	85.9	30%	0.303	48%	0.481	S	S	.	.			trans	-72.6	94.1	179.3	-175.3	0	0	0	0	111	T1297 N1302 Y1308 L1309	T1297-V1304 WeakPolarHBondContact O-CG2 3.31Å; N1302-V1304 WeakPolarHBondContact O-CG2 3.03Å; N1302-V1304 PolarHBondContact O-N 2.88Å; V1304-Y1308 HydrophobicContact CG1-CD1 4.25Å; V1304-L1309 HydrophobicContact CG1-CB 4.48Å; V1304-L1309 HydrophobicContact CG1-CD1 3.52Å; V1304-L1309 HydrophobicContact CG1-CD2 4.2Å; V1304-L1309 HydrophobicContact CG1-CG 3.4Å; V1304-L1309 VanDerWaalsContact CG1-CG 3.4Å
1305	T	39.2	Very low	45.7	Very low	64 Å²	64	87.8 Å²	87.8	39%	0.393	50%	0.495	S	S	.	.			trans	-73.7	164.3	172.1	70.9	0	0	0	0	111.6	T1303 E1307 Y1308 L1309	T1303-T1305 PolarHBondContact O-N 3.3Å; T1305-E1307 VanDerWaalsContact C-N 3.25Å; T1305-E1307 PolarHBondContact O-N 3.49Å; T1305-Y1308 PolarHBondContact O-N 3.12Å; T1305-Y1308 WeakPolarHBondContact OG1-CB 3.07Å; T1305-Y1308 PolarHBondContact OG1-N 3.43Å; T1305-L1309 PolarHBondContact O-N 2.88Å
1306	S	38.7	Very low	45.6	Very low	103 Å²	103	83.1 Å²	83.1	72%	0.72	47%	0.471	S	S	*	.	H	α-helix	trans	-63.7	-31.3	174.9	48.8	0	0	0	0	112.9	A1310	S1306-A1310 WeakPolarHBondContact O-CB 3.42Å; S1306-A1310 PolarHBondContact O-N 3.03Å
1307	E	41	Very low	45.6	Very low	152 Å²	152	77.6 Å²	77.6	71%	0.71	46%	0.456	S	S	*	.	H	α-helix	trans	-74.9	-39.1	171.8	-73.7	-174.3	120.6	0	0	111.9	T1305 L1309 A1310 V1311	T1305-E1307 VanDerWaalsContact C-N 3.25Å; T1305-E1307 PolarHBondContact O-N 3.49Å; E1307-L1309 VanDerWaalsContact C-N 3.32Å; E1307-L1309 PolarHBondContact O-N 2.99Å; E1307-A1310 CarbonylContact O-C 3.56Å; E1307-A1310 PolarHBondContact O-N 3.35Å; E1307-A1310 VanDerWaalsContact O-N 3.08Å; E1307-V1311 WeakPolarHBondContact O-CB 3.48Å; E1307-V1311 WeakPolarHBondContact O-CG2 3.35Å; E1307-V1311 PolarHBondContact O-N 3.49Å
1308	Y	48.3	Very low	45.6	Very low	110 Å²	110	80.3 Å²	80.3	43%	0.431	47%	0.47	S	S	.	.	H	α-helix	trans	-58.9	-45.1	172.5	-170.1	-87.9	0	0	0	110.7	V1304 T1305 A1310 V1311 H1312	V1304-Y1308 HydrophobicContact CG1-CD1 4.25Å; T1305-Y1308 PolarHBondContact O-N 3.12Å; T1305-Y1308 WeakPolarHBondContact OG1-CB 3.07Å; T1305-Y1308 PolarHBondContact OG1-N 3.43Å; Y1308-A1310 PolarHBondContact O-N 2.95Å; Y1308-V1311 PolarHBondContact O-N 3.21Å; Y1308-H1312 HydrophobicContact CE1-CB 4.47Å; Y1308-H1312 AromaticContact CE1-CD2 3.49Å; Y1308-H1312 VanDerWaalsContact CE1-CD2 3.49Å; Y1308-H1312 WeakPolarHBondContact CE1-CD2 3.22Å; Y1308-H1312 AromaticContact CZ-CD2 3.56Å; Y1308-H1312 VanDerWaalsContact O-CB 3.31Å; Y1308-H1312 WeakPolarHBondContact O-CB 3.44Å; Y1308-H1312 PolarHBondContact O-N 3.01Å; Y1308-H1312 PolarHBondContact OH-CD2 2.93Å
1309	L	49.5	Very low	45.7	Very low	45 Å²	45	79.7 Å²	79.7	24%	0.236	46%	0.464	C	S	.	.	H	α-helix	trans	-60.2	-43.4	171.1	-91.1	159.5	0	0	0	112.4	V1304 T1305 E1307 V1311 F1313	V1304-L1309 HydrophobicContact CG1-CB 4.48Å; V1304-L1309 HydrophobicContact CG1-CD1 3.52Å; V1304-L1309 HydrophobicContact CG1-CD2 4.2Å; V1304-L1309 HydrophobicContact CG1-CG 3.4Å; V1304-L1309 VanDerWaalsContact CG1-CG 3.4Å; T1305-L1309 PolarHBondContact O-N 2.88Å; E1307-L1309 VanDerWaalsContact C-N 3.32Å; E1307-L1309 PolarHBondContact O-N 2.99Å; L1309-V1311 PolarHBondContact O-N 3.27Å; L1309-F1313 HydrophobicContact CB-CD2 4.27Å; L1309-F1313 HydrophobicContact CB-CE2 4.12Å; L1309-F1313 HydrophobicContact CD2-CD2 4.2Å; L1309-F1313 HydrophobicContact CD2-CE2 3.47Å; L1309-F1313 VanDerWaalsContact CD2-CE2 3.47Å; L1309-F1313 HydrophobicContact CD2-CZ 3.65Å; L1309-F1313 HydrophobicContact CG-CE2 4.33Å; L1309-F1313 WeakPolarHBondContact O-CB 3.36Å; L1309-F1313 WeakPolarHBondContact O-CD2 3.1Å; L1309-F1313 VanDerWaalsContact O-CG 3.27Å; L1309-F1313 WeakPolarHBondContact O-CG 3.45Å; L1309-F1313 PolarHBondContact O-N 2.91Å
1310	A	43.8	Very low	45.7	Very low	60 Å²	60	81.2 Å²	81.2	50%	0.496	46%	0.457	S	S	.	.	H	α-helix	trans	-64.3	-40.2	178.8	0	0	0	0	0	112.7	S1306 E1307 Y1308 K1314	S1306-A1310 WeakPolarHBondContact O-CB 3.42Å; S1306-A1310 PolarHBondContact O-N 3.03Å; E1307-A1310 CarbonylContact O-C 3.56Å; E1307-A1310 PolarHBondContact O-N 3.35Å; E1307-A1310 VanDerWaalsContact O-N 3.08Å; Y1308-A1310 PolarHBondContact O-N 2.95Å; A1310-K1314 WeakPolarHBondContact O-CB 3.42Å; A1310-K1314 PolarHBondContact O-N 3.23Å
1311	V	47.6	Very low	45.8	Very low	101 Å²	101	84.5 Å²	84.5	61%	0.612	47%	0.465	S	S	*	.	H	α-helix	trans	-70.7	-47.4	177	172.5	0	0	0	0	110.7	E1307 Y1308 L1309 F1313 K1314 S1315	E1307-V1311 WeakPolarHBondContact O-CB 3.48Å; E1307-V1311 WeakPolarHBondContact O-CG2 3.35Å; E1307-V1311 PolarHBondContact O-N 3.49Å; Y1308-V1311 PolarHBondContact O-N 3.21Å; L1309-V1311 PolarHBondContact O-N 3.27Å; V1311-F1313 PolarHBondContact O-N 3.04Å; V1311-K1314 CarbonylContact O-C 3.52Å; V1311-K1314 WeakPolarHBondContact O-CA 3.29Å; V1311-K1314 WeakPolarHBondContact O-CB 3.32Å; V1311-K1314 PolarHBondContact O-N 3.05Å; V1311-S1315 PolarHBondContact O-N 3.02Å
1312	H	52.3	Low	45.8	Very low	52 Å²	52	85 Å²	85	24%	0.241	46%	0.458	C	S	.	.	H	α-helix	trans	-66.7	-35.8	177.4	-131.3	-68.4	0	0	0	111.8	Y1308 K1314 S1315 I1316	Y1308-H1312 HydrophobicContact CE1-CB 4.47Å; Y1308-H1312 AromaticContact CE1-CD2 3.49Å; Y1308-H1312 VanDerWaalsContact CE1-CD2 3.49Å; Y1308-H1312 WeakPolarHBondContact CE1-CD2 3.22Å; Y1308-H1312 AromaticContact CZ-CD2 3.56Å; Y1308-H1312 VanDerWaalsContact O-CB 3.31Å; Y1308-H1312 WeakPolarHBondContact O-CB 3.44Å; Y1308-H1312 PolarHBondContact O-N 3.01Å; Y1308-H1312 PolarHBondContact OH-CD2 2.93Å; H1312-K1314 VanDerWaalsContact C-N 3.29Å; H1312-K1314 PolarHBondContact O-N 3.45Å; H1312-S1315 WeakPolarHBondContact O-CB 3.46Å; H1312-S1315 PolarHBondContact O-N 2.8Å; H1312-I1316 WeakPolarHBondContact O-CB 3.45Å; H1312-I1316 WeakPolarHBondContact O-CD1 3.45Å; H1312-I1316 WeakPolarHBondContact O-CG1 3.33Å; H1312-I1316 PolarHBondContact O-N 3.11Å
1313	F	53.7	Low	45.9	Very low	43 Å²	43	85.5 Å²	85.5	19%	0.189	47%	0.47	C	S	.	.	H	α-helix	trans	-64.7	-33.3	169.9	-78.1	-47.6	0	0	0	112.5	L1294 L1309 V1311 S1315 L1317 F1344	L1294-F1313 HydrophobicContact CD2-CE1 3.56Å; L1294-F1313 HydrophobicContact CD2-CZ 3.59Å; L1294-F1313 HydrophobicContact CG-CE1 4.23Å; L1309-F1313 HydrophobicContact CB-CD2 4.27Å; L1309-F1313 HydrophobicContact CB-CE2 4.12Å; L1309-F1313 HydrophobicContact CD2-CD2 4.2Å; L1309-F1313 HydrophobicContact CD2-CE2 3.47Å; L1309-F1313 VanDerWaalsContact CD2-CE2 3.47Å; L1309-F1313 HydrophobicContact CD2-CZ 3.65Å; L1309-F1313 HydrophobicContact CG-CE2 4.33Å; L1309-F1313 WeakPolarHBondContact O-CB 3.36Å; L1309-F1313 WeakPolarHBondContact O-CD2 3.1Å; L1309-F1313 VanDerWaalsContact O-CG 3.27Å; L1309-F1313 WeakPolarHBondContact O-CG 3.45Å; L1309-F1313 PolarHBondContact O-N 2.91Å; V1311-F1313 PolarHBondContact O-N 3.04Å; F1313-S1315 VanDerWaalsContact C-N 3.34Å; F1313-L1317 VanDerWaalsContact O-CB 3.24Å; F1313-L1317 WeakPolarHBondContact O-CB 3.35Å; F1313-L1317 WeakPolarHBondContact O-CD1 3.27Å; F1313-L1317 WeakPolarHBondContact O-CG 3.38Å; F1313-L1317 PolarHBondContact O-N 2.88Å; F1313-F1344 HydrophobicContact CD1-CE2 4.09Å; F1313-F1344 HydrophobicContact CD1-CZ 4.1Å; F1313-F1344 HydrophobicContact CD2-CZ 4.28Å; F1313-F1344 AromaticContact CE1-CE2 3.43Å; F1313-F1344 HydrophobicContact CE1-CE2 3.43Å; F1313-F1344 VanDerWaalsContact CE1-CE2 3.43Å; F1313-F1344 AromaticContact CE1-CZ 3.54Å; F1313-F1344 HydrophobicContact CE1-CZ 3.54Å; F1313-F1344 HydrophobicContact CE2-CE2 4.45Å; F1313-F1344 AromaticContact CE2-CZ 3.73Å; F1313-F1344 HydrophobicContact CE2-CZ 3.73Å; F1313-F1344 HydrophobicContact CG-CZ 4.48Å; F1313-F1344 AromaticContact CZ-CE2 3.67Å; F1313-F1344 HydrophobicContact CZ-CE2 3.67Å; F1313-F1344 AromaticContact CZ-CZ 3.35Å; F1313-F1344 HydrophobicContact CZ-CZ 3.35Å
1314	K	50.6	Low	45.3	Very low	145 Å²	145	86.4 Å²	86.4	63%	0.63	48%	0.484	S	S	*	.	H	α-helix	trans	-68	-36.7	172.8	-160.9	-179.1	-178.7	-171	0	111	A1310 V1311 H1312 N1318	A1310-K1314 WeakPolarHBondContact O-CB 3.42Å; A1310-K1314 PolarHBondContact O-N 3.23Å; V1311-K1314 CarbonylContact O-C 3.52Å; V1311-K1314 WeakPolarHBondContact O-CA 3.29Å; V1311-K1314 WeakPolarHBondContact O-CB 3.32Å; V1311-K1314 PolarHBondContact O-N 3.05Å; H1312-K1314 VanDerWaalsContact C-N 3.29Å; H1312-K1314 PolarHBondContact O-N 3.45Å; K1314-N1318 WeakPolarHBondContact O-CB 3.41Å; K1314-N1318 PolarHBondContact O-N 3.02Å; K1314-N1318 VanDerWaalsContact O-N 3.09Å; K1314-N1318 PolarHBondContact O-OD1 3.01Å
1315	S	51.6	Low	44.7	Very low	48 Å²	48	89.9 Å²	89.9	34%	0.336	51%	0.506	S	S	.	.	H	α-helix	trans	-65.2	-55.5	172.6	-144.1	0	0	0	0	111.7	V1311 H1312 F1313 L1317 N1318 E1319	V1311-S1315 PolarHBondContact O-N 3.02Å; H1312-S1315 WeakPolarHBondContact O-CB 3.46Å; H1312-S1315 PolarHBondContact O-N 2.8Å; F1313-S1315 VanDerWaalsContact C-N 3.34Å; S1315-L1317 PolarHBondContact O-N 2.98Å; S1315-L1317 VanDerWaalsContact O-N 3.15Å; S1315-N1318 CarbonylContact O-C 3.52Å; S1315-N1318 WeakPolarHBondContact O-CA 3.45Å; S1315-N1318 PolarHBondContact O-N 2.88Å; S1315-E1319 WeakPolarHBondContact CB-OE1 3.47Å; S1315-E1319 WeakPolarHBondContact O-CG 3.38Å; S1315-E1319 PolarHBondContact O-N 2.91Å; S1315-E1319 PolarHBondContact OG-OE1 2.98Å
1316	I	52.1	Low	44.3	Very low	3 Å²	3	92.6 Å²	92.6	2%	0.015	52%	0.522	C	S	.	.	H	α-helix	trans	-56.8	-34.1	178.6	-66.1	162.4	0	0	0	112.1	L1290 E1293 H1312 N1320	L1290-I1316 HydrophobicContact CD1-CG2 4.29Å; L1290-I1316 HydrophobicContact CD2-CG2 4.32Å; L1290-I1316 HydrophobicContact CG-CG2 3.8Å; E1293-I1316 HydrophobicContact CB-CD1 4.48Å; H1312-I1316 WeakPolarHBondContact O-CB 3.45Å; H1312-I1316 WeakPolarHBondContact O-CD1 3.45Å; H1312-I1316 WeakPolarHBondContact O-CG1 3.33Å; H1312-I1316 PolarHBondContact O-N 3.11Å; I1316-N1320 PolarHBondContact O-ND2 3.3Å
1317	L	51.9	Low	43.9	Very low	94 Å²	94	94.2 Å²	94.2	49%	0.492	52%	0.523	S	S	.	.	H	α-helix	trans	-81.8	-16.8	174.4	-70.6	171.8	0	0	0	114.4	F1313 S1315	F1313-L1317 VanDerWaalsContact O-CB 3.24Å; F1313-L1317 WeakPolarHBondContact O-CB 3.35Å; F1313-L1317 WeakPolarHBondContact O-CD1 3.27Å; F1313-L1317 WeakPolarHBondContact O-CG 3.38Å; F1313-L1317 PolarHBondContact O-N 2.88Å; S1315-L1317 PolarHBondContact O-N 2.98Å; S1315-L1317 VanDerWaalsContact O-N 3.15Å
1318	N	53.3	Low	43.5	Very low	84 Å²	84	93.5 Å²	93.5	45%	0.449	52%	0.522	S	S	.	.	H	α-helix	trans	-95.2	-42.5	178.4	-80.1	2.9	0	0	0	112.9	K1314 S1315 N1320 N1321	K1314-N1318 WeakPolarHBondContact O-CB 3.41Å; K1314-N1318 PolarHBondContact O-N 3.02Å; K1314-N1318 VanDerWaalsContact O-N 3.09Å; K1314-N1318 PolarHBondContact O-OD1 3.01Å; S1315-N1318 CarbonylContact O-C 3.52Å; S1315-N1318 WeakPolarHBondContact O-CA 3.45Å; S1315-N1318 PolarHBondContact O-N 2.88Å; N1318-N1320 PolarHBondContact O-N 2.68Å; N1318-N1321 WeakPolarHBondContact O-CB 3.38Å; N1318-N1321 PolarHBondContact O-N 3.47Å; N1318-N1321 PolarHBondContact O-ND2 3.36Å
1319	E	50.6	Low	42.7	Very low	99 Å²	99	95.9 Å²	95.9	46%	0.463	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-17.8	-177.3	-74	168	-130.9	0	0	113.2	S1315 N1321	S1315-E1319 WeakPolarHBondContact CB-OE1 3.47Å; S1315-E1319 WeakPolarHBondContact O-CG 3.38Å; S1315-E1319 PolarHBondContact O-N 2.91Å; S1315-E1319 PolarHBondContact OG-OE1 2.98Å; E1319-N1321 PolarHBondContact O-N 2.64Å
1320	N	47.5	Very low	41.6	Very low	98 Å²	98	100.9 Å²	100.9	52%	0.524	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.6	-2.6	171	-79.4	-87.8	0	0	0	114.2	I1316 N1318	I1316-N1320 PolarHBondContact O-ND2 3.3Å; N1318-N1320 PolarHBondContact O-N 2.68Å
1321	N	40.6	Very low	41.4	Very low	111 Å²	111	105.8 Å²	105.8	59%	0.594	58%	0.582	S	S	*	*	S	Bend	trans	-99.5	-24.4	177.5	-63.4	-40.3	0	0	0	114.2	N1318 E1319 C1323	N1318-N1321 WeakPolarHBondContact O-CB 3.38Å; N1318-N1321 PolarHBondContact O-N 3.47Å; N1318-N1321 PolarHBondContact O-ND2 3.36Å; E1319-N1321 PolarHBondContact O-N 2.64Å; N1321-C1323 PolarHBondContact O-N 3.16Å; N1321-C1323 VanDerWaalsContact O-N 3.1Å
1322	D	35.9	Very low	40.6	Very low	130 Å²	130	105.2 Å²	105.2	70%	0.695	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	5.9	-165.1	-63.9	-41	0	0	0	114.8	A1324	D1322-A1324 VanDerWaalsContact C-N 3.34Å; D1322-A1324 PolarHBondContact O-N 3.2Å
1323	C	35.8	Very low	39.7	Very low	132 Å²	132	109.5 Å²	109.5	89%	0.892	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	23.7	178.7	-150	0	0	0	0	113.4	N1321	N1321-C1323 PolarHBondContact O-N 3.16Å; N1321-C1323 VanDerWaalsContact O-N 3.1Å
1324	A	27.1	Very low	38.7	Very low	90 Å²	90	113.7 Å²	113.7	74%	0.744	64%	0.641	S	S	*	*			trans	-143.5	46.7	-174.1	0	0	0	0	0	114	D1322	D1322-A1324 VanDerWaalsContact C-N 3.34Å; D1322-A1324 PolarHBondContact O-N 3.2Å
1325	T	27.1	Very low	38.1	Very low	123 Å²	123	112.5 Å²	112.5	76%	0.755	65%	0.646	S	S	*	*			trans	-96.7	168.9	156.7	51.1	0	0	0	0	110.5
1326	V	31	Very low	37.5	Very low	122 Å²	122	117.2 Å²	117.2	74%	0.739	66%	0.662	S	S	*	*			trans	82.8	92.5	176.4	-171.6	0	0	0	0	115.7
1327	N	29.6	Very low	37.2	Very low	137 Å²	137	127.3 Å²	127.3	73%	0.733	70%	0.7	S	S	*	*			trans	80.2	132.3	132.4	-71.2	-2	0	0	0	124.3
1328	I	34.1	Very low	37.4	Very low	136 Å²	136	126.4 Å²	126.4	70%	0.697	70%	0.702	S	S	*	*			trans	76.6	99.4	135.9	-64.4	165.9	0	0	0	118.2
1329	H	31.4	Very low	37.6	Very low	161 Å²	161	123.5 Å²	123.5	75%	0.745	69%	0.686	S	S	*	*	S	Bend	trans	50.3	129.9	142	-62.1	-49.1	0	0	0	122.1
1330	N	27.1	Very low	38.1	Very low	149 Å²	149	121.6 Å²	121.6	80%	0.797	68%	0.681	S	S	*	*	S	Bend	trans	70.1	32.7	149.5	-56.8	-2.7	0	0	0	118.1
1331	N	39	Very low	38.4	Very low	164 Å²	164	120.5 Å²	120.5	88%	0.877	68%	0.681	S	S	*	*			trans	-145.1	120.8	153.9	-90.6	-59.5	0	0	0	110.6
1332	A	31	Very low	39.4	Very low	89 Å²	89	120.7 Å²	120.7	74%	0.736	67%	0.674	S	S	*	*			trans	-144.3	132	-176.5	0	0	0	0	0	110.5
1333	N	32.2	Very low	40.9	Very low	141 Å²	141	116.3 Å²	116.3	75%	0.754	65%	0.649	S	S	*	*			cis	-140.5	136.3	-7.5	-86	-38.1	0	0	0	109.6	V1335	N1333-V1335 PolarHBondContact O-N 3.46Å
1334	V	32.9	Very low	42.1	Very low	132 Å²	132	112.2 Å²	112.2	80%	0.8	62%	0.616	S	S	*	*			trans	-76.6	102.6	175.7	179.2	0	0	0	0	109.4	H1336	V1334-H1336 PolarHBondContact O-N 3.29Å
1335	V	38	Very low	43.7	Very low	120 Å²	120	115.8 Å²	115.8	73%	0.727	61%	0.61	S	S	*	*			trans	-74.5	92.9	-179.4	-176.7	0	0	0	0	110.6	N1333 R1337	N1333-V1335 PolarHBondContact O-N 3.46Å; V1335-R1337 PolarHBondContact O-N 3.12Å
1336	H	38.9	Very low	45.6	Very low	146 Å²	146	110.2 Å²	110.2	68%	0.676	58%	0.576	S	S	*	*			trans	-54.2	108.6	169.4	-89.8	-129.1	0	0	0	110.9	V1334 S1338	V1334-H1336 PolarHBondContact O-N 3.29Å; H1336-S1338 PolarHBondContact O-N 3.09Å
1337	R	46.7	Very low	47.2	Very low	215 Å²	215	104.5 Å²	104.5	81%	0.811	54%	0.542	S	S	*	.			trans	-75	77	171.2	-76.6	-171.5	172.2	-170.6	-1.4	110.6	V1335	V1335-R1337 PolarHBondContact O-N 3.12Å
1338	S	54.8	Low	48.6	Very low	76 Å²	76	102 Å²	102	53%	0.531	53%	0.528	S	S	.	.			trans	-53.7	150.3	176.5	57.8	0	0	0	0	113.3	H1336 T1340	H1336-S1338 PolarHBondContact O-N 3.09Å; S1338-T1340 WeakPolarHBondContact O-CG2 3.49Å; S1338-T1340 PolarHBondContact O-N 3.16Å
1339	I	59.1	Low	50	Low	22 Å²	22	102 Å²	102	11%	0.113	52%	0.523	C	S	.	.			trans	-62	110.8	178.7	-64.8	172.9	0	0	0	109.6	M1287 L1290 H1343	M1287-I1339 HydrophobicContact CB-CD1 4.25Å; M1287-I1339 HydrophobicContact CG-CD1 4.24Å; L1290-I1339 HydrophobicContact CB-CD1 4.45Å; L1290-I1339 HydrophobicContact CD1-CD1 3.72Å; L1290-I1339 HydrophobicContact CD1-CG2 4.1Å; I1339-H1343 HydrophobicContact CG2-CB 4.02Å
1340	T	60.3	Low	51.6	Low	60 Å²	60	95.7 Å²	95.7	37%	0.368	49%	0.494	S	S	.	.			trans	-82.2	157.4	-178.7	70.2	0	0	0	0	112.4	S1338 R1342 H1343 F1344	S1338-T1340 WeakPolarHBondContact O-CG2 3.49Å; S1338-T1340 PolarHBondContact O-N 3.16Å; T1340-R1342 PolarHBondContact O-N 3.28Å; T1340-H1343 WeakPolarHBondContact O-CB 3.24Å; T1340-H1343 PolarHBondContact O-N 3.48Å; T1340-H1343 PolarHBondContact OG1-ND1 3.23Å; T1340-F1344 PolarHBondContact O-N 3.01Å
1341	S	53.3	Low	53	Low	75 Å²	75	92.3 Å²	92.3	52%	0.524	48%	0.475	S	S	.	.	H	α-helix	trans	-59.4	-16.4	180	58.9	0	0	0	0	114.9	R1345	S1341-R1345 WeakPolarHBondContact O-CB 3.46Å; S1341-R1345 VanDerWaalsContact O-CG 3.31Å; S1341-R1345 WeakPolarHBondContact O-CG 3.38Å; S1341-R1345 PolarHBondContact O-N 2.81Å
1342	R	62.8	Low	53.5	Low	114 Å²	114	86.8 Å²	86.8	43%	0.43	45%	0.453	S	S	.	.	H	α-helix	trans	-72.5	-39.4	170.3	-67.8	-169.9	-171.2	145.7	-10.6	112.8	D1156 T1340 R1345 S1346	D1156-R1342 VanDerWaalsContact CB-NH1 3.32Å; D1156-R1342 VanDerWaalsContact CG-NH1 3.28Å; D1156-R1342 IonicContact OD2-CZ 3.77Å; D1156-R1342 IonicContact OD2-NH1 3.87Å; D1156-R1342 PolarHBondContact OD2-NH1 3.06Å; T1340-R1342 PolarHBondContact O-N 3.28Å; R1342-R1345 PolarHBondContact O-N 3.2Å; R1342-S1346 PolarHBondContact O-N 2.72Å; R1342-S1346 PolarHBondContact O-OG 3Å
1343	H	65.9	Low	54.8	Low	38 Å²	38	86.9 Å²	86.9	18%	0.176	44%	0.44	C	S	.	.	H	α-helix	trans	-63.3	-49.4	175.3	-65.4	91.6	0	0	0	109.9	I1339 T1340 R1345 S1346 L1347	I1339-H1343 HydrophobicContact CG2-CB 4.02Å; T1340-H1343 WeakPolarHBondContact O-CB 3.24Å; T1340-H1343 PolarHBondContact O-N 3.48Å; T1340-H1343 PolarHBondContact OG1-ND1 3.23Å; H1343-R1345 PolarHBondContact O-N 3.34Å; H1343-S1346 WeakPolarHBondContact O-CB 3.48Å; H1343-S1346 PolarHBondContact O-N 3.42Å; H1343-S1346 VanDerWaalsContact O-N 3.1Å; H1343-L1347 PolarHBondContact O-N 3.09Å
1344	F	62.4	Low	56	Low	46 Å²	46	83 Å²	83	20%	0.202	41%	0.414	C	S	.	.	H	α-helix	trans	-59.7	-42.9	176.4	179.2	-107.4	0	0	0	113.3	L1290 L1294 F1313 T1340 S1346 L1347 L1348	L1290-F1344 HydrophobicContact CD2-CD2 4.46Å; L1294-F1344 HydrophobicContact CD1-CE2 4.28Å; F1313-F1344 HydrophobicContact CD1-CE2 4.09Å; F1313-F1344 HydrophobicContact CD1-CZ 4.1Å; F1313-F1344 HydrophobicContact CD2-CZ 4.28Å; F1313-F1344 AromaticContact CE1-CE2 3.43Å; F1313-F1344 HydrophobicContact CE1-CE2 3.43Å; F1313-F1344 VanDerWaalsContact CE1-CE2 3.43Å; F1313-F1344 AromaticContact CE1-CZ 3.54Å; F1313-F1344 HydrophobicContact CE1-CZ 3.54Å; F1313-F1344 HydrophobicContact CE2-CE2 4.45Å; F1313-F1344 AromaticContact CE2-CZ 3.73Å; F1313-F1344 HydrophobicContact CE2-CZ 3.73Å; F1313-F1344 HydrophobicContact CG-CZ 4.48Å; F1313-F1344 AromaticContact CZ-CE2 3.67Å; F1313-F1344 HydrophobicContact CZ-CE2 3.67Å; F1313-F1344 AromaticContact CZ-CZ 3.35Å; F1313-F1344 HydrophobicContact CZ-CZ 3.35Å; T1340-F1344 PolarHBondContact O-N 3.01Å; F1344-S1346 VanDerWaalsContact C-N 3.35Å; F1344-S1346 PolarHBondContact O-N 3.01Å; F1344-L1347 WeakPolarHBondContact O-CB 3.43Å; F1344-L1347 PolarHBondContact O-N 3.45Å; F1344-L1348 HydrophobicContact CD1-CD1 4.27Å; F1344-L1348 HydrophobicContact CE1-CD1 3.53Å; F1344-L1348 HydrophobicContact CE1-CG 4.34Å; F1344-L1348 HydrophobicContact CE2-CD1 4.36Å; F1344-L1348 HydrophobicContact CE2-CG 4.37Å; F1344-L1348 HydrophobicContact CZ-CD1 3.57Å; F1344-L1348 HydrophobicContact CZ-CG 4.03Å; F1344-L1348 PolarHBondContact O-N 3.38Å; F1344-L1348 VanDerWaalsContact O-N 3.12Å
1345	R	60	Low	56.7	Low	165 Å²	165	81 Å²	81	62%	0.623	40%	0.396	S	S	*	.	H	α-helix	trans	-64.7	-35.2	173.3	-79.7	177.5	173.9	175.1	-1.1	113.2	S1341 R1342 H1343 K1349	S1341-R1345 WeakPolarHBondContact O-CB 3.46Å; S1341-R1345 VanDerWaalsContact O-CG 3.31Å; S1341-R1345 WeakPolarHBondContact O-CG 3.38Å; S1341-R1345 PolarHBondContact O-N 2.81Å; R1342-R1345 PolarHBondContact O-N 3.2Å; H1343-R1345 PolarHBondContact O-N 3.34Å; R1345-K1349 WeakPolarHBondContact O-CB 3.05Å; R1345-K1349 PolarHBondContact O-N 3.07Å; R1345-K1349 VanDerWaalsContact O-N 3.16Å
1346	S	67	Low	56.9	Low	6 Å²	6	82.4 Å²	82.4	4%	0.042	39%	0.388	C	S	.	.	H	α-helix	trans	-66.2	-40.5	173.7	-62.4	0	0	0	0	111.1	A1160 R1342 H1343 F1344 K1349 Q1350	A1160-S1346 WeakPolarHBondContact CB-OG 3.27Å; R1342-S1346 PolarHBondContact O-N 2.72Å; R1342-S1346 PolarHBondContact O-OG 3Å; H1343-S1346 WeakPolarHBondContact O-CB 3.48Å; H1343-S1346 PolarHBondContact O-N 3.42Å; H1343-S1346 VanDerWaalsContact O-N 3.1Å; F1344-S1346 VanDerWaalsContact C-N 3.35Å; F1344-S1346 PolarHBondContact O-N 3.01Å; S1346-K1349 PolarHBondContact O-N 3.17Å; S1346-Q1350 WeakPolarHBondContact O-CG 3.23Å; S1346-Q1350 PolarHBondContact O-N 3.16Å
1347	L	64.2	Low	57.5	Low	2 Å²	2	78.9 Å²	78.9	1%	0.01	38%	0.38	C	S	.	.	H	α-helix	trans	-58.4	-54.5	176.7	-171.3	76.7	0	0	0	112.4	A1164 I1168 M1287 C1291 L1294 H1343 F1344 K1349 Q1350 L1351	A1164-L1347 HydrophobicContact CB-CD1 4.37Å; I1168-L1347 HydrophobicContact CD1-CD1 3.84Å; I1168-L1347 HydrophobicContact CG1-CD1 3.89Å; M1287-L1347 HydrophobicContact CE-CD1 3.62Å; C1291-L1347 WeakPolarHBondContact SG-CD1 3.49Å; L1294-L1347 HydrophobicContact CD1-CD2 3.37Å; H1343-L1347 PolarHBondContact O-N 3.09Å; F1344-L1347 WeakPolarHBondContact O-CB 3.43Å; F1344-L1347 PolarHBondContact O-N 3.45Å; L1347-K1349 PolarHBondContact O-N 3.21Å; L1347-Q1350 PolarHBondContact O-N 3.49Å; L1347-L1351 HydrophobicContact CD2-CD1 4.45Å; L1347-L1351 HydrophobicContact CG-CD1 4.11Å; L1347-L1351 PolarHBondContact O-N 3.31Å
1348	L	59.9	Low	57.4	Low	84 Å²	84	75.9 Å²	75.9	44%	0.44	37%	0.373	S	S	.	.	H	α-helix	trans	-56.6	-39	177.1	-75.5	173.8	0	0	0	111.8	F1344 A1352	F1344-L1348 HydrophobicContact CD1-CD1 4.27Å; F1344-L1348 HydrophobicContact CE1-CD1 3.53Å; F1344-L1348 HydrophobicContact CE1-CG 4.34Å; F1344-L1348 HydrophobicContact CE2-CD1 4.36Å; F1344-L1348 HydrophobicContact CE2-CG 4.37Å; F1344-L1348 HydrophobicContact CZ-CD1 3.57Å; F1344-L1348 HydrophobicContact CZ-CG 4.03Å; F1344-L1348 PolarHBondContact O-N 3.38Å; F1344-L1348 VanDerWaalsContact O-N 3.12Å; L1348-A1352 WeakPolarHBondContact O-CB 3.22Å; L1348-A1352 PolarHBondContact O-N 3.09Å
1349	K	62.5	Low	56.6	Low	137 Å²	137	73.9 Å²	73.9	60%	0.596	36%	0.359	S	S	*	.	H	α-helix	trans	-67.9	-40.2	179	-158.7	173.2	-173.4	-178.6	0	112.3	R1345 S1346 L1347 I1353	R1345-K1349 WeakPolarHBondContact O-CB 3.05Å; R1345-K1349 PolarHBondContact O-N 3.07Å; R1345-K1349 VanDerWaalsContact O-N 3.16Å; S1346-K1349 PolarHBondContact O-N 3.17Å; L1347-K1349 PolarHBondContact O-N 3.21Å; K1349-I1353 HydrophobicContact CG-CD1 4.38Å; K1349-I1353 WeakPolarHBondContact O-CD1 3.29Å; K1349-I1353 VanDerWaalsContact O-CG1 3.23Å; K1349-I1353 WeakPolarHBondContact O-CG1 3.36Å; K1349-I1353 PolarHBondContact O-N 3.31Å; K1349-I1353 VanDerWaalsContact O-N 3.12Å
1350	Q	64.8	Low	55.7	Low	28 Å²	28	79.7 Å²	79.7	13%	0.131	39%	0.39	C	S	.	.	H	α-helix	trans	-71	-38.5	176.5	-64.4	-57.8	-29.3	0	0	112.5	N1161 A1164 N1165 I1168 S1346 L1347 I1353 R1354	N1161-Q1350 PolarHBondContact OD1-NE2 2.79Å; A1164-Q1350 HydrophobicContact CB-CG 4.4Å; N1165-Q1350 PolarHBondContact ND2-NE2 3.04Å; N1165-Q1350 PolarHBondContact ND2-OE1 3.08Å; N1165-Q1350 PolarHBondContact OD1-OE1 3.29Å; I1168-Q1350 HydrophobicContact CD1-CB 3.69Å; S1346-Q1350 WeakPolarHBondContact O-CG 3.23Å; S1346-Q1350 PolarHBondContact O-N 3.16Å; L1347-Q1350 PolarHBondContact O-N 3.49Å; Q1350-I1353 PolarHBondContact O-N 3.41Å; Q1350-R1354 PolarHBondContact O-N 3.37Å
1351	L	57	Low	54.9	Low	78 Å²	78	85.1 Å²	85.1	41%	0.408	41%	0.411	S	S	.	.	H	α-helix	trans	-60.2	-45.2	173	-77.4	167.7	0	0	0	111.6	I1168 L1347 I1353 R1354 H1355	I1168-L1351 HydrophobicContact CD1-CD2 4.43Å; I1168-L1351 HydrophobicContact CD1-CG 4.21Å; L1347-L1351 HydrophobicContact CD2-CD1 4.45Å; L1347-L1351 HydrophobicContact CG-CD1 4.11Å; L1347-L1351 PolarHBondContact O-N 3.31Å; L1351-I1353 PolarHBondContact O-N 3.2Å; L1351-R1354 PolarHBondContact O-N 2.97Å; L1351-H1355 PolarHBondContact O-N 2.72Å
1352	A	49.8	Very low	54.2	Low	49 Å²	49	84.4 Å²	84.4	41%	0.405	41%	0.406	S	S	.	.	H	α-helix	trans	-62.2	-39.6	176	0	0	0	0	0	112.9	L1348 H1355 R1356	L1348-A1352 WeakPolarHBondContact O-CB 3.22Å; L1348-A1352 PolarHBondContact O-N 3.09Å; A1352-H1355 PolarHBondContact O-N 3.33Å; A1352-R1356 PolarHBondContact O-N 3.27Å; A1352-R1356 VanDerWaalsContact O-N 3.12Å
1353	I	58.2	Low	52.6	Low	91 Å²	91	86.9 Å²	86.9	47%	0.467	42%	0.423	S	S	.	.	H	α-helix	trans	-64.3	-48	176.3	-70	163.3	0	0	0	111	K1349 Q1350 L1351 H1355 R1356 S1357	K1349-I1353 HydrophobicContact CG-CD1 4.38Å; K1349-I1353 WeakPolarHBondContact O-CD1 3.29Å; K1349-I1353 VanDerWaalsContact O-CG1 3.23Å; K1349-I1353 WeakPolarHBondContact O-CG1 3.36Å; K1349-I1353 PolarHBondContact O-N 3.31Å; K1349-I1353 VanDerWaalsContact O-N 3.12Å; Q1350-I1353 PolarHBondContact O-N 3.41Å; L1351-I1353 PolarHBondContact O-N 3.2Å; I1353-H1355 VanDerWaalsContact C-N 3.32Å; I1353-H1355 PolarHBondContact O-N 3.42Å; I1353-R1356 VanDerWaalsContact O-CB 3.32Å; I1353-R1356 WeakPolarHBondContact O-CB 3.37Å; I1353-R1356 PolarHBondContact O-N 3.37Å; I1353-S1357 PolarHBondContact O-N 3.45Å
1354	R	57.5	Low	51	Low	59 Å²	59	91.7 Å²	91.7	22%	0.223	45%	0.449	C	S	.	.	H	α-helix	trans	-60.3	-39	176.1	-101.1	177.1	163.2	92.4	-8.4	112.6	N1165 E1172 Q1350 L1351 R1356 S1357 K1358	N1165-R1354 PolarHBondContact OD1-NH1 3.26Å; E1172-R1354 VanDerWaalsContact CD-NE 3.26Å; E1172-R1354 WeakPolarHBondContact OE1-CD 3.43Å; E1172-R1354 IonicContact OE1-CZ 3.53Å; E1172-R1354 IonicContact OE1-NE 3.1Å; E1172-R1354 PolarHBondContact OE1-NE 3.07Å; E1172-R1354 IonicContact OE1-NH2 2.72Å; E1172-R1354 IonicContact OE2-CZ 3.68Å; E1172-R1354 IonicContact OE2-NE 2.78Å; E1172-R1354 PolarHBondContact OE2-NE 3.43Å; E1172-R1354 IonicContact OE2-NH2 3.2Å; E1172-R1354 PolarHBondContact OE2-NH2 3.27Å; Q1350-R1354 PolarHBondContact O-N 3.37Å; L1351-R1354 PolarHBondContact O-N 2.97Å; R1354-R1356 VanDerWaalsContact C-N 3.32Å; R1354-R1356 PolarHBondContact O-N 3.24Å; R1354-S1357 PolarHBondContact O-N 2.8Å; R1354-S1357 PolarHBondContact O-OG 3.37Å; R1354-K1358 PolarHBondContact O-N 3.46Å
1355	H	47.1	Very low	49.4	Very low	89 Å²	89	96 Å²	96	41%	0.412	47%	0.474	S	S	.	.	H	α-helix	trans	-70.2	-29.8	178.9	-148.7	-54.8	0	0	0	112.5	L1351 A1352 I1353 C1359	L1351-H1355 PolarHBondContact O-N 2.72Å; A1352-H1355 PolarHBondContact O-N 3.33Å; I1353-H1355 VanDerWaalsContact C-N 3.32Å; I1353-H1355 PolarHBondContact O-N 3.42Å; H1355-C1359 PolarHBondContact O-N 2.98Å
1356	R	42.6	Very low	48	Very low	150 Å²	150	96.6 Å²	96.6	57%	0.566	49%	0.488	S	S	*	.	H	α-helix	trans	-58.3	-51.6	169.4	-121.9	178.7	-172.7	-179.5	3	110.7	A1352 I1353 R1354 K1358 C1359 L1372	A1352-R1356 PolarHBondContact O-N 3.27Å; A1352-R1356 VanDerWaalsContact O-N 3.12Å; I1353-R1356 VanDerWaalsContact O-CB 3.32Å; I1353-R1356 WeakPolarHBondContact O-CB 3.37Å; I1353-R1356 PolarHBondContact O-N 3.37Å; R1354-R1356 VanDerWaalsContact C-N 3.32Å; R1354-R1356 PolarHBondContact O-N 3.24Å; R1356-K1358 VanDerWaalsContact C-N 3.26Å; R1356-K1358 PolarHBondContact O-N 3.11Å; R1356-K1358 VanDerWaalsContact O-N 3.16Å; R1356-C1359 PolarHBondContact O-N 3.05Å; R1356-C1359 VanDerWaalsContact O-N 3.07Å; R1356-L1372 PolarHBondContact NH2-O 2.96Å
1357	S	50.8	Low	46.1	Very low	73 Å²	73	101.6 Å²	101.6	51%	0.51	52%	0.521	S	S	.	.	H	α-helix	trans	-64.4	-21.4	-175.7	56.9	0	0	0	0	115.6	I1353 R1354	I1353-S1357 PolarHBondContact O-N 3.45Å; R1354-S1357 PolarHBondContact O-N 2.8Å; R1354-S1357 PolarHBondContact O-OG 3.37Å
1358	K	45.6	Very low	44.5	Very low	152 Å²	152	106.7 Å²	106.7	66%	0.661	56%	0.557	S	S	*	*	H	α-helix	trans	-82.7	-28.7	173.3	-85.3	-175.4	174.6	177.9	0	113.4	R1354 R1356	R1354-K1358 PolarHBondContact O-N 3.46Å; R1356-K1358 VanDerWaalsContact C-N 3.26Å; R1356-K1358 PolarHBondContact O-N 3.11Å; R1356-K1358 VanDerWaalsContact O-N 3.16Å
1359	C	38.7	Very low	43	Very low	34 Å²	34	114.3 Å²	114.3	23%	0.23	58%	0.58	C	S	.	*	H	α-helix	trans	-71.6	-33.2	-177.3	-75.9	0	0	0	0	113.1	H1355 R1356 Q1361 S1362	H1355-C1359 PolarHBondContact O-N 2.98Å; R1356-C1359 PolarHBondContact O-N 3.05Å; R1356-C1359 VanDerWaalsContact O-N 3.07Å; C1359-Q1361 PolarHBondContact O-N 2.85Å; C1359-Q1361 VanDerWaalsContact O-N 3.17Å; C1359-S1362 PolarHBondContact O-N 3.28Å; C1359-S1362 VanDerWaalsContact O-N 3.11Å; C1359-S1362 PolarHBondContact O-OG 3.41Å
1360	D	39.9	Very low	41.4	Very low	144 Å²	144	110.8 Å²	110.8	77%	0.77	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-13.4	-177.9	-66.1	-27.1	0	0	0	114
1361	Q	43.3	Very low	39.8	Very low	174 Å²	174	119.6 Å²	119.6	81%	0.813	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-0.4	174.9	-65.3	-175	-21.2	0	0	113.7	C1359	C1359-Q1361 PolarHBondContact O-N 2.85Å; C1359-Q1361 VanDerWaalsContact O-N 3.17Å
1362	S	38	Very low	38.6	Very low	59 Å²	59	120.6 Å²	120.6	41%	0.413	62%	0.619	S	S	.	*	S	Bend	trans	-115.8	118.8	-173.2	63.5	0	0	0	0	113.5	C1359 K1381	C1359-S1362 PolarHBondContact O-N 3.28Å; C1359-S1362 VanDerWaalsContact O-N 3.11Å; C1359-S1362 PolarHBondContact O-OG 3.41Å; S1362-K1381 PolarHBondContact O-NZ 2.84Å; S1362-K1381 PolarHBondContact OG-NZ 3.09Å
1363	Q	30.3	Very low	38	Very low	167 Å²	167	123.5 Å²	123.5	78%	0.78	63%	0.628	S	S	*	*			trans	-54	162.6	-163.8	-67	177.9	-21	0	0	118.8
1364	L	30.4	Very low	36.8	Very low	139 Å²	139	124.6 Å²	124.6	73%	0.728	64%	0.635	S	S	*	*			trans	75.4	129.7	149.4	-74	155	0	0	0	121.5
1365	D	29.3	Very low	35.5	Very low	136 Å²	136	127.3 Å²	127.3	73%	0.727	66%	0.658	S	S	*	*			trans	46.5	100.2	145.2	-58	-10.5	0	0	0	121.9
1366	L	30.7	Very low	34.8	Very low	177 Å²	177	133.5 Å²	133.5	93%	0.927	68%	0.678	S	S	*	*			trans	-162.2	138.4	140.7	-102.3	140.9	0	0	0	110.5
1367	P	27.8	Very low	34.6	Very low	111 Å²	111	129.8 Å²	129.8	72%	0.721	67%	0.672	S	S	*	*			trans	-95.7	147.9	-166.8	35.2	-35.3	0	0	0	116.2
1368	S	29.5	Very low	33.8	Very low	110 Å²	110	130.1 Å²	130.1	77%	0.769	67%	0.667	S	S	*	*	S	Bend	trans	67.8	121.7	154.1	69.8	0	0	0	0	121
1369	R	28.1	Very low	33.2	Very low	244 Å²	244	132.8 Å²	132.8	92%	0.921	67%	0.673	S	S	*	*			trans	47.5	88.6	144.3	-69.8	-178	166.6	168	-3.2	118.7
1370	G	30	Very low	33.1	Very low	62 Å²	62	133.4 Å²	133.4	64%	0.639	69%	0.685	S	S	*	*			trans	-140.1	149.8	152.1	0	0	0	0	0	110.7
1371	R	32.1	Very low	33.3	Very low	213 Å²	213	133 Å²	133	80%	0.804	68%	0.677	S	S	*	*			trans	-76	138.4	162.6	-73.4	-178.1	178.4	159.7	-2.5	107.7
1372	L	31.4	Very low	33.2	Very low	99 Å²	99	128.9 Å²	128.9	52%	0.518	66%	0.656	S	S	.	*			trans	-128.3	50.1	-171.2	-66.6	171.6	0	0	0	111.6	R1356 D1374 T1377	R1356-L1372 PolarHBondContact NH2-O 2.96Å; L1372-D1374 VanDerWaalsContact C-N 3.3Å; L1372-T1377 HydrophobicContact CD2-CG2 3.58Å
1373	D	36	Very low	33	Very low	111 Å²	111	132.6 Å²	132.6	59%	0.594	67%	0.667	S	S	*	*			trans	-82.9	-13.5	167.1	-57.2	-51	0	0	0	111.5	V1375	D1373-V1375 PolarHBondContact O-N 3.02Å
1374	D	34.1	Very low	33.2	Very low	113 Å²	113	128.8 Å²	128.8	60%	0.604	66%	0.659	S	S	*	*			trans	-73.8	111.9	178.4	-73.4	-48.2	0	0	0	112.9	L1372 W1376 T1377	L1372-D1374 VanDerWaalsContact C-N 3.3Å; D1374-W1376 PolarHBondContact O-N 2.95Å; D1374-W1376 VanDerWaalsContact O-N 3.07Å; D1374-T1377 HydrophobicContact CB-CG2 4.12Å; D1374-T1377 WeakPolarHBondContact O-CB 3.46Å; D1374-T1377 VanDerWaalsContact O-CG2 3.3Å; D1374-T1377 WeakPolarHBondContact O-CG2 3.49Å; D1374-T1377 PolarHBondContact O-N 2.7Å; D1374-T1377 PolarHBondContact O-OG1 3.4Å
1375	V	28.8	Very low	33.5	Very low	117 Å²	117	126.7 Å²	126.7	71%	0.709	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-59.5	-18.9	180	176.6	0	0	0	0	113.5	D1373 T1377	D1373-V1375 PolarHBondContact O-N 3.02Å; V1375-T1377 VanDerWaalsContact C-N 3.29Å; V1375-T1377 PolarHBondContact O-N 2.86Å
1376	W	34.2	Very low	33.7	Very low	219 Å²	219	122.1 Å²	122.1	83%	0.83	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-80.2	-1.2	179.7	-77.5	83.7	0	0	0	115	D1374 L1378 R1379	D1374-W1376 PolarHBondContact O-N 2.95Å; D1374-W1376 VanDerWaalsContact O-N 3.07Å; W1376-L1378 PolarHBondContact O-N 2.91Å; W1376-L1378 VanDerWaalsContact O-N 3.1Å; W1376-R1379 WeakPolarHBondContact O-CB 3.36Å; W1376-R1379 PolarHBondContact O-N 2.7Å; W1376-R1379 VanDerWaalsContact O-N 3.11Å
1377	T	36.9	Very low	33.7	Very low	72 Å²	72	116.6 Å²	116.6	44%	0.442	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-71	-4.7	-174.3	48.4	0	0	0	0	114.9	L1372 D1374 V1375 R1379	L1372-T1377 HydrophobicContact CD2-CG2 3.58Å; D1374-T1377 HydrophobicContact CB-CG2 4.12Å; D1374-T1377 WeakPolarHBondContact O-CB 3.46Å; D1374-T1377 VanDerWaalsContact O-CG2 3.3Å; D1374-T1377 WeakPolarHBondContact O-CG2 3.49Å; D1374-T1377 PolarHBondContact O-N 2.7Å; D1374-T1377 PolarHBondContact O-OG1 3.4Å; V1375-T1377 VanDerWaalsContact C-N 3.29Å; V1375-T1377 PolarHBondContact O-N 2.86Å; T1377-R1379 PolarHBondContact O-N 2.98Å
1378	L	34.2	Very low	33.8	Very low	79 Å²	79	119.1 Å²	119.1	41%	0.414	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-61.3	-17.6	164.6	-73.6	167.2	0	0	0	113.7	W1376 G1380 K1381 F1382	W1376-L1378 PolarHBondContact O-N 2.91Å; W1376-L1378 VanDerWaalsContact O-N 3.1Å; L1378-G1380 PolarHBondContact O-N 3.01Å; L1378-K1381 PolarHBondContact O-N 3.02Å; L1378-F1382 HydrophobicContact CB-CD2 4.45Å
1379	R	34.1	Very low	34.2	Very low	209 Å²	209	117 Å²	117	79%	0.789	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-53.2	-24	-178.2	-161	177.9	-165.5	-165.4	4.9	114.6	W1376 T1377	W1376-R1379 WeakPolarHBondContact O-CB 3.36Å; W1376-R1379 PolarHBondContact O-N 2.7Å; W1376-R1379 VanDerWaalsContact O-N 3.11Å; T1377-R1379 PolarHBondContact O-N 2.98Å
1380	G	36.8	Very low	34.4	Very low	47 Å²	47	111.8 Å²	111.8	49%	0.485	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-77.9	-46.8	180	0	0	0	0	0	115.2	L1378 Q1383	L1378-G1380 PolarHBondContact O-N 3.01Å; G1380-Q1383 WeakPolarHBondContact O-CB 3.38Å; G1380-Q1383 PolarHBondContact O-N 3.18Å
1381	K	43.2	Very low	34.5	Very low	134 Å²	134	113.4 Å²	113.4	58%	0.583	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-15.3	-177.5	-73	-161	174.9	-171	0	113.6	S1362 L1378 Q1383	S1362-K1381 PolarHBondContact O-NZ 2.84Å; S1362-K1381 PolarHBondContact OG-NZ 3.09Å; L1378-K1381 PolarHBondContact O-N 3.02Å; K1381-Q1383 VanDerWaalsContact C-N 3.32Å
1382	F	40.9	Very low	34.5	Very low	89 Å²	89	106.4 Å²	106.4	39%	0.39	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	7.2	171.6	-82.1	-81.8	0	0	0	114.3	L1378 S1384 I1385 A1386	L1378-F1382 HydrophobicContact CB-CD2 4.45Å; F1382-S1384 PolarHBondContact O-N 3.05Å; F1382-I1385 HydrophobicContact CD1-CB 4.4Å; F1382-I1385 HydrophobicContact CD1-CD1 4Å; F1382-I1385 HydrophobicContact CE1-CD1 4.21Å; F1382-I1385 PolarHBondContact O-N 3.42Å; F1382-A1386 WeakPolarHBondContact O-CB 3.33Å; F1382-A1386 PolarHBondContact O-N 3.19Å
1383	Q	35.3	Very low	34.6	Very low	137 Å²	137	104.7 Å²	104.7	64%	0.64	54%	0.538	S	S	*	.	H	α-helix	trans	-60.9	-24.1	-166.7	-170.4	164.3	-9.8	0	0	115.4	G1380 K1381 S1387	G1380-Q1383 WeakPolarHBondContact O-CB 3.38Å; G1380-Q1383 PolarHBondContact O-N 3.18Å; K1381-Q1383 VanDerWaalsContact C-N 3.32Å; Q1383-S1387 WeakPolarHBondContact O-CB 3.3Å; Q1383-S1387 PolarHBondContact O-N 3.11Å; Q1383-S1387 PolarHBondContact O-OG 3.03Å
1384	S	33.1	Very low	34.6	Very low	87 Å²	87	102.9 Å²	102.9	61%	0.608	54%	0.538	S	S	*	.	H	α-helix	trans	-75.3	-42	172.9	49.7	0	0	0	0	113.6	F1382 S1387 Y1388	F1382-S1384 PolarHBondContact O-N 3.05Å; S1384-S1387 PolarHBondContact O-OG 3.04Å; S1384-Y1388 VanDerWaalsContact O-N 3.11Å; S1384-Y1388 PolarHBondContact O-N 3.38Å
1385	I	36.1	Very low	34.4	Very low	94 Å²	94	101.7 Å²	101.7	48%	0.482	54%	0.539	S	S	.	.	H	α-helix	trans	-70.9	-38	173.7	-67.1	169.3	0	0	0	109.5	F1382 Y1388 L1389	F1382-I1385 HydrophobicContact CD1-CB 4.4Å; F1382-I1385 HydrophobicContact CD1-CD1 4Å; F1382-I1385 HydrophobicContact CE1-CD1 4.21Å; F1382-I1385 PolarHBondContact O-N 3.42Å; I1385-Y1388 PolarHBondContact O-N 2.74Å; I1385-L1389 HydrophobicContact CG2-CD1 3.97Å; I1385-L1389 WeakPolarHBondContact O-CB 3.39Å; I1385-L1389 VanDerWaalsContact O-CG 3.28Å; I1385-L1389 WeakPolarHBondContact O-CG 3.34Å; I1385-L1389 PolarHBondContact O-N 3.5Å
1386	A	34.1	Very low	34.5	Very low	40 Å²	40	99.4 Å²	99.4	33%	0.331	53%	0.532	S	S	.	.	H	α-helix	trans	-67.8	-31.6	176	0	0	0	0	0	112.8	F1382 L1390	F1382-A1386 WeakPolarHBondContact O-CB 3.33Å; F1382-A1386 PolarHBondContact O-N 3.19Å; A1386-L1390 WeakPolarHBondContact O-CB 3.41Å; A1386-L1390 PolarHBondContact O-N 2.72Å
1387	S	30.1	Very low	34.3	Very low	62 Å²	62	97.8 Å²	97.8	43%	0.434	53%	0.533	S	S	.	.	H	α-helix	trans	-76.4	-38.1	173.4	61.7	0	0	0	0	112.5	Q1383 S1384 L1389 L1390 V1391	Q1383-S1387 WeakPolarHBondContact O-CB 3.3Å; Q1383-S1387 PolarHBondContact O-N 3.11Å; Q1383-S1387 PolarHBondContact O-OG 3.03Å; S1384-S1387 PolarHBondContact O-OG 3.04Å; S1387-L1389 VanDerWaalsContact C-N 3.32Å; S1387-L1389 PolarHBondContact O-N 3.27Å; S1387-L1390 PolarHBondContact O-N 2.67Å; S1387-V1391 WeakPolarHBondContact O-CG2 3.44Å; S1387-V1391 PolarHBondContact O-N 3.46Å
1388	Y	31.8	Very low	34	Very low	163 Å²	163	104.2 Å²	104.2	64%	0.639	55%	0.549	S	S	*	.	H	α-helix	trans	-59.1	-44.3	169.9	-175.4	-98.3	0	0	0	111.4	S1384 I1385 N1392	S1384-Y1388 VanDerWaalsContact O-N 3.11Å; S1384-Y1388 PolarHBondContact O-N 3.38Å; I1385-Y1388 PolarHBondContact O-N 2.74Å; Y1388-N1392 WeakPolarHBondContact CE1-ND2 3.4Å; Y1388-N1392 WeakPolarHBondContact CE2-ND2 3.43Å; Y1388-N1392 VanDerWaalsContact CZ-ND2 3.26Å; Y1388-N1392 WeakPolarHBondContact O-CB 3.41Å; Y1388-N1392 PolarHBondContact O-N 2.82Å; Y1388-N1392 VanDerWaalsContact O-N 3.12Å; Y1388-N1392 PolarHBondContact O-ND2 2.74Å
1389	L	36.1	Very low	33.8	Very low	66 Å²	66	107.9 Å²	107.9	35%	0.346	57%	0.569	S	S	.	*	H	α-helix	trans	-66.5	-37.5	173	-72.2	170.1	0	0	0	112.6	T1303 I1385 S1387 V1391 N1392 L1393	T1303-L1389 HydrophobicContact CG2-CD2 3.86Å; I1385-L1389 HydrophobicContact CG2-CD1 3.97Å; I1385-L1389 WeakPolarHBondContact O-CB 3.39Å; I1385-L1389 VanDerWaalsContact O-CG 3.28Å; I1385-L1389 WeakPolarHBondContact O-CG 3.34Å; I1385-L1389 PolarHBondContact O-N 3.5Å; S1387-L1389 VanDerWaalsContact C-N 3.32Å; S1387-L1389 PolarHBondContact O-N 3.27Å; L1389-V1391 PolarHBondContact O-N 2.85Å; L1389-N1392 PolarHBondContact O-N 2.85Å; L1389-L1393 WeakPolarHBondContact O-CB 3.45Å; L1389-L1393 PolarHBondContact O-N 3.25Å; L1389-L1393 VanDerWaalsContact O-CB 3.27Å; L1389-L1393 HydrophobicContact CD2-CD1 4.28Å; L1389-L1393 HydrophobicContact CB-CD1 4.36Å
1390	L	34.2	Very low	33.6	Very low	135 Å²	135	105.6 Å²	105.6	71%	0.707	57%	0.572	S	S	*	*	H	α-helix	trans	-62.5	-41.3	177.4	-135.7	75.8	0	0	0	112.1	A1386 S1387 A1394	A1386-L1390 WeakPolarHBondContact O-CB 3.41Å; A1386-L1390 PolarHBondContact O-N 2.72Å; S1387-L1390 PolarHBondContact O-N 2.67Å; L1390-A1394 WeakPolarHBondContact O-CB 3.41Å; L1390-A1394 PolarHBondContact O-N 3.23Å
1391	V	31.3	Very low	33.2	Very low	96 Å²	96	110.5 Å²	110.5	58%	0.582	58%	0.582	S	S	*	*	H	α-helix	trans	-71.8	-41.7	-179.7	172.9	0	0	0	0	111.2	S1387 L1389 S1395	S1387-V1391 WeakPolarHBondContact O-CG2 3.44Å; S1387-V1391 PolarHBondContact O-N 3.46Å; L1389-V1391 PolarHBondContact O-N 2.85Å; V1391-S1395 PolarHBondContact O-OG 3.24Å
1392	N	31	Very low	32.6	Very low	66 Å²	66	109.5 Å²	109.5	35%	0.353	59%	0.59	S	S	.	*	H	α-helix	trans	-86.8	-32.5	-173.3	-67.3	-24.3	0	0	0	113.9	Y1388 L1389 S1395 A1396	Y1388-N1392 WeakPolarHBondContact CE1-ND2 3.4Å; Y1388-N1392 WeakPolarHBondContact CE2-ND2 3.43Å; Y1388-N1392 VanDerWaalsContact CZ-ND2 3.26Å; Y1388-N1392 WeakPolarHBondContact O-CB 3.41Å; Y1388-N1392 PolarHBondContact O-N 2.82Å; Y1388-N1392 VanDerWaalsContact O-N 3.12Å; Y1388-N1392 PolarHBondContact O-ND2 2.74Å; L1389-N1392 PolarHBondContact O-N 2.85Å; N1392-S1395 WeakPolarHBondContact O-CB 3.46Å; N1392-S1395 PolarHBondContact O-N 3.16Å; N1392-A1396 PolarHBondContact O-N 3.41Å
1393	L	34.6	Very low	31.8	Very low	63 Å²	63	109.3 Å²	109.3	33%	0.33	60%	0.6	S	S	.	*	H	α-helix	trans	-72.1	-33.6	171.5	-77	163.5	0	0	0	112.2	T1303 L1389 S1395 A1396	T1303-L1393 HydrophobicContact CG2-CD1 4.46Å; T1303-L1393 HydrophobicContact CG2-CD2 3.99Å; T1303-L1393 HydrophobicContact CG2-CG 4.14Å; L1389-L1393 WeakPolarHBondContact O-CB 3.45Å; L1389-L1393 PolarHBondContact O-N 3.25Å; L1389-L1393 VanDerWaalsContact O-CB 3.27Å; L1389-L1393 HydrophobicContact CD2-CD1 4.28Å; L1389-L1393 HydrophobicContact CB-CD1 4.36Å; L1393-S1395 PolarHBondContact O-N 3.22Å; L1393-A1396 PolarHBondContact O-N 2.65Å
1394	A	35.6	Very low	31.5	Very low	72 Å²	72	109.5 Å²	109.5	60%	0.595	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-12	170.4	0	0	0	0	0	113.7	L1390	L1390-A1394 WeakPolarHBondContact O-CB 3.41Å; L1390-A1394 PolarHBondContact O-N 3.23Å
1395	S	29.4	Very low	31.2	Very low	89 Å²	89	110.8 Å²	110.8	62%	0.622	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-8	176.6	-55.5	0	0	0	0	113.7	V1391 N1392 L1393	V1391-S1395 PolarHBondContact O-OG 3.24Å; N1392-S1395 WeakPolarHBondContact O-CB 3.46Å; N1392-S1395 PolarHBondContact O-N 3.16Å; L1393-S1395 PolarHBondContact O-N 3.22Å
1396	A	30.8	Very low	30.7	Very low	69 Å²	69	111.8 Å²	111.8	57%	0.57	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-21.4	-174	0	0	0	0	0	114.4	N1392 L1393 R1398	N1392-A1396 PolarHBondContact O-N 3.41Å; L1393-A1396 PolarHBondContact O-N 2.65Å; A1396-R1398 PolarHBondContact O-N 2.61Å; A1396-R1398 VanDerWaalsContact O-N 3.09Å
1397	E	30.8	Very low	30.4	Very low	184 Å²	184	116.4 Å²	116.4	86%	0.86	64%	0.637	S	S	*	*	S	Bend	trans	-81.5	30	175.9	-65.6	-171.8	151.6	0	0	113.4
1398	R	30.2	Very low	30.4	Very low	207 Å²	207	125.6 Å²	125.6	78%	0.781	66%	0.664	S	S	*	*	S	Bend	trans	-136.6	139.9	172.2	-65.4	-174.3	-176.7	-177.3	2	109.7	A1396	A1396-R1398 PolarHBondContact O-N 2.61Å; A1396-R1398 VanDerWaalsContact O-N 3.09Å
1399	L	29.3	Very low	30.4	Very low	156 Å²	156	123.8 Å²	123.8	82%	0.817	67%	0.666	S	S	*	*			trans	65.6	66.4	175.8	-55.4	169.1	0	0	0	114.7
1400	N	30.2	Very low	30.1	Very low	162 Å²	162	126.8 Å²	126.8	87%	0.866	68%	0.682	S	S	*	*	S	Bend		-109	140.7	115.9	-147.6	-7.4	0	0	0	108.4	P1402	N1400-P1402 WeakPolarHBondContact O-CD 3.26Å
1401	Q	29.4	Very low	29.8	Very low	149 Å²	149	126.3 Å²	126.3	70%	0.696	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-90	130.3	-158.9	-66.6	172.5	-16.6	0	0	112.5
1402	P	30	Very low	29.8	Very low	114 Å²	114	128.1 Å²	128.1	74%	0.74	69%	0.687	S	S	*	*	P	Polyproline II helix		-75.6	128.1	109.3	32.7	-27.1	0	0	0	108.6	N1400	N1400-P1402 WeakPolarHBondContact O-CD 3.26Å
1403	S	25.6	Very low	29.7	Very low	85 Å²	85	132 Å²	132	59%	0.594	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-68.3	138.2	168.6	54	0	0	0	0	109.3
1404	N	27.3	Very low	29.3	Very low	140 Å²	140	136.6 Å²	136.6	75%	0.749	73%	0.733	S	S	*	*			trans	73.5	146.6	178.8	-48	-35.7	0	0	0	114.2
1405	T	26.8	Very low	28.9	Very low	114 Å²	114	141.2 Å²	141.2	70%	0.699	74%	0.743	S	S	*	*			cis	-161.9	144.7	-13.5	-106.5	0	0	0	0	110.2
1406	V	26.8	Very low	28.9	Very low	115 Å²	115	145.2 Å²	145.2	70%	0.697	75%	0.752	S	S	*	*			trans	35.3	102.9	150.7	-178.6	0	0	0	0	118.6
1407	I	28.1	Very low	28.7	Very low	137 Å²	137	151.6 Å²	151.6	70%	0.703	77%	0.767	S	S	*	*				49.4	111.3	122.1	-56.2	164	0	0	0	118.2
1408	Y	30.2	Very low	28.5	Very low	256 Å²	256	148.6 Å²	148.6	100%	1.004	76%	0.759	S	S	*	*				-168.7	0	115.8	-97.8	-68	0	0	0	109.2	K1237	K1237-Y1408 WeakPolarHBondContact CE-O 3.34Å; K1237-Y1408 PolarHBondContact NZ-O 2.66Å

Retrieved 1,408 of 1,408 residues in 311.8 ms (Link to these results)

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