A0A077Z3L5_TRITR Loading...

Pre-mRNA-processing factor 6

Involved in pre-mRNA splicing as component of the U4/U6-U5 tri-snRNP complex, one of the building blocks of the spliceosome. Enhances dihydrotestosterone-induced transactivation activity of AR, as well as dexamethasone-induced transactivation activity of NR3C1, but does not affect estrogen-induced transactivation.

AlphaFold DB , UniProt , Accession A0A077Z3L5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 983 aa.

						>A0A077Z3L5_TRITR|A0A077Z3L5
MAATVPGALVNKKRKHFIGMPAPLGYVAGVGRGATGFTTRSDIGPAREAGDVSDERHPHQPRKKTTGPGGEEREEVEEEEEEDLNDANYDEAIFKFPARYGGSLFSKDPYDKDDEEADAVYQLIDDRQDEKRREYREQKLKKLIEEYRKERPKIQQEFSDLKRQLAMVSEDEWSSIPEVGDVRNKRQRNPRAEKFTPVPDSVLSRFASADTANMLDLRQQMYGGLTTPSLGSATSLGMRSGVNMFGPGWSTGIATGSSTDLDLCKIGQARNQIMDMKLNQVIPPSIEYSLKQMLFYDFQLSDSVSGQTVVDPKGYLTDLQSMIPNYGGDISDIKKARLLLKSVRETNPNHPPAWIASARLEEVVGKLQVARNIIMNACEVCSQSEDVWLEAARLNPPDTARVTISQAVRALPHSVRIWMRAAELESEPKTKKRVLRKALEYIPNSVRLWKAAVALEEPDDARILLSRAVECCPTSVDLWLALAKLETYENARKVLNKARENIPTDRHVWLTAAKLEEAHGNVPMVHKIVERAVKSLRANMVEINRDQWLKDAMDAEKAGNPITCQSIVKSVIGFGIDEEDRKRTWMEDAEMFIAQGAYECARAVYAHAIKTFPEKKSVWLPAAHFERKHGTREALETILEEAVSKCPKAEILWLMYAKSKWLSGDVQGSRKILALAFQSNPNSEDIWLAAVKLESENSQFERARLLLKKARDSAPSARIWMKSAKLEWCLNELDAAIDLVKQGLSAYEDAPKLWMIGGQIYDQKGNLEEARSFYSQGIKKCPNSIPLLLLAASCEEKHGCLIKARAILERGRMKNPKMPELWLAAIRTEMRGGFRETAMNLLARALQDCPDSGILWAESIFAELRPARKSKSVDALRKCEHDPHVLLAVSKLFWAERKMTKAREWFGRTVKVEPDLGDSWAYFYKFELLHGTPEQQDDVRRRCVQAEPRHGEAWCQVSKDIKNWKLNVEQILEKVAEGLSIPT
					

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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	38.1	Very low	39.4	Very low	239 Å²	239	129.6 Å²	129.6	100%	1.177	83%	0.833	S	S	*	*				0	144.4	0	-61.9	-176.6	-165	0	0	107.7
2	A	34.8	Very low	40.7	Very low	107 Å²	107	136.6 Å²	136.6	88%	0.884	84%	0.84	S	S	*	*			trans	60.2	150.6	173.6	0	0	0	0	0	115.7
3	A	39.1	Very low	41.9	Very low	87 Å²	87	141 Å²	141	72%	0.719	84%	0.841	S	S	*	*			cis	-144	152.5	-16.5	0	0	0	0	0	109.6
4	T	37.4	Very low	42.5	Very low	145 Å²	145	146.8 Å²	146.8	89%	0.89	84%	0.84	S	S	*	*			trans	-64.4	124.5	164	45.2	0	0	0	0	110.9
5	V	42.3	Very low	43.3	Very low	131 Å²	131	146.5 Å²	146.5	79%	0.794	83%	0.826	S	S	*	*			trans	-135.7	133.7	164	-176.4	0	0	0	0	108.2
6	P	38.6	Very low	44.3	Very low	125 Å²	125	148.3 Å²	148.3	81%	0.812	83%	0.825	S	S	*	*			trans	-94.3	128.5	-155.2	34.4	-34.3	0	0	0	114.7
7	G	37.4	Very low	46	Very low	83 Å²	83	147.7 Å²	147.7	86%	0.856	81%	0.812	S	S	*	*			trans	-108.3	75.3	174.6	0	0	0	0	0	113.2
8	A	36.6	Very low	47	Very low	81 Å²	81	146.7 Å²	146.7	67%	0.669	80%	0.804	S	S	*	*			trans	-83.1	151.8	166.3	0	0	0	0	0	110.7
9	L	38.7	Very low	48.2	Very low	180 Å²	180	143.2 Å²	143.2	94%	0.942	80%	0.804	S	S	*	*	S	Bend	trans	66.2	49	166.7	-56	167.9	0	0	0	117.6
10	V	46	Very low	49.5	Very low	125 Å²	125	142.8 Å²	142.8	76%	0.758	80%	0.798	S	S	*	*			trans	-123.7	135	162.7	-171.7	0	0	0	0	111.9	K12	V10-K12 PolarHBondContact O-N 3.12Å
11	N	44.7	Very low	50.3	Low	123 Å²	123	141.7 Å²	141.7	66%	0.658	80%	0.797	S	S	*	*			trans	-67.4	117	-164.2	-164.2	-18.1	0	0	0	112.8	K13 R14	N11-K13 PolarHBondContact O-N 2.97Å; N11-R14 PolarHBondContact O-N 3.45Å; N11-R14 VanDerWaalsContact O-N 3.12Å
12	K	55.2	Low	51.6	Low	213 Å²	213	134.2 Å²	134.2	93%	0.926	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-0.9	-172.9	-80.4	-174.9	175.3	179.2	0	116.7	V10	V10-K12 PolarHBondContact O-N 3.12Å
13	K	56.2	Low	53.1	Low	194 Å²	194	133.5 Å²	133.5	84%	0.843	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-13.4	176.5	-71.8	-178.1	179.1	174	0	114.8	N11	N11-K13 PolarHBondContact O-N 2.97Å
14	R	50.1	Low	54.4	Low	222 Å²	222	138.3 Å²	138.3	84%	0.838	77%	0.772	S	S	*	*	S	Bend	trans	-90.7	109.9	173.4	-76.4	-169.6	173.7	-174	-1.2	110.3	N11 H16	N11-R14 PolarHBondContact O-N 3.45Å; N11-R14 VanDerWaalsContact O-N 3.12Å; R14-H16 PolarHBondContact O-N 3.26Å
15	K	54.2	Low	56	Low	143 Å²	143	135.3 Å²	135.3	62%	0.622	77%	0.769	S	S	*	*			trans	-65.9	126.5	170.7	-66.3	-178.1	179.4	179.6	0	108.6	F17 I18	K15-F17 HydrophobicContact CB-CD1 4.04Å; K15-F17 HydrophobicContact CB-CE1 3.64Å; K15-F17 HydrophobicContact CB-CZ 4.12Å; K15-F17 HydrophobicContact CD-CE1 3.78Å; K15-F17 HydrophobicContact CD-CZ 3.81Å; K15-F17 HydrophobicContact CG-CE1 4.26Å; K15-F17 PolarHBondContact O-N 2.71Å; K15-I18 HydrophobicContact CB-CD1 4.33Å; K15-I18 PolarHBondContact O-N 3.26Å; K15-I18 VanDerWaalsContact O-N 3.14Å
16	H	60.1	Low	57.2	Low	175 Å²	175	135 Å²	135	81%	0.81	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-15	-163.4	-137.9	-50.3	0	0	0	115.9	R14	R14-H16 PolarHBondContact O-N 3.26Å
17	F	73.2	Confident	58.5	Low	138 Å²	138	133.1 Å²	133.1	61%	0.605	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-18.7	-179.2	63.7	-96.7	0	0	0	114.2	K15 G19 M20	K15-F17 HydrophobicContact CB-CD1 4.04Å; K15-F17 HydrophobicContact CB-CE1 3.64Å; K15-F17 HydrophobicContact CB-CZ 4.12Å; K15-F17 HydrophobicContact CD-CE1 3.78Å; K15-F17 HydrophobicContact CD-CZ 3.81Å; K15-F17 HydrophobicContact CG-CE1 4.26Å; K15-F17 PolarHBondContact O-N 2.71Å; F17-G19 PolarHBondContact O-N 2.69Å; F17-G19 VanDerWaalsContact O-N 3.11Å; F17-M20 PolarHBondContact O-N 3.07Å
18	I	64	Low	59.7	Low	130 Å²	130	132.3 Å²	132.3	67%	0.667	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	106.9	-178.9	-66.5	176.6	0	0	0	108.6	K15	K15-I18 HydrophobicContact CB-CD1 4.33Å; K15-I18 PolarHBondContact O-N 3.26Å; K15-I18 VanDerWaalsContact O-N 3.14Å
19	G	69	Low	61	Low	79 Å²	79	130.2 Å²	130.2	81%	0.814	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	109.2	-3.5	-178.5	0	0	0	0	0	115	F17	F17-G19 PolarHBondContact O-N 2.69Å; F17-G19 VanDerWaalsContact O-N 3.11Å
20	M	73.7	Confident	62.5	Low	136 Å²	136	127.2 Å²	127.2	67%	0.67	70%	0.702	S	S	*	*	S	Bend	trans	-80.9	140.3	163.7	-59.7	-171.5	88.5	0	0	108.9	F17	F17-M20 PolarHBondContact O-N 3.07Å
21	P	67.5	Low	63.5	Low	120 Å²	120	123.7 Å²	123.7	78%	0.779	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-60.4	149.6	168.4	27.5	-33.9	0	0	0	109.7
22	A	64.1	Low	64.6	Low	81 Å²	81	127.6 Å²	127.6	67%	0.669	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-56.8	138	174.3	0	0	0	0	0	109.9	L24	A22-L24 PolarHBondContact O-N 2.85Å
23	P	67.7	Low	65.4	Low	92 Å²	92	120.5 Å²	120.5	60%	0.597	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-58	131.5	174.8	-21.7	32.4	0	0	0	110.3	G25 Y26	P23-G25 PolarHBondContact O-N 3.29Å; P23-Y26 WeakPolarHBondContact O-CB 3.32Å; P23-Y26 PolarHBondContact O-N 3.28Å
24	L	65.7	Low	65.7	Low	189 Å²	189	113.9 Å²	113.9	99%	0.99	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	122.2	172.4	-83.8	146.4	0	0	0	109.4	A22	A22-L24 PolarHBondContact O-N 2.85Å
25	G	71.3	Confident	66.2	Low	81 Å²	81	109.5 Å²	109.5	84%	0.835	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	90.8	3.5	-176	0	0	0	0	0	116.1	P23 V27	P23-G25 PolarHBondContact O-N 3.29Å; G25-V27 PolarHBondContact O-N 3.42Å
26	Y	66.8	Low	66.5	Low	124 Å²	124	106.5 Å²	106.5	49%	0.486	67%	0.672	S	S	.	*			trans	-79	104.6	173.3	179.1	-99.2	0	0	0	111.9	P23 A28	P23-Y26 WeakPolarHBondContact O-CB 3.32Å; P23-Y26 PolarHBondContact O-N 3.28Å; Y26-A28 HydrophobicContact CE1-CB 4.04Å
27	V	65.7	Low	66.1	Low	86 Å²	86	106.9 Å²	106.9	52%	0.521	67%	0.672	S	S	.	*			trans	-86.3	123.8	168.1	178.1	0	0	0	0	108.7	G25 G29 V30 G31	G25-V27 PolarHBondContact O-N 3.42Å; V27-G29 PolarHBondContact O-N 2.72Å; V27-V30 HydrophobicContact CB-CB 4.16Å; V27-V30 HydrophobicContact CB-CG2 4.46Å; V27-V30 HydrophobicContact CG1-CB 4.01Å; V27-V30 HydrophobicContact CG1-CG2 3.84Å; V27-G31 VanDerWaalsContact O-CA 3.31Å; V27-G31 WeakPolarHBondContact O-CA 3.48Å; V27-G31 PolarHBondContact O-N 3.33Å
28	A	63.7	Low	65.1	Low	67 Å²	67	105.9 Å²	105.9	55%	0.554	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-36.3	-165.9	0	0	0	0	0	115.1	Y26 R32	Y26-A28 HydrophobicContact CE1-CB 4.04Å; A28-R32 VanDerWaalsContact O-CB 3.26Å; A28-R32 WeakPolarHBondContact O-CB 3.03Å
29	G	64.2	Low	64.4	Low	37 Å²	37	103 Å²	103	38%	0.381	67%	0.666	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.7	-57.2	174.7	0	0	0	0	0	112.2	V27 G31 R32 G33 A34	V27-G29 PolarHBondContact O-N 2.72Å; G29-G31 PolarHBondContact O-N 2.83Å; G29-R32 PolarHBondContact O-N 2.94Å; G29-G33 PolarHBondContact O-N 3.28Å; G29-A34 WeakPolarHBondContact O-CB 3.38Å; G29-A34 PolarHBondContact O-N 3.47Å
30	V	68.6	Low	63.3	Low	117 Å²	117	107.9 Å²	107.9	71%	0.709	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-62.9	-44.2	-177.3	-176.9	0	0	0	0	111.9	V27 R32 G33	V27-V30 HydrophobicContact CB-CB 4.16Å; V27-V30 HydrophobicContact CB-CG2 4.46Å; V27-V30 HydrophobicContact CG1-CB 4.01Å; V27-V30 HydrophobicContact CG1-CG2 3.84Å; V30-R32 PolarHBondContact O-N 3.18Å; V30-G33 PolarHBondContact O-N 3.07Å
31	G	68.5	Low	62.2	Low	50 Å²	50	106.7 Å²	106.7	52%	0.515	67%	0.665	S	S	.	*	G	3₁₀ helix	trans	-70.1	-15.2	178.7	0	0	0	0	0	114.7	V27 G29	V27-G31 VanDerWaalsContact O-CA 3.31Å; V27-G31 WeakPolarHBondContact O-CA 3.48Å; V27-G31 PolarHBondContact O-N 3.33Å; G29-G31 PolarHBondContact O-N 2.83Å
32	R	68.1	Low	61.5	Low	206 Å²	206	105.5 Å²	105.5	78%	0.777	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-86.9	-11.5	168.5	-177.1	173.7	172.2	-170.9	-3.7	112.4	A28 G29 V30 A34	A28-R32 VanDerWaalsContact O-CB 3.26Å; A28-R32 WeakPolarHBondContact O-CB 3.03Å; G29-R32 PolarHBondContact O-N 2.94Å; V30-R32 PolarHBondContact O-N 3.18Å; R32-A34 HydrophobicContact CB-CB 4.41Å; R32-A34 HydrophobicContact CG-CB 4.45Å
33	G	70.4	Confident	60.5	Low	63 Å²	63	109 Å²	109	65%	0.649	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.1	24.8	-167.1	0	0	0	0	0	112.5	G29 V30	G29-G33 PolarHBondContact O-N 3.28Å; V30-G33 PolarHBondContact O-N 3.07Å
34	A	63.1	Low	59.1	Low	55 Å²	55	106.4 Å²	106.4	46%	0.455	65%	0.648	S	S	.	*			trans	-78.1	126.9	176.4	0	0	0	0	0	109.6	G29 R32	G29-A34 WeakPolarHBondContact O-CB 3.38Å; G29-A34 PolarHBondContact O-N 3.47Å; R32-A34 HydrophobicContact CB-CB 4.41Å; R32-A34 HydrophobicContact CG-CB 4.45Å
35	T	61.4	Low	57.8	Low	130 Å²	130	102.4 Å²	102.4	80%	0.798	63%	0.633	S	S	*	*			trans	-113.9	136.7	171.9	43.9	0	0	0	0	109	F37	T35-F37 PolarHBondContact O-N 2.88Å
36	G	60.8	Low	56.1	Low	81 Å²	81	102.6 Å²	102.6	84%	0.835	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-58.3	133	175.7	0	0	0	0	0	110.6
37	F	50.8	Low	54.6	Low	183 Å²	183	108.7 Å²	108.7	80%	0.803	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-87.1	127.5	179.3	55.1	-91.1	0	0	0	110	T35	T35-F37 PolarHBondContact O-N 2.88Å
38	T	51.4	Low	53.1	Low	117 Å²	117	113.5 Å²	113.5	72%	0.718	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-73.6	134	172.3	38.9	0	0	0	0	110.5	D42	T38-D42 HydrophobicContact CG2-CB 3.97Å
39	T	49.7	Very low	51.6	Low	69 Å²	69	115.2 Å²	115.2	42%	0.423	68%	0.68	S	S	.	*			trans	-87.7	175.8	177.1	69.1	0	0	0	0	110.8	S41 D42	T39-S41 PolarHBondContact O-N 3.44Å; T39-D42 WeakPolarHBondContact CA-OD2 3.3Å; T39-D42 PolarHBondContact N-OD2 3.4Å; T39-D42 CarbonylContact O-C 3.51Å; T39-D42 WeakPolarHBondContact O-CA 3.39Å; T39-D42 VanDerWaalsContact O-CB 3.23Å; T39-D42 WeakPolarHBondContact O-CB 3.39Å; T39-D42 PolarHBondContact O-N 2.88Å; T39-D42 PolarHBondContact OG1-OD2 3.2Å
40	R	45.4	Very low	50.6	Low	181 Å²	181	117.4 Å²	117.4	68%	0.683	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-77	-8	-178.9	-164.5	163.9	172.9	165.6	-1.5	114.1	I43	R40-I43 PolarHBondContact O-N 3.35Å
41	S	51.4	Low	49.1	Very low	111 Å²	111	119.7 Å²	119.7	78%	0.776	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-64.6	-30.8	160.7	-57.1	0	0	0	0	111	T39 I43	T39-S41 PolarHBondContact O-N 3.44Å; S41-I43 PolarHBondContact O-N 3.03Å
42	D	53	Low	47.7	Very low	95 Å²	95	123.6 Å²	123.6	51%	0.508	72%	0.724	S	S	.	*	G	3₁₀ helix	trans	-86.9	14.8	172.7	-40.9	-61.2	0	0	0	112.6	T38 T39	T38-D42 HydrophobicContact CG2-CB 3.97Å; T39-D42 WeakPolarHBondContact CA-OD2 3.3Å; T39-D42 PolarHBondContact N-OD2 3.4Å; T39-D42 CarbonylContact O-C 3.51Å; T39-D42 WeakPolarHBondContact O-CA 3.39Å; T39-D42 VanDerWaalsContact O-CB 3.23Å; T39-D42 WeakPolarHBondContact O-CB 3.39Å; T39-D42 PolarHBondContact O-N 2.88Å; T39-D42 PolarHBondContact OG1-OD2 3.2Å
43	I	42.6	Very low	46.3	Very low	154 Å²	154	119 Å²	119	79%	0.79	72%	0.724	S	S	*	*	S	Bend	trans	52.6	76.3	172.2	-48.2	-179.1	0	0	0	114.5	R40 S41	R40-I43 PolarHBondContact O-N 3.35Å; S41-I43 PolarHBondContact O-N 3.03Å
44	G	39	Very low	44.7	Very low	39 Å²	39	122.3 Å²	122.3	40%	0.402	73%	0.726	S	S	.	*			trans	-155	140.1	164	0	0	0	0	0	111.4
45	P	38	Very low	43.5	Very low	105 Å²	105	128.3 Å²	128.3	68%	0.682	75%	0.745	S	S	*	*			trans	-92.2	141.5	-167.3	34.1	-34.5	0	0	0	115.5
46	A	34.8	Very low	42.4	Very low	85 Å²	85	132.5 Å²	132.5	70%	0.702	75%	0.746	S	S	*	*			trans	73.1	109.1	148.1	0	0	0	0	0	120
47	R	36	Very low	41.4	Very low	251 Å²	251	136.7 Å²	136.7	95%	0.947	74%	0.744	S	S	*	*				-162.5	152.7	110.6	-122.7	172.4	159.4	147.3	-6.7	113.4
48	E	33.8	Very low	41.1	Very low	188 Å²	188	133.8 Å²	133.8	88%	0.879	74%	0.743	S	S	*	*			trans	-100.4	153	179.1	-64.9	175.5	137.8	0	0	112.5
49	A	33.2	Very low	40.5	Very low	103 Å²	103	136.9 Å²	136.9	85%	0.851	75%	0.749	S	S	*	*			trans	50.6	106.1	146.3	0	0	0	0	0	120.7
50	G	43.7	Very low	39.8	Very low	82 Å²	82	141.8 Å²	141.8	85%	0.845	77%	0.767	S	S	*	*				99.6	98.4	126.8	0	0	0	0	0	118.6
51	D	37.1	Very low	39.4	Very low	165 Å²	165	138.8 Å²	138.8	88%	0.882	77%	0.771	S	S	*	*				-151.5	159.8	126.5	-146.9	-16.1	0	0	0	110.7
52	V	37.7	Very low	38.5	Very low	133 Å²	133	145.4 Å²	145.4	81%	0.806	78%	0.779	S	S	*	*			trans	-99.6	126.3	-166.4	-177.2	0	0	0	0	111.7
53	S	38.5	Very low	37.8	Very low	110 Å²	110	150.2 Å²	150.2	77%	0.769	80%	0.796	S	S	*	*			trans	-103.9	130.1	163.7	55.2	0	0	0	0	111.6	E55	S53-E55 PolarHBondContact O-N 3.42Å
54	D	37.2	Very low	37.3	Very low	131 Å²	131	152.2 Å²	152.2	70%	0.701	80%	0.798	S	S	*	*			trans	-92.4	84.2	-166.9	-169.2	26.7	0	0	0	112.3
55	E	38	Very low	37.2	Very low	181 Å²	181	156.9 Å²	156.9	85%	0.846	82%	0.82	S	S	*	*			trans	-128.3	81.8	171.2	-69	-162.9	165.4	0	0	111.8	S53	S53-E55 PolarHBondContact O-N 3.42Å
56	R	38.4	Very low	37.2	Very low	219 Å²	219	158.5 Å²	158.5	83%	0.826	83%	0.827	S	S	*	*			trans	-98.9	69.4	168.5	-87.6	-176.8	-77.7	-167.4	-9.3	112
57	H	40.1	Very low	37.4	Very low	169 Å²	169	156.9 Å²	156.9	78%	0.782	82%	0.82	S	S	*	*			trans	-126	114.6	161	-82.2	-62.3	0	0	0	109.9	H59	H57-H59 PolarHBondContact O-N 2.88Å
58	P	43.1	Very low	37.4	Very low	121 Å²	121	151.9 Å²	151.9	79%	0.786	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-62.9	121.7	164.8	-15	29	0	0	0	108.1	Q60	P58-Q60 PolarHBondContact O-N 3.43Å
59	H	40	Very low	37.8	Very low	183 Å²	183	146.1 Å²	146.1	85%	0.847	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-59.3	127.5	171.4	-86.8	-104.4	0	0	0	109.2	H57	H57-H59 PolarHBondContact O-N 2.88Å
60	Q	33.8	Very low	38.1	Very low	171 Å²	171	145.1 Å²	145.1	80%	0.799	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-72.1	134.4	173.1	-68.1	-178.5	-8.1	0	0	108.8	P58 R62	P58-Q60 PolarHBondContact O-N 3.43Å; Q60-R62 PolarHBondContact O-N 2.87Å; Q60-R62 VanDerWaalsContact O-N 3.08Å
61	P	38.3	Very low	37.8	Very low	118 Å²	118	150.2 Å²	150.2	77%	0.766	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-60.5	117.6	165.2	25.3	-32.2	0	0	0	108.3	K63	P61-K63 VanDerWaalsContact C-N 3.32Å; P61-K63 PolarHBondContact O-N 3.2Å
62	R	32.3	Very low	37.7	Very low	251 Å²	251	151.6 Å²	151.6	95%	0.947	81%	0.813	S	S	*	*			trans	-65.9	86.7	178.2	-76.2	178.8	167.8	175.2	-2.1	110	Q60 K64	Q60-R62 PolarHBondContact O-N 2.87Å; Q60-R62 VanDerWaalsContact O-N 3.08Å; R62-K64 PolarHBondContact O-N 3.21Å
63	K	38	Very low	37.6	Very low	196 Å²	196	156.6 Å²	156.6	85%	0.852	82%	0.817	S	S	*	*			trans	-75.6	117.7	168.9	-100.6	-173.1	174.1	-176.5	0	110.2	P61 T65	P61-K63 VanDerWaalsContact C-N 3.32Å; P61-K63 PolarHBondContact O-N 3.2Å; K63-T65 PolarHBondContact O-N 2.85Å
64	K	33.3	Very low	37.7	Very low	195 Å²	195	160.3 Å²	160.3	85%	0.848	82%	0.823	S	S	*	*			trans	-31.6	111.1	178.2	-66.5	179.2	173.9	-176.5	0	113	R62 T66	R62-K64 PolarHBondContact O-N 3.21Å; K64-T66 PolarHBondContact O-N 3.45Å
65	T	36.1	Very low	37.4	Very low	138 Å²	138	162.8 Å²	162.8	85%	0.847	83%	0.83	S	S	*	*			trans	-86.3	97.5	158.5	47.3	0	0	0	0	108.3	K63 G67	K63-T65 PolarHBondContact O-N 2.85Å; T65-G67 PolarHBondContact O-N 3.5Å
66	T	37.9	Very low	37.5	Very low	138 Å²	138	160.2 Å²	160.2	85%	0.847	83%	0.826	S	S	*	*			trans	-68.5	99.3	168.4	6.7	0	0	0	0	109.2	K64	K64-T66 PolarHBondContact O-N 3.45Å
67	G	38.1	Very low	37.3	Very low	52 Å²	52	158.6 Å²	158.6	54%	0.536	83%	0.828	S	S	.	*			trans	-69.6	145	161.9	0	0	0	0	0	109.9	T65 G69	T65-G67 PolarHBondContact O-N 3.5Å; G67-G69 VanDerWaalsContact C-N 3.33Å; G67-G69 PolarHBondContact O-N 3.04Å
68	P	36.8	Very low	37.2	Very low	146 Å²	146	158 Å²	158	95%	0.948	83%	0.826	S	S	*	*	S	Bend	trans	-71.8	88.3	173.7	29.8	-33.8	0	0	0	110
69	G	42	Very low	37.3	Very low	67 Å²	67	161.5 Å²	161.5	69%	0.691	83%	0.831	S	S	*	*	S	Bend	trans	162.1	74.4	-175	0	0	0	0	0	109.6	G67 E71	G67-G69 VanDerWaalsContact C-N 3.33Å; G67-G69 PolarHBondContact O-N 3.04Å; G69-E71 PolarHBondContact O-N 2.88Å; G69-E71 VanDerWaalsContact O-N 3.07Å
70	G	39.8	Very low	37.7	Very low	81 Å²	81	160.9 Å²	160.9	84%	0.835	83%	0.829	S	S	*	*			trans	-79.8	83.4	-172.4	0	0	0	0	0	113
71	E	38.4	Very low	38.7	Very low	189 Å²	189	161.4 Å²	161.4	88%	0.883	83%	0.832	S	S	*	*			trans	-105	114.8	158.2	-74	-176.7	170	0	0	108.7	G69	G69-E71 PolarHBondContact O-N 2.88Å; G69-E71 VanDerWaalsContact O-N 3.07Å
72	E	33.7	Very low	39.6	Very low	194 Å²	194	162.9 Å²	162.9	91%	0.907	83%	0.828	S	S	*	*			trans	-71.1	143.3	175.3	-65	165.8	165.3	0	0	109.2
73	R	35	Very low	41.2	Very low	238 Å²	238	155.4 Å²	155.4	90%	0.898	81%	0.807	S	S	*	*			trans	-119.2	129.8	162.6	-80.8	-170.1	175.5	-167.4	-2.6	108.3	E75	R73-E75 PolarHBondContact O-N 3.1Å
74	E	40.9	Very low	42.8	Very low	189 Å²	189	150.6 Å²	150.6	88%	0.883	79%	0.79	S	S	*	*			trans	-49.6	124.9	175.1	-64.6	164.8	145.1	0	0	109.6	V76	E74-V76 PolarHBondContact O-N 3.46Å
75	E	31.6	Very low	44.6	Very low	182 Å²	182	146.1 Å²	146.1	85%	0.85	78%	0.775	S	S	*	*			trans	-72	110.2	172	-69.9	176.4	158.6	0	0	106.7	R73 E77	R73-E75 PolarHBondContact O-N 3.1Å; E75-E77 PolarHBondContact O-N 3.5Å
76	V	39.5	Very low	46.4	Very low	127 Å²	127	146 Å²	146	77%	0.77	77%	0.77	S	S	*	*			trans	-69.8	124.7	169.4	175.5	0	0	0	0	107	E74 E78	E74-V76 PolarHBondContact O-N 3.46Å; V76-E78 VanDerWaalsContact C-N 3.27Å; V76-E78 PolarHBondContact O-N 3.26Å
77	E	34.6	Very low	48.1	Very low	186 Å²	186	144.1 Å²	144.1	87%	0.869	77%	0.768	S	S	*	*			trans	-60.9	86.5	170.7	-61.9	172.1	149.8	0	0	109.5	E75	E75-E77 PolarHBondContact O-N 3.5Å
78	E	38.5	Very low	49.9	Very low	157 Å²	157	143.6 Å²	143.6	73%	0.734	75%	0.753	S	S	*	*			trans	-73	125.1	155	-71.5	-168.3	158.7	0	0	106.7	V76 E80	V76-E78 VanDerWaalsContact C-N 3.27Å; V76-E78 PolarHBondContact O-N 3.26Å; E78-E80 PolarHBondContact O-N 3.13Å
79	E	44.3	Very low	51.7	Low	193 Å²	193	139.9 Å²	139.9	90%	0.902	72%	0.72	S	S	*	*			trans	-65.8	76.9	174.8	-64.4	175.8	133.1	0	0	109	E81	E79-E81 PolarHBondContact O-N 2.73Å
80	E	48.9	Very low	52.9	Low	171 Å²	171	140.5 Å²	140.5	80%	0.799	71%	0.708	S	S	*	*			trans	-61.7	111.9	174.7	-72.1	-167.5	155.5	0	0	108	E78	E78-E80 PolarHBondContact O-N 3.13Å
81	E	53.8	Low	54.4	Low	182 Å²	182	144.4 Å²	144.4	85%	0.85	70%	0.704	S	S	*	*			trans	-51.1	146.2	-177.7	-62.3	173.9	135.1	0	0	110.3	E79 D83	E79-E81 PolarHBondContact O-N 2.73Å; E81-D83 PolarHBondContact O-N 3.13Å
82	E	57.4	Low	55.6	Low	148 Å²	148	139.3 Å²	139.3	69%	0.692	70%	0.695	S	S	*	*			trans	-51.8	118.8	171.8	-66.4	-178.7	166.7	0	0	108.7	L84	E82-L84 HydrophobicContact CB-CD1 4.48Å; E82-L84 HydrophobicContact CB-CG 4.16Å; E82-L84 WeakPolarHBondContact O-CG 3.41Å; E82-L84 PolarHBondContact O-N 2.76Å
83	D	66.8	Low	56.9	Low	94 Å²	94	132.7 Å²	132.7	50%	0.503	67%	0.665	S	S	.	*			trans	-73.1	77.7	-174.8	-172.5	12.6	0	0	0	110	E81 N85 N88	E81-D83 PolarHBondContact O-N 3.13Å; D83-N85 PolarHBondContact O-N 2.86Å; D83-N85 VanDerWaalsContact O-N 3.17Å; D83-N85 WeakPolarHBondContact OD1-CB 3.41Å; D83-N88 WeakPolarHBondContact O-CB 3.29Å; D83-N88 PolarHBondContact O-ND2 2.91Å
84	L	71.1	Confident	57.7	Low	96 Å²	96	130.4 Å²	130.4	50%	0.503	66%	0.662	S	S	.	*			trans	-78.8	15.8	-178.2	-67.7	167.2	0	0	0	112.4	E82 Y100	E82-L84 HydrophobicContact CB-CD1 4.48Å; E82-L84 HydrophobicContact CB-CG 4.16Å; E82-L84 WeakPolarHBondContact O-CG 3.41Å; E82-L84 PolarHBondContact O-N 2.76Å; L84-Y100 VanDerWaalsContact C-CE1 3.46Å; L84-Y100 VanDerWaalsContact CA-CE1 3.46Å; L84-Y100 HydrophobicContact CB-CE1 4.16Å; L84-Y100 HydrophobicContact CD2-CD1 4.32Å; L84-Y100 HydrophobicContact CD2-CD2 3.8Å; L84-Y100 HydrophobicContact CD2-CE1 4.01Å; L84-Y100 HydrophobicContact CD2-CE2 3.44Å; L84-Y100 VanDerWaalsContact CD2-CE2 3.44Å; L84-Y100 HydrophobicContact CD2-CG 4.22Å; L84-Y100 WeakPolarHBondContact O-CE1 3.21Å
85	N	71.9	Confident	58.4	Low	100 Å²	100	130.6 Å²	130.6	54%	0.535	66%	0.66	S	S	.	*			trans	-73.7	146.5	-176.2	-163.2	-4.6	0	0	0	111.4	D83 A87 N88 Y89	D83-N85 PolarHBondContact O-N 2.86Å; D83-N85 VanDerWaalsContact O-N 3.17Å; D83-N85 WeakPolarHBondContact OD1-CB 3.41Å; N85-A87 PolarHBondContact O-N 3.22Å; N85-N88 WeakPolarHBondContact O-CA 3.4Å; N85-N88 PolarHBondContact O-N 3.38Å; N85-Y89 PolarHBondContact O-N 3.29Å; N85-Y89 VanDerWaalsContact O-N 3.1Å
86	D	74.2	Confident	59.6	Low	137 Å²	137	129.2 Å²	129.2	73%	0.733	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	-23	-178.3	-76.3	-11.6	0	0	0	113	N88	D86-N88 VanDerWaalsContact C-N 3.28Å
87	A	73	Confident	60.4	Low	98 Å²	98	129 Å²	129	81%	0.81	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-19.1	174.3	0	0	0	0	0	113.7	N85	N85-A87 PolarHBondContact O-N 3.22Å
88	N	76.7	Confident	61.5	Low	40 Å²	40	121.4 Å²	121.4	21%	0.214	62%	0.621	C	S	.	*	T	Hydrogen-bonded Turn	trans	-103	-15.7	176.3	-163.8	37.3	0	0	0	112.4	D83 N85 D86 Y100 G101	D83-N88 WeakPolarHBondContact O-CB 3.29Å; D83-N88 PolarHBondContact O-ND2 2.91Å; N85-N88 WeakPolarHBondContact O-CA 3.4Å; N85-N88 PolarHBondContact O-N 3.38Å; D86-N88 VanDerWaalsContact C-N 3.28Å; N88-Y100 CarbonylContact O-C 3.56Å; N88-Y100 WeakPolarHBondContact O-CA 3.47Å; N88-G101 PolarHBondContact ND2-O 2.85Å; N88-G101 PolarHBondContact O-N 3.21Å; N88-G101 WeakPolarHBondContact OD1-CA 3.39Å; N88-G101 PolarHBondContact OD1-N 3.15Å; N88-G101 PolarHBondContact OD1-O 3.03Å; N88-G101 VanDerWaalsContact OD1-O 3.04Å
89	Y	74.1	Confident	62.7	Low	68 Å²	68	121.1 Å²	121.1	27%	0.267	61%	0.613	S	S	.	*	B	Isolated β-bridge	trans	-76.9	130.8	171.8	-173.8	-98.7	0	0	0	111.3	N85 E91 R99 Y100	N85-Y89 PolarHBondContact O-N 3.29Å; N85-Y89 VanDerWaalsContact O-N 3.1Å; Y89-E91 HydrophobicContact CD1-CG 4.4Å; Y89-E91 HydrophobicContact CE1-CG 3.66Å; Y89-R99 HydrophobicContact CD2-CB 3.98Å; Y89-R99 HydrophobicContact CE2-CB 3.53Å; Y89-R99 HydrophobicContact CE2-CG 4.31Å; Y89-R99 PolarHBondContact OH-NH1 3.32Å; Y89-R99 VanDerWaalsContact OH-NH1 3.11Å; Y89-Y100 HydrophobicContact CD2-CD1 4.05Å; Y89-Y100 HydrophobicContact CD2-CD2 4.39Å; Y89-Y100 AromaticContact CD2-CE1 3.68Å; Y89-Y100 HydrophobicContact CD2-CE1 3.68Å; Y89-Y100 HydrophobicContact CD2-CE2 4.05Å; Y89-Y100 HydrophobicContact CD2-CG 4.4Å; Y89-Y100 AromaticContact CD2-CZ 3.69Å; Y89-Y100 HydrophobicContact CG-CE1 4.18Å
90	D	67.5	Low	64	Low	80 Å²	80	116 Å²	116	43%	0.428	59%	0.587	S	S	.	*			trans	-131.2	107.5	177.3	-173	-2.4	0	0	0	111.5	A92 I93 R99	D90-A92 PolarHBondContact O-N 2.95Å; D90-A92 VanDerWaalsContact O-N 3.11Å; D90-A92 VanDerWaalsContact OD1-CB 3.26Å; D90-A92 WeakPolarHBondContact OD1-CB 3.19Å; D90-A92 PolarHBondContact OD1-N 2.81Å; D90-I93 HydrophobicContact CB-CD1 3.81Å; D90-I93 HydrophobicContact CB-CG1 3.91Å; D90-I93 PolarHBondContact O-N 3.09Å; D90-I93 VanDerWaalsContact O-N 3.13Å; D90-R99 PolarHBondContact N-O 2.88Å
91	E	70.7	Confident	64.9	Low	164 Å²	164	109.6 Å²	109.6	77%	0.766	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-24	176.8	-72.4	-165.4	139	0	0	113.4	Y89 I93	Y89-E91 HydrophobicContact CD1-CG 4.4Å; Y89-E91 HydrophobicContact CE1-CG 3.66Å; E91-I93 PolarHBondContact O-N 3.07Å
92	A	62.8	Low	65.6	Low	82 Å²	82	103.8 Å²	103.8	68%	0.678	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-16.1	-179.1	0	0	0	0	0	113.2	D90 F94	D90-A92 PolarHBondContact O-N 2.95Å; D90-A92 VanDerWaalsContact O-N 3.11Å; D90-A92 VanDerWaalsContact OD1-CB 3.26Å; D90-A92 WeakPolarHBondContact OD1-CB 3.19Å; D90-A92 PolarHBondContact OD1-N 2.81Å; A92-F94 PolarHBondContact O-N 3.35Å
93	I	60.7	Low	66.2	Low	55 Å²	55	100.5 Å²	100.5	28%	0.282	55%	0.548	S	S	.	.			trans	-80.2	49.1	179.4	-49.4	-179.9	0	0	0	110.5	D90 E91 K95 F96 A98	D90-I93 HydrophobicContact CB-CD1 3.81Å; D90-I93 HydrophobicContact CB-CG1 3.91Å; D90-I93 PolarHBondContact O-N 3.09Å; D90-I93 VanDerWaalsContact O-N 3.13Å; E91-I93 PolarHBondContact O-N 3.07Å; I93-K95 PolarHBondContact O-N 3.35Å; I93-F96 HydrophobicContact CG2-CB 3.8Å; I93-F96 HydrophobicContact CG2-CD2 4.36Å; I93-A98 VanDerWaalsContact CG2-O 3.27Å; I93-A98 WeakPolarHBondContact CG2-O 3.3Å
94	F	52.5	Low	66.2	Low	189 Å²	189	101.8 Å²	101.8	83%	0.829	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-14	179.9	-171.8	-95.2	0	0	0	113.7	A92	A92-F94 PolarHBondContact O-N 3.35Å
95	K	56.5	Low	66.2	Low	193 Å²	193	104.1 Å²	104.1	84%	0.839	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-7.7	-174.1	-89.9	-168.5	172.4	-171.1	0	115.8	I93	I93-K95 PolarHBondContact O-N 3.35Å
96	F	55.5	Low	66.1	Low	154 Å²	154	103.9 Å²	103.9	68%	0.675	57%	0.567	S	S	*	*	S	Bend	trans	-117	154.1	176.9	-73.8	-91.6	0	0	0	110.6	I93 A98	I93-F96 HydrophobicContact CG2-CB 3.8Å; I93-F96 HydrophobicContact CG2-CD2 4.36Å; F96-A98 PolarHBondContact O-N 2.91Å
97	P	56.6	Low	65.9	Low	123 Å²	123	105.8 Å²	105.8	80%	0.799	57%	0.569	S	S	*	*	S	Bend	trans	-63.2	-29.7	179.3	-23.2	34.6	0	0	0	113.8
98	A	58.2	Low	65.8	Low	25 Å²	25	106 Å²	106	21%	0.207	56%	0.556	C	S	.	*			trans	-82.8	114.9	178.1	0	0	0	0	0	110.9	I93 F96 L104	I93-A98 VanDerWaalsContact CG2-O 3.27Å; I93-A98 WeakPolarHBondContact CG2-O 3.3Å; F96-A98 PolarHBondContact O-N 2.91Å; A98-L104 HydrophobicContact CB-CD1 4.16Å
99	R	63.4	Low	65.8	Low	151 Å²	151	109 Å²	109	57%	0.57	58%	0.578	S	S	*	*	S	Bend	trans	-85.5	-11.8	169.7	-62.4	-179.5	175.5	-127.2	-1.2	113.4	Y89 D90	Y89-R99 HydrophobicContact CD2-CB 3.98Å; Y89-R99 HydrophobicContact CE2-CB 3.53Å; Y89-R99 HydrophobicContact CE2-CG 4.31Å; Y89-R99 PolarHBondContact OH-NH1 3.32Å; Y89-R99 VanDerWaalsContact OH-NH1 3.11Å; D90-R99 PolarHBondContact N-O 2.88Å
100	Y	71.9	Confident	66.1	Low	87 Å²	87	112 Å²	112	34%	0.341	59%	0.59	S	S	.	*	B	Isolated β-bridge	trans	-105.5	144.9	177.2	-67.2	-83	0	0	0	109.3	L84 N88 Y89 G102	L84-Y100 VanDerWaalsContact C-CE1 3.46Å; L84-Y100 VanDerWaalsContact CA-CE1 3.46Å; L84-Y100 HydrophobicContact CB-CE1 4.16Å; L84-Y100 HydrophobicContact CD2-CD1 4.32Å; L84-Y100 HydrophobicContact CD2-CD2 3.8Å; L84-Y100 HydrophobicContact CD2-CE1 4.01Å; L84-Y100 HydrophobicContact CD2-CE2 3.44Å; L84-Y100 VanDerWaalsContact CD2-CE2 3.44Å; L84-Y100 HydrophobicContact CD2-CG 4.22Å; L84-Y100 WeakPolarHBondContact O-CE1 3.21Å; N88-Y100 CarbonylContact O-C 3.56Å; N88-Y100 WeakPolarHBondContact O-CA 3.47Å; Y89-Y100 HydrophobicContact CD2-CD1 4.05Å; Y89-Y100 HydrophobicContact CD2-CD2 4.39Å; Y89-Y100 AromaticContact CD2-CE1 3.68Å; Y89-Y100 HydrophobicContact CD2-CE1 3.68Å; Y89-Y100 HydrophobicContact CD2-CE2 4.05Å; Y89-Y100 HydrophobicContact CD2-CG 4.4Å; Y89-Y100 AromaticContact CD2-CZ 3.69Å; Y89-Y100 HydrophobicContact CG-CE1 4.18Å; Y100-G102 PolarHBondContact O-N 2.85Å
101	G	66.7	Low	66.9	Low	36 Å²	36	113.2 Å²	113.2	37%	0.371	60%	0.597	S	S	.	*	S	Bend	trans	-66.8	110.9	175.2	0	0	0	0	0	110.9	N88	N88-G101 PolarHBondContact ND2-O 2.85Å; N88-G101 PolarHBondContact O-N 3.21Å; N88-G101 WeakPolarHBondContact OD1-CA 3.39Å; N88-G101 PolarHBondContact OD1-N 3.15Å; N88-G101 PolarHBondContact OD1-O 3.03Å; N88-G101 VanDerWaalsContact OD1-O 3.04Å
102	G	69	Low	67.6	Low	60 Å²	60	112.2 Å²	112.2	62%	0.619	59%	0.59	S	S	*	*	S	Bend	trans	161.9	149.6	-178.3	0	0	0	0	0	110.3	Y100	Y100-G102 PolarHBondContact O-N 2.85Å
103	S	69.4	Low	68.7	Low	78 Å²	78	114.6 Å²	114.6	55%	0.545	59%	0.591	S	S	.	*			trans	-79.7	127.7	168.4	-176.6	0	0	0	0	108.6	F105 S106	S103-F105 VanDerWaalsContact C-N 3.28Å; S103-F105 PolarHBondContact OG-N 2.94Å; S103-S106 PolarHBondContact O-OG 3.22Å
104	L	68.4	Low	70.1	Confident	122 Å²	122	115.3 Å²	115.3	64%	0.639	60%	0.595	S	S	*	*	S	Bend	trans	-72.8	-26.4	173.1	-129.7	115.3	0	0	0	111.8	A98	A98-L104 HydrophobicContact CB-CD1 4.16Å
105	F	70.7	Confident	71.6	Confident	144 Å²	144	111.8 Å²	111.8	63%	0.632	58%	0.581	S	S	*	*	S	Bend	trans	-96.5	-4.2	-168.2	-56.3	-71.9	0	0	0	113.8	S103 K107 D108	S103-F105 VanDerWaalsContact C-N 3.28Å; S103-F105 PolarHBondContact OG-N 2.94Å; F105-K107 PolarHBondContact O-N 2.86Å; F105-K107 VanDerWaalsContact O-N 3.12Å; F105-D108 PolarHBondContact O-N 3.2Å
106	S	70.4	Confident	73.2	Confident	95 Å²	95	108.4 Å²	108.4	66%	0.664	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	4.6	-179.1	56.8	0	0	0	0	114.8	S103	S103-S106 PolarHBondContact O-OG 3.22Å
107	K	68.7	Low	74.8	Confident	177 Å²	177	102.9 Å²	102.9	77%	0.77	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	-16.9	173.7	-82.9	-172.8	176	177.8	0	113.7	F105	F105-K107 PolarHBondContact O-N 2.86Å; F105-K107 VanDerWaalsContact O-N 3.12Å
108	D	71.1	Confident	76.2	Confident	103 Å²	103	100.3 Å²	100.3	55%	0.551	53%	0.531	S	S	*	.	S	Bend	trans	-73	153.5	177.3	-69.7	-40.1	0	0	0	109.8	F105 Y110	F105-D108 PolarHBondContact O-N 3.2Å; D108-Y110 PolarHBondContact O-N 3.2Å
109	P	76.1	Confident	77.7	Confident	104 Å²	104	101.7 Å²	101.7	68%	0.675	54%	0.542	S	S	*	.			trans	-56.3	113.3	174.5	-21.9	33.2	0	0	0	109.5	D111	P109-D111 PolarHBondContact O-N 2.93Å
110	Y	81.9	Confident	79	Confident	131 Å²	131	98.7 Å²	98.7	51%	0.514	54%	0.54	S	S	.	.			trans	-89.9	88.5	177.8	-167.2	-98	0	0	0	107.7	D108 D114 E115 D118	D108-Y110 PolarHBondContact O-N 3.2Å; Y110-D114 HydrophobicContact CD2-CB 3.85Å; Y110-D114 HydrophobicContact CE2-CB 3.94Å; Y110-D114 HydrophobicContact CG-CB 4.26Å; Y110-E115 HydrophobicContact CD1-CB 4.48Å; Y110-E115 HydrophobicContact CE1-CB 3.69Å; Y110-E115 HydrophobicContact CE1-CG 4.17Å; Y110-D118 WeakPolarHBondContact OH-CB 3.4Å; Y110-D118 PolarHBondContact OH-OD2 2.87Å
111	D	83.3	Confident	79.9	Confident	105 Å²	105	101.6 Å²	101.6	56%	0.561	55%	0.552	S	S	*	*			trans	-77.8	169.3	-177.7	-73.4	-14.4	0	0	0	109.9	P109 D113 D114 E115	P109-D111 PolarHBondContact O-N 2.93Å; D111-D113 PolarHBondContact O-N 3.32Å; D111-D114 PolarHBondContact N-OD2 3.17Å; D111-D114 WeakPolarHBondContact O-CA 3.39Å; D111-D114 WeakPolarHBondContact O-CB 3.47Å; D111-D114 PolarHBondContact O-N 3.02Å; D111-E115 PolarHBondContact O-N 3.35Å; D111-E115 VanDerWaalsContact O-N 3.09Å
112	K	85	Confident	80.9	Confident	143 Å²	143	106 Å²	106	62%	0.622	56%	0.563	S	S	*	*	H	α-helix	trans	-62.6	-29.3	-178	-165.2	173.4	-177.7	178.8	0	112.9	D114 E115 E116	K112-D114 VanDerWaalsContact C-N 3.3Å; K112-E115 PolarHBondContact O-N 2.91Å; K112-E116 PolarHBondContact O-N 3.26Å
113	D	87.6	Confident	81.9	Confident	132 Å²	132	109 Å²	109	71%	0.706	56%	0.564	S	S	*	*	H	α-helix	trans	-67.8	-32.9	175.3	-65.7	9.8	0	0	0	110.9	D111 A117	D111-D113 PolarHBondContact O-N 3.32Å; D113-A117 VanDerWaalsContact O-CB 3.26Å; D113-A117 WeakPolarHBondContact O-CB 3.38Å; D113-A117 PolarHBondContact O-N 3.26Å
114	D	88.8	Confident	82.8	Confident	69 Å²	69	108.9 Å²	108.9	37%	0.369	56%	0.556	S	S	.	*	H	α-helix	trans	-72.3	-39.2	173.6	-55.9	-62	0	0	0	111.2	Y110 D111 K112 E116 A117 D118	Y110-D114 HydrophobicContact CD2-CB 3.85Å; Y110-D114 HydrophobicContact CE2-CB 3.94Å; Y110-D114 HydrophobicContact CG-CB 4.26Å; D111-D114 PolarHBondContact N-OD2 3.17Å; D111-D114 WeakPolarHBondContact O-CA 3.39Å; D111-D114 WeakPolarHBondContact O-CB 3.47Å; D111-D114 PolarHBondContact O-N 3.02Å; K112-D114 VanDerWaalsContact C-N 3.3Å; D114-E116 PolarHBondContact O-N 3.45Å; D114-A117 PolarHBondContact O-N 3.09Å; D114-D118 WeakPolarHBondContact O-CB 3.38Å; D114-D118 PolarHBondContact O-N 2.83Å
115	E	84.4	Confident	83.7	Confident	116 Å²	116	108.3 Å²	108.3	54%	0.542	55%	0.554	S	S	.	*	H	α-helix	trans	-59.7	-44.8	172.7	-168.6	-177.4	-168.6	0	0	112	Y110 D111 K112 A119	Y110-E115 HydrophobicContact CD1-CB 4.48Å; Y110-E115 HydrophobicContact CE1-CB 3.69Å; Y110-E115 HydrophobicContact CE1-CG 4.17Å; D111-E115 PolarHBondContact O-N 3.35Å; D111-E115 VanDerWaalsContact O-N 3.09Å; K112-E115 PolarHBondContact O-N 2.91Å; E115-A119 VanDerWaalsContact O-CB 3.26Å; E115-A119 WeakPolarHBondContact O-CB 3.23Å; E115-A119 PolarHBondContact O-N 3.48Å
116	E	89.4	Confident	84.5	Confident	122 Å²	122	105.5 Å²	105.5	57%	0.57	55%	0.546	S	S	*	.	H	α-helix	trans	-68.2	-37	175.9	-70.6	-173.8	-165.7	0	0	111.9	K112 D114 V120	K112-E116 PolarHBondContact O-N 3.26Å; D114-E116 PolarHBondContact O-N 3.45Å; E116-V120 WeakPolarHBondContact O-CG2 3.39Å; E116-V120 PolarHBondContact O-N 2.84Å; E116-V120 VanDerWaalsContact O-N 3.11Å
117	A	88.8	Confident	85.3	Confident	37 Å²	37	109.1 Å²	109.1	31%	0.306	55%	0.545	S	S	.	.	H	α-helix	trans	-65.3	-49.5	175.6	0	0	0	0	0	112.2	D113 D114 A119 V120 Y121	D113-A117 VanDerWaalsContact O-CB 3.26Å; D113-A117 WeakPolarHBondContact O-CB 3.38Å; D113-A117 PolarHBondContact O-N 3.26Å; D114-A117 PolarHBondContact O-N 3.09Å; A117-A119 VanDerWaalsContact C-N 3.35Å; A117-A119 PolarHBondContact O-N 3.21Å; A117-V120 CarbonylContact O-C 3.57Å; A117-V120 WeakPolarHBondContact O-CA 3.41Å; A117-V120 WeakPolarHBondContact O-CB 3.49Å; A117-V120 PolarHBondContact O-N 3.23Å; A117-V120 VanDerWaalsContact O-N 3.1Å; A117-Y121 HydrophobicContact CB-CD2 4.45Å; A117-Y121 HydrophobicContact CB-CE2 4.26Å; A117-Y121 WeakPolarHBondContact O-CD2 3.49Å; A117-Y121 PolarHBondContact O-N 3.33Å
118	D	88	Confident	86	Confident	69 Å²	69	105.8 Å²	105.8	37%	0.369	53%	0.532	S	S	.	.	H	α-helix	trans	-66.4	-35	178.2	-94.2	5	0	0	0	112	Y110 D114 V120 Y121 Q122	Y110-D118 WeakPolarHBondContact OH-CB 3.4Å; Y110-D118 PolarHBondContact OH-OD2 2.87Å; D114-D118 WeakPolarHBondContact O-CB 3.38Å; D114-D118 PolarHBondContact O-N 2.83Å; D118-V120 VanDerWaalsContact C-N 3.29Å; D118-V120 PolarHBondContact O-N 2.82Å; D118-Y121 PolarHBondContact O-N 2.76Å; D118-Q122 VanDerWaalsContact O-CB 3.31Å; D118-Q122 WeakPolarHBondContact O-CB 3.34Å; D118-Q122 VanDerWaalsContact O-CG 3.28Å; D118-Q122 WeakPolarHBondContact O-CG 2.98Å; D118-Q122 PolarHBondContact O-N 3.45Å
119	A	87.7	Confident	86.6	Confident	55 Å²	55	103.5 Å²	103.5	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-60.8	-39.7	170.7	0	0	0	0	0	111.7	E115 A117 L123	E115-A119 VanDerWaalsContact O-CB 3.26Å; E115-A119 WeakPolarHBondContact O-CB 3.23Å; E115-A119 PolarHBondContact O-N 3.48Å; A117-A119 VanDerWaalsContact C-N 3.35Å; A117-A119 PolarHBondContact O-N 3.21Å; A119-L123 VanDerWaalsContact O-CB 3.29Å; A119-L123 WeakPolarHBondContact O-CB 3.25Å; A119-L123 PolarHBondContact O-N 3.47Å; A119-L123 VanDerWaalsContact O-N 3.09Å
120	V	91	Very high	86.9	Confident	87 Å²	87	104.2 Å²	104.2	53%	0.527	51%	0.514	S	S	.	.	H	α-helix	trans	-68.8	-42.9	174	170.2	0	0	0	0	111.6	E116 A117 D118 L123 I124	E116-V120 WeakPolarHBondContact O-CG2 3.39Å; E116-V120 PolarHBondContact O-N 2.84Å; E116-V120 VanDerWaalsContact O-N 3.11Å; A117-V120 CarbonylContact O-C 3.57Å; A117-V120 WeakPolarHBondContact O-CA 3.41Å; A117-V120 WeakPolarHBondContact O-CB 3.49Å; A117-V120 PolarHBondContact O-N 3.23Å; A117-V120 VanDerWaalsContact O-N 3.1Å; D118-V120 VanDerWaalsContact C-N 3.29Å; D118-V120 PolarHBondContact O-N 2.82Å; V120-L123 PolarHBondContact O-N 2.71Å; V120-I124 HydrophobicContact CG1-CD1 3.93Å; V120-I124 VanDerWaalsContact O-CG1 3.29Å; V120-I124 WeakPolarHBondContact O-CG1 3.39Å; V120-I124 PolarHBondContact O-N 2.92Å
121	Y	91.2	Very high	86.8	Confident	148 Å²	148	105 Å²	105	58%	0.58	52%	0.52	S	S	*	.	H	α-helix	trans	-66.3	-42	177.8	-72.6	-60.1	0	0	0	112.5	A117 D118 L123 I124 D125	A117-Y121 HydrophobicContact CB-CD2 4.45Å; A117-Y121 HydrophobicContact CB-CE2 4.26Å; A117-Y121 WeakPolarHBondContact O-CD2 3.49Å; A117-Y121 PolarHBondContact O-N 3.33Å; D118-Y121 PolarHBondContact O-N 2.76Å; Y121-L123 VanDerWaalsContact C-N 3.32Å; Y121-L123 PolarHBondContact O-N 3.02Å; Y121-I124 HydrophobicContact CD1-CD1 4.38Å; Y121-I124 WeakPolarHBondContact O-CB 3.42Å; Y121-I124 PolarHBondContact O-N 3.32Å; Y121-D125 PolarHBondContact O-N 2.94Å
122	Q	87.7	Confident	86.6	Confident	129 Å²	129	109 Å²	109	60%	0.603	53%	0.527	S	S	*	.	H	α-helix	trans	-60.2	-41.5	172.4	-74.5	179	23.4	0	0	111.6	D118 I124 D125 D126	D118-Q122 VanDerWaalsContact O-CB 3.31Å; D118-Q122 WeakPolarHBondContact O-CB 3.34Å; D118-Q122 VanDerWaalsContact O-CG 3.28Å; D118-Q122 WeakPolarHBondContact O-CG 2.98Å; D118-Q122 PolarHBondContact O-N 3.45Å; Q122-I124 VanDerWaalsContact C-N 3.32Å; Q122-I124 PolarHBondContact O-N 3.36Å; Q122-D125 PolarHBondContact O-N 3.41Å; Q122-D126 WeakPolarHBondContact O-CB 3.31Å; Q122-D126 PolarHBondContact O-N 2.97Å
123	L	89.4	Confident	86.7	Confident	122 Å²	122	105.6 Å²	105.6	64%	0.639	51%	0.511	S	S	*	.	H	α-helix	trans	-69	-31.7	177.7	-158.3	153.2	0	0	0	111.8	A119 V120 Y121 R127	A119-L123 VanDerWaalsContact O-CB 3.29Å; A119-L123 WeakPolarHBondContact O-CB 3.25Å; A119-L123 PolarHBondContact O-N 3.47Å; A119-L123 VanDerWaalsContact O-N 3.09Å; V120-L123 PolarHBondContact O-N 2.71Å; Y121-L123 VanDerWaalsContact C-N 3.32Å; Y121-L123 PolarHBondContact O-N 3.02Å; L123-R127 WeakPolarHBondContact O-CB 3.49Å; L123-R127 PolarHBondContact O-N 2.97Å
124	I	90.1	Very high	86.6	Confident	76 Å²	76	106.5 Å²	106.5	39%	0.39	51%	0.51	S	S	.	.	H	α-helix	trans	-66.3	-47.7	169.3	-70.9	164.8	0	0	0	110.7	V120 Y121 Q122 R127 Q128	V120-I124 HydrophobicContact CG1-CD1 3.93Å; V120-I124 VanDerWaalsContact O-CG1 3.29Å; V120-I124 WeakPolarHBondContact O-CG1 3.39Å; V120-I124 PolarHBondContact O-N 2.92Å; Y121-I124 HydrophobicContact CD1-CD1 4.38Å; Y121-I124 WeakPolarHBondContact O-CB 3.42Å; Y121-I124 PolarHBondContact O-N 3.32Å; Q122-I124 VanDerWaalsContact C-N 3.32Å; Q122-I124 PolarHBondContact O-N 3.36Å; I124-R127 CarbonylContact O-C 3.59Å; I124-R127 WeakPolarHBondContact O-CB 3.45Å; I124-R127 PolarHBondContact O-N 3.24Å; I124-Q128 WeakPolarHBondContact O-CG 3.25Å; I124-Q128 PolarHBondContact O-N 2.97Å
125	D	86.3	Confident	86.4	Confident	110 Å²	110	110.5 Å²	110.5	59%	0.588	52%	0.521	S	S	*	.	H	α-helix	trans	-66.2	-44.8	-178.8	-85.3	-9	0	0	0	111.8	Y121 Q122 R127 Q128 D129	Y121-D125 PolarHBondContact O-N 2.94Å; Q122-D125 PolarHBondContact O-N 3.41Å; D125-R127 PolarHBondContact O-N 3.3Å; D125-Q128 WeakPolarHBondContact O-CB 3.34Å; D125-Q128 PolarHBondContact O-N 3.46Å; D125-D129 VanDerWaalsContact O-CB 3.25Å; D125-D129 WeakPolarHBondContact O-CB 3.15Å; D125-D129 PolarHBondContact O-N 3.47Å
126	D	87.1	Confident	86.5	Confident	86 Å²	86	109.8 Å²	109.8	46%	0.46	51%	0.514	S	S	.	.	H	α-helix	trans	-53.6	-43.3	171.2	-94.4	-19.3	0	0	0	111.3	Q122 D129 E130 R133	Q122-D126 WeakPolarHBondContact O-CB 3.31Å; Q122-D126 PolarHBondContact O-N 2.97Å; D126-D129 CarbonylContact O-C 3.58Å; D126-D129 PolarHBondContact O-N 2.73Å; D126-E130 WeakPolarHBondContact O-CG 3.39Å; D126-E130 PolarHBondContact O-N 2.95Å; D126-R133 IonicContact OD1-CZ 2.64Å; D126-R133 IonicContact OD1-NH2 2.67Å; D126-R133 PolarHBondContact OD1-NH2 3.29Å
127	R	87	Confident	86.5	Confident	170 Å²	170	109.1 Å²	109.1	64%	0.642	51%	0.511	S	S	*	.	H	α-helix	trans	-71.9	-29.1	177.6	-173.2	-178.9	-174.8	82.2	-2.1	113.6	L123 I124 D125 D129	L123-R127 WeakPolarHBondContact O-CB 3.49Å; L123-R127 PolarHBondContact O-N 2.97Å; I124-R127 CarbonylContact O-C 3.59Å; I124-R127 WeakPolarHBondContact O-CB 3.45Å; I124-R127 PolarHBondContact O-N 3.24Å; D125-R127 PolarHBondContact O-N 3.3Å; R127-D129 VanDerWaalsContact C-N 3.32Å
128	Q	83.5	Confident	86.5	Confident	107 Å²	107	113.3 Å²	113.3	50%	0.5	52%	0.524	S	S	.	.	H	α-helix	trans	-68.3	-39.1	168	-67	-64.1	-15.1	0	0	110.3	I124 D125 K131	I124-Q128 WeakPolarHBondContact O-CG 3.25Å; I124-Q128 PolarHBondContact O-N 2.97Å; D125-Q128 WeakPolarHBondContact O-CB 3.34Å; D125-Q128 PolarHBondContact O-N 3.46Å; Q128-K131 WeakPolarHBondContact O-CB 3.49Å; Q128-K131 WeakPolarHBondContact O-CD 3.31Å; Q128-K131 WeakPolarHBondContact O-CG 3.45Å
129	D	83.5	Confident	86.5	Confident	56 Å²	56	115.7 Å²	115.7	30%	0.299	53%	0.531	S	S	.	.	H	α-helix	trans	-79.3	-31.5	-171.9	-155	58.2	0	0	0	113.3	D125 D126 R127 K131 R132 R133 R136	D125-D129 VanDerWaalsContact O-CB 3.25Å; D125-D129 WeakPolarHBondContact O-CB 3.15Å; D125-D129 PolarHBondContact O-N 3.47Å; D126-D129 CarbonylContact O-C 3.58Å; D126-D129 PolarHBondContact O-N 2.73Å; R127-D129 VanDerWaalsContact C-N 3.32Å; D129-K131 PolarHBondContact O-N 3.31Å; D129-K131 VanDerWaalsContact O-N 3.09Å; D129-R132 PolarHBondContact O-N 2.92Å; D129-R132 VanDerWaalsContact O-N 3.09Å; D129-R133 PolarHBondContact O-N 3.39Å; D129-R133 IonicContact OD2-NE 3.73Å; D129-R136 VanDerWaalsContact CG-CZ 3.5Å; D129-R136 VanDerWaalsContact CG-NH1 3.32Å; D129-R136 PolarHBondContact O-NH2 3.36Å; D129-R136 IonicContact OD1-CZ 3.38Å; D129-R136 IonicContact OD1-NE 3.42Å; D129-R136 IonicContact OD1-NH1 3.47Å; D129-R136 PolarHBondContact OD1-NH1 3.47Å; D129-R136 VanDerWaalsContact OD1-NH1 3.15Å; D129-R136 IonicContact OD1-NH2 2.75Å; D129-R136 PolarHBondContact OD1-NH2 2.94Å; D129-R136 IonicContact OD2-CZ 3.09Å; D129-R136 IonicContact OD2-NH1 2.7Å; D129-R136 PolarHBondContact OD2-NH1 2.96Å; D129-R136 IonicContact OD2-NH2 3.81Å; D129-R136 PolarHBondContact OD2-NH2 3.12Å
130	E	83.6	Confident	86.5	Confident	119 Å²	119	118 Å²	118	56%	0.556	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	-35.7	171.1	-89.8	-174.1	143.5	0	0	112.8	D126 R132 R133	D126-E130 WeakPolarHBondContact O-CG 3.39Å; D126-E130 PolarHBondContact O-N 2.95Å; E130-R132 PolarHBondContact O-N 3.42Å; E130-R133 PolarHBondContact O-N 3.2Å
131	K	79.4	Confident	86.5	Confident	148 Å²	148	121.5 Å²	121.5	64%	0.643	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-23.7	-179.7	-64.5	173	-174.7	166.5	0	113.9	Q128 D129	Q128-K131 WeakPolarHBondContact O-CB 3.49Å; Q128-K131 WeakPolarHBondContact O-CD 3.31Å; Q128-K131 WeakPolarHBondContact O-CG 3.45Å; D129-K131 PolarHBondContact O-N 3.31Å; D129-K131 VanDerWaalsContact O-N 3.09Å
132	R	80.2	Confident	86.4	Confident	188 Å²	188	121 Å²	121	71%	0.709	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.4	7.6	178.8	-71	-169.5	175.1	-176	-0.7	115	D129 E130 E134 Y135 R136	D129-R132 PolarHBondContact O-N 2.92Å; D129-R132 VanDerWaalsContact O-N 3.09Å; E130-R132 PolarHBondContact O-N 3.42Å; R132-E134 PolarHBondContact O-N 3.13Å; R132-Y135 PolarHBondContact O-N 2.92Å; R132-R136 WeakPolarHBondContact O-CB 3.5Å; R132-R136 PolarHBondContact O-N 3.27Å
133	R	85.6	Confident	86.4	Confident	72 Å²	72	119.8 Å²	119.8	27%	0.272	54%	0.541	S	S	.	.	H	α-helix	trans	-47.7	-59.7	-175.3	-175.3	172.7	-73	-177.1	-11	112.6	D126 D129 E130 Y135 R136 E137	D126-R133 IonicContact OD1-CZ 2.64Å; D126-R133 IonicContact OD1-NH2 2.67Å; D126-R133 PolarHBondContact OD1-NH2 3.29Å; D129-R133 PolarHBondContact O-N 3.39Å; D129-R133 IonicContact OD2-NE 3.73Å; E130-R133 PolarHBondContact O-N 3.2Å; R133-Y135 PolarHBondContact O-N 2.87Å; R133-R136 PolarHBondContact O-N 2.63Å; R133-E137 WeakPolarHBondContact CG-OE1 3.42Å; R133-E137 WeakPolarHBondContact O-CB 3.46Å; R133-E137 WeakPolarHBondContact O-CG 3.27Å; R133-E137 PolarHBondContact O-N 2.98Å
134	E	85.3	Confident	86.3	Confident	150 Å²	150	117.7 Å²	117.7	70%	0.701	53%	0.53	S	S	*	.	H	α-helix	trans	-55.4	-46.7	-179.4	-63.9	-169.6	150.9	0	0	113.4	R132 Q138	R132-E134 PolarHBondContact O-N 3.13Å; E134-Q138 WeakPolarHBondContact O-CB 3.48Å; E134-Q138 VanDerWaalsContact O-CG 3.25Å; E134-Q138 WeakPolarHBondContact O-CG 3.46Å; E134-Q138 PolarHBondContact O-N 2.95Å
135	Y	84.8	Confident	86.2	Confident	153 Å²	153	118.9 Å²	118.9	60%	0.6	53%	0.534	S	S	*	.	H	α-helix	trans	-65.9	-42.3	-178.9	176.1	-95.4	0	0	0	111.9	R132 R133 K139	R132-Y135 PolarHBondContact O-N 2.92Å; R133-Y135 PolarHBondContact O-N 2.87Å; Y135-K139 HydrophobicContact CE1-CD 4.24Å; Y135-K139 WeakPolarHBondContact O-CB 3.22Å; Y135-K139 PolarHBondContact O-N 3.49Å
136	R	87.3	Confident	86.4	Confident	102 Å²	102	119.7 Å²	119.7	39%	0.385	53%	0.534	S	S	.	.	H	α-helix	trans	-66.3	-47	-179.3	-161.2	-162.3	-38.9	120	21.2	110.8	D129 R132 R133 K139 L140	D129-R136 VanDerWaalsContact CG-CZ 3.5Å; D129-R136 VanDerWaalsContact CG-NH1 3.32Å; D129-R136 PolarHBondContact O-NH2 3.36Å; D129-R136 IonicContact OD1-CZ 3.38Å; D129-R136 IonicContact OD1-NE 3.42Å; D129-R136 IonicContact OD1-NH1 3.47Å; D129-R136 PolarHBondContact OD1-NH1 3.47Å; D129-R136 VanDerWaalsContact OD1-NH1 3.15Å; D129-R136 IonicContact OD1-NH2 2.75Å; D129-R136 PolarHBondContact OD1-NH2 2.94Å; D129-R136 IonicContact OD2-CZ 3.09Å; D129-R136 IonicContact OD2-NH1 2.7Å; D129-R136 PolarHBondContact OD2-NH1 2.96Å; D129-R136 IonicContact OD2-NH2 3.81Å; D129-R136 PolarHBondContact OD2-NH2 3.12Å; R132-R136 WeakPolarHBondContact O-CB 3.5Å; R132-R136 PolarHBondContact O-N 3.27Å; R133-R136 PolarHBondContact O-N 2.63Å; R136-K139 PolarHBondContact O-N 3.34Å; R136-L140 WeakPolarHBondContact O-CB 3.41Å; R136-L140 PolarHBondContact O-N 2.98Å
137	E	88.8	Confident	86.3	Confident	108 Å²	108	122.6 Å²	122.6	51%	0.505	54%	0.54	S	S	.	.	H	α-helix	trans	-64.2	-45.2	179.3	-72	177.3	-170.4	0	0	112	R133 K139 L140 K141	R133-E137 WeakPolarHBondContact CG-OE1 3.42Å; R133-E137 WeakPolarHBondContact O-CB 3.46Å; R133-E137 WeakPolarHBondContact O-CG 3.27Å; R133-E137 PolarHBondContact O-N 2.98Å; E137-K139 VanDerWaalsContact C-N 3.33Å; E137-K139 PolarHBondContact O-N 3.32Å; E137-L140 PolarHBondContact O-N 3.29Å; E137-K141 VanDerWaalsContact O-CB 3.24Å; E137-K141 WeakPolarHBondContact O-CB 3.36Å; E137-K141 PolarHBondContact O-N 3.08Å
138	Q	88.7	Confident	86.2	Confident	125 Å²	125	121.5 Å²	121.5	58%	0.584	54%	0.535	S	S	*	.	H	α-helix	trans	-60.4	-41.7	175.5	-75.2	-177.2	25.9	0	0	112.2	E134 K142	E134-Q138 WeakPolarHBondContact O-CB 3.48Å; E134-Q138 VanDerWaalsContact O-CG 3.25Å; E134-Q138 WeakPolarHBondContact O-CG 3.46Å; E134-Q138 PolarHBondContact O-N 2.95Å; Q138-K142 PolarHBondContact O-N 3.34Å
139	K	88.5	Confident	86.3	Confident	118 Å²	118	123.6 Å²	123.6	51%	0.513	54%	0.543	S	S	.	.	H	α-helix	trans	-67.2	-45	178.2	-172.2	174.3	-178.1	178.1	0	111.7	Y135 R136 E137 K141 K142 L143	Y135-K139 HydrophobicContact CE1-CD 4.24Å; Y135-K139 WeakPolarHBondContact O-CB 3.22Å; Y135-K139 PolarHBondContact O-N 3.49Å; R136-K139 PolarHBondContact O-N 3.34Å; E137-K139 VanDerWaalsContact C-N 3.33Å; E137-K139 PolarHBondContact O-N 3.32Å; K139-K141 VanDerWaalsContact C-N 3.35Å; K139-K141 PolarHBondContact O-N 3.24Å; K139-K142 PolarHBondContact O-N 3.05Å; K139-L143 PolarHBondContact O-N 2.69Å; K139-L143 VanDerWaalsContact O-N 3.12Å
140	L	87.3	Confident	86.3	Confident	105 Å²	105	128 Å²	128	55%	0.55	56%	0.562	S	S	.	*	H	α-helix	trans	-61.2	-43.6	177.1	-173.2	70.2	0	0	0	111.3	R136 E137 K142 L143 I144	R136-L140 WeakPolarHBondContact O-CB 3.41Å; R136-L140 PolarHBondContact O-N 2.98Å; E137-L140 PolarHBondContact O-N 3.29Å; L140-K142 PolarHBondContact O-N 3.42Å; L140-L143 PolarHBondContact O-N 2.93Å; L140-I144 HydrophobicContact CD1-CD1 4.32Å; L140-I144 HydrophobicContact CG-CD1 3.94Å; L140-I144 WeakPolarHBondContact O-CG1 3.41Å; L140-I144 PolarHBondContact O-N 3.4Å
141	K	90.8	Very high	86.4	Confident	159 Å²	159	130.3 Å²	130.3	69%	0.691	57%	0.565	S	S	*	*	H	α-helix	trans	-60.5	-44.4	178.7	-171.3	173.4	-176.8	175.4	0	112.3	E137 K139 E145	E137-K141 VanDerWaalsContact O-CB 3.24Å; E137-K141 WeakPolarHBondContact O-CB 3.36Å; E137-K141 PolarHBondContact O-N 3.08Å; K139-K141 VanDerWaalsContact C-N 3.35Å; K139-K141 PolarHBondContact O-N 3.24Å; K141-E145 PolarHBondContact O-N 2.96Å; K141-E145 VanDerWaalsContact O-N 3.16Å
142	K	90.2	Very high	86.6	Confident	138 Å²	138	125.4 Å²	125.4	60%	0.6	55%	0.549	S	S	*	.	H	α-helix	trans	-62.5	-46.9	174.8	-75.1	-176.3	177.2	-178.6	0	112.2	Q138 K139 L140 I144 E145 E146	Q138-K142 PolarHBondContact O-N 3.34Å; K139-K142 PolarHBondContact O-N 3.05Å; L140-K142 PolarHBondContact O-N 3.42Å; K142-I144 VanDerWaalsContact C-N 3.33Å; K142-I144 PolarHBondContact O-N 2.9Å; K142-E145 PolarHBondContact O-N 3.05Å; K142-E145 VanDerWaalsContact O-N 3.1Å; K142-E146 PolarHBondContact O-N 2.85Å
143	L	87.2	Confident	86.8	Confident	103 Å²	103	123.1 Å²	123.1	54%	0.539	54%	0.544	S	S	.	.	H	α-helix	trans	-58.9	-42.4	179.7	-115.4	163.7	0	0	0	112.5	K139 L140 E145 Y147	K139-L143 PolarHBondContact O-N 2.69Å; K139-L143 VanDerWaalsContact O-N 3.12Å; L140-L143 PolarHBondContact O-N 2.93Å; L143-E145 VanDerWaalsContact C-N 3.34Å; L143-Y147 VanDerWaalsContact O-CB 3.3Å; L143-Y147 WeakPolarHBondContact O-CB 3.34Å; L143-Y147 PolarHBondContact O-N 2.85Å
144	I	87.6	Confident	86.5	Confident	78 Å²	78	125.5 Å²	125.5	40%	0.4	56%	0.561	S	S	.	*	H	α-helix	trans	-67.9	-34.3	177.1	-67.1	168.6	0	0	0	111.6	L140 K142 R148	L140-I144 HydrophobicContact CD1-CD1 4.32Å; L140-I144 HydrophobicContact CG-CD1 3.94Å; L140-I144 WeakPolarHBondContact O-CG1 3.41Å; L140-I144 PolarHBondContact O-N 3.4Å; K142-I144 VanDerWaalsContact C-N 3.33Å; K142-I144 PolarHBondContact O-N 2.9Å; I144-R148 WeakPolarHBondContact O-CB 3.07Å; I144-R148 VanDerWaalsContact O-CG 3.29Å; I144-R148 WeakPolarHBondContact O-CG 3.31Å; I144-R148 PolarHBondContact O-N 2.94Å; I144-R148 VanDerWaalsContact O-N 3.13Å
145	E	88.7	Confident	86.4	Confident	102 Å²	102	125.3 Å²	125.3	48%	0.477	56%	0.56	S	S	.	*	H	α-helix	trans	-71.1	-44.3	177.7	-162.2	-169.1	137.5	0	0	112.1	K141 K142 L143 R148 K149	K141-E145 PolarHBondContact O-N 2.96Å; K141-E145 VanDerWaalsContact O-N 3.16Å; K142-E145 PolarHBondContact O-N 3.05Å; K142-E145 VanDerWaalsContact O-N 3.1Å; L143-E145 VanDerWaalsContact C-N 3.34Å; E145-R148 PolarHBondContact O-N 3.35Å; E145-K149 WeakPolarHBondContact O-CG 3.44Å; E145-K149 PolarHBondContact O-N 3.35Å; E145-K149 VanDerWaalsContact O-N 3.11Å; E145-K149 WeakPolarHBondContact OE1-CE 3.5Å; E145-K149 IonicContact OE1-NZ 3.11Å; E145-K149 PolarHBondContact OE1-NZ 3.47Å
146	E	89.1	Confident	86.3	Confident	127 Å²	127	121.4 Å²	121.4	59%	0.593	55%	0.547	S	S	*	.	H	α-helix	trans	-61.8	-47.6	174.6	-72.8	175.2	169.9	0	0	111.1	K142 R148 K149 E150	K142-E146 PolarHBondContact O-N 2.85Å; E146-R148 VanDerWaalsContact C-N 3.3Å; E146-R148 PolarHBondContact O-N 3.47Å; E146-K149 WeakPolarHBondContact O-CB 3.39Å; E146-K149 PolarHBondContact O-N 3Å; E146-E150 PolarHBondContact O-N 3.25Å
147	Y	84.7	Confident	86.1	Confident	146 Å²	146	121.5 Å²	121.5	57%	0.573	55%	0.552	S	S	*	*	H	α-helix	trans	-58.9	-38.8	177.3	-175.1	-101.2	0	0	0	112.8	L143 E150 R151	L143-Y147 VanDerWaalsContact O-CB 3.3Å; L143-Y147 WeakPolarHBondContact O-CB 3.34Å; L143-Y147 PolarHBondContact O-N 2.85Å; Y147-E150 PolarHBondContact O-N 3.26Å; Y147-R151 CarbonylContact O-C 3.52Å; Y147-R151 PolarHBondContact O-N 3Å
148	R	86.2	Confident	86	Confident	147 Å²	147	121.9 Å²	121.9	56%	0.555	55%	0.552	S	S	*	*	H	α-helix	trans	-72.7	-24	176.3	-75.9	177.6	-179.4	-169	3.7	114	I144 E145 E146	I144-R148 WeakPolarHBondContact O-CB 3.07Å; I144-R148 VanDerWaalsContact O-CG 3.29Å; I144-R148 WeakPolarHBondContact O-CG 3.31Å; I144-R148 PolarHBondContact O-N 2.94Å; I144-R148 VanDerWaalsContact O-N 3.13Å; E145-R148 PolarHBondContact O-N 3.35Å; E146-R148 VanDerWaalsContact C-N 3.3Å; E146-R148 PolarHBondContact O-N 3.47Å
149	K	84.3	Confident	85.9	Confident	151 Å²	151	118.7 Å²	118.7	66%	0.657	54%	0.544	S	S	*	.	H	α-helix	trans	-77.3	-37.3	172.4	-77	167.7	173.4	165.4	0	111.7	E145 E146	E145-K149 WeakPolarHBondContact O-CG 3.44Å; E145-K149 PolarHBondContact O-N 3.35Å; E145-K149 VanDerWaalsContact O-N 3.11Å; E145-K149 WeakPolarHBondContact OE1-CE 3.5Å; E145-K149 IonicContact OE1-NZ 3.11Å; E145-K149 PolarHBondContact OE1-NZ 3.47Å; E146-K149 WeakPolarHBondContact O-CB 3.39Å; E146-K149 PolarHBondContact O-N 3Å
150	E	84.5	Confident	85.8	Confident	150 Å²	150	117.2 Å²	117.2	70%	0.701	54%	0.542	S	S	*	.	H	α-helix	trans	-80.6	-38	180	-162.2	-174.8	-138	0	0	112.6	E146 Y147	E146-E150 PolarHBondContact O-N 3.25Å; Y147-E150 PolarHBondContact O-N 3.26Å
151	R	84.8	Confident	85.8	Confident	166 Å²	166	116 Å²	116	63%	0.626	54%	0.535	S	S	*	.	S	Bend	trans	-138.8	76.2	-178.5	-63	-171.5	-177.7	-157.7	-1.8	111.5	Y147	Y147-R151 CarbonylContact O-C 3.52Å; Y147-R151 PolarHBondContact O-N 3Å
152	P	84.5	Confident	85.7	Confident	46 Å²	46	116.1 Å²	116.1	30%	0.299	54%	0.536	S	S	.	.			trans	-56.3	147.8	168.7	24.5	-33.4	0	0	0	110.7	Q156 E157	P152-Q156 HydrophobicContact CB-CB 4.09Å; P152-E157 HydrophobicContact CB-CG 4.11Å; P152-E157 HydrophobicContact CG-CG 3.76Å
153	K	83.9	Confident	85.6	Confident	140 Å²	140	119.2 Å²	119.2	61%	0.609	54%	0.544	S	S	*	.			trans	-67	150.3	170.9	-66.1	-171	173.7	-169.2	0	108.8	Q155 Q156 E157	K153-Q155 HydrophobicContact CB-CG 4.02Å; K153-Q155 PolarHBondContact O-N 3.39Å; K153-Q155 VanDerWaalsContact O-N 3.08Å; K153-Q156 HydrophobicContact CB-CG 4.36Å; K153-Q156 WeakPolarHBondContact O-CA 3.16Å; K153-Q156 VanDerWaalsContact O-CB 3.26Å; K153-Q156 WeakPolarHBondContact O-CB 3.43Å; K153-Q156 PolarHBondContact O-N 3.13Å; K153-E157 PolarHBondContact O-N 3.05Å; K153-E157 VanDerWaalsContact O-N 3.16Å
154	I	79.5	Confident	85.6	Confident	121 Å²	121	119.5 Å²	119.5	62%	0.621	54%	0.542	S	S	*	.	H	α-helix	trans	-47.1	-45.3	177.6	-60.6	171.4	0	0	0	111.9	Q156 E157 F158	I154-Q156 PolarHBondContact O-N 3.23Å; I154-Q156 VanDerWaalsContact O-N 3.13Å; I154-E157 WeakPolarHBondContact O-CB 3.1Å; I154-E157 PolarHBondContact O-N 3.48Å; I154-E157 VanDerWaalsContact O-N 3.13Å; I154-F158 HydrophobicContact CG2-CD2 3.82Å; I154-F158 HydrophobicContact CG2-CE2 3.9Å; I154-F158 WeakPolarHBondContact O-CD2 3.48Å; I154-F158 PolarHBondContact O-N 2.81Å; I154-F158 VanDerWaalsContact O-N 3.11Å
155	Q	83.2	Confident	85.5	Confident	147 Å²	147	119.9 Å²	119.9	69%	0.687	55%	0.545	S	S	*	.	H	α-helix	trans	-62.2	-18.3	176.5	63.1	176.7	-6.9	0	0	115.7	K153	K153-Q155 HydrophobicContact CB-CG 4.02Å; K153-Q155 PolarHBondContact O-N 3.39Å; K153-Q155 VanDerWaalsContact O-N 3.08Å
156	Q	83.7	Confident	85.4	Confident	70 Å²	70	119.1 Å²	119.1	33%	0.327	56%	0.556	S	S	.	*	H	α-helix	trans	-89	-37.5	174.2	-62.9	173.3	-48.2	0	0	110.9	P152 K153 I154 F158 S159	P152-Q156 HydrophobicContact CB-CB 4.09Å; K153-Q156 HydrophobicContact CB-CG 4.36Å; K153-Q156 WeakPolarHBondContact O-CA 3.16Å; K153-Q156 VanDerWaalsContact O-CB 3.26Å; K153-Q156 WeakPolarHBondContact O-CB 3.43Å; K153-Q156 PolarHBondContact O-N 3.13Å; I154-Q156 PolarHBondContact O-N 3.23Å; I154-Q156 VanDerWaalsContact O-N 3.13Å; Q156-F158 VanDerWaalsContact C-N 3.31Å; Q156-F158 PolarHBondContact O-N 3.33Å; Q156-S159 VanDerWaalsContact O-CB 3.26Å; Q156-S159 WeakPolarHBondContact O-CB 3.36Å; Q156-S159 PolarHBondContact O-N 2.9Å; Q156-S159 VanDerWaalsContact O-N 3.13Å; Q156-S159 PolarHBondContact O-OG 3.23Å
157	E	82.2	Confident	85.3	Confident	105 Å²	105	120.9 Å²	120.9	49%	0.491	57%	0.566	S	S	.	*	H	α-helix	trans	-60	-40.4	173.1	-61.4	177.2	149.2	0	0	111.9	P152 K153 I154 S159	P152-E157 HydrophobicContact CB-CG 4.11Å; P152-E157 HydrophobicContact CG-CG 3.76Å; K153-E157 PolarHBondContact O-N 3.05Å; K153-E157 VanDerWaalsContact O-N 3.16Å; I154-E157 WeakPolarHBondContact O-CB 3.1Å; I154-E157 PolarHBondContact O-N 3.48Å; I154-E157 VanDerWaalsContact O-N 3.13Å; E157-S159 VanDerWaalsContact C-N 3.34Å
158	F	85.9	Confident	85.3	Confident	115 Å²	115	116.3 Å²	116.3	50%	0.504	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.3	12.7	175.9	-68.2	-81.2	0	0	0	113.7	I154 Q156 D160 L161 K162	I154-F158 HydrophobicContact CG2-CD2 3.82Å; I154-F158 HydrophobicContact CG2-CE2 3.9Å; I154-F158 WeakPolarHBondContact O-CD2 3.48Å; I154-F158 PolarHBondContact O-N 2.81Å; I154-F158 VanDerWaalsContact O-N 3.11Å; Q156-F158 VanDerWaalsContact C-N 3.31Å; Q156-F158 PolarHBondContact O-N 3.33Å; F158-D160 PolarHBondContact O-N 3.48Å; F158-L161 HydrophobicContact CD1-CD1 3.69Å; F158-L161 HydrophobicContact CE1-CD1 4.07Å; F158-K162 WeakPolarHBondContact O-CB 3.3Å; F158-K162 PolarHBondContact O-N 3.45Å
159	S	87.9	Confident	85.4	Confident	59 Å²	59	111.7 Å²	111.7	41%	0.413	54%	0.543	S	S	.	.	H	α-helix	trans	-73.5	-26.7	-173.2	67	0	0	0	0	114.1	Q156 E157 R163	Q156-S159 VanDerWaalsContact O-CB 3.26Å; Q156-S159 WeakPolarHBondContact O-CB 3.36Å; Q156-S159 PolarHBondContact O-N 2.9Å; Q156-S159 VanDerWaalsContact O-N 3.13Å; Q156-S159 PolarHBondContact O-OG 3.23Å; E157-S159 VanDerWaalsContact C-N 3.34Å; S159-R163 WeakPolarHBondContact O-CG 3.35Å; S159-R163 PolarHBondContact O-N 3.47Å
160	D	86.2	Confident	85.6	Confident	87 Å²	87	112.7 Å²	112.7	47%	0.465	55%	0.55	S	S	.	*	H	α-helix	trans	-76.8	-46.5	172.8	62.6	-23.5	0	0	0	111.4	F158 K162 R163 Q164	F158-D160 PolarHBondContact O-N 3.48Å; D160-K162 VanDerWaalsContact C-N 3.29Å; D160-K162 PolarHBondContact O-N 2.7Å; D160-R163 CarbonylContact O-C 3.6Å; D160-R163 WeakPolarHBondContact O-CA 3.5Å; D160-R163 WeakPolarHBondContact O-CB 3.47Å; D160-R163 PolarHBondContact O-N 3.12Å; D160-Q164 WeakPolarHBondContact O-CG 3.41Å; D160-Q164 PolarHBondContact O-N 3.39Å
161	L	86.2	Confident	85.6	Confident	80 Å²	80	111.6 Å²	111.6	42%	0.419	55%	0.549	S	S	.	.	H	α-helix	trans	-60.8	-38.1	172.8	-70.2	171.4	0	0	0	111.3	F158 R163 Q164 L165	F158-L161 HydrophobicContact CD1-CD1 3.69Å; F158-L161 HydrophobicContact CE1-CD1 4.07Å; L161-R163 VanDerWaalsContact C-N 3.31Å; L161-R163 PolarHBondContact O-N 3.45Å; L161-Q164 PolarHBondContact O-N 3.07Å; L161-L165 WeakPolarHBondContact O-CB 3.47Å; L161-L165 PolarHBondContact O-N 2.93Å
162	K	89.6	Confident	85.7	Confident	161 Å²	161	108.8 Å²	108.8	70%	0.7	54%	0.543	S	S	*	.	H	α-helix	trans	-67.4	-27.8	173.4	-171.4	170.7	-178.7	176.6	0	113	F158 D160	F158-K162 WeakPolarHBondContact O-CB 3.3Å; F158-K162 PolarHBondContact O-N 3.45Å; D160-K162 VanDerWaalsContact C-N 3.29Å; D160-K162 PolarHBondContact O-N 2.7Å
163	R	89	Confident	85.7	Confident	202 Å²	202	113.2 Å²	113.2	76%	0.762	55%	0.554	S	S	*	*	H	α-helix	trans	-75.7	-36.6	169.3	-75.6	179.4	-172.4	-172.7	3.5	112.2	S159 D160 L161 L165 A166	S159-R163 WeakPolarHBondContact O-CG 3.35Å; S159-R163 PolarHBondContact O-N 3.47Å; D160-R163 CarbonylContact O-C 3.6Å; D160-R163 WeakPolarHBondContact O-CA 3.5Å; D160-R163 WeakPolarHBondContact O-CB 3.47Å; D160-R163 PolarHBondContact O-N 3.12Å; L161-R163 VanDerWaalsContact C-N 3.31Å; L161-R163 PolarHBondContact O-N 3.45Å; R163-L165 VanDerWaalsContact C-N 3.33Å; R163-A166 WeakPolarHBondContact O-CB 3.21Å; R163-A166 PolarHBondContact O-N 3.02Å
164	Q	86.2	Confident	85.8	Confident	110 Å²	110	111.2 Å²	111.2	51%	0.514	56%	0.558	S	S	.	*	H	α-helix	trans	-66	-36.7	174.2	-68.2	173.3	20.8	0	0	111.6	D160 L161 A166 M167	D160-Q164 WeakPolarHBondContact O-CG 3.41Å; D160-Q164 PolarHBondContact O-N 3.39Å; L161-Q164 PolarHBondContact O-N 3.07Å; Q164-A166 PolarHBondContact O-N 3Å; Q164-A166 VanDerWaalsContact O-N 3.14Å; Q164-M167 WeakPolarHBondContact O-CB 3.42Å; Q164-M167 PolarHBondContact O-N 3.33Å
165	L	85.7	Confident	85.9	Confident	86 Å²	86	109.4 Å²	109.4	45%	0.45	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.6	-18.5	171.5	-92.9	155.2	0	0	0	114.3	L161 R163 M167 V168 W173	L161-L165 WeakPolarHBondContact O-CB 3.47Å; L161-L165 PolarHBondContact O-N 2.93Å; R163-L165 VanDerWaalsContact C-N 3.33Å; L165-M167 VanDerWaalsContact C-N 3.3Å; L165-V168 HydrophobicContact CD2-CG2 4.46Å; L165-W173 HydrophobicContact CD2-CH2 3.92Å; L165-W173 HydrophobicContact CD2-CZ2 3.58Å
166	A	87.3	Confident	85.7	Confident	85 Å²	85	107.7 Å²	107.7	70%	0.702	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-4.6	172.9	0	0	0	0	0	113.5	R163 Q164	R163-A166 WeakPolarHBondContact O-CB 3.21Å; R163-A166 PolarHBondContact O-N 3.02Å; Q164-A166 PolarHBondContact O-N 3Å; Q164-A166 VanDerWaalsContact O-N 3.14Å
167	M	85.3	Confident	85	Confident	164 Å²	164	109.6 Å²	109.6	81%	0.808	57%	0.569	S	S	*	*	S	Bend	trans	-89.3	-14.9	170.3	-61.3	-177.9	169.8	0	0	112.7	Q164 L165	Q164-M167 WeakPolarHBondContact O-CB 3.42Å; Q164-M167 PolarHBondContact O-N 3.33Å; L165-M167 VanDerWaalsContact C-N 3.3Å
168	V	86	Confident	84.6	Confident	51 Å²	51	114 Å²	114	31%	0.309	59%	0.589	S	S	.	*	S	Bend	trans	-70.4	126	177.2	178.8	0	0	0	0	108.7	L165 E172 W173	L165-V168 HydrophobicContact CD2-CG2 4.46Å; V168-E172 WeakPolarHBondContact CA-OE2 3.24Å; V168-E172 HydrophobicContact CG1-CB 3.56Å; V168-E172 WeakPolarHBondContact CG1-OE2 3.47Å; V168-W173 HydrophobicContact CG1-CG 4.21Å
169	S	88.8	Confident	83.5	Confident	50 Å²	50	115.7 Å²	115.7	35%	0.35	61%	0.609	S	S	.	*			trans	-72.5	158.8	-178.5	72.1	0	0	0	0	111.9	D171 E172 W173	S169-D171 PolarHBondContact O-N 3.42Å; S169-D171 PolarHBondContact OG-N 3.48Å; S169-E172 PolarHBondContact N-OE2 3.08Å; S169-E172 PolarHBondContact O-N 3.04Å; S169-E172 VanDerWaalsContact O-N 3.12Å; S169-E172 WeakPolarHBondContact OG-CG 3.25Å; S169-E172 PolarHBondContact OG-N 2.91Å; S169-E172 VanDerWaalsContact OG-N 3.1Å; S169-W173 VanDerWaalsContact O-CD1 3.26Å; S169-W173 PolarHBondContact O-N 3.49Å
170	E	88.4	Confident	81.7	Confident	172 Å²	172	116 Å²	116	80%	0.804	62%	0.621	S	S	*	*	H	α-helix	trans	-60.4	-29.4	172.9	-68.3	-171.6	148.7	0	0	111.9	W173 S174	E170-W173 WeakPolarHBondContact O-CB 3.24Å; E170-W173 PolarHBondContact O-N 2.97Å; E170-S174 WeakPolarHBondContact O-CB 3.26Å; E170-S174 PolarHBondContact O-N 3.15Å
171	D	83.9	Confident	80.1	Confident	126 Å²	126	119.6 Å²	119.6	67%	0.674	64%	0.641	S	S	*	*	H	α-helix	trans	-65.7	-42.7	173.4	-62.3	-33.4	0	0	0	111.9	S169 S174 S175	S169-D171 PolarHBondContact O-N 3.42Å; S169-D171 PolarHBondContact OG-N 3.48Å; D171-S174 PolarHBondContact O-N 3.32Å; D171-S174 PolarHBondContact O-OG 2.89Å; D171-S175 PolarHBondContact O-N 3.36Å; D171-S175 PolarHBondContact O-OG 2.94Å
172	E	86.4	Confident	78.6	Confident	108 Å²	108	123 Å²	123	51%	0.505	66%	0.664	S	S	.	*	H	α-helix	trans	-65.4	-37.4	173.7	-73.8	175.8	163.8	0	0	111.7	V168 S169 S175	V168-E172 WeakPolarHBondContact CA-OE2 3.24Å; V168-E172 HydrophobicContact CG1-CB 3.56Å; V168-E172 WeakPolarHBondContact CG1-OE2 3.47Å; S169-E172 PolarHBondContact N-OE2 3.08Å; S169-E172 PolarHBondContact O-N 3.04Å; S169-E172 VanDerWaalsContact O-N 3.12Å; S169-E172 WeakPolarHBondContact OG-CG 3.25Å; S169-E172 PolarHBondContact OG-N 2.91Å; S169-E172 VanDerWaalsContact OG-N 3.1Å; E172-S175 WeakPolarHBondContact CA-OG 3.35Å; E172-S175 PolarHBondContact O-N 3.1Å; E172-S175 PolarHBondContact O-OG 3.42Å
173	W	85.6	Confident	76.9	Confident	138 Å²	138	126.3 Å²	126.3	52%	0.523	67%	0.673	S	S	.	*	H	α-helix	trans	-64.1	-38.4	171.2	-82.4	104.8	0	0	0	112.8	L165 V168 S169 E170 S175 I176	L165-W173 HydrophobicContact CD2-CH2 3.92Å; L165-W173 HydrophobicContact CD2-CZ2 3.58Å; V168-W173 HydrophobicContact CG1-CG 4.21Å; S169-W173 VanDerWaalsContact O-CD1 3.26Å; S169-W173 PolarHBondContact O-N 3.49Å; E170-W173 WeakPolarHBondContact O-CB 3.24Å; E170-W173 PolarHBondContact O-N 2.97Å; W173-S175 VanDerWaalsContact C-N 3.26Å; W173-S175 PolarHBondContact O-N 3.34Å; W173-I176 HydrophobicContact CE3-CD1 3.68Å; W173-I176 HydrophobicContact CZ3-CD1 4.08Å
174	S	84.6	Confident	75.3	Confident	98 Å²	98	124.6 Å²	124.6	69%	0.685	68%	0.679	S	S	*	*	H	α-helix	trans	-71.6	-18.6	-179.7	80.1	0	0	0	0	113.9	E170 D171	E170-S174 WeakPolarHBondContact O-CB 3.26Å; E170-S174 PolarHBondContact O-N 3.15Å; D171-S174 PolarHBondContact O-N 3.32Å; D171-S174 PolarHBondContact O-OG 2.89Å
175	S	81.4	Confident	73.8	Confident	84 Å²	84	126.5 Å²	126.5	59%	0.587	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	10.4	-173.2	49.2	0	0	0	0	114.6	D171 E172 W173 P177	D171-S175 PolarHBondContact O-N 3.36Å; D171-S175 PolarHBondContact O-OG 2.94Å; E172-S175 WeakPolarHBondContact CA-OG 3.35Å; E172-S175 PolarHBondContact O-N 3.1Å; E172-S175 PolarHBondContact O-OG 3.42Å; W173-S175 VanDerWaalsContact C-N 3.26Å; W173-S175 PolarHBondContact O-N 3.34Å; S175-P177 VanDerWaalsContact O-CD 3.32Å; S175-P177 WeakPolarHBondContact O-CD 3.48Å
176	I	78.8	Confident	72.3	Confident	110 Å²	110	133.3 Å²	133.3	56%	0.564	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-68.3	120.2	175.9	-59.7	176.2	0	0	0	110.8	W173	W173-I176 HydrophobicContact CE3-CD1 3.68Å; W173-I176 HydrophobicContact CZ3-CD1 4.08Å
177	P	70.7	Confident	70.9	Confident	110 Å²	110	137.5 Å²	137.5	71%	0.714	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-72	140.8	179.9	-18.7	32.8	0	0	0	114.1	S175	S175-P177 VanDerWaalsContact O-CD 3.32Å; S175-P177 WeakPolarHBondContact O-CD 3.48Å
178	E	73.9	Confident	69.3	Low	198 Å²	198	136 Å²	136	93%	0.925	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-73.3	145.5	170.1	-72.7	-161.5	156.5	0	0	112.7
179	V	61.7	Low	67.9	Low	150 Å²	150	137.8 Å²	137.8	91%	0.909	70%	0.703	S	S	*	*			trans	-96	103.1	-176.7	-68.6	0	0	0	0	113.1
180	G	50.7	Low	66.3	Low	66 Å²	66	139.7 Å²	139.7	68%	0.68	71%	0.714	S	S	*	*			trans	-128.5	82.4	-175.6	0	0	0	0	0	116.2
181	D	52.2	Low	64.2	Low	163 Å²	163	142.4 Å²	142.4	87%	0.872	72%	0.717	S	S	*	*	S	Bend	trans	172.6	-2.8	139.2	-96.1	-15.6	0	0	0	118	R183	D181-R183 VanDerWaalsContact C-N 3.31Å; D181-R183 PolarHBondContact O-N 3.34Å
182	V	53.9	Low	62.7	Low	151 Å²	151	141.3 Å²	141.3	92%	0.915	73%	0.726	S	S	*	*			trans	-75.6	17.3	-162	-160.5	0	0	0	0	117.3
183	R	53.5	Low	61.2	Low	231 Å²	231	144 Å²	144	87%	0.872	74%	0.738	S	S	*	*			trans	-92	-9.6	-157.6	-169.2	164.1	160.3	159.4	-5.5	119.2	D181 K185	D181-R183 VanDerWaalsContact C-N 3.31Å; D181-R183 PolarHBondContact O-N 3.34Å; R183-K185 PolarHBondContact O-N 3.45Å; R183-K185 VanDerWaalsContact O-N 3.1Å
184	N	56	Low	59.6	Low	166 Å²	166	147.4 Å²	147.4	89%	0.888	76%	0.756	S	S	*	*			trans	-84.3	28.5	-165.7	-79.6	-16.5	0	0	0	118.5	R186	N184-R186 PolarHBondContact O-N 2.97Å
185	K	54.2	Low	58.7	Low	149 Å²	149	152.6 Å²	152.6	65%	0.648	77%	0.767	S	S	*	*			trans	-78.3	-10.4	-170.3	-124.9	176.2	-175.3	178.1	0	117.3	R183 Q187	R183-K185 PolarHBondContact O-N 3.45Å; R183-K185 VanDerWaalsContact O-N 3.1Å; K185-Q187 PolarHBondContact O-N 3.45Å
186	R	55.6	Low	58.2	Low	230 Å²	230	154 Å²	154	87%	0.868	77%	0.772	S	S	*	*	S	Bend	trans	-84.3	18.9	-160.8	-149.6	-176.2	-177.7	-175.5	0.9	117	N184 L225	N184-R186 PolarHBondContact O-N 2.97Å; R186-L225 WeakPolarHBondContact O-CD1 3.4Å
187	Q	57.7	Low	58.1	Low	172 Å²	172	154.7 Å²	154.7	80%	0.804	78%	0.784	S	S	*	*	S	Bend	trans	-130.1	-2.4	-162.6	-81	-170.1	-9.6	0	0	121.8	K185 L225	K185-Q187 PolarHBondContact O-N 3.45Å; Q187-L225 VanDerWaalsContact C-CD1 3.49Å
188	R	51.5	Low	57.9	Low	133 Å²	133	152.8 Å²	152.8	50%	0.502	77%	0.77	S	S	.	*			trans	-143	56.2	-159.8	-82.2	161.2	134.8	-170.6	-4.1	120.8	M221 Y222 G224 L225	R188-M221 PolarHBondContact NH1-O 3.4Å; R188-Y222 VanDerWaalsContact CZ-O 3.27Å; R188-Y222 PolarHBondContact NE-O 3Å; R188-G224 VanDerWaalsContact CB-N 3.26Å; R188-G224 WeakPolarHBondContact O-CA 3.42Å; R188-G224 PolarHBondContact O-N 3.01Å; R188-L225 VanDerWaalsContact N-CB 3.31Å
189	N	56.8	Low	57.8	Low	89 Å²	89	146.7 Å²	146.7	48%	0.476	75%	0.748	S	S	.	*			trans	-141.7	-173.8	176.1	-128.1	9.7	0	0	0	110.4	G224 L225	N189-G224 VanDerWaalsContact CG-O 3.24Å; N189-G224 PolarHBondContact ND2-O 3.4Å; N189-G224 PolarHBondContact OD1-O 3.34Å; N189-L225 HydrophobicContact CB-CB 3.79Å; N189-L225 HydrophobicContact CB-CD2 3.25Å; N189-L225 HydrophobicContact CB-CG 4.08Å; N189-L225 VanDerWaalsContact CB-N 3.31Å; N189-L225 VanDerWaalsContact CG-N 3.32Å; N189-L225 PolarHBondContact ND2-N 3.5Å
190	P	54.1	Low	58.2	Low	89 Å²	89	145.9 Å²	145.9	58%	0.578	74%	0.739	S	S	*	*			cis	-128.3	175.1	-13.2	26.6	-4.9	0	0	0	114.4
191	R	45.4	Very low	59	Low	229 Å²	229	146.2 Å²	146.2	86%	0.864	73%	0.73	S	S	*	*			trans	-132	144.4	146.8	-90.9	-174	168.8	169.2	-3.2	109.9
192	A	52.3	Low	59.6	Low	104 Å²	104	140.3 Å²	140.3	86%	0.86	70%	0.7	S	S	*	*			trans	-105.5	135.6	178.6	0	0	0	0	0	109.7
193	E	53.9	Low	59.6	Low	163 Å²	163	137.6 Å²	137.6	76%	0.762	68%	0.68	S	S	*	*			trans	-134.3	159.2	-170.7	-63.6	-168.2	167.1	0	0	113
194	K	52.7	Low	59.8	Low	210 Å²	210	129.6 Å²	129.6	91%	0.913	66%	0.66	S	S	*	*			trans	-67.9	144.7	-171.6	-73.6	176.5	173.1	177.8	0	113
195	F	65.5	Low	59.5	Low	207 Å²	207	129.9 Å²	129.9	91%	0.908	65%	0.648	S	S	*	*			trans	-90.7	128	171.7	-55.7	-80.8	0	0	0	111.7
196	T	71.9	Confident	59.1	Low	113 Å²	113	128.8 Å²	128.8	69%	0.693	64%	0.643	S	S	*	*			trans	-107.7	149.3	160.7	50.5	0	0	0	0	108.7	V198	T196-V198 PolarHBondContact O-N 3.11Å
197	P	76.9	Confident	58.9	Low	125 Å²	125	122 Å²	122	81%	0.812	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-56.2	128.3	172.3	24.4	-33.2	0	0	0	109.6
198	V	65.6	Low	58.6	Low	70 Å²	70	117.5 Å²	117.5	42%	0.424	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-69	123.5	-178.3	177.9	0	0	0	0	107.8	T196 V202 L203	T196-V198 PolarHBondContact O-N 3.11Å; V198-V202 HydrophobicContact CG1-CB 3.5Å; V198-V202 HydrophobicContact CG1-CG1 3.37Å; V198-L203 HydrophobicContact CB-CD2 4.23Å; V198-L203 HydrophobicContact CB-CG 4.36Å; V198-L203 HydrophobicContact CG1-CD2 4.03Å; V198-L203 HydrophobicContact CG1-CG 4.03Å
199	P	72.5	Confident	58.3	Low	71 Å²	71	113.1 Å²	113.1	46%	0.461	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-65.2	153.4	-179.1	27.3	-34.6	0	0	0	110.6	S201 V202 L203	P199-S201 PolarHBondContact O-N 3.49Å; P199-V202 HydrophobicContact CG-CB 4.08Å; P199-V202 HydrophobicContact CG-CG2 3.79Å; P199-V202 WeakPolarHBondContact O-CA 3.4Å; P199-V202 PolarHBondContact O-N 2.75Å; P199-L203 PolarHBondContact O-N 3.37Å
200	D	69.4	Low	57.5	Low	133 Å²	133	115.9 Å²	115.9	71%	0.711	63%	0.631	S	S	*	*	H	α-helix	trans	-58.1	-23.3	-177.9	-61.4	-15.6	0	0	0	113.4	V202 S204	D200-V202 VanDerWaalsContact C-N 3.3Å; D200-S204 VanDerWaalsContact O-CB 3.28Å; D200-S204 WeakPolarHBondContact O-CB 3.33Å; D200-S204 PolarHBondContact O-N 2.7Å; D200-S204 PolarHBondContact O-OG 2.84Å
201	S	68.1	Low	57	Low	72 Å²	72	117.9 Å²	117.9	50%	0.503	64%	0.642	S	S	.	*	H	α-helix	trans	-74.2	-16.7	173.1	60.8	0	0	0	0	114.5	P199 S204 R205	P199-S201 PolarHBondContact O-N 3.49Å; S201-S204 WeakPolarHBondContact CA-OG 3.46Å; S201-S204 PolarHBondContact O-OG 3.41Å; S201-R205 VanDerWaalsContact O-CG 3.29Å; S201-R205 WeakPolarHBondContact O-CG 3.42Å
202	V	64.1	Low	56.8	Low	40 Å²	40	110.4 Å²	110.4	24%	0.242	63%	0.629	C	S	.	*	H	α-helix	trans	-99.1	-34.7	171.6	176.9	0	0	0	0	109.6	V198 P199 D200 S204 R205 F206	V198-V202 HydrophobicContact CG1-CB 3.5Å; V198-V202 HydrophobicContact CG1-CG1 3.37Å; P199-V202 HydrophobicContact CG-CB 4.08Å; P199-V202 HydrophobicContact CG-CG2 3.79Å; P199-V202 WeakPolarHBondContact O-CA 3.4Å; P199-V202 PolarHBondContact O-N 2.75Å; D200-V202 VanDerWaalsContact C-N 3.3Å; V202-S204 VanDerWaalsContact C-N 3.3Å; V202-S204 PolarHBondContact O-N 3.39Å; V202-R205 PolarHBondContact O-N 2.95Å; V202-R205 VanDerWaalsContact O-N 3.15Å; V202-F206 HydrophobicContact CG1-CD2 3.59Å; V202-F206 HydrophobicContact CG1-CE2 3.61Å; V202-F206 WeakPolarHBondContact O-CD2 3.43Å; V202-F206 PolarHBondContact O-N 3.09Å
203	L	55	Low	56.1	Low	93 Å²	93	113.8 Å²	113.8	49%	0.487	63%	0.633	S	S	.	*	H	α-helix	trans	-59.5	-40	165.4	-65.9	175.2	0	0	0	111.6	V198 P199 F206 A207	V198-L203 HydrophobicContact CB-CD2 4.23Å; V198-L203 HydrophobicContact CB-CG 4.36Å; V198-L203 HydrophobicContact CG1-CD2 4.03Å; V198-L203 HydrophobicContact CG1-CG 4.03Å; P199-L203 PolarHBondContact O-N 3.37Å; L203-F206 PolarHBondContact O-N 3.44Å; L203-A207 WeakPolarHBondContact O-CB 3.37Å; L203-A207 PolarHBondContact O-N 2.98Å
204	S	56.2	Low	55.6	Low	64 Å²	64	114.3 Å²	114.3	45%	0.448	64%	0.637	S	S	.	*	H	α-helix	trans	-68.8	-31.9	173.9	73.3	0	0	0	0	112.7	D200 S201 V202 S208	D200-S204 VanDerWaalsContact O-CB 3.28Å; D200-S204 WeakPolarHBondContact O-CB 3.33Å; D200-S204 PolarHBondContact O-N 2.7Å; D200-S204 PolarHBondContact O-OG 2.84Å; S201-S204 WeakPolarHBondContact CA-OG 3.46Å; S201-S204 PolarHBondContact O-OG 3.41Å; V202-S204 VanDerWaalsContact C-N 3.3Å; V202-S204 PolarHBondContact O-N 3.39Å; S204-S208 VanDerWaalsContact O-CB 3.27Å; S204-S208 WeakPolarHBondContact O-CB 3.25Å; S204-S208 PolarHBondContact O-N 3.11Å; S204-S208 VanDerWaalsContact O-N 3.12Å; S204-S208 PolarHBondContact O-OG 2.96Å
205	R	49.8	Very low	54.9	Low	171 Å²	171	108.9 Å²	108.9	65%	0.645	62%	0.618	S	S	*	*	H	α-helix	trans	-69	-41.3	171.5	-78.4	174.8	-177.6	-176.6	4.8	112.7	S201 V202 S208 A209	S201-R205 VanDerWaalsContact O-CG 3.29Å; S201-R205 WeakPolarHBondContact O-CG 3.42Å; V202-R205 PolarHBondContact O-N 2.95Å; V202-R205 VanDerWaalsContact O-N 3.15Å; R205-S208 CarbonylContact O-C 3.53Å; R205-S208 WeakPolarHBondContact O-CA 3.41Å; R205-S208 PolarHBondContact O-N 3.37Å; R205-A209 WeakPolarHBondContact O-CB 3.49Å; R205-A209 PolarHBondContact O-N 3.21Å
206	F	45.4	Very low	53.9	Low	126 Å²	126	103 Å²	103	55%	0.553	60%	0.596	S	S	*	*	H	α-helix	trans	-75.3	-38.6	179.1	-82.8	-76.8	0	0	0	112.2	V202 L203 S208 A209 D210	V202-F206 HydrophobicContact CG1-CD2 3.59Å; V202-F206 HydrophobicContact CG1-CE2 3.61Å; V202-F206 WeakPolarHBondContact O-CD2 3.43Å; V202-F206 PolarHBondContact O-N 3.09Å; L203-F206 PolarHBondContact O-N 3.44Å; F206-S208 PolarHBondContact O-N 3.48Å; F206-S208 VanDerWaalsContact O-N 3.11Å; F206-A209 PolarHBondContact O-N 3.31Å; F206-D210 PolarHBondContact O-N 3.2Å
207	A	52.4	Low	52.8	Low	87 Å²	87	103.8 Å²	103.8	72%	0.719	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-14.1	166.5	0	0	0	0	0	113.3	L203	L203-A207 WeakPolarHBondContact O-CB 3.37Å; L203-A207 PolarHBondContact O-N 2.98Å
208	S	51.8	Low	51.8	Low	79 Å²	79	107.7 Å²	107.7	55%	0.552	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	4.7	170.3	-52.7	0	0	0	0	113.8	S204 R205 F206	S204-S208 VanDerWaalsContact O-CB 3.27Å; S204-S208 WeakPolarHBondContact O-CB 3.25Å; S204-S208 PolarHBondContact O-N 3.11Å; S204-S208 VanDerWaalsContact O-N 3.12Å; S204-S208 PolarHBondContact O-OG 2.96Å; R205-S208 CarbonylContact O-C 3.53Å; R205-S208 WeakPolarHBondContact O-CA 3.41Å; R205-S208 PolarHBondContact O-N 3.37Å; F206-S208 PolarHBondContact O-N 3.48Å; F206-S208 VanDerWaalsContact O-N 3.11Å
209	A	45.6	Very low	51.3	Low	41 Å²	41	110.5 Å²	110.5	34%	0.339	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-132.5	5.7	-171.6	0	0	0	0	0	115	R205 F206 T211 A212	R205-A209 WeakPolarHBondContact O-CB 3.49Å; R205-A209 PolarHBondContact O-N 3.21Å; F206-A209 PolarHBondContact O-N 3.31Å; A209-T211 PolarHBondContact O-N 3.22Å; A209-A212 PolarHBondContact O-N 3.05Å
210	D	39.4	Very low	50.6	Low	146 Å²	146	112.2 Å²	112.2	78%	0.781	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	39.9	174.1	-83.7	-18.5	0	0	0	114.1	F206	F206-D210 PolarHBondContact O-N 3.2Å
211	T	42.4	Very low	49.9	Very low	132 Å²	132	112 Å²	112	81%	0.81	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.6	20.4	153.7	45.3	0	0	0	0	113	A209	A209-T211 PolarHBondContact O-N 3.22Å
212	A	41.6	Very low	49.3	Very low	71 Å²	71	117 Å²	117	59%	0.587	61%	0.609	S	S	*	*			trans	-109.3	55.9	178.5	0	0	0	0	0	114.1	A209 M214	A209-A212 PolarHBondContact O-N 3.05Å; A212-M214 PolarHBondContact O-N 3.41Å
213	N	39	Very low	48.3	Very low	176 Å²	176	117.2 Å²	117.2	94%	0.941	62%	0.62	S	S	*	*			trans	-74	37.5	168.9	-93.6	-31.5	0	0	0	113.3
214	M	41.8	Very low	47.5	Very low	173 Å²	173	114.2 Å²	114.2	85%	0.852	61%	0.612	S	S	*	*			trans	-119.4	104.3	-179.4	-83.3	-87.1	-81.5	0	0	109.9	A212	A212-M214 PolarHBondContact O-N 3.41Å
215	L	38.7	Very low	46.7	Very low	96 Å²	96	114.6 Å²	114.6	50%	0.503	61%	0.608	S	S	.	*			trans	-61.7	146.1	-179.9	-68.3	152.8	0	0	0	112	L217 Q220	L215-L217 PolarHBondContact O-N 3.03Å; L215-Q220 HydrophobicContact CB-CG 3.9Å; L215-Q220 HydrophobicContact CD1-CG 4.38Å
216	D	44.6	Very low	46.3	Very low	83 Å²	83	110.6 Å²	110.6	44%	0.444	60%	0.603	S	S	.	*			trans	-52.3	122	170.3	174.5	13.2	0	0	0	110.9	R218 Q219 Q220	D216-R218 PolarHBondContact O-N 3.41Å; D216-R218 WeakPolarHBondContact OD1-CB 3.46Å; D216-R218 PolarHBondContact OD1-N 2.91Å; D216-Q219 HydrophobicContact CB-CB 4.27Å; D216-Q219 HydrophobicContact CB-CG 4.17Å; D216-Q219 PolarHBondContact O-N 2.98Å; D216-Q220 PolarHBondContact O-N 3.12Å; D216-Q220 VanDerWaalsContact O-N 3.11Å
217	L	49.3	Very low	45.9	Very low	131 Å²	131	111.2 Å²	111.2	69%	0.686	62%	0.617	S	S	*	*	H	α-helix	trans	-54.2	-28.8	179.2	-159	76.1	0	0	0	111.8	L215	L215-L217 PolarHBondContact O-N 3.03Å
218	R	55.6	Low	45.3	Very low	206 Å²	206	113.3 Å²	113.3	78%	0.777	62%	0.623	S	S	*	*	H	α-helix	trans	-76.9	-30.5	178.5	-153.7	174.8	-171.7	173.7	1.7	113.2	D216	D216-R218 PolarHBondContact O-N 3.41Å; D216-R218 WeakPolarHBondContact OD1-CB 3.46Å; D216-R218 PolarHBondContact OD1-N 2.91Å
219	Q	55.3	Low	44.2	Very low	130 Å²	130	114.9 Å²	114.9	61%	0.607	64%	0.635	S	S	*	*	H	α-helix	trans	-79.2	-34.1	175.2	-70.4	-178	-12.3	0	0	111.8	D216 M221 Y222 G223	D216-Q219 HydrophobicContact CB-CB 4.27Å; D216-Q219 HydrophobicContact CB-CG 4.17Å; D216-Q219 PolarHBondContact O-N 2.98Å; Q219-M221 VanDerWaalsContact C-N 3.31Å; Q219-M221 PolarHBondContact O-N 3.47Å; Q219-Y222 PolarHBondContact O-N 3.26Å; Q219-G223 PolarHBondContact O-N 3.41Å
220	Q	57.9	Low	43.6	Very low	107 Å²	107	121.3 Å²	121.3	50%	0.5	66%	0.662	S	S	.	*	H	α-helix	trans	-62.1	-32.8	176.1	-71.6	-167.5	-13.6	0	0	113.9	L215 D216 Y222	L215-Q220 HydrophobicContact CB-CG 3.9Å; L215-Q220 HydrophobicContact CD1-CG 4.38Å; D216-Q220 PolarHBondContact O-N 3.12Å; D216-Q220 VanDerWaalsContact O-N 3.11Å; Q220-Y222 PolarHBondContact O-N 2.89Å
221	M	53.3	Low	43.4	Very low	128 Å²	128	117.6 Å²	117.6	63%	0.631	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-25	-179.6	-76.7	-168.8	163.8	0	0	114.2	R188 Q219	R188-M221 PolarHBondContact NH1-O 3.4Å; Q219-M221 VanDerWaalsContact C-N 3.31Å; Q219-M221 PolarHBondContact O-N 3.47Å
222	Y	55.4	Low	42.9	Very low	176 Å²	176	117.4 Å²	117.4	69%	0.69	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.8	-4.8	-163.7	-67.6	-79.7	0	0	0	118	R188 Q219 Q220	R188-Y222 VanDerWaalsContact CZ-O 3.27Å; R188-Y222 PolarHBondContact NE-O 3Å; Q219-Y222 PolarHBondContact O-N 3.26Å; Q220-Y222 PolarHBondContact O-N 2.89Å
223	G	43.7	Very low	42.5	Very low	45 Å²	45	117.8 Å²	117.8	46%	0.464	67%	0.666	S	S	.	*			trans	-159.9	157.5	179.5	0	0	0	0	0	117.9	Q219	Q219-G223 PolarHBondContact O-N 3.41Å
224	G	39.2	Very low	42.2	Very low	31 Å²	31	115.6 Å²	115.6	32%	0.32	66%	0.659	S	S	.	*			trans	-116.3	-143	-167.3	0	0	0	0	0	115.3	R188 N189	R188-G224 VanDerWaalsContact CB-N 3.26Å; R188-G224 WeakPolarHBondContact O-CA 3.42Å; R188-G224 PolarHBondContact O-N 3.01Å; N189-G224 VanDerWaalsContact CG-O 3.24Å; N189-G224 PolarHBondContact ND2-O 3.4Å; N189-G224 PolarHBondContact OD1-O 3.34Å
225	L	39.1	Very low	41.8	Very low	72 Å²	72	112.3 Å²	112.3	38%	0.377	65%	0.653	S	S	.	*			cis	-159	-43.8	-12	123.8	159.7	0	0	0	115.2	R186 Q187 R188 N189	R186-L225 WeakPolarHBondContact O-CD1 3.4Å; Q187-L225 VanDerWaalsContact C-CD1 3.49Å; R188-L225 VanDerWaalsContact N-CB 3.31Å; N189-L225 HydrophobicContact CB-CB 3.79Å; N189-L225 HydrophobicContact CB-CD2 3.25Å; N189-L225 HydrophobicContact CB-CG 4.08Å; N189-L225 VanDerWaalsContact CB-N 3.31Å; N189-L225 VanDerWaalsContact CG-N 3.32Å; N189-L225 PolarHBondContact ND2-N 3.5Å
226	T	40	Very low	41.5	Very low	87 Å²	87	115.9 Å²	115.9	53%	0.534	67%	0.672	S	S	.	*			trans	-132.6	137.3	-175.2	54.8	0	0	0	0	117.1
227	T	37	Very low	41	Very low	139 Å²	139	115.2 Å²	115.2	85%	0.853	68%	0.684	S	S	*	*			trans	-108.1	138.1	157.1	-2.4	0	0	0	0	109.4
228	P	39.5	Very low	40.3	Very low	130 Å²	130	116.9 Å²	116.9	84%	0.844	69%	0.69	S	S	*	*			trans	-92.6	152.1	167.4	30.5	-22.5	0	0	0	112.2
229	S	30.2	Very low	39.2	Very low	113 Å²	113	117.4 Å²	117.4	79%	0.79	69%	0.692	S	S	*	*			trans	-125.9	138.4	179.7	173.3	0	0	0	0	110.5
230	L	32.9	Very low	38.1	Very low	176 Å²	176	117.1 Å²	117.1	92%	0.921	71%	0.705	S	S	*	*			trans	-179.4	149.9	155.3	-123.1	68.8	0	0	0	106.3
231	G	34.2	Very low	37	Very low	68 Å²	68	115.7 Å²	115.7	70%	0.701	72%	0.719	S	S	*	*			cis	153.4	120.5	-0.8	0	0	0	0	0	109.9
232	S	31.7	Very low	35.9	Very low	127 Å²	127	115.9 Å²	115.9	89%	0.888	73%	0.727	S	S	*	*			trans	23	129.1	159.6	-156.1	0	0	0	0	121.6
233	A	34.8	Very low	34.9	Very low	79 Å²	79	114 Å²	114	65%	0.653	73%	0.729	S	S	*	*				162.3	125.6	111.1	0	0	0	0	0	115
234	T	31.6	Very low	34.4	Very low	131 Å²	131	118.4 Å²	118.4	80%	0.804	74%	0.739	S	S	*	*			trans	37.3	133.5	139.4	62.8	0	0	0	0	121.2
235	S	33.8	Very low	34.2	Very low	103 Å²	103	126 Å²	126	72%	0.72	76%	0.763	S	S	*	*				-175.3	164.2	65.7	59	0	0	0	0	114.7
236	L	32.6	Very low	33.9	Very low	172 Å²	172	125.9 Å²	125.9	90%	0.901	78%	0.78	S	S	*	*			trans	13	145	150.2	-76.6	54.8	0	0	0	120.1
237	G	32.9	Very low	33.7	Very low	69 Å²	69	128 Å²	128	71%	0.711	80%	0.795	S	S	*	*			cis	147.6	165.5	1.7	0	0	0	0	0	113
238	M	34.9	Very low	33.4	Very low	165 Å²	165	124.7 Å²	124.7	81%	0.813	79%	0.789	S	S	*	*			trans	76	125.5	163.5	-78.1	-81.8	177.5	0	0	122
239	R	33.8	Very low	33.3	Very low	217 Å²	217	131.2 Å²	131.2	82%	0.819	80%	0.797	S	S	*	*			trans	93.1	89.3	141.3	-69.6	165.1	-174.6	-115.6	-0.1	121.7
240	S	31.8	Very low	33.4	Very low	125 Å²	125	131.2 Å²	131.2	87%	0.874	80%	0.797	S	S	*	*				23.8	125.3	114.6	-165.7	0	0	0	0	119.6
241	G	33.8	Very low	33.5	Very low	77 Å²	77	129.1 Å²	129.1	79%	0.794	79%	0.791	S	S	*	*			trans	-175.1	125.4	165	0	0	0	0	0	110.8
242	V	31.3	Very low	33.2	Very low	132 Å²	132	130 Å²	130	80%	0.8	80%	0.8	S	S	*	*			trans	-104.7	160	-168.6	172.1	0	0	0	0	111.5
243	N	33	Very low	33.4	Very low	137 Å²	137	131 Å²	131	73%	0.733	80%	0.795	S	S	*	*			trans	100.6	115.5	158	-86.9	-7.8	0	0	0	121.8
244	M	33.7	Very low	33.3	Very low	136 Å²	136	132 Å²	132	67%	0.67	80%	0.802	S	S	*	*				85.2	128.5	118.7	-71.9	-73.8	-132.2	0	0	123
245	F	34.6	Very low	33.3	Very low	190 Å²	190	132.8 Å²	132.8	83%	0.833	81%	0.807	S	S	*	*			trans	64.9	134.7	157.9	-69.9	-67.1	0	0	0	119.9
246	G	32.8	Very low	33.3	Very low	71 Å²	71	130.9 Å²	130.9	73%	0.732	80%	0.804	S	S	*	*			trans	-92.3	-145.7	-179.3	0	0	0	0	0	113.5
247	P	36.4	Very low	33.4	Very low	131 Å²	131	128 Å²	128	85%	0.851	80%	0.799	S	S	*	*			cis	-134.1	158.1	26.1	40.2	-23.5	0	0	0	117.4
248	G	31	Very low	33.8	Very low	69 Å²	69	128.8 Å²	128.8	71%	0.711	79%	0.793	S	S	*	*			trans	62.3	106.4	133	0	0	0	0	0	121.1
249	W	37.9	Very low	34.2	Very low	267 Å²	267	128.1 Å²	128.1	100%	1.011	80%	0.798	S	S	*	*			trans	-128.7	138.3	133.9	-81	-25.5	0	0	0	110.6
250	S	32.2	Very low	35	Very low	114 Å²	114	122.9 Å²	122.9	80%	0.797	79%	0.786	S	S	*	*			trans	-100.5	120.9	-171.5	54.2	0	0	0	0	112
251	T	34.3	Very low	36.2	Very low	131 Å²	131	122.1 Å²	122.1	80%	0.804	77%	0.772	S	S	*	*			trans	-138.4	98.9	157.5	50.8	0	0	0	0	109.2	I253	T251-I253 PolarHBondContact O-N 3.49Å
252	G	28.8	Very low	37.6	Very low	86 Å²	86	120.2 Å²	120.2	89%	0.887	74%	0.744	S	S	*	*			trans	-74.4	119.3	170.9	0	0	0	0	0	110.3
253	I	35.3	Very low	39.5	Very low	150 Å²	150	118.8 Å²	118.8	77%	0.769	73%	0.731	S	S	*	*			trans	-112.7	117.3	163.1	-65	179.3	0	0	0	106.6	T251 T255	T251-I253 PolarHBondContact O-N 3.49Å; I253-T255 PolarHBondContact O-N 3.07Å; I253-T255 VanDerWaalsContact O-N 3.08Å
254	A	32.5	Very low	41.4	Very low	99 Å²	99	115.5 Å²	115.5	82%	0.818	72%	0.718	S	S	*	*			trans	-70.4	103.6	-174.9	0	0	0	0	0	111.1	G256	A254-G256 VanDerWaalsContact C-N 3.34Å; A254-G256 PolarHBondContact O-N 3.24Å
255	T	31.7	Very low	43.2	Very low	147 Å²	147	114.6 Å²	114.6	90%	0.902	71%	0.71	S	S	*	*			trans	-73.7	87	168	51.4	0	0	0	0	109.5	I253	I253-T255 PolarHBondContact O-N 3.07Å; I253-T255 VanDerWaalsContact O-N 3.08Å
256	G	33.6	Very low	44.9	Very low	63 Å²	63	108.4 Å²	108.4	65%	0.649	69%	0.685	S	S	*	*			trans	-158.1	79.9	-175.4	0	0	0	0	0	114.9	A254	A254-G256 VanDerWaalsContact C-N 3.34Å; A254-G256 PolarHBondContact O-N 3.24Å
257	S	34.3	Very low	47	Very low	113 Å²	113	106.2 Å²	106.2	79%	0.79	66%	0.663	S	S	*	*	S	Bend	trans	-179.1	126.3	139	32.1	0	0	0	0	112.4
258	S	41.6	Very low	49.1	Very low	85 Å²	85	105.3 Å²	105.3	59%	0.594	65%	0.647	S	S	*	*			trans	24.8	105.6	156.9	56.7	0	0	0	0	119.1	D260	S258-D260 PolarHBondContact O-N 3.03Å; S258-D260 VanDerWaalsContact O-N 3.07Å
259	T	43.6	Very low	51.3	Low	150 Å²	150	104.1 Å²	104.1	92%	0.92	63%	0.631	S	S	*	*	S	Bend	trans	-77.8	34.7	167.3	52.6	0	0	0	0	113.8
260	D	50.3	Low	53.1	Low	107 Å²	107	99.6 Å²	99.6	57%	0.572	61%	0.613	S	S	*	*			trans	-110.4	114.3	164.6	-85	-40	0	0	0	107.1	S258 D262	S258-D260 PolarHBondContact O-N 3.03Å; S258-D260 VanDerWaalsContact O-N 3.07Å; D260-D262 PolarHBondContact O-N 3.47Å
261	L	57.6	Low	55.2	Low	109 Å²	109	98.3 Å²	98.3	57%	0.571	60%	0.597	S	S	*	*			trans	-75.9	67.9	175.3	-161.9	94.5	0	0	0	109.8	L263 I266	L261-L263 PolarHBondContact O-N 3.42Å; L261-I266 HydrophobicContact CD1-CD1 3.71Å; L261-I266 HydrophobicContact CD2-CD1 3.8Å; L261-I266 HydrophobicContact CG-CD1 3.56Å
262	D	62.9	Low	57.3	Low	38 Å²	38	98.6 Å²	98.6	20%	0.203	59%	0.59	C	S	.	*			trans	-53	102.3	-176.9	177.1	-11	0	0	0	110.2	D260 C264 K265 I266	D260-D262 PolarHBondContact O-N 3.47Å; D262-C264 PolarHBondContact O-N 2.95Å; D262-C264 VanDerWaalsContact OD1-CA 3.28Å; D262-C264 WeakPolarHBondContact OD1-CA 3.48Å; D262-C264 WeakPolarHBondContact OD1-CB 3.42Å; D262-C264 PolarHBondContact OD1-N 2.73Å; D262-K265 HydrophobicContact CB-CB 3.94Å; D262-K265 HydrophobicContact CB-CD 4.04Å; D262-K265 HydrophobicContact CB-CG 4.21Å; D262-K265 CarbonylContact O-C 3.54Å; D262-K265 WeakPolarHBondContact O-CA 3.38Å; D262-K265 PolarHBondContact O-N 3.29Å; D262-K265 PolarHBondContact OD1-N 2.7Å; D262-K265 WeakPolarHBondContact OD2-CD 3.44Å; D262-K265 WeakPolarHBondContact OD2-CE 3.44Å; D262-K265 WeakPolarHBondContact OD2-CG 3.25Å; D262-K265 IonicContact OD2-NZ 2.7Å; D262-K265 PolarHBondContact OD2-NZ 3.13Å; D262-I266 PolarHBondContact O-N 2.68Å
263	L	71.3	Confident	59.5	Low	102 Å²	102	98.5 Å²	98.5	53%	0.534	57%	0.568	S	S	.	*	H	α-helix	trans	-64.8	-20.8	179.9	-69	177.7	0	0	0	111.7	L261 G267	L261-L263 PolarHBondContact O-N 3.42Å; L263-G267 WeakPolarHBondContact O-CA 3.29Å; L263-G267 PolarHBondContact O-N 2.85Å
264	C	72.4	Confident	61.3	Low	67 Å²	67	96.3 Å²	96.3	45%	0.453	56%	0.556	S	S	.	*	H	α-helix	trans	-76	-34.7	167.4	-90.7	0	0	0	0	112.1	D262 G267 Q268 Y326	D262-C264 PolarHBondContact O-N 2.95Å; D262-C264 VanDerWaalsContact OD1-CA 3.28Å; D262-C264 WeakPolarHBondContact OD1-CA 3.48Å; D262-C264 WeakPolarHBondContact OD1-CB 3.42Å; D262-C264 PolarHBondContact OD1-N 2.73Å; C264-G267 CarbonylContact O-C 3.47Å; C264-Q268 WeakPolarHBondContact O-CA 3.23Å; C264-Q268 WeakPolarHBondContact O-CB 3.47Å; C264-Q268 WeakPolarHBondContact O-CG 3.15Å; C264-Q268 PolarHBondContact O-N 2.99Å; C264-Y326 VanDerWaalsContact CB-OH 3.22Å; C264-Y326 WeakPolarHBondContact CB-OH 3.42Å; C264-Y326 PolarHBondContact N-OH 3.14Å; C264-Y326 PolarHBondContact SG-OH 2.98Å
265	K	71.4	Confident	63	Low	118 Å²	118	95.5 Å²	95.5	51%	0.513	54%	0.538	S	S	.	.	H	α-helix	trans	-74.2	-41.4	171.4	-82.7	171.9	-161	150.9	0	113.2	D262 G267 Q268 A269	D262-K265 HydrophobicContact CB-CB 3.94Å; D262-K265 HydrophobicContact CB-CD 4.04Å; D262-K265 HydrophobicContact CB-CG 4.21Å; D262-K265 CarbonylContact O-C 3.54Å; D262-K265 WeakPolarHBondContact O-CA 3.38Å; D262-K265 PolarHBondContact O-N 3.29Å; D262-K265 PolarHBondContact OD1-N 2.7Å; D262-K265 WeakPolarHBondContact OD2-CD 3.44Å; D262-K265 WeakPolarHBondContact OD2-CE 3.44Å; D262-K265 WeakPolarHBondContact OD2-CG 3.25Å; D262-K265 IonicContact OD2-NZ 2.7Å; D262-K265 PolarHBondContact OD2-NZ 3.13Å; K265-G267 VanDerWaalsContact C-N 3.27Å; K265-Q268 PolarHBondContact O-N 2.7Å; K265-A269 WeakPolarHBondContact O-CB 3.43Å; K265-A269 PolarHBondContact O-N 3.23Å
266	I	71	Confident	64.9	Low	60 Å²	60	93.1 Å²	93.1	31%	0.308	52%	0.517	S	S	.	.	H	α-helix	trans	-66.1	-37.6	170.4	-70.5	-172.7	0	0	0	109.4	L261 D262 R270	L261-I266 HydrophobicContact CD1-CD1 3.71Å; L261-I266 HydrophobicContact CD2-CD1 3.8Å; L261-I266 HydrophobicContact CG-CD1 3.56Å; D262-I266 PolarHBondContact O-N 2.68Å; I266-R270 HydrophobicContact CG2-CG 4.14Å; I266-R270 WeakPolarHBondContact O-CA 3.49Å; I266-R270 WeakPolarHBondContact O-CB 3.36Å; I266-R270 WeakPolarHBondContact O-CG 3.46Å; I266-R270 PolarHBondContact O-N 2.93Å
267	G	77.3	Confident	66.8	Low	25 Å²	25	96 Å²	96	26%	0.258	51%	0.512	S	S	.	.	H	α-helix	trans	-61.8	-42.2	171.2	0	0	0	0	0	112.5	L263 C264 K265 N271	L263-G267 WeakPolarHBondContact O-CA 3.29Å; L263-G267 PolarHBondContact O-N 2.85Å; C264-G267 CarbonylContact O-C 3.47Å; K265-G267 VanDerWaalsContact C-N 3.27Å; G267-N271 WeakPolarHBondContact O-CA 3.31Å; G267-N271 WeakPolarHBondContact O-CB 3.31Å; G267-N271 PolarHBondContact O-N 3.44Å; G267-N271 PolarHBondContact O-ND2 3.13Å; G267-N271 PolarHBondContact O-OD1 2.58Å
268	Q	80.9	Confident	68	Low	111 Å²	111	93.6 Å²	93.6	52%	0.519	49%	0.49	S	S	.	.	H	α-helix	trans	-74	-40.2	178	-78.7	163.1	16	0	0	112.3	C264 K265 N271 Q272	C264-Q268 WeakPolarHBondContact O-CA 3.23Å; C264-Q268 WeakPolarHBondContact O-CB 3.47Å; C264-Q268 WeakPolarHBondContact O-CG 3.15Å; C264-Q268 PolarHBondContact O-N 2.99Å; K265-Q268 PolarHBondContact O-N 2.7Å; Q268-N271 CarbonylContact O-C 3.52Å; Q268-N271 PolarHBondContact O-N 3.45Å; Q268-Q272 WeakPolarHBondContact O-CB 3.24Å; Q268-Q272 VanDerWaalsContact O-CG 3.26Å; Q268-Q272 WeakPolarHBondContact O-CG 3.4Å; Q268-Q272 PolarHBondContact O-N 3.36Å
269	A	76.3	Confident	69	Low	45 Å²	45	95.1 Å²	95.1	37%	0.372	49%	0.492	S	S	.	.	H	α-helix	trans	-71.3	-38.7	175.7	0	0	0	0	0	110.9	K265 Q272 I273	K265-A269 WeakPolarHBondContact O-CB 3.43Å; K265-A269 PolarHBondContact O-N 3.23Å; A269-Q272 PolarHBondContact O-N 3.43Å; A269-I273 WeakPolarHBondContact O-CB 3.33Å; A269-I273 WeakPolarHBondContact O-CD1 3.29Å; A269-I273 WeakPolarHBondContact O-CG1 3.36Å; A269-I273 PolarHBondContact O-N 3.41Å
270	R	76	Confident	70.2	Confident	171 Å²	171	94.6 Å²	94.6	65%	0.645	48%	0.479	S	S	*	.	H	α-helix	trans	-71.4	-31.1	170.4	-68.3	174	97.8	163.7	5.7	111.7	I266 M274	I266-R270 HydrophobicContact CG2-CG 4.14Å; I266-R270 WeakPolarHBondContact O-CA 3.49Å; I266-R270 WeakPolarHBondContact O-CB 3.36Å; I266-R270 WeakPolarHBondContact O-CG 3.46Å; I266-R270 PolarHBondContact O-N 2.93Å; R270-M274 WeakPolarHBondContact O-CA 3.36Å; R270-M274 WeakPolarHBondContact O-CB 3.46Å; R270-M274 PolarHBondContact O-N 3.24Å
271	N	75.8	Confident	70.4	Confident	87 Å²	87	95 Å²	95	47%	0.465	49%	0.485	S	S	.	.	H	α-helix	trans	-70.7	-37.1	170.2	-77.4	-6.2	0	0	0	110.7	G267 Q268 M274 D275	G267-N271 WeakPolarHBondContact O-CA 3.31Å; G267-N271 WeakPolarHBondContact O-CB 3.31Å; G267-N271 PolarHBondContact O-N 3.44Å; G267-N271 PolarHBondContact O-ND2 3.13Å; G267-N271 PolarHBondContact O-OD1 2.58Å; Q268-N271 CarbonylContact O-C 3.52Å; Q268-N271 PolarHBondContact O-N 3.45Å; N271-M274 CarbonylContact O-C 3.53Å; N271-M274 PolarHBondContact O-N 3.43Å; N271-D275 WeakPolarHBondContact O-CA 3.26Å; N271-D275 WeakPolarHBondContact O-CB 3.26Å; N271-D275 PolarHBondContact O-N 3.01Å
272	Q	79.1	Confident	69.8	Low	137 Å²	137	93.2 Å²	93.2	64%	0.64	48%	0.475	S	S	*	.	H	α-helix	trans	-70.2	-37.9	173.5	-77.6	173.4	-0.8	0	0	111.6	Q268 A269 M274 M276	Q268-Q272 WeakPolarHBondContact O-CB 3.24Å; Q268-Q272 VanDerWaalsContact O-CG 3.26Å; Q268-Q272 WeakPolarHBondContact O-CG 3.4Å; Q268-Q272 PolarHBondContact O-N 3.36Å; A269-Q272 PolarHBondContact O-N 3.43Å; Q272-M274 VanDerWaalsContact C-N 3.34Å; Q272-M276 WeakPolarHBondContact O-CB 3.22Å; Q272-M276 PolarHBondContact O-N 3.34Å
273	I	75.7	Confident	69	Low	85 Å²	85	95.4 Å²	95.4	44%	0.436	49%	0.491	S	S	.	.	H	α-helix	trans	-70	-33.8	171.6	-68.5	163.5	0	0	0	110.7	A269 K277	A269-I273 WeakPolarHBondContact O-CB 3.33Å; A269-I273 WeakPolarHBondContact O-CD1 3.29Å; A269-I273 WeakPolarHBondContact O-CG1 3.36Å; A269-I273 PolarHBondContact O-N 3.41Å; I273-K277 HydrophobicContact CG2-CD 4.23Å; I273-K277 VanDerWaalsContact O-CB 3.28Å; I273-K277 WeakPolarHBondContact O-CB 3.36Å; I273-K277 WeakPolarHBondContact O-CG 3.28Å; I273-K277 PolarHBondContact O-N 3.19Å
274	M	72.7	Confident	67.8	Low	104 Å²	104	97.1 Å²	97.1	51%	0.512	51%	0.509	S	S	.	.	H	α-helix	trans	-71	-53.4	175.5	175.7	165.4	163.3	0	0	109.6	R270 N271 Q272 M276 K277 L278	R270-M274 WeakPolarHBondContact O-CA 3.36Å; R270-M274 WeakPolarHBondContact O-CB 3.46Å; R270-M274 PolarHBondContact O-N 3.24Å; N271-M274 CarbonylContact O-C 3.53Å; N271-M274 PolarHBondContact O-N 3.43Å; Q272-M274 VanDerWaalsContact C-N 3.34Å; M274-M276 VanDerWaalsContact C-N 3.31Å; M274-M276 PolarHBondContact O-N 3.44Å; M274-K277 CarbonylContact O-C 3.58Å; M274-K277 WeakPolarHBondContact O-CA 3.49Å; M274-K277 WeakPolarHBondContact O-CB 3.36Å; M274-K277 PolarHBondContact O-N 3.24Å; M274-L278 HydrophobicContact CE-CD1 3.96Å; M274-L278 HydrophobicContact CG-CD1 3.8Å; M274-L278 HydrophobicContact CG-CG 4.03Å; M274-L278 WeakPolarHBondContact O-CB 3.39Å; M274-L278 WeakPolarHBondContact O-CG 3.4Å; M274-L278 PolarHBondContact O-N 2.98Å
275	D	68	Low	66.7	Low	81 Å²	81	98 Å²	98	43%	0.433	52%	0.515	S	S	.	.	H	α-helix	trans	-55.7	-41.6	172.4	-66.9	-16.2	0	0	0	111.2	N271 L278 N279	N271-D275 WeakPolarHBondContact O-CA 3.26Å; N271-D275 WeakPolarHBondContact O-CB 3.26Å; N271-D275 PolarHBondContact O-N 3.01Å; D275-L278 PolarHBondContact O-N 3.43Å; D275-N279 WeakPolarHBondContact O-CB 3.44Å; D275-N279 PolarHBondContact O-N 3.37Å; D275-N279 PolarHBondContact O-ND2 3.36Å; D275-N279 PolarHBondContact O-OD1 2.88Å
276	M	70.9	Confident	65.4	Low	97 Å²	97	97.2 Å²	97.2	48%	0.478	52%	0.516	S	S	.	.	H	α-helix	trans	-63.2	-42.1	171.8	-176.3	-176.1	71	0	0	111.5	Q272 M274 Q280	Q272-M276 WeakPolarHBondContact O-CB 3.22Å; Q272-M276 PolarHBondContact O-N 3.34Å; M274-M276 VanDerWaalsContact C-N 3.31Å; M274-M276 PolarHBondContact O-N 3.44Å; M276-Q280 WeakPolarHBondContact O-CB 3.41Å; M276-Q280 WeakPolarHBondContact O-CG 3.34Å; M276-Q280 PolarHBondContact O-N 2.86Å
277	K	73.2	Confident	63.9	Low	123 Å²	123	102.5 Å²	102.5	54%	0.535	54%	0.539	S	S	.	.	H	α-helix	trans	-70.5	-32.8	174.3	-77.2	176.5	178.8	-170	0	113	I273 M274 Q280 V281	I273-K277 HydrophobicContact CG2-CD 4.23Å; I273-K277 VanDerWaalsContact O-CB 3.28Å; I273-K277 WeakPolarHBondContact O-CB 3.36Å; I273-K277 WeakPolarHBondContact O-CG 3.28Å; I273-K277 PolarHBondContact O-N 3.19Å; M274-K277 CarbonylContact O-C 3.58Å; M274-K277 WeakPolarHBondContact O-CA 3.49Å; M274-K277 WeakPolarHBondContact O-CB 3.36Å; M274-K277 PolarHBondContact O-N 3.24Å; K277-Q280 PolarHBondContact O-N 3.25Å; K277-V281 VanDerWaalsContact O-CB 3.24Å; K277-V281 WeakPolarHBondContact O-CB 3.31Å; K277-V281 WeakPolarHBondContact O-CG2 3.46Å; K277-V281 PolarHBondContact O-N 3.36Å
278	L	60.7	Low	62.3	Low	64 Å²	64	112.5 Å²	112.5	34%	0.335	57%	0.571	S	S	.	*	H	α-helix	trans	-68.9	-47.5	175.5	-71.7	173.1	0	0	0	108	M274 D275 Q280 V281 I282	M274-L278 HydrophobicContact CE-CD1 3.96Å; M274-L278 HydrophobicContact CG-CD1 3.8Å; M274-L278 HydrophobicContact CG-CG 4.03Å; M274-L278 WeakPolarHBondContact O-CB 3.39Å; M274-L278 WeakPolarHBondContact O-CG 3.4Å; M274-L278 PolarHBondContact O-N 2.98Å; D275-L278 PolarHBondContact O-N 3.43Å; L278-Q280 VanDerWaalsContact C-N 3.25Å; L278-Q280 PolarHBondContact O-N 3.06Å; L278-V281 CarbonylContact O-C 3.33Å; L278-V281 PolarHBondContact O-N 2.81Å; L278-I282 HydrophobicContact CB-CD1 4.03Å; L278-I282 HydrophobicContact CD2-CD1 3.92Å; L278-I282 WeakPolarHBondContact O-CA 3.38Å; L278-I282 WeakPolarHBondContact O-CB 3.37Å; L278-I282 VanDerWaalsContact O-CG1 3.29Å; L278-I282 WeakPolarHBondContact O-CG1 3.47Å; L278-I282 PolarHBondContact O-N 2.85Å
279	N	62.8	Low	60.4	Low	117 Å²	117	112.3 Å²	112.3	63%	0.626	58%	0.582	S	S	*	*	H	α-helix	trans	-64.1	-27.4	173.9	-66	-13	0	0	0	112.9	D275	D275-N279 WeakPolarHBondContact O-CB 3.44Å; D275-N279 PolarHBondContact O-N 3.37Å; D275-N279 PolarHBondContact O-ND2 3.36Å; D275-N279 PolarHBondContact O-OD1 2.88Å
280	Q	67.2	Low	58.6	Low	138 Å²	138	118.4 Å²	118.4	65%	0.645	61%	0.607	S	S	*	*	H	α-helix	trans	-77.1	-24.8	170.8	-77.2	169.9	-2.1	0	0	113.7	M276 K277 L278	M276-Q280 WeakPolarHBondContact O-CB 3.41Å; M276-Q280 WeakPolarHBondContact O-CG 3.34Å; M276-Q280 PolarHBondContact O-N 2.86Å; K277-Q280 PolarHBondContact O-N 3.25Å; L278-Q280 VanDerWaalsContact C-N 3.25Å; L278-Q280 PolarHBondContact O-N 3.06Å
281	V	56	Low	56.6	Low	115 Å²	115	120.4 Å²	120.4	70%	0.697	62%	0.621	S	S	*	*	H	α-helix	trans	-107.5	-22.5	-173.2	171.6	0	0	0	0	112.9	K277 L278 P283	K277-V281 VanDerWaalsContact O-CB 3.24Å; K277-V281 WeakPolarHBondContact O-CB 3.31Å; K277-V281 WeakPolarHBondContact O-CG2 3.46Å; K277-V281 PolarHBondContact O-N 3.36Å; L278-V281 CarbonylContact O-C 3.33Å; L278-V281 PolarHBondContact O-N 2.81Å; V281-P283 WeakPolarHBondContact O-CD 3.47Å
282	I	44.6	Very low	54.6	Low	72 Å²	72	125.4 Å²	125.4	37%	0.369	64%	0.641	S	S	.	*	S	Bend	trans	-103.1	110.9	-176.3	-61.9	177.7	0	0	0	109.2	L278	L278-I282 HydrophobicContact CB-CD1 4.03Å; L278-I282 HydrophobicContact CD2-CD1 3.92Å; L278-I282 WeakPolarHBondContact O-CA 3.38Å; L278-I282 WeakPolarHBondContact O-CB 3.37Å; L278-I282 VanDerWaalsContact O-CG1 3.29Å; L278-I282 WeakPolarHBondContact O-CG1 3.47Å; L278-I282 PolarHBondContact O-N 2.85Å
283	P	46.8	Very low	52.4	Low	84 Å²	84	127.6 Å²	127.6	55%	0.545	65%	0.654	S	S	.	*			trans	-63.8	145.5	163.8	27.1	-32.8	0	0	0	109.9	V281 S285	V281-P283 WeakPolarHBondContact O-CD 3.47Å; P283-S285 PolarHBondContact O-N 2.9Å; P283-S285 PolarHBondContact O-OG 3.38Å
284	P	46	Very low	50.2	Low	138 Å²	138	131.2 Å²	131.2	90%	0.896	67%	0.673	S	S	*	*	S	Bend	trans	-71.6	41.5	-154.2	29.1	-39.2	0	0	0	117.3
285	S	47.8	Very low	48.1	Very low	85 Å²	85	134.7 Å²	134.7	59%	0.594	69%	0.686	S	S	*	*	S	Bend	trans	-126.3	9.9	-164.1	63.4	0	0	0	0	115.8	P283	P283-S285 PolarHBondContact O-N 2.9Å; P283-S285 PolarHBondContact O-OG 3.38Å
286	I	45.5	Very low	46.3	Very low	103 Å²	103	139.2 Å²	139.2	53%	0.528	70%	0.698	S	S	.	*			trans	-133.3	-5.2	-166.4	-51.1	-174.5	0	0	0	114.2	Y288	I286-Y288 PolarHBondContact O-N 3.03Å; I286-Y288 VanDerWaalsContact O-N 3.13Å
287	E	39.4	Very low	44.3	Very low	170 Å²	170	141 Å²	141	79%	0.794	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-15.6	-161.3	-143.4	178	162.9	0	0	116.9
288	Y	42.3	Very low	42.2	Very low	236 Å²	236	143.1 Å²	143.1	93%	0.925	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-2.9	-163.3	-101.8	-90	0	0	0	117.8	I286	I286-Y288 PolarHBondContact O-N 3.03Å; I286-Y288 VanDerWaalsContact O-N 3.13Å
289	S	42.3	Very low	40.8	Very low	107 Å²	107	146.3 Å²	146.3	75%	0.748	73%	0.732	S	S	*	*	S	Bend	trans	-102.9	2.1	-157.2	-163.3	0	0	0	0	118.5
290	L	37.2	Very low	39.2	Very low	173 Å²	173	147.9 Å²	147.9	91%	0.906	74%	0.74	S	S	*	*	S	Bend	trans	-129.3	20.2	-164.2	-82.5	171.9	0	0	0	117.5
291	K	35.4	Very low	37.3	Very low	213 Å²	213	145.5 Å²	145.5	93%	0.926	74%	0.738	S	S	*	*	S	Bend	trans	-113	16.4	-176.2	-102.9	178.9	-179.5	171.9	0	116.8
292	Q	33.2	Very low	36.1	Very low	191 Å²	191	146.6 Å²	146.6	89%	0.893	74%	0.74	S	S	*	*			trans	-132.2	91.5	178.9	-75.3	179.5	-15.6	0	0	112.4
293	M	31.6	Very low	35.6	Very low	184 Å²	184	148.1 Å²	148.1	91%	0.906	76%	0.757	S	S	*	*			trans	-170.4	134.6	148.7	-117.6	176.7	-172.2	0	0	114
294	L	30.9	Very low	35.2	Very low	161 Å²	161	151.4 Å²	151.4	84%	0.843	78%	0.775	S	S	*	*			trans	101	92.7	157.1	-56.9	179.6	0	0	0	121
295	F	28.3	Very low	34.8	Very low	176 Å²	176	150.7 Å²	150.7	77%	0.772	77%	0.774	S	S	*	*			trans	-154.6	159.2	138.8	-121.1	-149.4	0	0	0	105.6
296	Y	30.2	Very low	35.1	Very low	177 Å²	177	150.4 Å²	150.4	69%	0.694	78%	0.784	S	S	*	*			cis	-152.8	-160.2	7.2	-149.2	-8	0	0	0	109
297	D	30	Very low	35.2	Very low	135 Å²	135	154 Å²	154	72%	0.722	80%	0.799	S	S	*	*			trans	63.9	155.9	155.4	-58	-20.8	0	0	0	123.2
298	F	28.7	Very low	36.2	Very low	166 Å²	166	152.9 Å²	152.9	73%	0.728	80%	0.804	S	S	*	*			cis	-169.7	164.5	-39.6	-168.3	-153.9	0	0	0	109.8
299	Q	31.1	Very low	37.1	Very low	132 Å²	132	147.4 Å²	147.4	62%	0.617	80%	0.795	S	S	*	*			trans	76.2	119.1	152.6	-89.6	166.9	-26.5	0	0	124.7
300	L	28.1	Very low	38.6	Very low	150 Å²	150	147 Å²	147	79%	0.785	79%	0.787	S	S	*	*				47.2	151.1	123.3	-59.3	174.7	0	0	0	121.3
301	S	28	Very low	40.6	Very low	88 Å²	88	143.2 Å²	143.2	62%	0.615	77%	0.768	S	S	*	*			cis	-165.4	160.7	-19.1	53.5	0	0	0	0	108.2
302	D	31.8	Very low	42.9	Very low	138 Å²	138	137.3 Å²	137.3	74%	0.738	75%	0.751	S	S	*	*				167.6	135.4	125.4	-94.4	19.7	0	0	0	116.8
303	S	34	Very low	45.1	Very low	103 Å²	103	135.8 Å²	135.8	72%	0.72	74%	0.742	S	S	*	*			trans	72.8	59.3	133.8	-58.1	0	0	0	0	122.7
304	V	36.8	Very low	47.6	Very low	153 Å²	153	128.1 Å²	128.1	93%	0.927	71%	0.71	S	S	*	*				-144.8	118.8	128.8	-174.1	0	0	0	0	108.4
305	S	37.7	Very low	50.2	Low	123 Å²	123	126.3 Å²	126.3	86%	0.86	69%	0.693	S	S	*	*			trans	-103	151.5	-175.2	60.9	0	0	0	0	113.6
306	G	54.7	Low	52.9	Low	80 Å²	80	123.4 Å²	123.4	83%	0.825	69%	0.685	S	S	*	*	S	Bend	trans	117.1	-3.9	159.9	0	0	0	0	0	118.5
307	Q	47.4	Very low	55.5	Low	179 Å²	179	118.8 Å²	118.8	84%	0.836	68%	0.675	S	S	*	*			trans	-117.6	114.7	177.1	-66.7	-176.1	0.9	0	0	111.4	V309	Q307-V309 PolarHBondContact O-N 3.43Å
308	T	61.4	Low	58.2	Low	146 Å²	146	116.7 Å²	116.7	90%	0.896	66%	0.664	S	S	*	*			trans	-86.5	86.7	177.4	52.8	0	0	0	0	110.7
309	V	61.5	Low	60.7	Low	121 Å²	121	112.2 Å²	112.2	73%	0.733	65%	0.647	S	S	*	*			trans	-109.5	112.6	167.6	-178.4	0	0	0	0	108.3	Q307	Q307-V309 PolarHBondContact O-N 3.43Å
310	V	71.8	Confident	63.2	Low	98 Å²	98	113.3 Å²	113.3	59%	0.594	65%	0.652	S	S	*	*			trans	-75.1	132	169.4	175	0	0	0	0	108	P312 Y315	V310-P312 VanDerWaalsContact O-CD 3.25Å; V310-P312 WeakPolarHBondContact O-CD 3.05Å; V310-Y315 HydrophobicContact CG1-CD2 3.75Å; V310-Y315 HydrophobicContact CG1-CG 3.87Å
311	D	80.2	Confident	65.7	Low	93 Å²	93	110.4 Å²	110.4	50%	0.497	65%	0.645	S	S	.	*			trans	-63.7	115.3	171.7	171	22	0	0	0	109.2	K313 G314 Y315	D311-K313 PolarHBondContact O-N 3.12Å; D311-K313 WeakPolarHBondContact OD1-CB 3.47Å; D311-K313 PolarHBondContact OD1-N 3.05Å; D311-G314 VanDerWaalsContact CG-N 3.3Å; D311-G314 PolarHBondContact O-N 3.14Å; D311-G314 PolarHBondContact OD2-N 3.28Å; D311-Y315 WeakPolarHBondContact O-CB 3.36Å; D311-Y315 PolarHBondContact O-N 3.15Å
312	P	83	Confident	68	Low	89 Å²	89	112.3 Å²	112.3	58%	0.578	65%	0.646	S	S	*	*	H	α-helix	trans	-63.3	-26.6	179.8	26.8	-35.1	0	0	0	112	V310 L316	V310-P312 VanDerWaalsContact O-CD 3.25Å; V310-P312 WeakPolarHBondContact O-CD 3.05Å; P312-L316 VanDerWaalsContact O-CB 3.25Å; P312-L316 WeakPolarHBondContact O-CB 3.15Å; P312-L316 WeakPolarHBondContact O-CD1 3.48Å; P312-L316 WeakPolarHBondContact O-CG 3.47Å; P312-L316 PolarHBondContact O-N 3.34Å
313	K	80.8	Confident	69.9	Low	159 Å²	159	110.9 Å²	110.9	69%	0.691	64%	0.637	S	S	*	*	H	α-helix	trans	-73.3	-47.1	176.3	-170.5	-176.7	177	-171.9	0	111.1	D311 T317	D311-K313 PolarHBondContact O-N 3.12Å; D311-K313 WeakPolarHBondContact OD1-CB 3.47Å; D311-K313 PolarHBondContact OD1-N 3.05Å; K313-T317 WeakPolarHBondContact O-CB 3.22Å; K313-T317 PolarHBondContact O-N 2.92Å; K313-T317 PolarHBondContact O-OG1 3.33Å
314	G	83.6	Confident	71.3	Confident	23 Å²	23	110.6 Å²	110.6	24%	0.237	63%	0.632	C	S	.	*	H	α-helix	trans	-55.1	-53.9	170.7	0	0	0	0	0	111.6	D311 L316 T317 D318	D311-G314 VanDerWaalsContact CG-N 3.3Å; D311-G314 PolarHBondContact O-N 3.14Å; D311-G314 PolarHBondContact OD2-N 3.28Å; G314-L316 PolarHBondContact O-N 3.02Å; G314-T317 CarbonylContact O-C 3.6Å; G314-T317 WeakPolarHBondContact O-CA 3.14Å; G314-T317 VanDerWaalsContact O-CB 3.27Å; G314-T317 WeakPolarHBondContact O-CB 3.19Å; G314-T317 PolarHBondContact O-N 2.87Å; G314-D318 PolarHBondContact O-N 3.16Å
315	Y	85	Confident	72.7	Confident	124 Å²	124	109.6 Å²	109.6	49%	0.486	62%	0.622	S	S	.	*	H	α-helix	trans	-64.7	-36.3	-177.4	-165	-101.6	0	0	0	113.8	V310 D311 T317 D318 L319	V310-Y315 HydrophobicContact CG1-CD2 3.75Å; V310-Y315 HydrophobicContact CG1-CG 3.87Å; D311-Y315 WeakPolarHBondContact O-CB 3.36Å; D311-Y315 PolarHBondContact O-N 3.15Å; Y315-T317 VanDerWaalsContact C-N 3.33Å; Y315-D318 PolarHBondContact O-N 3.35Å; Y315-L319 HydrophobicContact CD1-CD1 3.84Å; Y315-L319 HydrophobicContact CD1-CG 4.12Å; Y315-L319 HydrophobicContact CE1-CD1 3.64Å; Y315-L319 HydrophobicContact CE1-CD2 4.35Å; Y315-L319 HydrophobicContact CE1-CG 3.93Å; Y315-L319 WeakPolarHBondContact O-CB 3.39Å; Y315-L319 WeakPolarHBondContact O-CG 3.45Å; Y315-L319 PolarHBondContact O-N 3.19Å
316	L	85.3	Confident	73.9	Confident	114 Å²	114	109.6 Å²	109.6	60%	0.597	60%	0.604	S	S	*	*	H	α-helix	trans	-68.6	-33.5	171.1	-73.2	173.1	0	0	0	112.1	P312 G314 D318 L319 Q320	P312-L316 VanDerWaalsContact O-CB 3.25Å; P312-L316 WeakPolarHBondContact O-CB 3.15Å; P312-L316 WeakPolarHBondContact O-CD1 3.48Å; P312-L316 WeakPolarHBondContact O-CG 3.47Å; P312-L316 PolarHBondContact O-N 3.34Å; G314-L316 PolarHBondContact O-N 3.02Å; L316-D318 VanDerWaalsContact C-N 3.34Å; L316-L319 HydrophobicContact CD2-CD1 4.47Å; L316-Q320 WeakPolarHBondContact O-CB 3.31Å; L316-Q320 PolarHBondContact O-N 3.37Å
317	T	84.8	Confident	74.1	Confident	81 Å²	81	108.7 Å²	108.7	50%	0.497	59%	0.594	S	S	.	*	H	α-helix	trans	-66.4	-37.6	172.6	-53	0	0	0	0	111	K313 G314 Y315 Q320 S321	K313-T317 WeakPolarHBondContact O-CB 3.22Å; K313-T317 PolarHBondContact O-N 2.92Å; K313-T317 PolarHBondContact O-OG1 3.33Å; G314-T317 CarbonylContact O-C 3.6Å; G314-T317 WeakPolarHBondContact O-CA 3.14Å; G314-T317 VanDerWaalsContact O-CB 3.27Å; G314-T317 WeakPolarHBondContact O-CB 3.19Å; G314-T317 PolarHBondContact O-N 2.87Å; Y315-T317 VanDerWaalsContact C-N 3.33Å; T317-Q320 PolarHBondContact O-N 3.16Å; T317-S321 PolarHBondContact O-N 2.87Å
318	D	86	Confident	75	Confident	91 Å²	91	101.9 Å²	101.9	49%	0.487	57%	0.572	S	S	.	*	H	α-helix	trans	-74.4	-40.1	177.5	-67.7	-25.6	0	0	0	112.6	G314 Y315 L316 Q320 S321 M322	G314-D318 PolarHBondContact O-N 3.16Å; Y315-D318 PolarHBondContact O-N 3.35Å; L316-D318 VanDerWaalsContact C-N 3.34Å; D318-Q320 VanDerWaalsContact C-N 3.3Å; D318-Q320 PolarHBondContact O-N 3.48Å; D318-S321 PolarHBondContact O-N 2.82Å; D318-S321 VanDerWaalsContact O-N 3.15Å; D318-S321 PolarHBondContact O-OG 2.85Å; D318-M322 WeakPolarHBondContact O-CG 3.46Å; D318-M322 PolarHBondContact O-N 3.35Å
319	L	82.9	Confident	75.6	Confident	72 Å²	72	99.9 Å²	99.9	38%	0.377	56%	0.556	S	S	.	*	H	α-helix	trans	-60.8	-42	169.2	-75.4	177.9	0	0	0	110.8	Y315 L316 S321 M322 I323	Y315-L319 HydrophobicContact CD1-CD1 3.84Å; Y315-L319 HydrophobicContact CD1-CG 4.12Å; Y315-L319 HydrophobicContact CE1-CD1 3.64Å; Y315-L319 HydrophobicContact CE1-CD2 4.35Å; Y315-L319 HydrophobicContact CE1-CG 3.93Å; Y315-L319 WeakPolarHBondContact O-CB 3.39Å; Y315-L319 WeakPolarHBondContact O-CG 3.45Å; Y315-L319 PolarHBondContact O-N 3.19Å; L316-L319 HydrophobicContact CD2-CD1 4.47Å; L319-S321 PolarHBondContact O-N 3.31Å; L319-M322 HydrophobicContact CD2-CE 3.95Å; L319-M322 PolarHBondContact O-N 2.84Å; L319-I323 WeakPolarHBondContact O-CG1 3.25Å; L319-I323 PolarHBondContact O-N 3.49Å
320	Q	82.6	Confident	76.5	Confident	154 Å²	154	99.1 Å²	99.1	72%	0.72	55%	0.547	S	S	*	.	H	α-helix	trans	-67	-24.3	175.9	-170.4	169.1	6.4	0	0	112.9	L316 T317 D318	L316-Q320 WeakPolarHBondContact O-CB 3.31Å; L316-Q320 PolarHBondContact O-N 3.37Å; T317-Q320 PolarHBondContact O-N 3.16Å; D318-Q320 VanDerWaalsContact C-N 3.3Å; D318-Q320 PolarHBondContact O-N 3.48Å
321	S	80	Confident	77.1	Confident	90 Å²	90	97.2 Å²	97.2	63%	0.629	54%	0.538	S	S	*	.	H	α-helix	trans	-84.6	-23.7	173.2	80.4	0	0	0	0	113.7	T317 D318 L319	T317-S321 PolarHBondContact O-N 2.87Å; D318-S321 PolarHBondContact O-N 2.82Å; D318-S321 VanDerWaalsContact O-N 3.15Å; D318-S321 PolarHBondContact O-OG 2.85Å; L319-S321 PolarHBondContact O-N 3.31Å
322	M	77.5	Confident	77.3	Confident	128 Å²	128	96.5 Å²	96.5	63%	0.631	53%	0.534	S	S	*	.	H	α-helix	trans	-86.5	-12.9	177.2	-74	-164.6	-64.1	0	0	115.3	D318 L319 P324	D318-M322 WeakPolarHBondContact O-CG 3.46Å; D318-M322 PolarHBondContact O-N 3.35Å; L319-M322 HydrophobicContact CD2-CE 3.95Å; L319-M322 PolarHBondContact O-N 2.84Å; M322-P324 VanDerWaalsContact O-CD 3.3Å; M322-P324 WeakPolarHBondContact O-CD 3.44Å; M322-P324 VanDerWaalsContact O-N 3.16Å
323	I	70.9	Confident	77.4	Confident	108 Å²	108	93.6 Å²	93.6	55%	0.554	51%	0.513	S	S	*	.	S	Bend	trans	-60	118.7	175.5	-69.8	163.8	0	0	0	109	L319 N325	L319-I323 WeakPolarHBondContact O-CG1 3.25Å; L319-I323 PolarHBondContact O-N 3.49Å; I323-N325 PolarHBondContact O-N 3.29Å; I323-N325 VanDerWaalsContact O-N 3.11Å
324	P	63.5	Low	77.8	Confident	97 Å²	97	92.3 Å²	92.3	63%	0.63	51%	0.508	S	S	*	.			trans	-70.3	113.3	179.3	27.6	-32.7	0	0	0	109.6	M322 Y326 G327	M322-P324 VanDerWaalsContact O-CD 3.3Å; M322-P324 WeakPolarHBondContact O-CD 3.44Å; M322-P324 VanDerWaalsContact O-N 3.16Å; P324-Y326 PolarHBondContact O-N 3.06Å; P324-G327 PolarHBondContact O-N 2.7Å
325	N	66.4	Low	78.1	Confident	131 Å²	131	97.6 Å²	97.6	70%	0.701	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	3.2	175.1	-69.8	-32.9	0	0	0	114.9	I323	I323-N325 PolarHBondContact O-N 3.29Å; I323-N325 VanDerWaalsContact O-N 3.11Å
326	Y	63	Low	78.3	Confident	124 Å²	124	93.2 Å²	93.2	49%	0.486	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134	19	-173.4	-71.8	-82.2	0	0	0	113.6	C264 P324 G328	C264-Y326 VanDerWaalsContact CB-OH 3.22Å; C264-Y326 WeakPolarHBondContact CB-OH 3.42Å; C264-Y326 PolarHBondContact N-OH 3.14Å; C264-Y326 PolarHBondContact SG-OH 2.98Å; P324-Y326 PolarHBondContact O-N 3.06Å; Y326-G328 PolarHBondContact O-N 2.86Å
327	G	58.9	Low	78.6	Confident	60 Å²	60	90.8 Å²	90.8	62%	0.619	50%	0.496	S	S	*	.			trans	-76.1	100.7	174.1	0	0	0	0	0	112.4	P324	P324-G327 PolarHBondContact O-N 2.7Å
328	G	65	Low	78.9	Confident	36 Å²	36	92.9 Å²	92.9	37%	0.371	50%	0.504	S	S	.	.			trans	-70.7	172.5	174.8	0	0	0	0	0	114.4	Y326 I330 I333	Y326-G328 PolarHBondContact O-N 2.86Å; G328-I330 PolarHBondContact O-N 2.95Å; G328-I333 WeakPolarHBondContact O-CD1 3.21Å
329	D	74.7	Confident	79.2	Confident	105 Å²	105	93.6 Å²	93.6	56%	0.561	51%	0.507	S	S	*	.			trans	-63.5	126.1	-174	-108.7	-43.2	0	0	0	113.5	S331 D332 I333	D329-S331 PolarHBondContact O-N 3.27Å; D329-S331 VanDerWaalsContact O-N 3.14Å; D329-D332 PolarHBondContact O-N 3.42Å; D329-D332 VanDerWaalsContact O-N 3.15Å; D329-I333 WeakPolarHBondContact O-CG1 3.33Å; D329-I333 PolarHBondContact O-N 3.17Å
330	I	80.3	Confident	79.7	Confident	105 Å²	105	91.9 Å²	91.9	54%	0.538	50%	0.498	S	S	.	.	H	α-helix	trans	-63.6	-25	-172.9	-171.4	56.5	0	0	0	113.6	G328 K334	G328-I330 PolarHBondContact O-N 2.95Å; I330-K334 VanDerWaalsContact O-CG 3.31Å; I330-K334 WeakPolarHBondContact O-CG 3.34Å; I330-K334 PolarHBondContact O-N 3.31Å
331	S	83.9	Confident	80.2	Confident	58 Å²	58	89 Å²	89	41%	0.406	48%	0.483	S	S	.	.	H	α-helix	trans	-72.7	-46.3	175.9	56.2	0	0	0	0	111.3	D329 K334 K335	D329-S331 PolarHBondContact O-N 3.27Å; D329-S331 VanDerWaalsContact O-N 3.14Å; S331-K334 WeakPolarHBondContact O-CB 3.47Å; S331-K334 PolarHBondContact O-N 2.98Å; S331-K335 PolarHBondContact O-N 2.85Å; S331-K335 VanDerWaalsContact O-N 3.11Å
332	D	85.1	Confident	80.8	Confident	77 Å²	77	87.2 Å²	87.2	41%	0.412	47%	0.471	S	S	.	.	H	α-helix	trans	-75.3	-33.5	-179.4	-74.9	-11.4	0	0	0	112.1	D329 K334 K335 A336	D329-D332 PolarHBondContact O-N 3.42Å; D329-D332 VanDerWaalsContact O-N 3.15Å; D332-K334 PolarHBondContact O-N 2.8Å; D332-K335 PolarHBondContact O-N 3.41Å; D332-K335 VanDerWaalsContact O-N 3.12Å; D332-K335 VanDerWaalsContact OD1-CD 3.32Å; D332-K335 WeakPolarHBondContact OD1-CD 3.3Å; D332-K335 VanDerWaalsContact OD1-CE 3.24Å; D332-K335 WeakPolarHBondContact OD1-CE 3.47Å; D332-K335 IonicContact OD1-NZ 2.73Å; D332-K335 PolarHBondContact OD1-NZ 2.94Å; D332-A336 WeakPolarHBondContact O-CB 3.39Å; D332-A336 PolarHBondContact O-N 2.9Å
333	I	85.4	Confident	81.5	Confident	28 Å²	28	83 Å²	83	14%	0.144	45%	0.452	C	S	.	.	H	α-helix	trans	-55.1	-39.7	166.2	-73.5	165.4	0	0	0	111.3	G328 D329 R337 V364	G328-I333 WeakPolarHBondContact O-CD1 3.21Å; D329-I333 WeakPolarHBondContact O-CG1 3.33Å; D329-I333 PolarHBondContact O-N 3.17Å; I333-R337 VanDerWaalsContact O-CB 3.32Å; I333-R337 WeakPolarHBondContact O-CB 3.28Å; I333-R337 PolarHBondContact O-N 2.97Å; I333-V364 HydrophobicContact CD1-CG2 4.18Å; I333-V364 HydrophobicContact CG1-CG2 4.33Å; I333-V364 HydrophobicContact CG2-CG1 4.43Å; I333-V364 HydrophobicContact CG2-CG2 3.45Å; I333-V364 VanDerWaalsContact CG2-CG2 3.45Å
334	K	88.5	Confident	82.4	Confident	133 Å²	133	80.4 Å²	80.4	58%	0.578	44%	0.435	S	S	*	.	H	α-helix	trans	-69.8	-40.1	176	-73.1	169.4	-177.9	177.1	0	112	I330 S331 D332 R337 L338	I330-K334 VanDerWaalsContact O-CG 3.31Å; I330-K334 WeakPolarHBondContact O-CG 3.34Å; I330-K334 PolarHBondContact O-N 3.31Å; S331-K334 WeakPolarHBondContact O-CB 3.47Å; S331-K334 PolarHBondContact O-N 2.98Å; D332-K334 PolarHBondContact O-N 2.8Å; K334-R337 PolarHBondContact O-N 3.16Å; K334-L338 PolarHBondContact O-N 3.25Å; K334-L338 VanDerWaalsContact O-N 3.15Å
335	K	89.8	Confident	83.8	Confident	134 Å²	134	81.3 Å²	81.3	58%	0.583	43%	0.431	S	S	*	.	H	α-helix	trans	-63.1	-47.3	174.4	-63.6	175.2	-163.5	159	0	111.5	S331 D332 R337 L338 L339	S331-K335 PolarHBondContact O-N 2.85Å; S331-K335 VanDerWaalsContact O-N 3.11Å; D332-K335 PolarHBondContact O-N 3.41Å; D332-K335 VanDerWaalsContact O-N 3.12Å; D332-K335 VanDerWaalsContact OD1-CD 3.32Å; D332-K335 WeakPolarHBondContact OD1-CD 3.3Å; D332-K335 VanDerWaalsContact OD1-CE 3.24Å; D332-K335 WeakPolarHBondContact OD1-CE 3.47Å; D332-K335 IonicContact OD1-NZ 2.73Å; D332-K335 PolarHBondContact OD1-NZ 2.94Å; K335-R337 VanDerWaalsContact C-N 3.33Å; K335-R337 PolarHBondContact O-N 3.23Å; K335-L338 WeakPolarHBondContact O-CB 3.37Å; K335-L338 PolarHBondContact O-N 3.3Å; K335-L338 VanDerWaalsContact O-N 3.15Å; K335-L339 PolarHBondContact O-N 3.47Å
336	A	90.5	Very high	85	Confident	32 Å²	32	79.7 Å²	79.7	26%	0.264	43%	0.426	S	S	.	.	H	α-helix	trans	-61.1	-40.6	177.9	0	0	0	0	0	111.9	D332 L338 L339 L340 L360	D332-A336 WeakPolarHBondContact O-CB 3.39Å; D332-A336 PolarHBondContact O-N 2.9Å; A336-L338 VanDerWaalsContact C-N 3.34Å; A336-L338 PolarHBondContact O-N 3.38Å; A336-L339 PolarHBondContact O-N 3.45Å; A336-L340 WeakPolarHBondContact O-CB 3.03Å; A336-L340 WeakPolarHBondContact O-CG 3.31Å; A336-L340 PolarHBondContact O-N 3.11Å; A336-L360 HydrophobicContact CB-CD1 4.32Å; A336-L360 HydrophobicContact CB-CD2 3.73Å
337	R	91.1	Very high	86.3	Confident	63 Å²	63	77.9 Å²	77.9	24%	0.238	43%	0.425	C	S	.	.	H	α-helix	trans	-59.8	-41.6	173.8	-179.8	-177.2	-74.3	108.4	3.2	112.1	I333 K334 K335 K341 L360 E361	I333-R337 VanDerWaalsContact O-CB 3.32Å; I333-R337 WeakPolarHBondContact O-CB 3.28Å; I333-R337 PolarHBondContact O-N 2.97Å; K334-R337 PolarHBondContact O-N 3.16Å; K335-R337 VanDerWaalsContact C-N 3.33Å; K335-R337 PolarHBondContact O-N 3.23Å; R337-K341 VanDerWaalsContact O-CB 3.26Å; R337-K341 WeakPolarHBondContact O-CB 3.41Å; R337-K341 PolarHBondContact O-N 3.12Å; R337-K341 VanDerWaalsContact O-N 3.1Å; R337-L360 HydrophobicContact CB-CD2 4.16Å; R337-E361 IonicContact CZ-OE1 2.69Å; R337-E361 IonicContact CZ-OE2 2.62Å; R337-E361 IonicContact NE-OE1 2.62Å; R337-E361 PolarHBondContact NE-OE1 3.06Å; R337-E361 IonicContact NE-OE2 3.15Å; R337-E361 IonicContact NH2-OE1 3.99Å; R337-E361 PolarHBondContact NH2-OE1 3.09Å; R337-E361 IonicContact NH2-OE2 2.81Å; R337-E361 PolarHBondContact NH2-OE2 3.28Å
338	L	91.9	Very high	87.8	Confident	124 Å²	124	77.8 Å²	77.8	65%	0.649	41%	0.413	S	S	*	.	H	α-helix	trans	-67.5	-44.7	176	-177.3	64.2	0	0	0	111.7	K334 K335 A336 K341 S342	K334-L338 PolarHBondContact O-N 3.25Å; K334-L338 VanDerWaalsContact O-N 3.15Å; K335-L338 WeakPolarHBondContact O-CB 3.37Å; K335-L338 PolarHBondContact O-N 3.3Å; K335-L338 VanDerWaalsContact O-N 3.15Å; A336-L338 VanDerWaalsContact C-N 3.34Å; A336-L338 PolarHBondContact O-N 3.38Å; L338-K341 WeakPolarHBondContact O-CB 3.37Å; L338-K341 PolarHBondContact O-N 3.17Å; L338-S342 PolarHBondContact O-N 2.99Å
339	L	91.7	Very high	88.9	Confident	107 Å²	107	82.5 Å²	82.5	56%	0.56	43%	0.43	S	S	*	.	H	α-helix	trans	-59.1	-55.7	177.6	179.4	64.2	0	0	0	111	K335 A336 K341 S342 V343	K335-L339 PolarHBondContact O-N 3.47Å; A336-L339 PolarHBondContact O-N 3.45Å; L339-K341 VanDerWaalsContact C-N 3.26Å; L339-K341 PolarHBondContact O-N 3.37Å; L339-S342 WeakPolarHBondContact O-CA 3.45Å; L339-S342 PolarHBondContact O-N 3.19Å; L339-S342 PolarHBondContact O-OG 2.96Å; L339-V343 HydrophobicContact CD1-CG2 4.48Å; L339-V343 WeakPolarHBondContact O-CG2 3.42Å; L339-V343 PolarHBondContact O-N 3.39Å
340	L	92.8	Very high	89.8	Confident	36 Å²	36	81.7 Å²	81.7	19%	0.188	42%	0.423	C	S	.	.	H	α-helix	trans	-64.1	-31.2	-178.3	-65.3	179.3	0	0	0	112.5	A336 V343 R344 A356 L360	A336-L340 WeakPolarHBondContact O-CB 3.03Å; A336-L340 WeakPolarHBondContact O-CG 3.31Å; A336-L340 PolarHBondContact O-N 3.11Å; L340-V343 PolarHBondContact O-N 2.66Å; L340-R344 WeakPolarHBondContact O-CG 3.34Å; L340-R344 PolarHBondContact O-N 2.78Å; L340-R344 VanDerWaalsContact O-N 3.1Å; L340-A356 HydrophobicContact CD1-CB 4.17Å; L340-A356 HydrophobicContact CD2-CB 3.96Å; L340-L360 HydrophobicContact CD1-CB 3.97Å; L340-L360 HydrophobicContact CD1-CD2 3.77Å; L340-L360 HydrophobicContact CD1-CG 4.48Å
341	K	92.9	Very high	90.3	Very high	93 Å²	93	78.2 Å²	78.2	40%	0.404	41%	0.407	S	S	.	.	H	α-helix	trans	-59.5	-46.3	168.6	177.9	177.9	177.1	-170.5	0	111.8	R337 L338 L339 V343 R344 E345	R337-K341 VanDerWaalsContact O-CB 3.26Å; R337-K341 WeakPolarHBondContact O-CB 3.41Å; R337-K341 PolarHBondContact O-N 3.12Å; R337-K341 VanDerWaalsContact O-N 3.1Å; L338-K341 WeakPolarHBondContact O-CB 3.37Å; L338-K341 PolarHBondContact O-N 3.17Å; L339-K341 VanDerWaalsContact C-N 3.26Å; L339-K341 PolarHBondContact O-N 3.37Å; K341-V343 PolarHBondContact O-N 3.27Å; K341-R344 VanDerWaalsContact O-CG 3.25Å; K341-R344 WeakPolarHBondContact O-CG 3.36Å; K341-E345 WeakPolarHBondContact CE-OE1 3.09Å; K341-E345 WeakPolarHBondContact CG-OE1 3.1Å; K341-E345 IonicContact NZ-OE1 3.4Å; K341-E345 WeakPolarHBondContact O-CB 3.39Å; K341-E345 VanDerWaalsContact O-CG 3.31Å; K341-E345 WeakPolarHBondContact O-CG 3.37Å; K341-E345 PolarHBondContact O-N 2.81Å
342	S	93.1	Very high	90.7	Very high	52 Å²	52	79 Å²	79	36%	0.364	41%	0.41	S	S	.	.	H	α-helix	trans	-66.6	-34.4	176.6	73.1	0	0	0	0	113.1	L338 L339 E345 T346	L338-S342 PolarHBondContact O-N 2.99Å; L339-S342 WeakPolarHBondContact O-CA 3.45Å; L339-S342 PolarHBondContact O-N 3.19Å; L339-S342 PolarHBondContact O-OG 2.96Å; S342-E345 PolarHBondContact O-N 3.04Å; S342-T346 WeakPolarHBondContact O-CB 3.39Å; S342-T346 WeakPolarHBondContact O-CG2 3.45Å; S342-T346 PolarHBondContact O-N 2.73Å; S342-T346 PolarHBondContact O-OG1 2.77Å
343	V	92.5	Very high	91	Very high	41 Å²	41	75.4 Å²	75.4	25%	0.248	39%	0.392	C	S	.	.	H	α-helix	trans	-68.3	-43.4	-179.9	179.1	0	0	0	0	111.6	L339 L340 K341 T346 N347 A353	L339-V343 HydrophobicContact CD1-CG2 4.48Å; L339-V343 WeakPolarHBondContact O-CG2 3.42Å; L339-V343 PolarHBondContact O-N 3.39Å; L340-V343 PolarHBondContact O-N 2.66Å; K341-V343 PolarHBondContact O-N 3.27Å; V343-T346 PolarHBondContact O-OG1 3.25Å; V343-T346 VanDerWaalsContact O-OG1 3.11Å; V343-N347 PolarHBondContact O-N 2.92Å; V343-A353 HydrophobicContact CG1-CB 3.72Å
344	R	90.7	Very high	91.5	Very high	53 Å²	53	75.3 Å²	75.3	20%	0.2	39%	0.39	C	S	.	.	H	α-helix	trans	-70.7	-30.5	176.7	70.7	-175.5	-176.8	-148.3	4.1	113.3	L340 K341 N347 P348 A353 W354	L340-R344 WeakPolarHBondContact O-CG 3.34Å; L340-R344 PolarHBondContact O-N 2.78Å; L340-R344 VanDerWaalsContact O-N 3.1Å; K341-R344 VanDerWaalsContact O-CG 3.25Å; K341-R344 WeakPolarHBondContact O-CG 3.36Å; R344-N347 CarbonylContact O-C 3.56Å; R344-P348 WeakPolarHBondContact O-CA 3.38Å; R344-A353 HydrophobicContact CB-CB 4.48Å; R344-W354 HydrophobicContact CB-CD2 4.32Å; R344-W354 HydrophobicContact CB-CH2 4.48Å; R344-W354 HydrophobicContact CB-CZ2 4.26Å
345	E	91.6	Very high	91.7	Very high	116 Å²	116	69.9 Å²	69.9	54%	0.542	37%	0.367	S	S	.	.	H	α-helix	trans	-75.9	-35.8	178	-75.6	166.9	-170.1	0	0	111.9	K341 S342	K341-E345 WeakPolarHBondContact CE-OE1 3.09Å; K341-E345 WeakPolarHBondContact CG-OE1 3.1Å; K341-E345 IonicContact NZ-OE1 3.4Å; K341-E345 WeakPolarHBondContact O-CB 3.39Å; K341-E345 VanDerWaalsContact O-CG 3.31Å; K341-E345 WeakPolarHBondContact O-CG 3.37Å; K341-E345 PolarHBondContact O-N 2.81Å; S342-E345 PolarHBondContact O-N 3.04Å
346	T	92.6	Very high	91.8	Very high	97 Å²	97	65.4 Å²	65.4	60%	0.595	36%	0.355	S	S	*	.	H	α-helix	trans	-77.7	-32.7	174.5	49.9	0	0	0	0	113.4	S342 V343	S342-T346 WeakPolarHBondContact O-CB 3.39Å; S342-T346 WeakPolarHBondContact O-CG2 3.45Å; S342-T346 PolarHBondContact O-N 2.73Å; S342-T346 PolarHBondContact O-OG1 2.77Å; V343-T346 PolarHBondContact O-OG1 3.25Å; V343-T346 VanDerWaalsContact O-OG1 3.11Å
347	N	89.5	Confident	91.9	Very high	85 Å²	85	64 Å²	64	46%	0.455	34%	0.343	S	S	.	.			trans	-129.6	74.2	-177.3	-62	-86.6	0	0	0	111.6	V343 R344 N349 H350	V343-N347 PolarHBondContact O-N 2.92Å; R344-N347 CarbonylContact O-C 3.56Å; N347-N349 VanDerWaalsContact C-N 3.27Å; N347-N349 PolarHBondContact O-N 3.3Å; N347-H350 HydrophobicContact CB-CB 3.85Å; N347-H350 WeakPolarHBondContact O-CB 3.25Å; N347-H350 PolarHBondContact O-N 3.21Å
348	P	90	Very high	92	Very high	58 Å²	58	61.1 Å²	61.1	38%	0.377	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-38	-178	-25.9	35.4	0	0	0	113.2	R344 H350 W354 V380 C381	R344-P348 WeakPolarHBondContact O-CA 3.38Å; P348-H350 PolarHBondContact O-N 3.21Å; P348-W354 PolarHBondContact O-NE1 3.21Å; P348-V380 HydrophobicContact CB-CG1 3.87Å; P348-V380 VanDerWaalsContact O-CG1 3.24Å; P348-V380 WeakPolarHBondContact O-CG1 3.46Å; P348-C381 PolarHBondContact O-SG 3.16Å; P348-C381 VanDerWaalsContact O-SG 3.35Å
349	N	89.3	Confident	92	Very high	135 Å²	135	61.1 Å²	61.1	72%	0.722	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	7.7	-176.1	-62.7	-3.3	0	0	0	114.1	N347 P351	N347-N349 VanDerWaalsContact C-N 3.27Å; N347-N349 PolarHBondContact O-N 3.3Å; N349-P351 VanDerWaalsContact O-CD 3.31Å; N349-P351 WeakPolarHBondContact O-CD 3.29Å
350	H	91.9	Very high	91.9	Very high	88 Å²	88	57.3 Å²	57.3	41%	0.407	30%	0.304	S	S	.	.			trans	-98.7	102.1	-175.1	-176.7	-150.8	0	0	0	111.4	N347 P348 A353	N347-H350 HydrophobicContact CB-CB 3.85Å; N347-H350 WeakPolarHBondContact O-CB 3.25Å; N347-H350 PolarHBondContact O-N 3.21Å; P348-H350 PolarHBondContact O-N 3.21Å; H350-A353 HydrophobicContact CB-CB 4.35Å; H350-A353 WeakPolarHBondContact O-CB 3.28Å; H350-A353 PolarHBondContact O-N 3.48Å; H350-A353 VanDerWaalsContact O-N 3.12Å
351	P	91.3	Very high	91.8	Very high	33 Å²	33	56.2 Å²	56.2	21%	0.214	30%	0.298	C	S	.	.	H	α-helix	trans	-62.7	-41.9	-168.6	-17.9	30.1	0	0	0	114.7	N349 A353 W354 I355 C381 S384 V387	N349-P351 VanDerWaalsContact O-CD 3.31Å; N349-P351 WeakPolarHBondContact O-CD 3.29Å; P351-A353 VanDerWaalsContact C-N 3.25Å; P351-A353 PolarHBondContact O-N 3.26Å; P351-W354 PolarHBondContact O-N 2.93Å; P351-I355 PolarHBondContact O-N 3.27Å; P351-C381 HydrophobicContact CB-CB 4.36Å; P351-C381 HydrophobicContact CG-CB 4.22Å; P351-S384 WeakPolarHBondContact CB-OG 3.04Å; P351-V387 HydrophobicContact CB-CG2 3.59Å
352	P	92.7	Very high	91.6	Very high	73 Å²	73	54.4 Å²	54.4	47%	0.474	29%	0.291	S	S	.	.	H	α-helix	trans	-55.2	-30.8	173.1	-30.4	36.7	0	0	0	115.7	W354 I355 A356	P352-W354 VanDerWaalsContact C-N 3.31Å; P352-W354 PolarHBondContact O-N 2.9Å; P352-I355 PolarHBondContact O-N 3.45Å; P352-A356 VanDerWaalsContact O-CB 3.3Å; P352-A356 WeakPolarHBondContact O-CB 3.41Å; P352-A356 PolarHBondContact O-N 2.95Å
353	A	92.6	Very high	91.2	Very high	3 Å²	3	56.7 Å²	56.7	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-63.3	-40	179.5	0	0	0	0	0	112	V343 R344 H350 P351 S357	V343-A353 HydrophobicContact CG1-CB 3.72Å; R344-A353 HydrophobicContact CB-CB 4.48Å; H350-A353 HydrophobicContact CB-CB 4.35Å; H350-A353 WeakPolarHBondContact O-CB 3.28Å; H350-A353 PolarHBondContact O-N 3.48Å; H350-A353 VanDerWaalsContact O-N 3.12Å; P351-A353 VanDerWaalsContact C-N 3.25Å; P351-A353 PolarHBondContact O-N 3.26Å; A353-S357 WeakPolarHBondContact O-CB 3.49Å; A353-S357 PolarHBondContact O-N 3.18Å; A353-S357 VanDerWaalsContact O-N 3.1Å; A353-S357 PolarHBondContact O-OG 3.37Å
354	W	94.4	Very high	90.9	Very high	26 Å²	26	56.8 Å²	56.8	10%	0.098	30%	0.303	C	S	.	.	H	α-helix	trans	-72.5	-43.7	176.1	-65.5	100.4	0	0	0	112.3	R344 P348 P351 P352 A356 S357 A358 I373 N376 A377	R344-W354 HydrophobicContact CB-CD2 4.32Å; R344-W354 HydrophobicContact CB-CH2 4.48Å; R344-W354 HydrophobicContact CB-CZ2 4.26Å; P348-W354 PolarHBondContact O-NE1 3.21Å; P351-W354 PolarHBondContact O-N 2.93Å; P352-W354 VanDerWaalsContact C-N 3.31Å; P352-W354 PolarHBondContact O-N 2.9Å; W354-A356 PolarHBondContact O-N 2.85Å; W354-S357 WeakPolarHBondContact O-CB 3.38Å; W354-S357 PolarHBondContact O-N 3.09Å; W354-A358 PolarHBondContact O-N 3.48Å; W354-I373 HydrophobicContact CE3-CG2 3.98Å; W354-N376 HydrophobicContact CH2-CB 4.49Å; W354-N376 HydrophobicContact CZ3-CB 4.11Å; W354-A377 HydrophobicContact CB-CB 3.33Å; W354-A377 HydrophobicContact CD2-CB 3.59Å; W354-A377 HydrophobicContact CE3-CB 3.84Å; W354-A377 HydrophobicContact CG-CB 3.37Å
355	I	93.2	Very high	90.5	Very high	19 Å²	19	57 Å²	57	10%	0.097	32%	0.322	C	S	.	.	H	α-helix	trans	-60.2	-46.1	177.3	-65.7	168.9	0	0	0	110.6	P351 P352 A358 R359 I374 D386 V387 E390	P351-I355 PolarHBondContact O-N 3.27Å; P352-I355 PolarHBondContact O-N 3.45Å; I355-A358 PolarHBondContact O-N 3.44Å; I355-R359 HydrophobicContact CG2-CG 4.42Å; I355-R359 WeakPolarHBondContact O-CB 3.5Å; I355-R359 WeakPolarHBondContact O-CG 3.46Å; I355-R359 PolarHBondContact O-N 2.81Å; I355-I374 HydrophobicContact CG1-CD1 4.21Å; I355-D386 HydrophobicContact CD1-CB 3.9Å; I355-V387 HydrophobicContact CD1-CG2 3.96Å; I355-V387 HydrophobicContact CG1-CG2 3.95Å; I355-E390 HydrophobicContact CD1-CG 4.42Å; I355-E390 HydrophobicContact CG1-CB 4.5Å; I355-E390 HydrophobicContact CG1-CG 4.2Å; I355-E390 HydrophobicContact CG2-CG 3.97Å
356	A	91.9	Very high	90.2	Very high	39 Å²	39	56.5 Å²	56.5	32%	0.322	32%	0.318	S	S	.	.	H	α-helix	trans	-62	-43.5	175.6	0	0	0	0	0	111.7	L340 P352 W354 A358 R359 L360	L340-A356 HydrophobicContact CD1-CB 4.17Å; L340-A356 HydrophobicContact CD2-CB 3.96Å; P352-A356 VanDerWaalsContact O-CB 3.3Å; P352-A356 WeakPolarHBondContact O-CB 3.41Å; P352-A356 PolarHBondContact O-N 2.95Å; W354-A356 PolarHBondContact O-N 2.85Å; A356-A358 VanDerWaalsContact C-N 3.34Å; A356-A358 PolarHBondContact O-N 2.94Å; A356-R359 PolarHBondContact O-N 3.29Å; A356-L360 WeakPolarHBondContact O-CB 3.43Å; A356-L360 PolarHBondContact O-N 3.35Å
357	S	92.4	Very high	90.1	Very high	4 Å²	4	55.4 Å²	55.4	3%	0.028	31%	0.308	C	S	.	.	H	α-helix	trans	-59.4	-42.8	176.6	-64.5	0	0	0	0	112.4	A353 W354 E361	A353-S357 WeakPolarHBondContact O-CB 3.49Å; A353-S357 PolarHBondContact O-N 3.18Å; A353-S357 VanDerWaalsContact O-N 3.1Å; A353-S357 PolarHBondContact O-OG 3.37Å; W354-S357 WeakPolarHBondContact O-CB 3.38Å; W354-S357 PolarHBondContact O-N 3.09Å; S357-E361 PolarHBondContact O-N 2.98Å
358	A	93.1	Very high	90.2	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-71.6	-45.1	-179.8	0	0	0	0	0	111.9	W354 I355 A356 L360 E361 E362 A370 I373 I374 L394	W354-A358 PolarHBondContact O-N 3.48Å; I355-A358 PolarHBondContact O-N 3.44Å; A356-A358 VanDerWaalsContact C-N 3.34Å; A356-A358 PolarHBondContact O-N 2.94Å; A358-L360 VanDerWaalsContact C-N 3.3Å; A358-L360 PolarHBondContact O-N 3.01Å; A358-E361 PolarHBondContact O-N 2.91Å; A358-E362 PolarHBondContact O-N 3.24Å; A358-A370 HydrophobicContact CB-CB 4.42Å; A358-A370 WeakPolarHBondContact O-CB 3.4Å; A358-I373 HydrophobicContact CB-CG2 4.17Å; A358-I374 HydrophobicContact CB-CB 4.1Å; A358-I374 HydrophobicContact CB-CD1 4.26Å; A358-L394 HydrophobicContact CB-CD1 3.77Å
359	R	91.5	Very high	90.3	Very high	124 Å²	124	56.9 Å²	56.9	47%	0.468	31%	0.311	S	S	.	.	H	α-helix	trans	-62.3	-33.9	176.2	-72.5	178.9	179.4	176.6	-0.1	112.7	I355 A356 E362 V363 E390	I355-R359 HydrophobicContact CG2-CG 4.42Å; I355-R359 WeakPolarHBondContact O-CB 3.5Å; I355-R359 WeakPolarHBondContact O-CG 3.46Å; I355-R359 PolarHBondContact O-N 2.81Å; A356-R359 PolarHBondContact O-N 3.29Å; R359-E362 WeakPolarHBondContact O-CB 3.44Å; R359-E362 PolarHBondContact O-N 3.22Å; R359-V363 PolarHBondContact O-N 2.96Å; R359-V363 VanDerWaalsContact O-N 3.08Å; R359-E390 IonicContact CZ-OE1 3.56Å; R359-E390 IonicContact NE-OE1 3.39Å; R359-E390 PolarHBondContact NE-OE1 2.7Å; R359-E390 IonicContact NE-OE2 2.84Å; R359-E390 IonicContact NH2-OE1 3.48Å; R359-E390 PolarHBondContact NH2-OE1 2.72Å
360	L	90.5	Very high	90.5	Very high	27 Å²	27	50.4 Å²	50.4	14%	0.141	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-42.3	174.3	-178.9	65.2	0	0	0	112	A336 R337 L340 A356 A358 E362 V363 V364	A336-L360 HydrophobicContact CB-CD1 4.32Å; A336-L360 HydrophobicContact CB-CD2 3.73Å; R337-L360 HydrophobicContact CB-CD2 4.16Å; L340-L360 HydrophobicContact CD1-CB 3.97Å; L340-L360 HydrophobicContact CD1-CD2 3.77Å; L340-L360 HydrophobicContact CD1-CG 4.48Å; A356-L360 WeakPolarHBondContact O-CB 3.43Å; A356-L360 PolarHBondContact O-N 3.35Å; A358-L360 VanDerWaalsContact C-N 3.3Å; A358-L360 PolarHBondContact O-N 3.01Å; L360-E362 VanDerWaalsContact C-N 3.32Å; L360-V363 HydrophobicContact CD1-CG2 4.32Å; L360-V363 VanDerWaalsContact O-CG2 3.28Å; L360-V363 WeakPolarHBondContact O-CG2 3.5Å; L360-V364 WeakPolarHBondContact O-CG2 3.48Å; L360-V364 PolarHBondContact O-N 3.1Å
361	E	89.8	Confident	90.6	Very high	13 Å²	13	48.9 Å²	48.9	6%	0.061	27%	0.267	C	S	.	.	H	α-helix	trans	-72.6	-27.6	177.4	-62.2	-65.4	175.8	0	0	112.3	R337 S357 A358 G365 K366 V369 A370 I373	R337-E361 IonicContact CZ-OE1 2.69Å; R337-E361 IonicContact CZ-OE2 2.62Å; R337-E361 IonicContact NE-OE1 2.62Å; R337-E361 PolarHBondContact NE-OE1 3.06Å; R337-E361 IonicContact NE-OE2 3.15Å; R337-E361 IonicContact NH2-OE1 3.99Å; R337-E361 PolarHBondContact NH2-OE1 3.09Å; R337-E361 IonicContact NH2-OE2 2.81Å; R337-E361 PolarHBondContact NH2-OE2 3.28Å; S357-E361 PolarHBondContact O-N 2.98Å; A358-E361 PolarHBondContact O-N 2.91Å; E361-G365 PolarHBondContact O-N 2.94Å; E361-K366 HydrophobicContact CB-CB 4.34Å; E361-K366 CarbonylContact O-C 3.52Å; E361-K366 WeakPolarHBondContact O-CA 3.47Å; E361-K366 PolarHBondContact O-N 3.44Å; E361-V369 HydrophobicContact CB-CB 4.36Å; E361-V369 HydrophobicContact CG-CB 4.3Å; E361-V369 HydrophobicContact CG-CG1 3.94Å; E361-A370 HydrophobicContact CB-CB 3.99Å; E361-I373 HydrophobicContact CG-CD1 3.89Å
362	E	88.9	Confident	90.7	Very high	55 Å²	55	51.6 Å²	51.6	26%	0.257	28%	0.28	S	S	.	.	H	α-helix	trans	-63.4	-50.7	171.8	174.9	179.5	-158.2	0	0	112.4	A358 R359 L360 V364 G365 L367 A370 R393 L394	A358-E362 PolarHBondContact O-N 3.24Å; R359-E362 WeakPolarHBondContact O-CB 3.44Å; R359-E362 PolarHBondContact O-N 3.22Å; L360-E362 VanDerWaalsContact C-N 3.32Å; E362-V364 PolarHBondContact O-N 3.12Å; E362-G365 WeakPolarHBondContact O-CA 3.36Å; E362-G365 PolarHBondContact O-N 2.98Å; E362-L367 HydrophobicContact CB-CD2 4.33Å; E362-L367 HydrophobicContact CG-CD2 3.92Å; E362-A370 HydrophobicContact CB-CB 4.49Å; E362-R393 IonicContact OE1-CZ 3.36Å; E362-R393 IonicContact OE1-NH1 3.83Å; E362-R393 PolarHBondContact OE1-NH1 3.11Å; E362-R393 IonicContact OE1-NH2 2.72Å; E362-R393 IonicContact OE2-CZ 3.94Å; E362-R393 IonicContact OE2-NH1 2.66Å; E362-R393 PolarHBondContact OE2-NH1 3.12Å; E362-R393 IonicContact OE2-NH2 2.85Å; E362-R393 PolarHBondContact OE2-NH2 2.9Å; E362-L394 HydrophobicContact CB-CD2 4.21Å; E362-L394 HydrophobicContact CG-CD2 4.26Å; E362-L394 WeakPolarHBondContact OE2-CD2 3.45Å
363	V	86	Confident	90.7	Very high	101 Å²	101	48.9 Å²	48.9	61%	0.612	26%	0.262	S	S	*	.	H	α-helix	trans	-66.1	-22	179.8	-61.3	0	0	0	0	113	R359 L360 G365	R359-V363 PolarHBondContact O-N 2.96Å; R359-V363 VanDerWaalsContact O-N 3.08Å; L360-V363 HydrophobicContact CD1-CG2 4.32Å; L360-V363 VanDerWaalsContact O-CG2 3.28Å; L360-V363 WeakPolarHBondContact O-CG2 3.5Å; V363-G365 VanDerWaalsContact C-N 3.26Å
364	V	84.4	Confident	90.8	Very high	42 Å²	42	48.8 Å²	48.8	26%	0.255	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-3.5	172.4	-179.2	0	0	0	0	112.1	I333 L360 E362 K366	I333-V364 HydrophobicContact CD1-CG2 4.18Å; I333-V364 HydrophobicContact CG1-CG2 4.33Å; I333-V364 HydrophobicContact CG2-CG1 4.43Å; I333-V364 HydrophobicContact CG2-CG2 3.45Å; I333-V364 VanDerWaalsContact CG2-CG2 3.45Å; L360-V364 WeakPolarHBondContact O-CG2 3.48Å; L360-V364 PolarHBondContact O-N 3.1Å; E362-V364 PolarHBondContact O-N 3.12Å; V364-K366 VanDerWaalsContact C-N 3.31Å; V364-K366 HydrophobicContact CG1-CD 4.21Å; V364-K366 HydrophobicContact CG1-CG 4.21Å; V364-K366 PolarHBondContact O-N 2.92Å
365	G	82.3	Confident	90.6	Very high	58 Å²	58	50.2 Å²	50.2	60%	0.598	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	3.7	-177	0	0	0	0	0	114.7	E361 E362 V363 L367	E361-G365 PolarHBondContact O-N 2.94Å; E362-G365 WeakPolarHBondContact O-CA 3.36Å; E362-G365 PolarHBondContact O-N 2.98Å; V363-G365 VanDerWaalsContact C-N 3.26Å; G365-L367 PolarHBondContact O-N 3.39Å; G365-L367 VanDerWaalsContact O-N 3.07Å
366	K	86.3	Confident	90.5	Very high	105 Å²	105	53.4 Å²	53.4	46%	0.457	29%	0.287	S	S	.	.			trans	-88.2	54.1	-178.5	-67.4	-175	-179.9	-173.6	0	112.1	E361 V364 Q368 V369 A370	E361-K366 HydrophobicContact CB-CB 4.34Å; E361-K366 CarbonylContact O-C 3.52Å; E361-K366 WeakPolarHBondContact O-CA 3.47Å; E361-K366 PolarHBondContact O-N 3.44Å; V364-K366 VanDerWaalsContact C-N 3.31Å; V364-K366 HydrophobicContact CG1-CD 4.21Å; V364-K366 HydrophobicContact CG1-CG 4.21Å; V364-K366 PolarHBondContact O-N 2.92Å; K366-Q368 PolarHBondContact O-N 3.21Å; K366-Q368 VanDerWaalsContact O-N 3.09Å; K366-V369 HydrophobicContact CB-CB 4.31Å; K366-V369 HydrophobicContact CB-CG2 4.19Å; K366-V369 WeakPolarHBondContact O-CB 3.28Å; K366-V369 PolarHBondContact O-N 2.73Å; K366-A370 PolarHBondContact O-N 2.8Å; K366-A370 VanDerWaalsContact O-N 3.17Å
367	L	90.2	Very high	90.4	Very high	75 Å²	75	51.6 Å²	51.6	39%	0.393	27%	0.271	S	S	.	.	H	α-helix	trans	-50.3	-39.2	-175.2	-66.5	175.8	0	0	0	114	E362 G365 V369 A370 R371	E362-L367 HydrophobicContact CB-CD2 4.33Å; E362-L367 HydrophobicContact CG-CD2 3.92Å; G365-L367 PolarHBondContact O-N 3.39Å; G365-L367 VanDerWaalsContact O-N 3.07Å; L367-V369 VanDerWaalsContact C-N 3.34Å; L367-V369 PolarHBondContact O-N 3.35Å; L367-A370 WeakPolarHBondContact O-CB 3.3Å; L367-A370 PolarHBondContact O-N 3.14Å; L367-R371 WeakPolarHBondContact O-CG 3.31Å; L367-R371 PolarHBondContact O-N 2.85Å
368	Q	92.2	Very high	90.2	Very high	107 Å²	107	51.5 Å²	51.5	50%	0.5	27%	0.271	S	S	.	.	H	α-helix	trans	-68.9	-31.8	-179.6	-165.7	57.3	34.3	0	0	113.1	K366 N372	K366-Q368 PolarHBondContact O-N 3.21Å; K366-Q368 VanDerWaalsContact O-N 3.09Å; Q368-N372 PolarHBondContact NE2-OD1 3.33Å; Q368-N372 VanDerWaalsContact O-CG 3.3Å; Q368-N372 PolarHBondContact O-N 2.96Å; Q368-N372 PolarHBondContact O-OD1 3.35Å
369	V	92.3	Very high	90	Very high	66 Å²	66	58.8 Å²	58.8	40%	0.4	31%	0.305	S	S	.	.	H	α-helix	trans	-71.1	-41.2	174	-173.9	0	0	0	0	109.9	E361 K366 L367 R371 N372 I373	E361-V369 HydrophobicContact CB-CB 4.36Å; E361-V369 HydrophobicContact CG-CB 4.3Å; E361-V369 HydrophobicContact CG-CG1 3.94Å; K366-V369 HydrophobicContact CB-CB 4.31Å; K366-V369 HydrophobicContact CB-CG2 4.19Å; K366-V369 WeakPolarHBondContact O-CB 3.28Å; K366-V369 PolarHBondContact O-N 2.73Å; L367-V369 VanDerWaalsContact C-N 3.34Å; L367-V369 PolarHBondContact O-N 3.35Å; V369-R371 VanDerWaalsContact C-N 3.35Å; V369-R371 PolarHBondContact O-N 3.13Å; V369-N372 PolarHBondContact O-N 3.27Å; V369-I373 HydrophobicContact CG1-CD1 3.99Å; V369-I373 VanDerWaalsContact O-CG1 3.31Å; V369-I373 WeakPolarHBondContact O-CG1 3.35Å; V369-I373 PolarHBondContact O-N 2.8Å
370	A	93	Very high	89.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-57.4	-45.1	174.2	0	0	0	0	0	112.4	A358 E361 E362 K366 L367 I373 I374 L394	A358-A370 HydrophobicContact CB-CB 4.42Å; A358-A370 WeakPolarHBondContact O-CB 3.4Å; E361-A370 HydrophobicContact CB-CB 3.99Å; E362-A370 HydrophobicContact CB-CB 4.49Å; K366-A370 PolarHBondContact O-N 2.8Å; K366-A370 VanDerWaalsContact O-N 3.17Å; L367-A370 WeakPolarHBondContact O-CB 3.3Å; L367-A370 PolarHBondContact O-N 3.14Å; A370-I373 PolarHBondContact O-N 2.84Å; A370-I374 PolarHBondContact O-N 3.44Å; A370-L394 HydrophobicContact CB-CD1 4.44Å; A370-L394 HydrophobicContact CB-CD2 4.34Å
371	R	93.8	Very high	89.7	Confident	55 Å²	55	55 Å²	55	21%	0.208	30%	0.297	C	S	.	.	H	α-helix	trans	-60.5	-46.4	176.4	-70.8	171.5	-170.2	155.6	-1.3	112.5	L367 V369 I373 I374 M375 L394 N395	L367-R371 WeakPolarHBondContact O-CG 3.31Å; L367-R371 PolarHBondContact O-N 2.85Å; V369-R371 VanDerWaalsContact C-N 3.35Å; V369-R371 PolarHBondContact O-N 3.13Å; R371-I373 VanDerWaalsContact C-N 3.33Å; R371-I373 PolarHBondContact O-N 3.23Å; R371-I374 WeakPolarHBondContact O-CG2 3.46Å; R371-I374 PolarHBondContact O-N 3.26Å; R371-M375 WeakPolarHBondContact O-CB 3.49Å; R371-M375 VanDerWaalsContact O-CG 3.31Å; R371-M375 WeakPolarHBondContact O-CG 3.43Å; R371-M375 PolarHBondContact O-N 3.09Å; R371-L394 HydrophobicContact CG-CB 4.36Å; R371-L394 PolarHBondContact NE-O 3.22Å; R371-N395 WeakPolarHBondContact CG-OD1 3.48Å
372	N	93	Very high	89.5	Confident	91 Å²	91	57 Å²	57	49%	0.487	31%	0.312	S	S	.	.	H	α-helix	trans	-63.9	-39.5	178.6	-66.4	5.3	0	0	0	111.4	Q368 V369 N376	Q368-N372 PolarHBondContact NE2-OD1 3.33Å; Q368-N372 VanDerWaalsContact O-CG 3.3Å; Q368-N372 PolarHBondContact O-N 2.96Å; Q368-N372 PolarHBondContact O-OD1 3.35Å; V369-N372 PolarHBondContact O-N 3.27Å; N372-N376 VanDerWaalsContact O-CG 3.31Å; N372-N376 PolarHBondContact O-N 3.41Å; N372-N376 PolarHBondContact O-OD1 2.96Å
373	I	93.5	Very high	89.3	Confident	16 Å²	16	62.5 Å²	62.5	8%	0.082	34%	0.337	C	S	.	.	H	α-helix	trans	-62.8	-46.3	176.6	-70.1	168	0	0	0	111.4	W354 A358 E361 V369 A370 R371 A377	W354-I373 HydrophobicContact CE3-CG2 3.98Å; A358-I373 HydrophobicContact CB-CG2 4.17Å; E361-I373 HydrophobicContact CG-CD1 3.89Å; V369-I373 HydrophobicContact CG1-CD1 3.99Å; V369-I373 VanDerWaalsContact O-CG1 3.31Å; V369-I373 WeakPolarHBondContact O-CG1 3.35Å; V369-I373 PolarHBondContact O-N 2.8Å; A370-I373 PolarHBondContact O-N 2.84Å; R371-I373 VanDerWaalsContact C-N 3.33Å; R371-I373 PolarHBondContact O-N 3.23Å; I373-A377 PolarHBondContact O-N 3.05Å
374	I	93.3	Very high	89.5	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-74.7	-29.3	-176.9	-156.6	68.7	0	0	0	112.6	I355 A358 A370 R371 A377 C378 V387 E390 A391 L394	I355-I374 HydrophobicContact CG1-CD1 4.21Å; A358-I374 HydrophobicContact CB-CB 4.1Å; A358-I374 HydrophobicContact CB-CD1 4.26Å; A370-I374 PolarHBondContact O-N 3.44Å; R371-I374 WeakPolarHBondContact O-CG2 3.46Å; R371-I374 PolarHBondContact O-N 3.26Å; I374-A377 HydrophobicContact CD1-CB 4.26Å; I374-A377 VanDerWaalsContact O-CB 3.3Å; I374-A377 WeakPolarHBondContact O-CB 3.39Å; I374-A377 PolarHBondContact O-N 3.38Å; I374-C378 PolarHBondContact O-N 3.07Å; I374-C378 PolarHBondContact O-SG 2.91Å; I374-C378 VanDerWaalsContact O-SG 3.39Å; I374-V387 HydrophobicContact CD1-CG1 4.16Å; I374-E390 HydrophobicContact CD1-CB 4.1Å; I374-E390 HydrophobicContact CG1-CB 4.25Å; I374-A391 HydrophobicContact CG1-CB 3.97Å; I374-A391 HydrophobicContact CG2-CB 4.06Å; I374-L394 HydrophobicContact CB-CD1 4.1Å; I374-L394 HydrophobicContact CG1-CD1 4.39Å; I374-L394 HydrophobicContact CG2-CB 4.46Å; I374-L394 HydrophobicContact CG2-CD1 3.89Å
375	M	90.7	Very high	89.9	Confident	56 Å²	56	59.4 Å²	59.4	28%	0.276	32%	0.316	S	S	.	.	H	α-helix	trans	-65.3	-45	173.2	-73.5	-57.3	-58.1	0	0	111.8	R371 A377 C378 E379 T403	R371-M375 WeakPolarHBondContact O-CB 3.49Å; R371-M375 VanDerWaalsContact O-CG 3.31Å; R371-M375 WeakPolarHBondContact O-CG 3.43Å; R371-M375 PolarHBondContact O-N 3.09Å; M375-A377 PolarHBondContact O-N 3.29Å; M375-C378 WeakPolarHBondContact O-CB 3.41Å; M375-C378 PolarHBondContact O-N 2.92Å; M375-C378 VanDerWaalsContact O-N 3.12Å; M375-E379 PolarHBondContact O-N 2.74Å; M375-T403 HydrophobicContact CE-CG2 3.94Å; M375-T403 HydrophobicContact SD-CG2 3.48Å; M375-T403 WeakPolarHBondContact SD-CG2 3.5Å
376	N	90.6	Very high	90.4	Very high	87 Å²	87	60.2 Å²	60.2	47%	0.465	31%	0.306	S	S	.	.	H	α-helix	trans	-60.1	-34.7	173.1	-65.4	8.6	0	0	0	111.5	W354 N372 E379 V380	W354-N376 HydrophobicContact CH2-CB 4.49Å; W354-N376 HydrophobicContact CZ3-CB 4.11Å; N372-N376 VanDerWaalsContact O-CG 3.31Å; N372-N376 PolarHBondContact O-N 3.41Å; N372-N376 PolarHBondContact O-OD1 2.96Å; N376-E379 PolarHBondContact O-N 2.69Å; N376-V380 WeakPolarHBondContact O-CG2 3.35Å; N376-V380 PolarHBondContact O-N 3.16Å
377	A	90.6	Very high	90.7	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66.2	-34.9	176.3	0	0	0	0	0	113.2	W354 I373 I374 M375 E379 V380 C381 V387	W354-A377 HydrophobicContact CB-CB 3.33Å; W354-A377 HydrophobicContact CD2-CB 3.59Å; W354-A377 HydrophobicContact CE3-CB 3.84Å; W354-A377 HydrophobicContact CG-CB 3.37Å; I373-A377 PolarHBondContact O-N 3.05Å; I374-A377 HydrophobicContact CD1-CB 4.26Å; I374-A377 VanDerWaalsContact O-CB 3.3Å; I374-A377 WeakPolarHBondContact O-CB 3.39Å; I374-A377 PolarHBondContact O-N 3.38Å; M375-A377 PolarHBondContact O-N 3.29Å; A377-E379 VanDerWaalsContact C-N 3.28Å; A377-E379 PolarHBondContact O-N 3.01Å; A377-V380 PolarHBondContact O-N 3.49Å; A377-C381 WeakPolarHBondContact O-CA 3.33Å; A377-C381 VanDerWaalsContact O-CB 3.31Å; A377-C381 WeakPolarHBondContact O-CB 3.38Å; A377-C381 PolarHBondContact O-N 3Å; A377-V387 HydrophobicContact CB-CG1 3.73Å
378	C	88.6	Confident	90.8	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.02	27%	0.269	C	S	.	.	H	α-helix	trans	-63.1	-34.6	175.9	-70.5	0	0	0	0	112.6	I374 M375 S382 W388 A391	I374-C378 PolarHBondContact O-N 3.07Å; I374-C378 PolarHBondContact O-SG 2.91Å; I374-C378 VanDerWaalsContact O-SG 3.39Å; M375-C378 WeakPolarHBondContact O-CB 3.41Å; M375-C378 PolarHBondContact O-N 2.92Å; M375-C378 VanDerWaalsContact O-N 3.12Å; C378-S382 WeakPolarHBondContact O-CA 3.35Å; C378-S382 PolarHBondContact O-N 3.19Å; C378-W388 HydrophobicContact CB-CD2 4.43Å; C378-W388 HydrophobicContact CB-CE3 4.02Å; C378-W388 HydrophobicContact CB-CH2 3.63Å; C378-W388 HydrophobicContact CB-CZ2 4.06Å; C378-W388 HydrophobicContact CB-CZ3 3.61Å; C378-W388 VanDerWaalsContact SG-CE3 3.55Å; C378-A391 VanDerWaalsContact SG-CB 3.51Å
379	E	88.8	Confident	90.9	Very high	154 Å²	154	48.9 Å²	48.9	72%	0.72	25%	0.253	S	S	*	.	H	α-helix	trans	-72	-43	178.1	-62.8	-179	171.5	0	0	111.6	M375 N376 A377	M375-E379 PolarHBondContact O-N 2.74Å; N376-E379 PolarHBondContact O-N 2.69Å; A377-E379 VanDerWaalsContact C-N 3.28Å; A377-E379 PolarHBondContact O-N 3.01Å
380	V	89.7	Confident	90.8	Very high	62 Å²	62	46.8 Å²	46.8	38%	0.376	24%	0.239	S	C	.	.	H	α-helix	trans	-78.5	-43	-179	-177.8	0	0	0	0	112.5	P348 N376 A377	P348-V380 HydrophobicContact CB-CG1 3.87Å; P348-V380 VanDerWaalsContact O-CG1 3.24Å; P348-V380 WeakPolarHBondContact O-CG1 3.46Å; N376-V380 WeakPolarHBondContact O-CG2 3.35Å; N376-V380 PolarHBondContact O-N 3.16Å; A377-V380 PolarHBondContact O-N 3.49Å
381	C	85.5	Confident	90.8	Very high	10 Å²	10	46.8 Å²	46.8	7%	0.068	24%	0.239	C	C	.	.	S	Bend	trans	-105.8	42.2	-173.9	-62.6	0	0	0	0	113	P348 P351 A377 Q383 S384 V387	P348-C381 PolarHBondContact O-SG 3.16Å; P348-C381 VanDerWaalsContact O-SG 3.35Å; P351-C381 HydrophobicContact CB-CB 4.36Å; P351-C381 HydrophobicContact CG-CB 4.22Å; A377-C381 WeakPolarHBondContact O-CA 3.33Å; A377-C381 VanDerWaalsContact O-CB 3.31Å; A377-C381 WeakPolarHBondContact O-CB 3.38Å; A377-C381 PolarHBondContact O-N 3Å; C381-Q383 PolarHBondContact O-N 3.34Å; C381-S384 PolarHBondContact O-N 3.15Å; C381-S384 PolarHBondContact O-OG 3.47Å; C381-V387 HydrophobicContact CB-CG2 4.41Å
382	S	85.6	Confident	90.7	Very high	53 Å²	53	44.2 Å²	44.2	37%	0.371	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-28.8	-171.7	61.1	0	0	0	0	115.7	C378 S384 W388	C378-S382 WeakPolarHBondContact O-CA 3.35Å; C378-S382 PolarHBondContact O-N 3.19Å; S382-S384 VanDerWaalsContact C-N 3.33Å; S382-S384 PolarHBondContact O-N 2.91Å; S382-W388 PolarHBondContact O-NE1 3.19Å
383	Q	85.7	Confident	90.7	Very high	171 Å²	171	44.4 Å²	44.4	80%	0.799	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-4.1	178.4	-66.2	-173.9	-13.7	0	0	114.8	C381	C381-Q383 PolarHBondContact O-N 3.34Å
384	S	90.4	Very high	90.6	Very high	19 Å²	19	44.1 Å²	44.1	13%	0.133	22%	0.222	C	C	.	.			trans	-99.5	116.3	-174	66.5	0	0	0	0	113	P351 C381 S382 D386 V387	P351-S384 WeakPolarHBondContact CB-OG 3.04Å; C381-S384 PolarHBondContact O-N 3.15Å; C381-S384 PolarHBondContact O-OG 3.47Å; S382-S384 VanDerWaalsContact C-N 3.33Å; S382-S384 PolarHBondContact O-N 2.91Å; S384-D386 VanDerWaalsContact C-N 3.33Å; S384-D386 PolarHBondContact O-N 2.93Å; S384-V387 WeakPolarHBondContact OG-CB 3.26Å; S384-V387 WeakPolarHBondContact OG-CG2 3.36Å
385	E	91.4	Very high	90.5	Very high	59 Å²	59	45.2 Å²	45.2	28%	0.276	23%	0.228	S	C	.	.	H	α-helix	trans	-65.8	-31.7	-178.6	50.6	170.4	-172	0	0	113.5	W388 L389 L411 S414 R416 I417	E385-W388 PolarHBondContact O-N 3.18Å; E385-L389 VanDerWaalsContact O-CG 3.29Å; E385-L389 WeakPolarHBondContact O-CG 3.41Å; E385-L389 PolarHBondContact O-N 3.43Å; E385-L411 HydrophobicContact CB-CD1 3.92Å; E385-S414 WeakPolarHBondContact OE2-CB 3.27Å; E385-S414 PolarHBondContact OE2-OG 3.08Å; E385-R416 VanDerWaalsContact CD-NE 3.3Å; E385-R416 IonicContact OE1-CZ 2.74Å; E385-R416 VanDerWaalsContact OE1-CZ 3.22Å; E385-R416 IonicContact OE1-NE 3.77Å; E385-R416 PolarHBondContact OE1-NE 3Å; E385-R416 IonicContact OE1-NH2 3.81Å; E385-R416 PolarHBondContact OE1-NH2 3.35Å; E385-R416 IonicContact OE2-CZ 2.88Å; E385-R416 IonicContact OE2-NE 3.67Å; E385-R416 PolarHBondContact OE2-NE 3.16Å; E385-R416 IonicContact OE2-NH2 3.2Å; E385-I417 HydrophobicContact CB-CD1 3.99Å; E385-I417 HydrophobicContact CB-CG1 4.32Å
386	D	92.4	Very high	90.4	Very high	76 Å²	76	45.1 Å²	45.1	41%	0.406	23%	0.231	S	C	.	.	H	α-helix	trans	-69	-34.2	-178.2	-66.5	-51	0	0	0	113.6	I355 S384 L389 E390 R416	I355-D386 HydrophobicContact CD1-CB 3.9Å; S384-D386 VanDerWaalsContact C-N 3.33Å; S384-D386 PolarHBondContact O-N 2.93Å; D386-L389 PolarHBondContact O-N 3.05Å; D386-E390 PolarHBondContact O-N 3.21Å; D386-R416 IonicContact OD1-CZ 2.87Å; D386-R416 IonicContact OD1-NH1 3.85Å; D386-R416 PolarHBondContact OD1-NH1 3.18Å; D386-R416 IonicContact OD1-NH2 3.25Å; D386-R416 PolarHBondContact OD1-NH2 3.28Å; D386-R416 IonicContact OD2-NH2 3.57Å; D386-R416 PolarHBondContact OD2-NH2 3.2Å
387	V	92.7	Very high	90.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.7	-42.9	175.7	168	0	0	0	0	110.5	P351 I355 I374 A377 C381 S384 L389 E390 A391	P351-V387 HydrophobicContact CB-CG2 3.59Å; I355-V387 HydrophobicContact CD1-CG2 3.96Å; I355-V387 HydrophobicContact CG1-CG2 3.95Å; I374-V387 HydrophobicContact CD1-CG1 4.16Å; A377-V387 HydrophobicContact CB-CG1 3.73Å; C381-V387 HydrophobicContact CB-CG2 4.41Å; S384-V387 WeakPolarHBondContact OG-CB 3.26Å; S384-V387 WeakPolarHBondContact OG-CG2 3.36Å; V387-L389 VanDerWaalsContact C-N 3.34Å; V387-L389 PolarHBondContact O-N 3.24Å; V387-E390 PolarHBondContact O-N 3.39Å; V387-A391 WeakPolarHBondContact O-CB 3.04Å; V387-A391 PolarHBondContact O-N 3.17Å
388	W	93.9	Very high	90.2	Very high	16 Å²	16	49.5 Å²	49.5	6%	0.061	26%	0.259	C	S	.	.	H	α-helix	trans	-62.8	-39	175.1	-71.3	115.7	0	0	0	112.7	C378 S382 E385 A392 T403 Q406 A407	C378-W388 HydrophobicContact CB-CD2 4.43Å; C378-W388 HydrophobicContact CB-CE3 4.02Å; C378-W388 HydrophobicContact CB-CH2 3.63Å; C378-W388 HydrophobicContact CB-CZ2 4.06Å; C378-W388 HydrophobicContact CB-CZ3 3.61Å; C378-W388 VanDerWaalsContact SG-CE3 3.55Å; S382-W388 PolarHBondContact O-NE1 3.19Å; E385-W388 PolarHBondContact O-N 3.18Å; W388-A392 WeakPolarHBondContact O-CB 3.44Å; W388-A392 PolarHBondContact O-N 3.27Å; W388-T403 WeakPolarHBondContact CZ3-O 3.36Å; W388-Q406 HydrophobicContact CH2-CB 3.63Å; W388-Q406 HydrophobicContact CZ3-CB 3.7Å; W388-A407 HydrophobicContact CB-CB 3.57Å; W388-A407 HydrophobicContact CD2-CB 3.45Å; W388-A407 VanDerWaalsContact CD2-CB 3.45Å; W388-A407 HydrophobicContact CE3-CB 3.66Å; W388-A407 HydrophobicContact CG-CB 3.41Å; W388-A407 VanDerWaalsContact CG-CB 3.41Å; W388-A407 HydrophobicContact CZ3-CB 4.49Å
389	L	93	Very high	90.3	Very high	32 Å²	32	52.5 Å²	52.5	17%	0.168	28%	0.277	C	S	.	.	H	α-helix	trans	-67.6	-39.8	176.6	-70.1	170.5	0	0	0	112.3	E385 D386 V387 A392 R393 R416 R420	E385-L389 VanDerWaalsContact O-CG 3.29Å; E385-L389 WeakPolarHBondContact O-CG 3.41Å; E385-L389 PolarHBondContact O-N 3.43Å; D386-L389 PolarHBondContact O-N 3.05Å; V387-L389 VanDerWaalsContact C-N 3.34Å; V387-L389 PolarHBondContact O-N 3.24Å; L389-A392 PolarHBondContact O-N 2.8Å; L389-R393 PolarHBondContact O-N 2.78Å; L389-R393 VanDerWaalsContact O-N 3.16Å; L389-R416 HydrophobicContact CD1-CB 3.91Å; L389-R420 HydrophobicContact CD2-CB 3.67Å; L389-R420 HydrophobicContact CD2-CG 3.96Å
390	E	91	Very high	90.4	Very high	23 Å²	23	45.1 Å²	45.1	11%	0.107	24%	0.243	C	C	.	.	H	α-helix	trans	-69.3	-39.4	174.1	-75.7	-67.4	155.1	0	0	112.5	I355 R359 I374 D386 V387 A392 R393 L394	I355-E390 HydrophobicContact CD1-CG 4.42Å; I355-E390 HydrophobicContact CG1-CB 4.5Å; I355-E390 HydrophobicContact CG1-CG 4.2Å; I355-E390 HydrophobicContact CG2-CG 3.97Å; R359-E390 IonicContact CZ-OE1 3.56Å; R359-E390 IonicContact NE-OE1 3.39Å; R359-E390 PolarHBondContact NE-OE1 2.7Å; R359-E390 IonicContact NE-OE2 2.84Å; R359-E390 IonicContact NH2-OE1 3.48Å; R359-E390 PolarHBondContact NH2-OE1 2.72Å; I374-E390 HydrophobicContact CD1-CB 4.1Å; I374-E390 HydrophobicContact CG1-CB 4.25Å; D386-E390 PolarHBondContact O-N 3.21Å; V387-E390 PolarHBondContact O-N 3.39Å; E390-A392 VanDerWaalsContact C-N 3.29Å; E390-A392 PolarHBondContact O-N 2.73Å; E390-R393 WeakPolarHBondContact O-CB 3.5Å; E390-R393 PolarHBondContact O-N 2.84Å; E390-R393 IonicContact OE1-NE 2.71Å; E390-R393 IonicContact OE2-CZ 3.53Å; E390-R393 VanDerWaalsContact OE2-CZ 3.25Å; E390-R393 IonicContact OE2-NE 3.45Å; E390-R393 PolarHBondContact OE2-NE 3.42Å; E390-R393 IonicContact OE2-NH2 2.7Å; E390-R393 PolarHBondContact OE2-NH2 3.11Å; E390-L394 PolarHBondContact O-N 2.85Å
391	A	92.5	Very high	90.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.9	-40.8	172.7	0	0	0	0	0	111.7	I374 C378 V387 R393 N395	I374-A391 HydrophobicContact CG1-CB 3.97Å; I374-A391 HydrophobicContact CG2-CB 4.06Å; C378-A391 VanDerWaalsContact SG-CB 3.51Å; V387-A391 WeakPolarHBondContact O-CB 3.04Å; V387-A391 PolarHBondContact O-N 3.17Å; A391-R393 PolarHBondContact O-N 2.78Å; A391-N395 WeakPolarHBondContact O-CB 3.39Å; A391-N395 PolarHBondContact O-N 3.32Å; A391-N395 PolarHBondContact O-ND2 2.82Å
392	A	91.5	Very high	90.7	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-76.1	-2.3	174.8	0	0	0	0	0	114.7	W388 L389 E390 A400 I404 R420	W388-A392 WeakPolarHBondContact O-CB 3.44Å; W388-A392 PolarHBondContact O-N 3.27Å; L389-A392 PolarHBondContact O-N 2.8Å; E390-A392 VanDerWaalsContact C-N 3.29Å; E390-A392 PolarHBondContact O-N 2.73Å; A392-A400 HydrophobicContact CB-CB 4.49Å; A392-I404 HydrophobicContact CB-CD1 3.73Å; A392-I404 HydrophobicContact CB-CG1 3.53Å; A392-R420 HydrophobicContact CB-CG 4.42Å; A392-R420 PolarHBondContact O-NH2 3.36Å
393	R	93.3	Very high	91	Very high	95 Å²	95	48.3 Å²	48.3	36%	0.358	25%	0.248	S	C	.	.	H	α-helix	trans	-101.9	-41.1	174	-170.7	-169.2	64.7	75.9	2.8	111.8	E362 L389 E390 A391	E362-R393 IonicContact OE1-CZ 3.36Å; E362-R393 IonicContact OE1-NH1 3.83Å; E362-R393 PolarHBondContact OE1-NH1 3.11Å; E362-R393 IonicContact OE1-NH2 2.72Å; E362-R393 IonicContact OE2-CZ 3.94Å; E362-R393 IonicContact OE2-NH1 2.66Å; E362-R393 PolarHBondContact OE2-NH1 3.12Å; E362-R393 IonicContact OE2-NH2 2.85Å; E362-R393 PolarHBondContact OE2-NH2 2.9Å; L389-R393 PolarHBondContact O-N 2.78Å; L389-R393 VanDerWaalsContact O-N 3.16Å; E390-R393 WeakPolarHBondContact O-CB 3.5Å; E390-R393 PolarHBondContact O-N 2.84Å; E390-R393 IonicContact OE1-NE 2.71Å; E390-R393 IonicContact OE2-CZ 3.53Å; E390-R393 VanDerWaalsContact OE2-CZ 3.25Å; E390-R393 IonicContact OE2-NE 3.45Å; E390-R393 PolarHBondContact OE2-NE 3.42Å; E390-R393 IonicContact OE2-NH2 2.7Å; E390-R393 PolarHBondContact OE2-NH2 3.11Å; A391-R393 PolarHBondContact O-N 2.78Å
394	L	91.7	Very high	91.2	Very high	10 Å²	10	40.6 Å²	40.6	5%	0.052	21%	0.212	C	C	.	.	H	α-helix	trans	-76.8	-26.6	-178.3	-73.5	168.6	0	0	0	113.8	A358 E362 A370 R371 I374 E390	A358-L394 HydrophobicContact CB-CD1 3.77Å; E362-L394 HydrophobicContact CB-CD2 4.21Å; E362-L394 HydrophobicContact CG-CD2 4.26Å; E362-L394 WeakPolarHBondContact OE2-CD2 3.45Å; A370-L394 HydrophobicContact CB-CD1 4.44Å; A370-L394 HydrophobicContact CB-CD2 4.34Å; R371-L394 HydrophobicContact CG-CB 4.36Å; R371-L394 PolarHBondContact NE-O 3.22Å; I374-L394 HydrophobicContact CB-CD1 4.1Å; I374-L394 HydrophobicContact CG1-CD1 4.39Å; I374-L394 HydrophobicContact CG2-CB 4.46Å; I374-L394 HydrophobicContact CG2-CD1 3.89Å; E390-L394 PolarHBondContact O-N 2.85Å
395	N	90	Very high	91.2	Very high	22 Å²	22	42.3 Å²	42.3	12%	0.118	22%	0.224	C	C	.	.	S	Bend	trans	-87	146.4	-178.7	-75.8	-47.8	0	0	0	112.7	R371 A391 A400	R371-N395 WeakPolarHBondContact CG-OD1 3.48Å; A391-N395 WeakPolarHBondContact O-CB 3.39Å; A391-N395 PolarHBondContact O-N 3.32Å; A391-N395 PolarHBondContact O-ND2 2.82Å; N395-A400 HydrophobicContact CB-CB 4.32Å
396	P	90.6	Very high	91.2	Very high	54 Å²	54	43.3 Å²	43.3	35%	0.351	23%	0.229	S	C	.	.			trans	-51.6	154.7	167.1	-26.5	34.4	0	0	0	112.8	D398 T399 A400	P396-D398 VanDerWaalsContact C-N 3.27Å; P396-D398 PolarHBondContact O-N 3.46Å; P396-D398 VanDerWaalsContact O-N 3.13Å; P396-T399 VanDerWaalsContact CD-OG1 3.29Å; P396-T399 WeakPolarHBondContact CD-OG1 3.47Å; P396-T399 PolarHBondContact O-N 3.31Å; P396-T399 PolarHBondContact O-OG1 2.67Å; P396-A400 VanDerWaalsContact O-CB 3.31Å; P396-A400 WeakPolarHBondContact O-CB 3.27Å; P396-A400 PolarHBondContact O-N 2.72Å
397	P	87.7	Confident	91.2	Very high	76 Å²	76	39.7 Å²	39.7	49%	0.494	21%	0.21	S	C	.	.	H	α-helix	trans	-58.2	-33.6	-169.2	22.1	-34.1	0	0	0	114.2	A400 R401	P397-A400 PolarHBondContact O-N 2.96Å; P397-R401 WeakPolarHBondContact O-CG 3.41Å; P397-R401 PolarHBondContact O-N 3.26Å; P397-R401 PolarHBondContact O-NE 3.06Å
398	D	88.9	Confident	91	Very high	103 Å²	103	40.9 Å²	40.9	55%	0.551	22%	0.217	S	C	*	.	H	α-helix	trans	-68.9	-50.3	179.8	-54.3	-34.4	0	0	0	111.6	P396 A400 R401 V402	P396-D398 VanDerWaalsContact C-N 3.27Å; P396-D398 PolarHBondContact O-N 3.46Å; P396-D398 VanDerWaalsContact O-N 3.13Å; D398-A400 VanDerWaalsContact C-N 3.33Å; D398-A400 PolarHBondContact O-N 3.29Å; D398-R401 PolarHBondContact O-N 2.76Å; D398-R401 IonicContact OD1-CZ 3.72Å; D398-R401 IonicContact OD1-NH2 2.6Å; D398-R401 PolarHBondContact OD1-NH2 2.91Å; D398-V402 PolarHBondContact O-N 2.98Å
399	T	90.4	Very high	90.8	Very high	66 Å²	66	50 Å²	50	41%	0.405	25%	0.251	S	S	.	.	H	α-helix	trans	-63.4	-37.4	172.9	37.5	0	0	0	0	112.4	P396 R401 V402 T403	P396-T399 VanDerWaalsContact CD-OG1 3.29Å; P396-T399 WeakPolarHBondContact CD-OG1 3.47Å; P396-T399 PolarHBondContact O-N 3.31Å; P396-T399 PolarHBondContact O-OG1 2.67Å; T399-R401 VanDerWaalsContact C-N 3.33Å; T399-R401 PolarHBondContact O-N 2.89Å; T399-V402 WeakPolarHBondContact O-CB 3.37Å; T399-V402 PolarHBondContact O-N 3.48Å; T399-V402 VanDerWaalsContact O-N 3.14Å; T399-T403 PolarHBondContact O-N 2.75Å
400	A	90.8	Very high	90.7	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-65.3	-35.9	179.1	0	0	0	0	0	112	A392 N395 P396 P397 D398 V402 T403 I404 L424	A392-A400 HydrophobicContact CB-CB 4.49Å; N395-A400 HydrophobicContact CB-CB 4.32Å; P396-A400 VanDerWaalsContact O-CB 3.31Å; P396-A400 WeakPolarHBondContact O-CB 3.27Å; P396-A400 PolarHBondContact O-N 2.72Å; P397-A400 PolarHBondContact O-N 2.96Å; D398-A400 VanDerWaalsContact C-N 3.33Å; D398-A400 PolarHBondContact O-N 3.29Å; A400-V402 VanDerWaalsContact C-N 3.33Å; A400-V402 PolarHBondContact O-N 3.09Å; A400-T403 WeakPolarHBondContact CA-OG1 3.42Å; A400-T403 PolarHBondContact O-N 3.05Å; A400-T403 PolarHBondContact O-OG1 2.77Å; A400-I404 WeakPolarHBondContact O-CG1 3.27Å; A400-I404 PolarHBondContact O-N 3.06Å; A400-L424 VanDerWaalsContact C-CD1 3.45Å; A400-L424 HydrophobicContact CB-CD1 3.52Å; A400-L424 HydrophobicContact CB-CD2 4.23Å
401	R	90.2	Very high	90.6	Very high	104 Å²	104	51.5 Å²	51.5	39%	0.392	27%	0.266	S	S	.	.	H	α-helix	trans	-61.1	-40.5	172	-76.1	-178.7	-75.4	174.5	-6.1	111.8	P397 D398 T399 S405 L424 E425	P397-R401 WeakPolarHBondContact O-CG 3.41Å; P397-R401 PolarHBondContact O-N 3.26Å; P397-R401 PolarHBondContact O-NE 3.06Å; D398-R401 PolarHBondContact O-N 2.76Å; D398-R401 IonicContact OD1-CZ 3.72Å; D398-R401 IonicContact OD1-NH2 2.6Å; D398-R401 PolarHBondContact OD1-NH2 2.91Å; T399-R401 VanDerWaalsContact C-N 3.33Å; T399-R401 PolarHBondContact O-N 2.89Å; R401-S405 PolarHBondContact O-N 3.19Å; R401-L424 HydrophobicContact CG-CB 4.06Å; R401-L424 HydrophobicContact CG-CD1 4.07Å; R401-E425 WeakPolarHBondContact CD-OE1 3.46Å
402	V	91.3	Very high	90.4	Very high	83 Å²	83	53.1 Å²	53.1	50%	0.503	28%	0.277	S	S	.	.	H	α-helix	trans	-64.7	-47.2	174.3	-178.1	0	0	0	0	111.2	D398 T399 A400 I404 S405 Q406	D398-V402 PolarHBondContact O-N 2.98Å; T399-V402 WeakPolarHBondContact O-CB 3.37Å; T399-V402 PolarHBondContact O-N 3.48Å; T399-V402 VanDerWaalsContact O-N 3.14Å; A400-V402 VanDerWaalsContact C-N 3.33Å; A400-V402 PolarHBondContact O-N 3.09Å; V402-I404 VanDerWaalsContact C-N 3.33Å; V402-I404 PolarHBondContact O-N 3.16Å; V402-S405 WeakPolarHBondContact O-CB 3.17Å; V402-S405 PolarHBondContact O-N 3.31Å; V402-S405 VanDerWaalsContact O-N 3.09Å; V402-S405 PolarHBondContact O-OG 3.34Å; V402-Q406 PolarHBondContact O-N 3.09Å
403	T	91	Very high	90.3	Very high	4 Å²	4	59.9 Å²	59.9	3%	0.025	31%	0.308	C	S	.	.	H	α-helix	trans	-62	-39.4	179	57.4	0	0	0	0	112.3	M375 W388 T399 A400 S405 Q406 A407	M375-T403 HydrophobicContact CE-CG2 3.94Å; M375-T403 HydrophobicContact SD-CG2 3.48Å; M375-T403 WeakPolarHBondContact SD-CG2 3.5Å; W388-T403 WeakPolarHBondContact CZ3-O 3.36Å; T399-T403 PolarHBondContact O-N 2.75Å; A400-T403 WeakPolarHBondContact CA-OG1 3.42Å; A400-T403 PolarHBondContact O-N 3.05Å; A400-T403 PolarHBondContact O-OG1 2.77Å; T403-S405 VanDerWaalsContact C-N 3.34Å; T403-S405 PolarHBondContact O-N 3Å; T403-Q406 PolarHBondContact O-N 3.1Å; T403-A407 PolarHBondContact O-N 2.88Å
404	I	91	Very high	90.3	Very high	10 Å²	10	55.9 Å²	55.9	5%	0.051	29%	0.294	C	S	.	.	H	α-helix	trans	-66.7	-36.3	175	-69.7	-168.8	0	0	0	111.6	A392 A400 V402 Q406 A407 V408 I417 R420 A421 L424	A392-I404 HydrophobicContact CB-CD1 3.73Å; A392-I404 HydrophobicContact CB-CG1 3.53Å; A400-I404 WeakPolarHBondContact O-CG1 3.27Å; A400-I404 PolarHBondContact O-N 3.06Å; V402-I404 VanDerWaalsContact C-N 3.33Å; V402-I404 PolarHBondContact O-N 3.16Å; I404-Q406 PolarHBondContact O-N 3.17Å; I404-A407 WeakPolarHBondContact O-CB 3.46Å; I404-A407 PolarHBondContact O-N 3.29Å; I404-A407 VanDerWaalsContact O-N 3.16Å; I404-V408 HydrophobicContact CG2-CG2 4.15Å; I404-V408 WeakPolarHBondContact O-CG2 2.69Å; I404-V408 PolarHBondContact O-N 3.4Å; I404-I417 HydrophobicContact CG2-CG2 4.19Å; I404-R420 HydrophobicContact CD1-CB 4.02Å; I404-R420 HydrophobicContact CD1-CG 3.62Å; I404-A421 HydrophobicContact CG2-CB 3.57Å; I404-L424 HydrophobicContact CD1-CD1 3.45Å; I404-L424 VanDerWaalsContact CD1-CD1 3.45Å; I404-L424 HydrophobicContact CD1-CG 4.04Å; I404-L424 HydrophobicContact CG1-CD1 4.11Å
405	S	90.3	Very high	90.3	Very high	54 Å²	54	57.1 Å²	57.1	38%	0.378	30%	0.302	S	S	.	.	H	α-helix	trans	-62.9	-30.2	176.4	81.6	0	0	0	0	112.9	R401 V402 T403 R409	R401-S405 PolarHBondContact O-N 3.19Å; V402-S405 WeakPolarHBondContact O-CB 3.17Å; V402-S405 PolarHBondContact O-N 3.31Å; V402-S405 VanDerWaalsContact O-N 3.09Å; V402-S405 PolarHBondContact O-OG 3.34Å; T403-S405 VanDerWaalsContact C-N 3.34Å; T403-S405 PolarHBondContact O-N 3Å; S405-R409 WeakPolarHBondContact O-CG 3.45Å
406	Q	90.7	Very high	90.4	Very high	80 Å²	80	60.5 Å²	60.5	37%	0.374	31%	0.313	S	S	.	.	H	α-helix	trans	-75.1	-45	171.3	-65.4	171	-26.2	0	0	110.9	W388 V402 T403 I404 V408 R409 A410	W388-Q406 HydrophobicContact CH2-CB 3.63Å; W388-Q406 HydrophobicContact CZ3-CB 3.7Å; V402-Q406 PolarHBondContact O-N 3.09Å; T403-Q406 PolarHBondContact O-N 3.1Å; I404-Q406 PolarHBondContact O-N 3.17Å; Q406-V408 VanDerWaalsContact C-N 3.34Å; Q406-V408 PolarHBondContact O-N 3.16Å; Q406-R409 WeakPolarHBondContact O-CB 3.39Å; Q406-R409 PolarHBondContact O-N 2.88Å; Q406-A410 PolarHBondContact O-N 3.42Å; Q406-A410 VanDerWaalsContact O-N 3.12Å
407	A	91.9	Very high	90.5	Very high	1 Å²	1	58 Å²	58	1%	0.008	30%	0.297	C	S	.	.	H	α-helix	trans	-55.2	-44.8	176.7	0	0	0	0	0	113	W388 T403 I404 R409 A410 L411 I417	W388-A407 HydrophobicContact CB-CB 3.57Å; W388-A407 HydrophobicContact CD2-CB 3.45Å; W388-A407 VanDerWaalsContact CD2-CB 3.45Å; W388-A407 HydrophobicContact CE3-CB 3.66Å; W388-A407 HydrophobicContact CG-CB 3.41Å; W388-A407 VanDerWaalsContact CG-CB 3.41Å; W388-A407 HydrophobicContact CZ3-CB 4.49Å; T403-A407 PolarHBondContact O-N 2.88Å; I404-A407 WeakPolarHBondContact O-CB 3.46Å; I404-A407 PolarHBondContact O-N 3.29Å; I404-A407 VanDerWaalsContact O-N 3.16Å; A407-R409 VanDerWaalsContact C-N 3.3Å; A407-R409 PolarHBondContact O-N 2.92Å; A407-A410 PolarHBondContact O-N 3.48Å; A407-L411 PolarHBondContact O-N 3.24Å; A407-I417 HydrophobicContact CB-CD1 4.18Å; A407-I417 HydrophobicContact CB-CG2 3.83Å
408	V	90.1	Very high	90.8	Very high	24 Å²	24	55 Å²	55	15%	0.145	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-32.5	177.7	168.8	0	0	0	0	112.2	I404 Q406 P412 I417 W418	I404-V408 HydrophobicContact CG2-CG2 4.15Å; I404-V408 WeakPolarHBondContact O-CG2 2.69Å; I404-V408 PolarHBondContact O-N 3.4Å; Q406-V408 VanDerWaalsContact C-N 3.34Å; Q406-V408 PolarHBondContact O-N 3.16Å; V408-P412 WeakPolarHBondContact O-CA 3.46Å; V408-I417 HydrophobicContact CG2-CG2 3.65Å; V408-W418 HydrophobicContact CG1-CH2 3.52Å; V408-W418 HydrophobicContact CG1-CZ2 3.35Å; V408-W418 HydrophobicContact CG1-CZ3 4.26Å; V408-W418 HydrophobicContact CG2-CD2 4.38Å; V408-W418 HydrophobicContact CG2-CE3 4.41Å; V408-W418 HydrophobicContact CG2-CH2 4.46Å; V408-W418 HydrophobicContact CG2-CZ2 4.41Å; V408-W418 HydrophobicContact CG2-CZ3 4.46Å
409	R	89.5	Confident	91	Very high	209 Å²	209	51.4 Å²	51.4	79%	0.789	26%	0.256	S	S	*	.	H	α-helix	trans	-71.1	-35.4	175	-68.7	172.4	-174.1	-175.9	2.4	112.1	S405 Q406 A407	S405-R409 WeakPolarHBondContact O-CG 3.45Å; Q406-R409 WeakPolarHBondContact O-CB 3.39Å; Q406-R409 PolarHBondContact O-N 2.88Å; A407-R409 VanDerWaalsContact C-N 3.3Å; A407-R409 PolarHBondContact O-N 2.92Å
410	A	89.7	Confident	91	Very high	45 Å²	45	51.4 Å²	51.4	37%	0.372	25%	0.249	S	C	.	.	H	α-helix	trans	-76.7	-38	176.7	0	0	0	0	0	112.6	Q406 A407	Q406-A410 PolarHBondContact O-N 3.42Å; Q406-A410 VanDerWaalsContact O-N 3.12Å; A407-A410 PolarHBondContact O-N 3.48Å
411	L	89.6	Confident	91.1	Very high	40 Å²	40	52 Å²	52	21%	0.209	25%	0.253	C	S	.	.			trans	-135.7	68.6	-170.3	-64.3	174.3	0	0	0	111.9	E385 A407 H413 S414 I417	E385-L411 HydrophobicContact CB-CD1 3.92Å; A407-L411 PolarHBondContact O-N 3.24Å; L411-H413 PolarHBondContact O-N 2.7Å; L411-S414 PolarHBondContact O-N 3.44Å; L411-I417 HydrophobicContact CB-CD1 3.77Å; L411-I417 HydrophobicContact CD1-CD1 3.91Å; L411-I417 HydrophobicContact CG-CD1 4.48Å
412	P	89.1	Confident	91.1	Very high	35 Å²	35	47.1 Å²	47.1	23%	0.227	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-23	-176	26	-35.3	0	0	0	113.9	V408 W418 Y441	V408-P412 WeakPolarHBondContact O-CA 3.46Å; P412-W418 PolarHBondContact O-NE1 3.42Å; P412-Y441 HydrophobicContact CB-CD1 3.92Å; P412-Y441 HydrophobicContact CB-CE1 4.1Å; P412-Y441 HydrophobicContact CB-CG 4.39Å
413	H	89.3	Confident	91	Very high	142 Å²	142	47.7 Å²	47.7	66%	0.657	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.5	6.5	-177.5	-57.2	-60.7	0	0	0	114.7	L411 V415 I442	L411-H413 PolarHBondContact O-N 2.7Å; H413-V415 PolarHBondContact O-N 2.9Å; H413-I442 VanDerWaalsContact C-CD1 3.42Å; H413-I442 VanDerWaalsContact O-CD1 3.29Å; H413-I442 WeakPolarHBondContact O-CD1 3.31Å
414	S	91.7	Very high	90.9	Very high	11 Å²	11	48.9 Å²	48.9	8%	0.077	24%	0.239	C	C	.	.			trans	-85.8	111.5	174.4	174.4	0	0	0	0	112.3	E385 L411 R416 I417 W418	E385-S414 WeakPolarHBondContact OE2-CB 3.27Å; E385-S414 PolarHBondContact OE2-OG 3.08Å; L411-S414 PolarHBondContact O-N 3.44Å; S414-R416 PolarHBondContact O-N 2.76Å; S414-R416 PolarHBondContact OG-N 3.17Å; S414-I417 PolarHBondContact O-N 2.79Å; S414-I417 PolarHBondContact OG-N 2.98Å; S414-W418 PolarHBondContact O-N 3.16Å
415	V	92.1	Very high	90.8	Very high	37 Å²	37	50.1 Å²	50.1	22%	0.224	24%	0.244	C	C	.	.	H	α-helix	trans	-57.9	-32.4	170.4	176.2	0	0	0	0	111.8	H413 M419 I442 R447 L448	H413-V415 PolarHBondContact O-N 2.9Å; V415-M419 HydrophobicContact CG1-CG 4.19Å; V415-M419 WeakPolarHBondContact O-CB 3.35Å; V415-M419 VanDerWaalsContact O-CG 3.3Å; V415-M419 WeakPolarHBondContact O-CG 3.41Å; V415-M419 PolarHBondContact O-N 2.88Å; V415-I442 HydrophobicContact CG2-CD1 3.73Å; V415-I442 HydrophobicContact CG2-CG2 3.91Å; V415-R447 HydrophobicContact CG1-CB 4.49Å; V415-L448 HydrophobicContact CG1-CD2 4.08Å; V415-L448 HydrophobicContact CG1-CG 4.06Å
416	R	92.5	Very high	90.6	Very high	93 Å²	93	53.1 Å²	53.1	35%	0.351	27%	0.265	S	S	.	.	H	α-helix	trans	-68	-43.8	-177	-59.3	-160.1	-74.1	150.5	-19	111.5	E385 D386 L389 S414 M419 R420	E385-R416 VanDerWaalsContact CD-NE 3.3Å; E385-R416 IonicContact OE1-CZ 2.74Å; E385-R416 VanDerWaalsContact OE1-CZ 3.22Å; E385-R416 IonicContact OE1-NE 3.77Å; E385-R416 PolarHBondContact OE1-NE 3Å; E385-R416 IonicContact OE1-NH2 3.81Å; E385-R416 PolarHBondContact OE1-NH2 3.35Å; E385-R416 IonicContact OE2-CZ 2.88Å; E385-R416 IonicContact OE2-NE 3.67Å; E385-R416 PolarHBondContact OE2-NE 3.16Å; E385-R416 IonicContact OE2-NH2 3.2Å; D386-R416 IonicContact OD1-CZ 2.87Å; D386-R416 IonicContact OD1-NH1 3.85Å; D386-R416 PolarHBondContact OD1-NH1 3.18Å; D386-R416 IonicContact OD1-NH2 3.25Å; D386-R416 PolarHBondContact OD1-NH2 3.28Å; D386-R416 IonicContact OD2-NH2 3.57Å; D386-R416 PolarHBondContact OD2-NH2 3.2Å; L389-R416 HydrophobicContact CD1-CB 3.91Å; S414-R416 PolarHBondContact O-N 2.76Å; S414-R416 PolarHBondContact OG-N 3.17Å; R416-M419 PolarHBondContact O-N 3.02Å; R416-R420 WeakPolarHBondContact O-CB 3.41Å; R416-R420 PolarHBondContact O-N 2.88Å
417	I	93	Very high	90.6	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-64	-44.6	178	-62.5	173.7	0	0	0	110.3	E385 I404 A407 V408 L411 S414 R420 A421	E385-I417 HydrophobicContact CB-CD1 3.99Å; E385-I417 HydrophobicContact CB-CG1 4.32Å; I404-I417 HydrophobicContact CG2-CG2 4.19Å; A407-I417 HydrophobicContact CB-CD1 4.18Å; A407-I417 HydrophobicContact CB-CG2 3.83Å; V408-I417 HydrophobicContact CG2-CG2 3.65Å; L411-I417 HydrophobicContact CB-CD1 3.77Å; L411-I417 HydrophobicContact CD1-CD1 3.91Å; L411-I417 HydrophobicContact CG-CD1 4.48Å; S414-I417 PolarHBondContact O-N 2.79Å; S414-I417 PolarHBondContact OG-N 2.98Å; I417-R420 PolarHBondContact O-N 3.01Å; I417-A421 WeakPolarHBondContact O-CB 3.06Å; I417-A421 PolarHBondContact O-N 3.05Å
418	W	94.6	Very high	90.6	Very high	13 Å²	13	58.2 Å²	58.2	5%	0.049	30%	0.295	C	S	.	.	H	α-helix	trans	-64.3	-39.4	176.4	-75.3	115.1	0	0	0	113.9	V408 P412 S414 A421 A422 V434 K437 A438 Y441 L448	V408-W418 HydrophobicContact CG1-CH2 3.52Å; V408-W418 HydrophobicContact CG1-CZ2 3.35Å; V408-W418 HydrophobicContact CG1-CZ3 4.26Å; V408-W418 HydrophobicContact CG2-CD2 4.38Å; V408-W418 HydrophobicContact CG2-CE3 4.41Å; V408-W418 HydrophobicContact CG2-CH2 4.46Å; V408-W418 HydrophobicContact CG2-CZ2 4.41Å; V408-W418 HydrophobicContact CG2-CZ3 4.46Å; P412-W418 PolarHBondContact O-NE1 3.42Å; S414-W418 PolarHBondContact O-N 3.16Å; W418-A421 WeakPolarHBondContact O-CB 3.45Å; W418-A421 PolarHBondContact O-N 3.36Å; W418-A422 PolarHBondContact O-N 3.49Å; W418-V434 HydrophobicContact CE3-CG1 4.01Å; W418-V434 HydrophobicContact CZ3-CG1 4.31Å; W418-K437 HydrophobicContact CH2-CB 3.84Å; W418-K437 HydrophobicContact CZ3-CB 3.92Å; W418-A438 HydrophobicContact CB-CB 3.56Å; W418-A438 HydrophobicContact CD2-CB 3.43Å; W418-A438 VanDerWaalsContact CD2-CB 3.43Å; W418-A438 HydrophobicContact CE3-CB 3.64Å; W418-A438 HydrophobicContact CG-CB 3.41Å; W418-A438 VanDerWaalsContact CG-CB 3.41Å; W418-A438 HydrophobicContact CZ3-CB 4.43Å; W418-Y441 HydrophobicContact CH2-CD2 4.14Å; W418-Y441 HydrophobicContact CH2-CE2 4.18Å; W418-Y441 AromaticContact CZ2-CD2 3.43Å; W418-Y441 HydrophobicContact CZ2-CD2 3.43Å; W418-Y441 VanDerWaalsContact CZ2-CD2 3.43Å; W418-Y441 AromaticContact CZ2-CE2 3.78Å; W418-Y441 HydrophobicContact CZ2-CE2 3.78Å; W418-Y441 HydrophobicContact CZ2-CG 4.35Å; W418-L448 HydrophobicContact CB-CD2 4.22Å
419	M	92.4	Very high	90.6	Very high	26 Å²	26	64 Å²	64	13%	0.128	32%	0.319	C	S	.	.	H	α-helix	trans	-62.8	-44.1	172.9	-76.2	-63.3	-49.6	0	0	111.2	V415 R416 A421 A422 E423 L435 R447 L448 A451	V415-M419 HydrophobicContact CG1-CG 4.19Å; V415-M419 WeakPolarHBondContact O-CB 3.35Å; V415-M419 VanDerWaalsContact O-CG 3.3Å; V415-M419 WeakPolarHBondContact O-CG 3.41Å; V415-M419 PolarHBondContact O-N 2.88Å; R416-M419 PolarHBondContact O-N 3.02Å; M419-A421 VanDerWaalsContact C-N 3.33Å; M419-A421 PolarHBondContact O-N 3.45Å; M419-A422 CarbonylContact O-C 3.28Å; M419-A422 PolarHBondContact O-N 3.24Å; M419-A422 VanDerWaalsContact O-N 3.15Å; M419-E423 WeakPolarHBondContact O-CG 3.4Å; M419-E423 PolarHBondContact O-N 2.89Å; M419-L435 HydrophobicContact SD-CD2 4.49Å; M419-R447 HydrophobicContact CG-CG 4.38Å; M419-R447 HydrophobicContact SD-CG 4.08Å; M419-L448 HydrophobicContact CG-CD2 4.03Å; M419-L448 HydrophobicContact SD-CD2 3.84Å; M419-A451 HydrophobicContact CE-CB 3.96Å; M419-A451 HydrophobicContact SD-CB 3.8Å
420	R	90.3	Very high	90.7	Very high	67 Å²	67	55.6 Å²	55.6	25%	0.253	29%	0.291	S	S	.	.	H	α-helix	trans	-65.3	-36.2	176.9	-171.2	66	-174.2	150.9	5.1	112.1	L389 A392 I404 R416 I417 A422 E423 L424	L389-R420 HydrophobicContact CD2-CB 3.67Å; L389-R420 HydrophobicContact CD2-CG 3.96Å; A392-R420 HydrophobicContact CB-CG 4.42Å; A392-R420 PolarHBondContact O-NH2 3.36Å; I404-R420 HydrophobicContact CD1-CB 4.02Å; I404-R420 HydrophobicContact CD1-CG 3.62Å; R416-R420 WeakPolarHBondContact O-CB 3.41Å; R416-R420 PolarHBondContact O-N 2.88Å; I417-R420 PolarHBondContact O-N 3.01Å; R420-A422 VanDerWaalsContact C-N 3.31Å; R420-A422 PolarHBondContact O-N 2.76Å; R420-E423 WeakPolarHBondContact CD-OE2 3.33Å; R420-E423 IonicContact CZ-OE2 3.96Å; R420-E423 IonicContact NH1-OE2 3.31Å; R420-E423 PolarHBondContact NH1-OE2 3.4Å; R420-E423 WeakPolarHBondContact O-CB 3.46Å; R420-E423 PolarHBondContact O-N 3.46Å; R420-E423 VanDerWaalsContact O-N 3.12Å; R420-L424 PolarHBondContact O-N 3.01Å; R420-L424 VanDerWaalsContact O-N 3.12Å
421	A	92	Very high	90.9	Very high	11 Å²	11	56.3 Å²	56.3	9%	0.091	29%	0.285	C	S	.	.	H	α-helix	trans	-57.6	-44.4	171.2	0	0	0	0	0	111.5	I404 I417 W418 M419 E423 L424 V434	I404-A421 HydrophobicContact CG2-CB 3.57Å; I417-A421 WeakPolarHBondContact O-CB 3.06Å; I417-A421 PolarHBondContact O-N 3.05Å; W418-A421 WeakPolarHBondContact O-CB 3.45Å; W418-A421 PolarHBondContact O-N 3.36Å; M419-A421 VanDerWaalsContact C-N 3.33Å; M419-A421 PolarHBondContact O-N 3.45Å; A421-E423 VanDerWaalsContact C-N 3.28Å; A421-E423 PolarHBondContact O-N 2.92Å; A421-L424 PolarHBondContact O-N 3.05Å; A421-V434 HydrophobicContact CB-CG1 3.56Å
422	A	90.9	Very high	91	Very high	2 Å²	2	56.4 Å²	56.4	2%	0.017	28%	0.284	C	S	.	.	H	α-helix	trans	-72.4	-16	177	0	0	0	0	0	114	W418 M419 R420 K431 V434 L435	W418-A422 PolarHBondContact O-N 3.49Å; M419-A422 CarbonylContact O-C 3.28Å; M419-A422 PolarHBondContact O-N 3.24Å; M419-A422 VanDerWaalsContact O-N 3.15Å; R420-A422 VanDerWaalsContact C-N 3.31Å; R420-A422 PolarHBondContact O-N 2.76Å; A422-K431 HydrophobicContact CB-CG 3.95Å; A422-K431 VanDerWaalsContact O-CD 3.22Å; A422-K431 WeakPolarHBondContact O-CD 3.23Å; A422-K431 WeakPolarHBondContact O-CE 3.47Å; A422-K431 WeakPolarHBondContact O-CG 3.48Å; A422-K431 PolarHBondContact O-NZ 3.02Å; A422-V434 HydrophobicContact CB-CG1 4.3Å; A422-L435 HydrophobicContact CB-CD1 4.15Å; A422-L435 HydrophobicContact CB-CD2 3.75Å; A422-L435 HydrophobicContact CB-CG 3.79Å
423	E	90	Very high	91.2	Very high	96 Å²	96	62.7 Å²	62.7	45%	0.449	30%	0.303	S	S	.	.	H	α-helix	trans	-84.5	-31.9	172.8	-73.6	169.3	-165.6	0	0	113.1	M419 R420 A421 E425	M419-E423 WeakPolarHBondContact O-CG 3.4Å; M419-E423 PolarHBondContact O-N 2.89Å; R420-E423 WeakPolarHBondContact CD-OE2 3.33Å; R420-E423 IonicContact CZ-OE2 3.96Å; R420-E423 IonicContact NH1-OE2 3.31Å; R420-E423 PolarHBondContact NH1-OE2 3.4Å; R420-E423 WeakPolarHBondContact O-CB 3.46Å; R420-E423 PolarHBondContact O-N 3.46Å; R420-E423 VanDerWaalsContact O-N 3.12Å; A421-E423 VanDerWaalsContact C-N 3.28Å; A421-E423 PolarHBondContact O-N 2.92Å; E423-E425 VanDerWaalsContact C-N 3.3Å
424	L	89.1	Confident	91.3	Very high	29 Å²	29	57.3 Å²	57.3	15%	0.152	28%	0.28	C	S	.	.	H	α-helix	trans	-73.2	-21.5	177	-67.3	-170.8	0	0	0	113.5	A400 R401 I404 R420 A421	A400-L424 VanDerWaalsContact C-CD1 3.45Å; A400-L424 HydrophobicContact CB-CD1 3.52Å; A400-L424 HydrophobicContact CB-CD2 4.23Å; R401-L424 HydrophobicContact CG-CB 4.06Å; R401-L424 HydrophobicContact CG-CD1 4.07Å; I404-L424 HydrophobicContact CD1-CD1 3.45Å; I404-L424 VanDerWaalsContact CD1-CD1 3.45Å; I404-L424 HydrophobicContact CD1-CG 4.04Å; I404-L424 HydrophobicContact CG1-CD1 4.11Å; R420-L424 PolarHBondContact O-N 3.01Å; R420-L424 VanDerWaalsContact O-N 3.12Å; A421-L424 PolarHBondContact O-N 3.05Å
425	E	88.5	Confident	91.4	Very high	36 Å²	36	56.8 Å²	56.8	17%	0.168	28%	0.277	C	S	.	.			trans	-84.6	116.3	179.7	-70.5	-60.1	144.2	0	0	111.4	R401 E423 T430 K431 V434	R401-E425 WeakPolarHBondContact CD-OE1 3.46Å; E423-E425 VanDerWaalsContact C-N 3.3Å; E425-T430 WeakPolarHBondContact OE2-CB 3.43Å; E425-T430 PolarHBondContact OE2-OG1 2.75Å; E425-K431 HydrophobicContact CB-CB 4.23Å; E425-V434 HydrophobicContact CG-CG2 4.21Å
426	S	86.6	Confident	91.4	Very high	117 Å²	117	61.4 Å²	61.4	82%	0.818	29%	0.29	S	S	*	.			trans	-76.5	-34.3	176.7	53.4	0	0	0	0	113.1
427	E	90.6	Very high	91.3	Very high	110 Å²	110	62.9 Å²	62.9	51%	0.514	30%	0.299	S	S	.	.	S	Bend	trans	-79.2	131.8	180	-70.8	-169.2	-172.3	0	0	112	K429 T430 K431	E427-K429 PolarHBondContact O-N 3.32Å; E427-T430 HydrophobicContact CB-CG2 4.28Å; E427-T430 PolarHBondContact O-N 2.83Å; E427-T430 PolarHBondContact O-OG1 3.42Å; E427-T430 VanDerWaalsContact O-OG1 3.09Å; E427-K431 WeakPolarHBondContact O-CB 3.29Å; E427-K431 PolarHBondContact O-N 3.45Å
428	P	90	Very high	91.4	Very high	77 Å²	77	62.8 Å²	62.8	50%	0.5	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-28.9	176.1	25.8	-33.9	0	0	0	111.8	K432	P428-K432 WeakPolarHBondContact O-CB 3.49Å; P428-K432 WeakPolarHBondContact O-CG 3.25Å; P428-K432 PolarHBondContact O-N 3.48Å
429	K	92.1	Very high	91.3	Very high	147 Å²	147	62.8 Å²	62.8	64%	0.639	30%	0.299	S	S	*	.	H	α-helix	trans	-68.2	-43.6	178	-68.5	-179.4	-178.3	174.3	0	112.5	E427 R433	E427-K429 PolarHBondContact O-N 3.32Å; K429-R433 WeakPolarHBondContact O-CG 3.3Å; K429-R433 PolarHBondContact O-N 3.25Å
430	T	91.3	Very high	91.2	Very high	32 Å²	32	69 Å²	69	20%	0.196	33%	0.328	C	S	.	.	H	α-helix	trans	-72	-41.4	176.9	58.7	0	0	0	0	110.5	E425 E427 K432 R433 V434	E425-T430 WeakPolarHBondContact OE2-CB 3.43Å; E425-T430 PolarHBondContact OE2-OG1 2.75Å; E427-T430 HydrophobicContact CB-CG2 4.28Å; E427-T430 PolarHBondContact O-N 2.83Å; E427-T430 PolarHBondContact O-OG1 3.42Å; E427-T430 VanDerWaalsContact O-OG1 3.09Å; T430-K432 PolarHBondContact O-N 3.46Å; T430-R433 WeakPolarHBondContact O-CA 3.32Å; T430-R433 WeakPolarHBondContact O-CB 3.4Å; T430-R433 PolarHBondContact O-N 2.92Å; T430-V434 WeakPolarHBondContact O-CG2 3.46Å; T430-V434 PolarHBondContact O-N 3.4Å
431	K	92.7	Very high	91.3	Very high	59 Å²	59	71.4 Å²	71.4	26%	0.257	34%	0.338	S	S	.	.	H	α-helix	trans	-56.2	-44.8	174.1	-166.8	173.7	-179.1	140.3	0	113.3	A422 E425 E427 R433 V434 L435 L455	A422-K431 HydrophobicContact CB-CG 3.95Å; A422-K431 VanDerWaalsContact O-CD 3.22Å; A422-K431 WeakPolarHBondContact O-CD 3.23Å; A422-K431 WeakPolarHBondContact O-CE 3.47Å; A422-K431 WeakPolarHBondContact O-CG 3.48Å; A422-K431 PolarHBondContact O-NZ 3.02Å; E425-K431 HydrophobicContact CB-CB 4.23Å; E427-K431 WeakPolarHBondContact O-CB 3.29Å; E427-K431 PolarHBondContact O-N 3.45Å; K431-R433 PolarHBondContact O-N 2.87Å; K431-V434 PolarHBondContact O-N 2.93Å; K431-L435 HydrophobicContact CG-CD1 4.26Å; K431-L435 WeakPolarHBondContact O-CG 3.33Å; K431-L435 PolarHBondContact O-N 3.14Å; K431-L455 HydrophobicContact CB-CD1 4.14Å; K431-L455 HydrophobicContact CD-CD1 3.72Å; K431-L455 HydrophobicContact CD-CD2 4.07Å; K431-L455 HydrophobicContact CG-CD1 3.6Å
432	K	92.5	Very high	91.2	Very high	42 Å²	42	71.5 Å²	71.5	18%	0.183	34%	0.337	C	S	.	.	H	α-helix	trans	-57.9	-45.1	171.4	-77	174.1	-172.7	-159.1	0	112.1	P428 T430 V434 L435 R436 L455 E456	P428-K432 WeakPolarHBondContact O-CB 3.49Å; P428-K432 WeakPolarHBondContact O-CG 3.25Å; P428-K432 PolarHBondContact O-N 3.48Å; T430-K432 PolarHBondContact O-N 3.46Å; K432-V434 PolarHBondContact O-N 2.92Å; K432-L435 PolarHBondContact O-N 3Å; K432-R436 WeakPolarHBondContact O-CB 3.37Å; K432-R436 VanDerWaalsContact O-CG 3.25Å; K432-R436 WeakPolarHBondContact O-CG 3.32Å; K432-R436 PolarHBondContact O-N 2.69Å; K432-L455 WeakPolarHBondContact CE-O 3.38Å; K432-L455 HydrophobicContact CG-CB 4.04Å; K432-L455 HydrophobicContact CG-CD1 4.25Å; K432-L455 PolarHBondContact NZ-O 2.82Å; K432-E456 WeakPolarHBondContact CD-OE2 3.34Å; K432-E456 WeakPolarHBondContact CE-OE2 3.25Å; K432-E456 IonicContact NZ-OE2 3.31Å; K432-E456 PolarHBondContact NZ-OE2 2.94Å
433	R	92.3	Very high	91.2	Very high	168 Å²	168	74.2 Å²	74.2	63%	0.634	35%	0.354	S	S	*	.	H	α-helix	trans	-62.4	-41.6	177.2	-66.6	172.5	-167.7	179.9	4	112.1	K429 T430 K431 K437	K429-R433 WeakPolarHBondContact O-CG 3.3Å; K429-R433 PolarHBondContact O-N 3.25Å; T430-R433 WeakPolarHBondContact O-CA 3.32Å; T430-R433 WeakPolarHBondContact O-CB 3.4Å; T430-R433 PolarHBondContact O-N 2.92Å; K431-R433 PolarHBondContact O-N 2.87Å; R433-K437 WeakPolarHBondContact O-CG 3.37Å; R433-K437 PolarHBondContact O-N 2.73Å; R433-K437 VanDerWaalsContact O-N 3.08Å
434	V	92.5	Very high	91.3	Very high	28 Å²	28	75.4 Å²	75.4	17%	0.17	36%	0.363	C	S	.	.	H	α-helix	trans	-63	-47.4	177.1	171.5	0	0	0	0	110.8	W418 A421 A422 E425 T430 K431 K432 K437 A438	W418-V434 HydrophobicContact CE3-CG1 4.01Å; W418-V434 HydrophobicContact CZ3-CG1 4.31Å; A421-V434 HydrophobicContact CB-CG1 3.56Å; A422-V434 HydrophobicContact CB-CG1 4.3Å; E425-V434 HydrophobicContact CG-CG2 4.21Å; T430-V434 WeakPolarHBondContact O-CG2 3.46Å; T430-V434 PolarHBondContact O-N 3.4Å; K431-V434 PolarHBondContact O-N 2.93Å; K432-V434 PolarHBondContact O-N 2.92Å; V434-K437 PolarHBondContact O-N 3.4Å; V434-A438 WeakPolarHBondContact O-CB 2.94Å; V434-A438 PolarHBondContact O-N 3.33Å
435	L	93.1	Very high	91.3	Very high	1 Å²	1	74.6 Å²	74.6	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-70	-35.5	179.9	-70	168.9	0	0	0	113.2	M419 A422 K431 K432 A438 L439 L448 A451 A452 L455	M419-L435 HydrophobicContact SD-CD2 4.49Å; A422-L435 HydrophobicContact CB-CD1 4.15Å; A422-L435 HydrophobicContact CB-CD2 3.75Å; A422-L435 HydrophobicContact CB-CG 3.79Å; K431-L435 HydrophobicContact CG-CD1 4.26Å; K431-L435 WeakPolarHBondContact O-CG 3.33Å; K431-L435 PolarHBondContact O-N 3.14Å; K432-L435 PolarHBondContact O-N 3Å; L435-A438 WeakPolarHBondContact O-CB 3.27Å; L435-A438 PolarHBondContact O-N 3.18Å; L435-L439 WeakPolarHBondContact O-CG 3.16Å; L435-L439 PolarHBondContact O-N 3.41Å; L435-L448 HydrophobicContact CD2-CD2 4.08Å; L435-A451 HydrophobicContact CD1-CB 4.16Å; L435-A451 HydrophobicContact CD2-CB 4.18Å; L435-A452 HydrophobicContact CB-CB 4.15Å; L435-A452 HydrophobicContact CD1-CB 4.46Å; L435-L455 HydrophobicContact CD1-CD1 3.6Å
436	R	92	Very high	91.5	Very high	134 Å²	134	75 Å²	75	51%	0.506	37%	0.365	S	S	.	.	H	α-helix	trans	-63.4	-42.4	173	-71.9	174.9	-171	-163.7	3	111.5	K432 L439 E440 E456	K432-R436 WeakPolarHBondContact O-CB 3.37Å; K432-R436 VanDerWaalsContact O-CG 3.25Å; K432-R436 WeakPolarHBondContact O-CG 3.32Å; K432-R436 PolarHBondContact O-N 2.69Å; R436-L439 PolarHBondContact O-N 3.35Å; R436-E440 PolarHBondContact O-N 3.25Å; R436-E440 VanDerWaalsContact O-N 3.11Å; R436-E456 IonicContact CZ-OE1 3.98Å; R436-E456 IonicContact NE-OE1 2.6Å; R436-E456 PolarHBondContact NE-OE1 3.33Å; R436-E456 IonicContact NH2-OE1 3.77Å; R436-E456 PolarHBondContact NH2-OE1 2.66Å; R436-E456 IonicContact NH2-OE2 2.7Å
437	K	91.7	Very high	91.7	Very high	123 Å²	123	76.3 Å²	76.3	54%	0.535	35%	0.352	S	S	.	.	H	α-helix	trans	-62.1	-42.4	170.5	-73.3	-179.4	176.3	-169.8	0	112	W418 R433 V434 L439 E440 Y441	W418-K437 HydrophobicContact CH2-CB 3.84Å; W418-K437 HydrophobicContact CZ3-CB 3.92Å; R433-K437 WeakPolarHBondContact O-CG 3.37Å; R433-K437 PolarHBondContact O-N 2.73Å; R433-K437 VanDerWaalsContact O-N 3.08Å; V434-K437 PolarHBondContact O-N 3.4Å; K437-L439 VanDerWaalsContact C-N 3.3Å; K437-L439 PolarHBondContact O-N 2.93Å; K437-E440 VanDerWaalsContact O-CB 3.3Å; K437-E440 WeakPolarHBondContact O-CB 3.14Å; K437-E440 PolarHBondContact O-N 2.89Å; K437-E440 VanDerWaalsContact O-N 3.17Å; K437-Y441 VanDerWaalsContact O-CD2 3.26Å; K437-Y441 WeakPolarHBondContact O-CD2 3.46Å; K437-Y441 PolarHBondContact O-N 3.48Å
438	A	93.3	Very high	91.9	Very high	0 Å²	0	71 Å²	71	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-60	-40	177.2	0	0	0	0	0	112.5	W418 V434 L435 Y441 I442 L448	W418-A438 HydrophobicContact CB-CB 3.56Å; W418-A438 HydrophobicContact CD2-CB 3.43Å; W418-A438 VanDerWaalsContact CD2-CB 3.43Å; W418-A438 HydrophobicContact CE3-CB 3.64Å; W418-A438 HydrophobicContact CG-CB 3.41Å; W418-A438 VanDerWaalsContact CG-CB 3.41Å; W418-A438 HydrophobicContact CZ3-CB 4.43Å; V434-A438 WeakPolarHBondContact O-CB 2.94Å; V434-A438 PolarHBondContact O-N 3.33Å; L435-A438 WeakPolarHBondContact O-CB 3.27Å; L435-A438 PolarHBondContact O-N 3.18Å; A438-Y441 PolarHBondContact O-N 3.01Å; A438-I442 PolarHBondContact O-N 3.39Å; A438-L448 HydrophobicContact CB-CD1 3.59Å; A438-L448 HydrophobicContact CB-CD2 4.13Å; A438-L448 HydrophobicContact CB-CG 4.48Å
439	L	92.8	Very high	92.1	Very high	14 Å²	14	68 Å²	68	7%	0.073	31%	0.306	C	S	.	.	H	α-helix	trans	-70.5	-27.5	176.4	-72.5	171.1	0	0	0	113.5	L435 R436 K437 I442 P443 L448 W449 A452	L435-L439 WeakPolarHBondContact O-CG 3.16Å; L435-L439 PolarHBondContact O-N 3.41Å; R436-L439 PolarHBondContact O-N 3.35Å; K437-L439 VanDerWaalsContact C-N 3.3Å; K437-L439 PolarHBondContact O-N 2.93Å; L439-I442 CarbonylContact O-C 3.55Å; L439-P443 WeakPolarHBondContact O-CA 3.33Å; L439-L448 HydrophobicContact CD2-CB 3.53Å; L439-L448 HydrophobicContact CD2-CD1 4.37Å; L439-L448 HydrophobicContact CG-CB 4.11Å; L439-W449 HydrophobicContact CD1-CD2 4.08Å; L439-W449 HydrophobicContact CD1-CE3 3.7Å; L439-W449 HydrophobicContact CD1-CH2 4.22Å; L439-W449 HydrophobicContact CD1-CZ3 3.8Å; L439-W449 HydrophobicContact CD2-CD2 3.62Å; L439-W449 HydrophobicContact CD2-CE3 4.13Å; L439-W449 HydrophobicContact CD2-CG 3.88Å; L439-W449 HydrophobicContact CD2-CZ2 4.04Å; L439-W449 HydrophobicContact CG-CD2 4.5Å; L439-A452 HydrophobicContact CD1-CB 3.89Å
440	E	91.9	Very high	92.1	Very high	155 Å²	155	65.2 Å²	65.2	72%	0.724	29%	0.294	S	S	*	.	H	α-helix	trans	-64.3	-41.4	171.5	-168.7	-179.5	175.9	0	0	111.3	R436 K437	R436-E440 PolarHBondContact O-N 3.25Å; R436-E440 VanDerWaalsContact O-N 3.11Å; K437-E440 VanDerWaalsContact O-CB 3.3Å; K437-E440 WeakPolarHBondContact O-CB 3.14Å; K437-E440 PolarHBondContact O-N 2.89Å; K437-E440 VanDerWaalsContact O-N 3.17Å
441	Y	91.2	Very high	92.1	Very high	119 Å²	119	64.8 Å²	64.8	47%	0.467	29%	0.294	S	S	.	.	H	α-helix	trans	-80.8	-28.2	175	-70.4	-77.5	0	0	0	114.3	P412 W418 K437 A438	P412-Y441 HydrophobicContact CB-CD1 3.92Å; P412-Y441 HydrophobicContact CB-CE1 4.1Å; P412-Y441 HydrophobicContact CB-CG 4.39Å; W418-Y441 HydrophobicContact CH2-CD2 4.14Å; W418-Y441 HydrophobicContact CH2-CE2 4.18Å; W418-Y441 AromaticContact CZ2-CD2 3.43Å; W418-Y441 HydrophobicContact CZ2-CD2 3.43Å; W418-Y441 VanDerWaalsContact CZ2-CD2 3.43Å; W418-Y441 AromaticContact CZ2-CE2 3.78Å; W418-Y441 HydrophobicContact CZ2-CE2 3.78Å; W418-Y441 HydrophobicContact CZ2-CG 4.35Å; K437-Y441 VanDerWaalsContact O-CD2 3.26Å; K437-Y441 WeakPolarHBondContact O-CD2 3.46Å; K437-Y441 PolarHBondContact O-N 3.48Å; A438-Y441 PolarHBondContact O-N 3.01Å
442	I	90.7	Very high	92.1	Very high	12 Å²	12	62.1 Å²	62.1	6%	0.062	28%	0.283	C	S	.	.			trans	-140.8	71.1	-170.7	-40.7	173.7	0	0	0	112	H413 V415 A438 L439 N444 S445 L448	H413-I442 VanDerWaalsContact C-CD1 3.42Å; H413-I442 VanDerWaalsContact O-CD1 3.29Å; H413-I442 WeakPolarHBondContact O-CD1 3.31Å; V415-I442 HydrophobicContact CG2-CD1 3.73Å; V415-I442 HydrophobicContact CG2-CG2 3.91Å; A438-I442 PolarHBondContact O-N 3.39Å; L439-I442 CarbonylContact O-C 3.55Å; I442-N444 VanDerWaalsContact C-N 3.32Å; I442-N444 WeakPolarHBondContact CG2-OD1 3.4Å; I442-N444 PolarHBondContact O-N 3.14Å; I442-S445 PolarHBondContact O-OG 3.41Å; I442-L448 HydrophobicContact CB-CD1 4.11Å; I442-L448 HydrophobicContact CD1-CD1 4.46Å
443	P	91	Very high	92.1	Very high	60 Å²	60	61.2 Å²	61.2	39%	0.39	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-16.2	-175.4	29.6	-36.6	0	0	0	114.4	L439 S445 W449 C471	L439-P443 WeakPolarHBondContact O-CA 3.33Å; P443-S445 VanDerWaalsContact C-N 3.32Å; P443-S445 PolarHBondContact O-N 2.84Å; P443-W449 PolarHBondContact O-NE1 3.26Å; P443-C471 VanDerWaalsContact O-CB 3.25Å; P443-C471 WeakPolarHBondContact O-CB 3.5Å
444	N	90.7	Very high	92	Very high	120 Å²	120	57.2 Å²	57.2	64%	0.642	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	7.6	-177.1	65.9	-10.5	0	0	0	114.2	I442 C472	I442-N444 VanDerWaalsContact C-N 3.32Å; I442-N444 WeakPolarHBondContact CG2-OD1 3.4Å; I442-N444 PolarHBondContact O-N 3.14Å; N444-C472 VanDerWaalsContact C-SG 3.51Å; N444-C472 PolarHBondContact O-SG 2.9Å
445	S	90.6	Very high	91.9	Very high	13 Å²	13	58.1 Å²	58.1	9%	0.091	29%	0.287	C	S	.	.			trans	-103.1	102	-169.7	65.4	0	0	0	0	113.2	I442 P443 R447 L448 W449	I442-S445 PolarHBondContact O-OG 3.41Å; P443-S445 VanDerWaalsContact C-N 3.32Å; P443-S445 PolarHBondContact O-N 2.84Å; S445-R447 PolarHBondContact O-N 3.06Å; S445-L448 PolarHBondContact O-N 3Å; S445-L448 WeakPolarHBondContact OG-CB 3.22Å; S445-L448 VanDerWaalsContact OG-CD1 3.23Å; S445-L448 WeakPolarHBondContact OG-CD1 3.25Å; S445-L448 VanDerWaalsContact OG-CG 3.23Å; S445-L448 WeakPolarHBondContact OG-CG 3.29Å; S445-W449 PolarHBondContact O-N 2.98Å
446	V	91.6	Very high	91.7	Very high	43 Å²	43	59 Å²	59	26%	0.261	29%	0.292	S	S	.	.	H	α-helix	trans	-51.3	-34.1	177.8	-178.4	0	0	0	0	112.6	W449 K450 C472 L478	V446-W449 PolarHBondContact O-N 3.46Å; V446-K450 HydrophobicContact CG1-CD 4.17Å; V446-K450 HydrophobicContact CG1-CG 4.33Å; V446-K450 WeakPolarHBondContact O-CB 3.4Å; V446-K450 WeakPolarHBondContact O-CG 3.33Å; V446-K450 PolarHBondContact O-N 3.12Å; V446-C472 HydrophobicContact CG2-CB 3.94Å; V446-L478 HydrophobicContact CG1-CD1 4.37Å; V446-L478 HydrophobicContact CG1-CG 4.38Å
447	R	92	Very high	91.6	Very high	145 Å²	145	59 Å²	59	55%	0.547	30%	0.297	S	S	.	.	H	α-helix	trans	-66.2	-42.2	179.3	-173.7	174.4	177.6	170.4	-1.9	112.8	V415 M419 S445 A451	V415-R447 HydrophobicContact CG1-CB 4.49Å; M419-R447 HydrophobicContact CG-CG 4.38Å; M419-R447 HydrophobicContact SD-CG 4.08Å; S445-R447 PolarHBondContact O-N 3.06Å; R447-A451 WeakPolarHBondContact O-CB 3.45Å; R447-A451 PolarHBondContact O-N 3.37Å
448	L	93.3	Very high	91.5	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-68.9	-41.9	176.3	-66.9	-174.9	0	0	0	110.8	V415 W418 M419 L435 A438 L439 I442 S445 A451 A452	V415-L448 HydrophobicContact CG1-CD2 4.08Å; V415-L448 HydrophobicContact CG1-CG 4.06Å; W418-L448 HydrophobicContact CB-CD2 4.22Å; M419-L448 HydrophobicContact CG-CD2 4.03Å; M419-L448 HydrophobicContact SD-CD2 3.84Å; L435-L448 HydrophobicContact CD2-CD2 4.08Å; A438-L448 HydrophobicContact CB-CD1 3.59Å; A438-L448 HydrophobicContact CB-CD2 4.13Å; A438-L448 HydrophobicContact CB-CG 4.48Å; L439-L448 HydrophobicContact CD2-CB 3.53Å; L439-L448 HydrophobicContact CD2-CD1 4.37Å; L439-L448 HydrophobicContact CG-CB 4.11Å; I442-L448 HydrophobicContact CB-CD1 4.11Å; I442-L448 HydrophobicContact CD1-CD1 4.46Å; S445-L448 PolarHBondContact O-N 3Å; S445-L448 WeakPolarHBondContact OG-CB 3.22Å; S445-L448 VanDerWaalsContact OG-CD1 3.23Å; S445-L448 WeakPolarHBondContact OG-CD1 3.25Å; S445-L448 VanDerWaalsContact OG-CG 3.23Å; S445-L448 WeakPolarHBondContact OG-CG 3.29Å; L448-A451 PolarHBondContact O-N 2.91Å; L448-A452 WeakPolarHBondContact O-CB 3.48Å; L448-A452 PolarHBondContact O-N 2.87Å
449	W	94.7	Very high	91.3	Very high	12 Å²	12	61.2 Å²	61.2	5%	0.045	32%	0.319	C	S	.	.	H	α-helix	trans	-59	-49.9	175.8	-73.9	114.1	0	0	0	112	L439 P443 S445 V446 A451 A452 V453 L464 R467 A468 C471 L478	L439-W449 HydrophobicContact CD1-CD2 4.08Å; L439-W449 HydrophobicContact CD1-CE3 3.7Å; L439-W449 HydrophobicContact CD1-CH2 4.22Å; L439-W449 HydrophobicContact CD1-CZ3 3.8Å; L439-W449 HydrophobicContact CD2-CD2 3.62Å; L439-W449 HydrophobicContact CD2-CE3 4.13Å; L439-W449 HydrophobicContact CD2-CG 3.88Å; L439-W449 HydrophobicContact CD2-CZ2 4.04Å; L439-W449 HydrophobicContact CG-CD2 4.5Å; P443-W449 PolarHBondContact O-NE1 3.26Å; S445-W449 PolarHBondContact O-N 2.98Å; V446-W449 PolarHBondContact O-N 3.46Å; W449-A451 VanDerWaalsContact C-N 3.32Å; W449-A451 PolarHBondContact O-N 3.22Å; W449-A452 PolarHBondContact O-N 3.01Å; W449-V453 WeakPolarHBondContact O-CB 2.99Å; W449-V453 WeakPolarHBondContact O-CG2 3.44Å; W449-V453 PolarHBondContact O-N 3.01Å; W449-L464 HydrophobicContact CE3-CD1 4.34Å; W449-L464 HydrophobicContact CE3-CG 4.07Å; W449-L464 HydrophobicContact CZ3-CD1 3.67Å; W449-L464 HydrophobicContact CZ3-CG 3.83Å; W449-R467 HydrophobicContact CH2-CB 4.13Å; W449-R467 HydrophobicContact CH2-CG 3.72Å; W449-R467 HydrophobicContact CZ2-CG 4.36Å; W449-R467 HydrophobicContact CZ3-CB 4.43Å; W449-R467 HydrophobicContact CZ3-CG 4.48Å; W449-A468 HydrophobicContact CB-CB 3.94Å; W449-A468 HydrophobicContact CD2-CB 3.39Å; W449-A468 HydrophobicContact CE3-CB 3.41Å; W449-A468 VanDerWaalsContact CE3-CB 3.41Å; W449-A468 HydrophobicContact CG-CB 3.63Å; W449-A468 HydrophobicContact CZ3-CB 4.07Å; W449-C471 HydrophobicContact CZ2-CB 4.15Å; W449-L478 HydrophobicContact CB-CD1 4.13Å; W449-L478 HydrophobicContact CB-CD2 4.46Å
450	K	92.3	Very high	91.2	Very high	89 Å²	89	64.4 Å²	64.4	39%	0.387	34%	0.336	S	S	.	.	H	α-helix	trans	-57.4	-43.9	175.1	-74.8	-178.7	177.9	-177.5	0	112.2	V446 A452 A454 D477 L478	V446-K450 HydrophobicContact CG1-CD 4.17Å; V446-K450 HydrophobicContact CG1-CG 4.33Å; V446-K450 WeakPolarHBondContact O-CB 3.4Å; V446-K450 WeakPolarHBondContact O-CG 3.33Å; V446-K450 PolarHBondContact O-N 3.12Å; K450-A452 VanDerWaalsContact C-N 3.35Å; K450-A452 PolarHBondContact O-N 3.3Å; K450-A454 VanDerWaalsContact O-CB 3.32Å; K450-A454 WeakPolarHBondContact O-CB 3.31Å; K450-A454 PolarHBondContact O-N 3.04Å; K450-A454 VanDerWaalsContact O-N 3.08Å; K450-D477 WeakPolarHBondContact CE-OD2 3.24Å; K450-D477 IonicContact NZ-OD2 2.75Å; K450-D477 PolarHBondContact NZ-OD2 2.67Å; K450-L478 HydrophobicContact CG-CD2 3.87Å
451	A	91.6	Very high	91.1	Very high	23 Å²	23	57.2 Å²	57.2	19%	0.19	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-34.3	179.3	0	0	0	0	0	113	M419 L435 R447 L448 W449	M419-A451 HydrophobicContact CE-CB 3.96Å; M419-A451 HydrophobicContact SD-CB 3.8Å; L435-A451 HydrophobicContact CD1-CB 4.16Å; L435-A451 HydrophobicContact CD2-CB 4.18Å; R447-A451 WeakPolarHBondContact O-CB 3.45Å; R447-A451 PolarHBondContact O-N 3.37Å; L448-A451 PolarHBondContact O-N 2.91Å; W449-A451 VanDerWaalsContact C-N 3.32Å; W449-A451 PolarHBondContact O-N 3.22Å
452	A	92.6	Very high	91.1	Very high	3 Å²	3	55.7 Å²	55.7	3%	0.025	30%	0.297	C	S	.	.	H	α-helix	trans	-74.9	-48.4	177.1	0	0	0	0	0	111.5	L435 L439 L448 W449 K450 A454 L455 L464	L435-A452 HydrophobicContact CB-CB 4.15Å; L435-A452 HydrophobicContact CD1-CB 4.46Å; L439-A452 HydrophobicContact CD1-CB 3.89Å; L448-A452 WeakPolarHBondContact O-CB 3.48Å; L448-A452 PolarHBondContact O-N 2.87Å; W449-A452 PolarHBondContact O-N 3.01Å; K450-A452 VanDerWaalsContact C-N 3.35Å; K450-A452 PolarHBondContact O-N 3.3Å; A452-A454 VanDerWaalsContact C-N 3.27Å; A452-A454 PolarHBondContact O-N 3.35Å; A452-L455 PolarHBondContact O-N 3.48Å; A452-L464 HydrophobicContact CB-CD2 3.72Å
453	V	91.4	Very high	91.1	Very high	23 Å²	23	60 Å²	60	14%	0.139	32%	0.319	C	S	.	.	H	α-helix	trans	-57.1	-39.3	177.7	169.9	0	0	0	0	111.6	W449 L455 E456 A461 L464 L465	W449-V453 WeakPolarHBondContact O-CB 2.99Å; W449-V453 WeakPolarHBondContact O-CG2 3.44Å; W449-V453 PolarHBondContact O-N 3.01Å; V453-L455 PolarHBondContact O-N 3.21Å; V453-E456 PolarHBondContact O-N 3.13Å; V453-A461 HydrophobicContact CG1-CB 4.26Å; V453-L464 HydrophobicContact CG2-CB 4.34Å; V453-L464 HydrophobicContact CG2-CD2 3.82Å; V453-L464 HydrophobicContact CG2-CG 4.18Å; V453-L465 HydrophobicContact CB-CG 4.47Å; V453-L465 HydrophobicContact CG1-CD1 3.84Å; V453-L465 HydrophobicContact CG1-CD2 4.08Å; V453-L465 HydrophobicContact CG1-CG 3.82Å; V453-L465 HydrophobicContact CG2-CD2 3.85Å; V453-L465 HydrophobicContact CG2-CG 3.73Å
454	A	91	Very high	91.1	Very high	85 Å²	85	58.6 Å²	58.6	70%	0.702	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-6	178.6	0	0	0	0	0	115.2	K450 A452	K450-A454 VanDerWaalsContact O-CB 3.32Å; K450-A454 WeakPolarHBondContact O-CB 3.31Å; K450-A454 PolarHBondContact O-N 3.04Å; K450-A454 VanDerWaalsContact O-N 3.08Å; A452-A454 VanDerWaalsContact C-N 3.27Å; A452-A454 PolarHBondContact O-N 3.35Å
455	L	90.1	Very high	91.1	Very high	46 Å²	46	53 Å²	53	24%	0.241	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-15.4	176.4	-59.5	172.5	0	0	0	113.1	K431 K432 L435 A452 V453	K431-L455 HydrophobicContact CB-CD1 4.14Å; K431-L455 HydrophobicContact CD-CD1 3.72Å; K431-L455 HydrophobicContact CD-CD2 4.07Å; K431-L455 HydrophobicContact CG-CD1 3.6Å; K432-L455 WeakPolarHBondContact CE-O 3.38Å; K432-L455 HydrophobicContact CG-CB 4.04Å; K432-L455 HydrophobicContact CG-CD1 4.25Å; K432-L455 PolarHBondContact NZ-O 2.82Å; L435-L455 HydrophobicContact CD1-CD1 3.6Å; A452-L455 PolarHBondContact O-N 3.48Å; V453-L455 PolarHBondContact O-N 3.21Å
456	E	88.2	Confident	91.2	Very high	21 Å²	21	54.6 Å²	54.6	10%	0.098	29%	0.289	C	S	.	.	S	Bend	trans	-90.3	150.9	-174.8	-57.1	-63	-177.7	0	0	111.9	K432 R436 V453 D460 A461 L464	K432-E456 WeakPolarHBondContact CD-OE2 3.34Å; K432-E456 WeakPolarHBondContact CE-OE2 3.25Å; K432-E456 IonicContact NZ-OE2 3.31Å; K432-E456 PolarHBondContact NZ-OE2 2.94Å; R436-E456 IonicContact CZ-OE1 3.98Å; R436-E456 IonicContact NE-OE1 2.6Å; R436-E456 PolarHBondContact NE-OE1 3.33Å; R436-E456 IonicContact NH2-OE1 3.77Å; R436-E456 PolarHBondContact NH2-OE1 2.66Å; R436-E456 IonicContact NH2-OE2 2.7Å; V453-E456 PolarHBondContact O-N 3.13Å; E456-D460 HydrophobicContact CB-CB 3.92Å; E456-D460 HydrophobicContact CG-CB 4.46Å; E456-A461 HydrophobicContact CB-CB 4.09Å; E456-L464 HydrophobicContact CG-CD2 3.99Å
457	E	90.6	Very high	91.2	Very high	132 Å²	132	59 Å²	59	62%	0.617	30%	0.301	S	S	*	.			trans	-66.9	156.8	171.9	-65.5	-58.1	153.6	0	0	110.3	D459 D460 A461	E457-D459 VanDerWaalsContact C-N 3.27Å; E457-D459 PolarHBondContact O-N 3.13Å; E457-D460 PolarHBondContact O-N 2.84Å; E457-D460 VanDerWaalsContact O-N 3.09Å; E457-A461 WeakPolarHBondContact O-CB 3.46Å; E457-A461 PolarHBondContact O-N 2.8Å
458	P	89	Confident	91.2	Very high	73 Å²	73	52.1 Å²	52.1	47%	0.474	28%	0.275	S	S	.	.	H	α-helix	trans	-53.9	-35.1	-169.6	17.9	-32.8	0	0	0	115.4	R462 L485	P458-R462 WeakPolarHBondContact O-CB 3.29Å; P458-R462 PolarHBondContact O-N 3.31Å; P458-L485 HydrophobicContact CB-CD2 3.86Å
459	D	89.5	Confident	91.1	Very high	98 Å²	98	52.5 Å²	52.5	52%	0.524	28%	0.277	S	S	.	.	H	α-helix	trans	-71.2	-48.7	176.3	-80.9	-52.7	0	0	0	113.2	E457 A461 R462 I463	E457-D459 VanDerWaalsContact C-N 3.27Å; E457-D459 PolarHBondContact O-N 3.13Å; D459-A461 VanDerWaalsContact C-N 3.31Å; D459-A461 PolarHBondContact O-N 2.99Å; D459-R462 WeakPolarHBondContact O-CB 3.26Å; D459-R462 PolarHBondContact O-N 2.6Å; D459-R462 IonicContact OD1-CZ 3.94Å; D459-R462 IonicContact OD1-NE 3.93Å; D459-R462 IonicContact OD1-NH2 2.72Å; D459-R462 PolarHBondContact OD1-NH2 2.6Å; D459-I463 WeakPolarHBondContact O-CG1 3.2Å; D459-I463 PolarHBondContact O-N 2.79Å; D459-I463 VanDerWaalsContact O-N 3.17Å
460	D	90.8	Very high	90.9	Very high	81 Å²	81	58 Å²	58	43%	0.433	30%	0.303	S	S	.	.	H	α-helix	trans	-64.5	-38.6	175.5	-79.2	-21.7	0	0	0	110.9	E456 E457 R462 I463 L464	E456-D460 HydrophobicContact CB-CB 3.92Å; E456-D460 HydrophobicContact CG-CB 4.46Å; E457-D460 PolarHBondContact O-N 2.84Å; E457-D460 VanDerWaalsContact O-N 3.09Å; D460-R462 PolarHBondContact O-N 2.95Å; D460-I463 PolarHBondContact O-N 3.39Å; D460-L464 VanDerWaalsContact O-CB 3.31Å; D460-L464 WeakPolarHBondContact O-CB 3.44Å; D460-L464 PolarHBondContact O-N 3.31Å
461	A	90.5	Very high	90.9	Very high	4 Å²	4	55.4 Å²	55.4	3%	0.033	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-40.3	176	0	0	0	0	0	111.8	V453 E456 E457 D459 L464 L465 L485	V453-A461 HydrophobicContact CG1-CB 4.26Å; E456-A461 HydrophobicContact CB-CB 4.09Å; E457-A461 WeakPolarHBondContact O-CB 3.46Å; E457-A461 PolarHBondContact O-N 2.8Å; D459-A461 VanDerWaalsContact C-N 3.31Å; D459-A461 PolarHBondContact O-N 2.99Å; A461-L464 PolarHBondContact O-N 3.09Å; A461-L465 WeakPolarHBondContact O-CB 3.45Å; A461-L465 WeakPolarHBondContact O-CD1 3.49Å; A461-L465 VanDerWaalsContact O-CG 3.22Å; A461-L465 WeakPolarHBondContact O-CG 3.37Å; A461-L465 PolarHBondContact O-N 3.06Å; A461-L485 HydrophobicContact CB-CD1 4Å
462	R	90.4	Very high	90.8	Very high	87 Å²	87	54.6 Å²	54.6	33%	0.328	29%	0.289	S	S	.	.	H	α-helix	trans	-62.6	-44.9	173.6	171.1	174.9	57.4	109.4	-4.9	112	P458 D459 D460 L464 L465 S466 L485 E486	P458-R462 WeakPolarHBondContact O-CB 3.29Å; P458-R462 PolarHBondContact O-N 3.31Å; D459-R462 WeakPolarHBondContact O-CB 3.26Å; D459-R462 PolarHBondContact O-N 2.6Å; D459-R462 IonicContact OD1-CZ 3.94Å; D459-R462 IonicContact OD1-NE 3.93Å; D459-R462 IonicContact OD1-NH2 2.72Å; D459-R462 PolarHBondContact OD1-NH2 2.6Å; D460-R462 PolarHBondContact O-N 2.95Å; R462-L464 VanDerWaalsContact C-N 3.35Å; R462-L465 PolarHBondContact O-N 2.98Å; R462-S466 PolarHBondContact O-N 2.77Å; R462-L485 HydrophobicContact CB-CB 4.38Å; R462-E486 HydrophobicContact CG-CG 3.98Å
463	I	90.9	Very high	90.7	Very high	103 Å²	103	56.7 Å²	56.7	53%	0.528	30%	0.302	S	S	.	.	H	α-helix	trans	-65.3	-40	176.4	-63.4	166.7	0	0	0	110.8	D459 D460 S466 R467	D459-I463 WeakPolarHBondContact O-CG1 3.2Å; D459-I463 PolarHBondContact O-N 2.79Å; D459-I463 VanDerWaalsContact O-N 3.17Å; D460-I463 PolarHBondContact O-N 3.39Å; I463-S466 PolarHBondContact O-OG 2.89Å; I463-R467 PolarHBondContact O-N 3.15Å
464	L	90.8	Very high	90.6	Very high	30 Å²	30	61.1 Å²	61.1	16%	0.157	33%	0.33	C	S	.	.	H	α-helix	trans	-69.3	-38.8	177.8	-163.4	71.5	0	0	0	111.4	W449 A452 V453 E456 D460 A461 R462 R467 A468	W449-L464 HydrophobicContact CE3-CD1 4.34Å; W449-L464 HydrophobicContact CE3-CG 4.07Å; W449-L464 HydrophobicContact CZ3-CD1 3.67Å; W449-L464 HydrophobicContact CZ3-CG 3.83Å; A452-L464 HydrophobicContact CB-CD2 3.72Å; V453-L464 HydrophobicContact CG2-CB 4.34Å; V453-L464 HydrophobicContact CG2-CD2 3.82Å; V453-L464 HydrophobicContact CG2-CG 4.18Å; E456-L464 HydrophobicContact CG-CD2 3.99Å; D460-L464 VanDerWaalsContact O-CB 3.31Å; D460-L464 WeakPolarHBondContact O-CB 3.44Å; D460-L464 PolarHBondContact O-N 3.31Å; A461-L464 PolarHBondContact O-N 3.09Å; R462-L464 VanDerWaalsContact C-N 3.35Å; L464-R467 PolarHBondContact O-N 3.26Å; L464-A468 WeakPolarHBondContact O-CB 3.11Å; L464-A468 PolarHBondContact O-N 3.21Å
465	L	92.1	Very high	90.6	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-67.7	-38.2	177	-82.1	164.2	0	0	0	113	V453 A461 R462 R467 A468 V469 L478 A481 L482 L485	V453-L465 HydrophobicContact CB-CG 4.47Å; V453-L465 HydrophobicContact CG1-CD1 3.84Å; V453-L465 HydrophobicContact CG1-CD2 4.08Å; V453-L465 HydrophobicContact CG1-CG 3.82Å; V453-L465 HydrophobicContact CG2-CD2 3.85Å; V453-L465 HydrophobicContact CG2-CG 3.73Å; A461-L465 WeakPolarHBondContact O-CB 3.45Å; A461-L465 WeakPolarHBondContact O-CD1 3.49Å; A461-L465 VanDerWaalsContact O-CG 3.22Å; A461-L465 WeakPolarHBondContact O-CG 3.37Å; A461-L465 PolarHBondContact O-N 3.06Å; R462-L465 PolarHBondContact O-N 2.98Å; L465-R467 VanDerWaalsContact C-N 3.29Å; L465-R467 PolarHBondContact O-N 3.33Å; L465-A468 WeakPolarHBondContact O-CA 3.41Å; L465-A468 WeakPolarHBondContact O-CB 3.11Å; L465-A468 PolarHBondContact O-N 3.47Å; L465-V469 PolarHBondContact O-N 3.07Å; L465-L478 HydrophobicContact CD2-CB 4.24Å; L465-L478 HydrophobicContact CD2-CD2 3.92Å; L465-A481 HydrophobicContact CD1-CB 3.92Å; L465-A481 HydrophobicContact CD2-CB 4.08Å; L465-L482 HydrophobicContact CB-CB 4.04Å; L465-L482 HydrophobicContact CB-CD1 4.19Å; L465-L482 HydrophobicContact CB-CG 3.9Å; L465-L482 HydrophobicContact CD1-CB 4.43Å; L465-L485 HydrophobicContact CD1-CD1 3.67Å
466	S	91.6	Very high	90.6	Very high	47 Å²	47	56.8 Å²	56.8	33%	0.329	30%	0.297	S	S	.	.	H	α-helix	trans	-61.2	-41.3	176	68.3	0	0	0	0	111.1	R462 I463 V469 E470	R462-S466 PolarHBondContact O-N 2.77Å; I463-S466 PolarHBondContact O-OG 2.89Å; S466-V469 VanDerWaalsContact O-CG2 3.27Å; S466-V469 WeakPolarHBondContact O-CG2 3.36Å; S466-E470 WeakPolarHBondContact O-CG 3.46Å; S466-E470 PolarHBondContact O-N 2.82Å
467	R	91.4	Very high	90.7	Very high	137 Å²	137	60.1 Å²	60.1	52%	0.517	32%	0.315	S	S	.	.	H	α-helix	trans	-67.3	-37.6	170.6	-170.7	56.9	178.6	159	3	112.7	W449 I463 L464 L465 E470 C471	W449-R467 HydrophobicContact CH2-CB 4.13Å; W449-R467 HydrophobicContact CH2-CG 3.72Å; W449-R467 HydrophobicContact CZ2-CG 4.36Å; W449-R467 HydrophobicContact CZ3-CB 4.43Å; W449-R467 HydrophobicContact CZ3-CG 4.48Å; I463-R467 PolarHBondContact O-N 3.15Å; L464-R467 PolarHBondContact O-N 3.26Å; L465-R467 VanDerWaalsContact C-N 3.29Å; L465-R467 PolarHBondContact O-N 3.33Å; R467-E470 WeakPolarHBondContact CD-OE2 3.44Å; R467-E470 IonicContact CZ-OE2 3.04Å; R467-E470 IonicContact NH1-OE2 3.16Å; R467-E470 PolarHBondContact NH1-OE2 3.09Å; R467-E470 PolarHBondContact O-N 3.27Å; R467-C471 PolarHBondContact O-N 2.87Å; R467-C471 VanDerWaalsContact O-N 3.08Å; R467-C471 PolarHBondContact O-SG 3.24Å
468	A	92.9	Very high	90.8	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.1	-40.4	-179.8	0	0	0	0	0	113	W449 L464 L465 C471 C472 L478	W449-A468 HydrophobicContact CB-CB 3.94Å; W449-A468 HydrophobicContact CD2-CB 3.39Å; W449-A468 HydrophobicContact CE3-CB 3.41Å; W449-A468 VanDerWaalsContact CE3-CB 3.41Å; W449-A468 HydrophobicContact CG-CB 3.63Å; W449-A468 HydrophobicContact CZ3-CB 4.07Å; L464-A468 WeakPolarHBondContact O-CB 3.11Å; L464-A468 PolarHBondContact O-N 3.21Å; L465-A468 WeakPolarHBondContact O-CA 3.41Å; L465-A468 WeakPolarHBondContact O-CB 3.11Å; L465-A468 PolarHBondContact O-N 3.47Å; A468-C471 PolarHBondContact O-N 3.49Å; A468-C472 WeakPolarHBondContact O-CB 3.27Å; A468-C472 PolarHBondContact O-N 2.97Å; A468-L478 HydrophobicContact CB-CD1 3.82Å
469	V	91.4	Very high	91.1	Very high	8 Å²	8	51.1 Å²	51.1	5%	0.048	27%	0.267	C	S	.	.	H	α-helix	trans	-73.4	-27	177.5	-62	0	0	0	0	113	L465 S466 C472 P473 L478 W479 L482	L465-V469 PolarHBondContact O-N 3.07Å; S466-V469 VanDerWaalsContact O-CG2 3.27Å; S466-V469 WeakPolarHBondContact O-CG2 3.36Å; V469-C472 CarbonylContact O-C 3.59Å; V469-P473 VanDerWaalsContact O-CA 3.23Å; V469-P473 WeakPolarHBondContact O-CA 3.23Å; V469-L478 HydrophobicContact CG1-CB 3.71Å; V469-W479 HydrophobicContact CB-CD2 3.92Å; V469-W479 HydrophobicContact CB-CE3 4.01Å; V469-W479 HydrophobicContact CB-CH2 3.82Å; V469-W479 HydrophobicContact CB-CZ2 3.73Å; V469-W479 HydrophobicContact CB-CZ3 3.97Å; V469-W479 HydrophobicContact CG1-CD2 3.78Å; V469-W479 HydrophobicContact CG1-CE3 3.97Å; V469-W479 HydrophobicContact CG1-CG 4.1Å; V469-W479 HydrophobicContact CG1-CZ3 4.4Å; V469-W479 HydrophobicContact CG2-CE3 4.1Å; V469-W479 HydrophobicContact CG2-CH2 3.71Å; V469-W479 HydrophobicContact CG2-CZ2 4.17Å; V469-W479 HydrophobicContact CG2-CZ3 3.69Å; V469-L482 HydrophobicContact CB-CD1 4.41Å; V469-L482 HydrophobicContact CG1-CD1 3.91Å; V469-L482 HydrophobicContact CG2-CD1 3.57Å
470	E	90.3	Very high	91.2	Very high	126 Å²	126	47.6 Å²	47.6	59%	0.589	25%	0.247	S	C	*	.	H	α-helix	trans	-67	-43.1	169.3	-71.4	174.9	173.8	0	0	111.7	S466 R467	S466-E470 WeakPolarHBondContact O-CG 3.46Å; S466-E470 PolarHBondContact O-N 2.82Å; R467-E470 WeakPolarHBondContact CD-OE2 3.44Å; R467-E470 IonicContact CZ-OE2 3.04Å; R467-E470 IonicContact NH1-OE2 3.16Å; R467-E470 PolarHBondContact NH1-OE2 3.09Å; R467-E470 PolarHBondContact O-N 3.27Å
471	C	91.1	Very high	91.1	Very high	35 Å²	35	45.3 Å²	45.3	24%	0.236	24%	0.24	C	C	.	.	H	α-helix	trans	-77.5	-26.9	179	-64.4	0	0	0	0	113.3	P443 W449 R467 A468	P443-C471 VanDerWaalsContact O-CB 3.25Å; P443-C471 WeakPolarHBondContact O-CB 3.5Å; W449-C471 HydrophobicContact CZ2-CB 4.15Å; R467-C471 PolarHBondContact O-N 2.87Å; R467-C471 VanDerWaalsContact O-N 3.08Å; R467-C471 PolarHBondContact O-SG 3.24Å; A468-C471 PolarHBondContact O-N 3.49Å
472	C	89.7	Confident	91.2	Very high	6 Å²	6	45.3 Å²	45.3	4%	0.041	24%	0.239	C	C	.	.			trans	-130.4	63.5	-177.1	-62.9	0	0	0	0	112	N444 V446 A468 V469 T474 S475 L478	N444-C472 VanDerWaalsContact C-SG 3.51Å; N444-C472 PolarHBondContact O-SG 2.9Å; V446-C472 HydrophobicContact CG2-CB 3.94Å; A468-C472 WeakPolarHBondContact O-CB 3.27Å; A468-C472 PolarHBondContact O-N 2.97Å; V469-C472 CarbonylContact O-C 3.59Å; C472-T474 PolarHBondContact O-N 2.64Å; C472-T474 VanDerWaalsContact O-N 3.13Å; C472-S475 PolarHBondContact O-N 2.92Å; C472-S475 PolarHBondContact O-OG 3.35Å; C472-L478 HydrophobicContact CB-CD1 4.04Å
473	P	90.1	Very high	91.3	Very high	48 Å²	48	41.3 Å²	41.3	31%	0.312	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.8	-172	26.7	-36.1	0	0	0	114.1	V469 S475 W479	V469-P473 VanDerWaalsContact O-CA 3.23Å; V469-P473 WeakPolarHBondContact O-CA 3.23Å; P473-S475 VanDerWaalsContact C-N 3.33Å; P473-W479 PolarHBondContact O-NE1 3.28Å
474	T	89.8	Confident	91.2	Very high	116 Å²	116	44.2 Å²	44.2	71%	0.712	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-5.2	-179.8	53.8	0	0	0	0	114.4	C472 I502	C472-T474 PolarHBondContact O-N 2.64Å; C472-T474 VanDerWaalsContact O-N 3.13Å; T474-I502 WeakPolarHBondContact O-CD1 3.27Å
475	S	90.6	Very high	91.1	Very high	12 Å²	12	46 Å²	46	8%	0.084	24%	0.243	C	C	.	.			trans	-97.7	101.9	-172.2	64.3	0	0	0	0	113.2	C472 P473 D477 L478 W479	C472-S475 PolarHBondContact O-N 2.92Å; C472-S475 PolarHBondContact O-OG 3.35Å; P473-S475 VanDerWaalsContact C-N 3.33Å; S475-D477 VanDerWaalsContact C-N 3.31Å; S475-D477 PolarHBondContact O-N 3.45Å; S475-L478 PolarHBondContact O-N 3.47Å; S475-L478 VanDerWaalsContact OG-CD1 3.24Å; S475-L478 WeakPolarHBondContact OG-CD1 3.37Å; S475-L478 WeakPolarHBondContact OG-CG 3.35Å; S475-W479 VanDerWaalsContact O-CD1 3.24Å
476	V	90.9	Very high	90.8	Very high	28 Å²	28	48.1 Å²	48.1	17%	0.17	25%	0.253	C	S	.	.	H	α-helix	trans	-49.1	-49.7	178.4	175	0	0	0	0	111.9	L478 W479 L480 I502 D505 H507 V508	V476-L478 VanDerWaalsContact C-N 3.26Å; V476-L478 PolarHBondContact O-N 3.01Å; V476-L478 VanDerWaalsContact O-N 3.16Å; V476-W479 WeakPolarHBondContact O-CB 3.38Å; V476-W479 PolarHBondContact O-N 3.11Å; V476-L480 HydrophobicContact CG1-CD1 3.67Å; V476-L480 HydrophobicContact CG1-CD2 4.39Å; V476-L480 HydrophobicContact CG1-CG 3.79Å; V476-L480 WeakPolarHBondContact O-CG 3.46Å; V476-L480 PolarHBondContact O-N 3.04Å; V476-I502 HydrophobicContact CB-CD1 4.42Å; V476-I502 HydrophobicContact CG2-CD1 3.68Å; V476-I502 HydrophobicContact CG2-CG2 4Å; V476-D505 VanDerWaalsContact CG1-OD2 3.28Å; V476-D505 WeakPolarHBondContact CG1-OD2 3.3Å; V476-D505 HydrophobicContact CG2-CB 3.89Å; V476-H507 HydrophobicContact CG1-CB 4.35Å; V476-V508 HydrophobicContact CG1-CG2 4.33Å
477	D	91	Very high	90.8	Very high	90 Å²	90	50.3 Å²	50.3	48%	0.481	26%	0.264	S	S	.	.	H	α-helix	trans	-57.8	-35.7	-173.1	-58.2	-51.1	0	0	0	114	K450 S475 A481	K450-D477 WeakPolarHBondContact CE-OD2 3.24Å; K450-D477 IonicContact NZ-OD2 2.75Å; K450-D477 PolarHBondContact NZ-OD2 2.67Å; S475-D477 VanDerWaalsContact C-N 3.31Å; S475-D477 PolarHBondContact O-N 3.45Å; D477-A481 VanDerWaalsContact O-CB 3.3Å; D477-A481 WeakPolarHBondContact O-CB 3.47Å; D477-A481 PolarHBondContact O-N 3.35Å
478	L	92.5	Very high	90.7	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-71.7	-42.1	178.7	-60.7	-173.3	0	0	0	110.5	V446 W449 K450 L465 A468 V469 C472 S475 V476 L480 A481 L482	V446-L478 HydrophobicContact CG1-CD1 4.37Å; V446-L478 HydrophobicContact CG1-CG 4.38Å; W449-L478 HydrophobicContact CB-CD1 4.13Å; W449-L478 HydrophobicContact CB-CD2 4.46Å; K450-L478 HydrophobicContact CG-CD2 3.87Å; L465-L478 HydrophobicContact CD2-CB 4.24Å; L465-L478 HydrophobicContact CD2-CD2 3.92Å; A468-L478 HydrophobicContact CB-CD1 3.82Å; V469-L478 HydrophobicContact CG1-CB 3.71Å; C472-L478 HydrophobicContact CB-CD1 4.04Å; S475-L478 PolarHBondContact O-N 3.47Å; S475-L478 VanDerWaalsContact OG-CD1 3.24Å; S475-L478 WeakPolarHBondContact OG-CD1 3.37Å; S475-L478 WeakPolarHBondContact OG-CG 3.35Å; V476-L478 VanDerWaalsContact C-N 3.26Å; V476-L478 PolarHBondContact O-N 3.01Å; V476-L478 VanDerWaalsContact O-N 3.16Å; L478-L480 PolarHBondContact O-N 3.45Å; L478-A481 PolarHBondContact O-N 3.15Å; L478-L482 VanDerWaalsContact O-CB 3.28Å; L478-L482 WeakPolarHBondContact O-CB 3.47Å; L478-L482 PolarHBondContact O-N 2.79Å
479	W	94.1	Very high	90.6	Very high	13 Å²	13	53 Å²	53	5%	0.049	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-42.8	172.7	-69.9	111.4	0	0	0	112.4	V469 P473 S475 V476 L482 A483 V494 K497 A498 N501	V469-W479 HydrophobicContact CB-CD2 3.92Å; V469-W479 HydrophobicContact CB-CE3 4.01Å; V469-W479 HydrophobicContact CB-CH2 3.82Å; V469-W479 HydrophobicContact CB-CZ2 3.73Å; V469-W479 HydrophobicContact CB-CZ3 3.97Å; V469-W479 HydrophobicContact CG1-CD2 3.78Å; V469-W479 HydrophobicContact CG1-CE3 3.97Å; V469-W479 HydrophobicContact CG1-CG 4.1Å; V469-W479 HydrophobicContact CG1-CZ3 4.4Å; V469-W479 HydrophobicContact CG2-CE3 4.1Å; V469-W479 HydrophobicContact CG2-CH2 3.71Å; V469-W479 HydrophobicContact CG2-CZ2 4.17Å; V469-W479 HydrophobicContact CG2-CZ3 3.69Å; P473-W479 PolarHBondContact O-NE1 3.28Å; S475-W479 VanDerWaalsContact O-CD1 3.24Å; V476-W479 WeakPolarHBondContact O-CB 3.38Å; V476-W479 PolarHBondContact O-N 3.11Å; W479-L482 PolarHBondContact O-N 3.27Å; W479-A483 WeakPolarHBondContact O-CB 3.15Å; W479-A483 PolarHBondContact O-N 2.9Å; W479-V494 HydrophobicContact CE3-CG1 3.81Å; W479-V494 HydrophobicContact CZ3-CG1 4.31Å; W479-K497 HydrophobicContact CH2-CB 3.9Å; W479-K497 HydrophobicContact CZ3-CB 3.84Å; W479-A498 HydrophobicContact CB-CB 3.71Å; W479-A498 HydrophobicContact CD2-CB 3.7Å; W479-A498 HydrophobicContact CE3-CB 3.92Å; W479-A498 HydrophobicContact CG-CB 3.6Å; W479-N501 VanDerWaalsContact CZ2-ND2 3.28Å; W479-N501 WeakPolarHBondContact CZ2-ND2 3.41Å
480	L	91.6	Very high	90.6	Very high	23 Å²	23	55.3 Å²	55.3	12%	0.12	29%	0.293	C	S	.	.	H	α-helix	trans	-70.3	-37	179.1	-59.5	-169.7	0	0	0	112.6	V476 L478 K484 L495 H507 V508 T511	V476-L480 HydrophobicContact CG1-CD1 3.67Å; V476-L480 HydrophobicContact CG1-CD2 4.39Å; V476-L480 HydrophobicContact CG1-CG 3.79Å; V476-L480 WeakPolarHBondContact O-CG 3.46Å; V476-L480 PolarHBondContact O-N 3.04Å; L478-L480 PolarHBondContact O-N 3.45Å; L480-K484 WeakPolarHBondContact O-CG 3.16Å; L480-K484 PolarHBondContact O-N 2.93Å; L480-L495 HydrophobicContact CD2-CD2 4.25Å; L480-H507 HydrophobicContact CD1-CB 3.86Å; L480-V508 HydrophobicContact CD2-CB 4.49Å; L480-V508 HydrophobicContact CD2-CG2 4.23Å; L480-T511 HydrophobicContact CD2-CG2 4.16Å
481	A	90.3	Very high	90.6	Very high	33 Å²	33	49.3 Å²	49.3	27%	0.273	27%	0.265	S	S	.	.	H	α-helix	trans	-65.4	-43.9	174.3	0	0	0	0	0	111.3	L465 D477 L478 K484 L485	L465-A481 HydrophobicContact CD1-CB 3.92Å; L465-A481 HydrophobicContact CD2-CB 4.08Å; D477-A481 VanDerWaalsContact O-CB 3.3Å; D477-A481 WeakPolarHBondContact O-CB 3.47Å; D477-A481 PolarHBondContact O-N 3.35Å; L478-A481 PolarHBondContact O-N 3.15Å; A481-K484 PolarHBondContact O-N 2.98Å; A481-L485 PolarHBondContact O-N 2.85Å
482	L	92.2	Very high	90.7	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-62.3	-47.9	177.6	-159.3	175.8	0	0	0	110.5	L465 V469 L478 W479 K484 L485 E486 V494	L465-L482 HydrophobicContact CB-CB 4.04Å; L465-L482 HydrophobicContact CB-CD1 4.19Å; L465-L482 HydrophobicContact CB-CG 3.9Å; L465-L482 HydrophobicContact CD1-CB 4.43Å; V469-L482 HydrophobicContact CB-CD1 4.41Å; V469-L482 HydrophobicContact CG1-CD1 3.91Å; V469-L482 HydrophobicContact CG2-CD1 3.57Å; L478-L482 VanDerWaalsContact O-CB 3.28Å; L478-L482 WeakPolarHBondContact O-CB 3.47Å; L478-L482 PolarHBondContact O-N 2.79Å; W479-L482 PolarHBondContact O-N 3.27Å; L482-K484 PolarHBondContact O-N 2.81Å; L482-K484 VanDerWaalsContact O-N 3.16Å; L482-L485 PolarHBondContact O-N 3.24Å; L482-E486 HydrophobicContact CD2-CG 3.73Å; L482-E486 PolarHBondContact O-N 3.22Å; L482-E486 VanDerWaalsContact O-N 3.08Å; L482-V494 HydrophobicContact CB-CG1 4.31Å; L482-V494 HydrophobicContact CD2-CB 4.32Å; L482-V494 HydrophobicContact CD2-CG1 3.87Å; L482-V494 HydrophobicContact CD2-CG2 3.55Å; L482-V494 HydrophobicContact CG-CG1 4.48Å
483	A	91.3	Very high	90.8	Very high	3 Å²	3	57.6 Å²	57.6	3%	0.025	29%	0.293	C	S	.	.	H	α-helix	trans	-62.6	-21.1	178.1	0	0	0	0	0	114.5	W479 A491 V494 L495	W479-A483 WeakPolarHBondContact O-CB 3.15Å; W479-A483 PolarHBondContact O-N 2.9Å; A483-A491 VanDerWaalsContact O-CB 3.27Å; A483-A491 WeakPolarHBondContact O-CB 3.19Å; A483-V494 HydrophobicContact CB-CG1 4.01Å; A483-L495 HydrophobicContact CB-CD1 4.1Å; A483-L495 HydrophobicContact CB-CD2 3.7Å; A483-L495 HydrophobicContact CB-CG 3.71Å
484	K	88.5	Confident	91	Very high	164 Å²	164	56 Å²	56	71%	0.713	28%	0.282	S	S	*	.	H	α-helix	trans	-83.6	-26.6	173.8	-75.8	175	179.2	-177.7	0	113.8	L480 A481 L482	L480-K484 WeakPolarHBondContact O-CG 3.16Å; L480-K484 PolarHBondContact O-N 2.93Å; A481-K484 PolarHBondContact O-N 2.98Å; L482-K484 PolarHBondContact O-N 2.81Å; L482-K484 VanDerWaalsContact O-N 3.16Å
485	L	88.8	Confident	91.1	Very high	69 Å²	69	50.6 Å²	50.6	36%	0.361	25%	0.249	S	C	.	.	H	α-helix	trans	-93.9	-14.1	-178.7	-71.1	172.8	0	0	0	113.1	P458 A461 R462 L465 A481 L482	P458-L485 HydrophobicContact CB-CD2 3.86Å; A461-L485 HydrophobicContact CB-CD1 4Å; R462-L485 HydrophobicContact CB-CB 4.38Å; L465-L485 HydrophobicContact CD1-CD1 3.67Å; A481-L485 PolarHBondContact O-N 2.85Å; L482-L485 PolarHBondContact O-N 3.24Å
486	E	87.4	Confident	91.2	Very high	45 Å²	45	53.4 Å²	53.4	21%	0.21	26%	0.263	C	S	.	.	S	Bend	trans	-89.2	157.2	176.8	-84.5	-164.3	170.7	0	0	114.5	R462 L482 N490 A491 V494	R462-E486 HydrophobicContact CG-CG 3.98Å; L482-E486 HydrophobicContact CD2-CG 3.73Å; L482-E486 PolarHBondContact O-N 3.22Å; L482-E486 VanDerWaalsContact O-N 3.08Å; E486-N490 HydrophobicContact CB-CB 4.33Å; E486-N490 WeakPolarHBondContact OE2-CB 3.27Å; E486-A491 HydrophobicContact CB-CB 4.26Å; E486-V494 WeakPolarHBondContact OE2-CG2 3.49Å
487	T	91.1	Very high	91.3	Very high	93 Å²	93	57.8 Å²	57.8	57%	0.571	28%	0.28	S	S	*	.			trans	-61.8	148.1	169.4	58.6	0	0	0	0	110.7	E489 N490 A491	T487-E489 VanDerWaalsContact C-N 3.29Å; T487-E489 PolarHBondContact O-N 3.22Å; T487-N490 PolarHBondContact O-N 3.35Å; T487-N490 PolarHBondContact OG1-ND2 3.02Å; T487-A491 WeakPolarHBondContact O-CB 3.41Å; T487-A491 PolarHBondContact O-N 3.45Å
488	Y	89.5	Confident	91.4	Very high	58 Å²	58	53.5 Å²	53.5	23%	0.227	26%	0.257	C	S	.	.	H	α-helix	trans	-39.2	-49.7	-178.9	172.1	-114.2	0	0	0	115.5	N490 R492 L515 E516 H519 N521	Y488-N490 PolarHBondContact O-N 3.18Å; Y488-R492 HydrophobicContact CD2-CG 4.49Å; Y488-R492 HydrophobicContact CE2-CG 4.23Å; Y488-R492 WeakPolarHBondContact O-CB 3.46Å; Y488-R492 WeakPolarHBondContact O-CG 3.4Å; Y488-R492 PolarHBondContact O-N 3.39Å; Y488-R492 PolarHBondContact OH-NH1 3.06Å; Y488-L515 HydrophobicContact CD2-CD1 4.44Å; Y488-L515 HydrophobicContact CD2-CD2 4.28Å; Y488-L515 HydrophobicContact CD2-CG 4.1Å; Y488-E516 PolarHBondContact OH-OE1 2.88Å; Y488-E516 PolarHBondContact OH-OE2 2.94Å; Y488-E516 VanDerWaalsContact OH-OE2 3.05Å; Y488-H519 HydrophobicContact CD2-CB 4.27Å; Y488-H519 AromaticContact CD2-CD2 3.97Å; Y488-H519 AromaticContact CD2-CE1 3.9Å; Y488-H519 AromaticContact CD2-CG 3.66Å; Y488-H519 AromaticContact CD2-ND1 3.6Å; Y488-H519 HydrophobicContact CE2-CB 4.23Å; Y488-H519 AromaticContact CG-CD2 3.96Å; Y488-N521 PolarHBondContact OH-ND2 2.8Å
489	E	90.5	Very high	91.3	Very high	135 Å²	135	56.5 Å²	56.5	63%	0.631	27%	0.268	S	S	*	.	H	α-helix	trans	-65.1	-37.6	-178.5	-62.6	-173.2	178.2	0	0	113.3	T487 K493	T487-E489 VanDerWaalsContact C-N 3.29Å; T487-E489 PolarHBondContact O-N 3.22Å; E489-K493 WeakPolarHBondContact O-CG 3.48Å; E489-K493 PolarHBondContact O-N 2.92Å
490	N	91.4	Very high	91.1	Very high	56 Å²	56	62.9 Å²	62.9	30%	0.299	30%	0.299	S	S	.	.	H	α-helix	trans	-84	-39.8	-178.9	-62.9	-36.1	0	0	0	110.5	E486 T487 Y488 R492 K493 V494	E486-N490 HydrophobicContact CB-CB 4.33Å; E486-N490 WeakPolarHBondContact OE2-CB 3.27Å; T487-N490 PolarHBondContact O-N 3.35Å; T487-N490 PolarHBondContact OG1-ND2 3.02Å; Y488-N490 PolarHBondContact O-N 3.18Å; N490-R492 PolarHBondContact O-N 3.39Å; N490-K493 CarbonylContact O-C 3.54Å; N490-K493 WeakPolarHBondContact O-CA 3.26Å; N490-K493 WeakPolarHBondContact O-CB 3.38Å; N490-K493 PolarHBondContact O-N 2.65Å; N490-K493 PolarHBondContact OD1-NZ 3.33Å; N490-V494 VanDerWaalsContact O-CG2 3.3Å; N490-V494 WeakPolarHBondContact O-CG2 3.36Å; N490-V494 PolarHBondContact O-N 3.33Å
491	A	91.3	Very high	91.1	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-52.2	-39.9	168.3	0	0	0	0	0	112.2	A483 E486 T487 V494 L495 L515	A483-A491 VanDerWaalsContact O-CB 3.27Å; A483-A491 WeakPolarHBondContact O-CB 3.19Å; E486-A491 HydrophobicContact CB-CB 4.26Å; T487-A491 WeakPolarHBondContact O-CB 3.41Å; T487-A491 PolarHBondContact O-N 3.45Å; A491-V494 PolarHBondContact O-N 2.87Å; A491-L495 WeakPolarHBondContact O-CB 3.44Å; A491-L495 VanDerWaalsContact O-CG 3.24Å; A491-L495 WeakPolarHBondContact O-CG 3.25Å; A491-L495 PolarHBondContact O-N 2.92Å; A491-L515 HydrophobicContact CB-CD1 4.28Å; A491-L515 HydrophobicContact CB-CD2 3.72Å
492	R	91.4	Very high	91.1	Very high	109 Å²	109	64.9 Å²	64.9	41%	0.411	31%	0.305	S	S	.	.	H	α-helix	trans	-64.1	-40.6	171.5	-78.4	178.8	54.7	165.1	-7.6	113.4	Y488 N490 N496 L515 E516	Y488-R492 HydrophobicContact CD2-CG 4.49Å; Y488-R492 HydrophobicContact CE2-CG 4.23Å; Y488-R492 WeakPolarHBondContact O-CB 3.46Å; Y488-R492 WeakPolarHBondContact O-CG 3.4Å; Y488-R492 PolarHBondContact O-N 3.39Å; Y488-R492 PolarHBondContact OH-NH1 3.06Å; N490-R492 PolarHBondContact O-N 3.39Å; R492-N496 PolarHBondContact O-N 3.25Å; R492-N496 PolarHBondContact O-OD1 3.16Å; R492-L515 HydrophobicContact CG-CD2 3.94Å; R492-E516 IonicContact CZ-OE1 3.49Å; R492-E516 IonicContact NE-OE1 2.7Å; R492-E516 IonicContact NH1-OE1 3.44Å; R492-E516 PolarHBondContact NH1-OE1 3.32Å
493	K	92.8	Very high	90.9	Very high	107 Å²	107	67.2 Å²	67.2	47%	0.465	32%	0.32	S	S	.	.	H	α-helix	trans	-65.6	-40.1	174.4	-63.1	164.7	-161.4	161.8	0	111.3	E489 N490 N496 K497	E489-K493 WeakPolarHBondContact O-CG 3.48Å; E489-K493 PolarHBondContact O-N 2.92Å; N490-K493 CarbonylContact O-C 3.54Å; N490-K493 WeakPolarHBondContact O-CA 3.26Å; N490-K493 WeakPolarHBondContact O-CB 3.38Å; N490-K493 PolarHBondContact O-N 2.65Å; N490-K493 PolarHBondContact OD1-NZ 3.33Å; K493-N496 WeakPolarHBondContact O-CB 3.27Å; K493-N496 PolarHBondContact O-N 3.11Å; K493-K497 WeakPolarHBondContact O-CG 3.36Å; K493-K497 PolarHBondContact O-N 3.27Å
494	V	93.3	Very high	90.8	Very high	13 Å²	13	70.8 Å²	70.8	8%	0.079	34%	0.342	C	S	.	.	H	α-helix	trans	-63.1	-47.4	176.5	169.6	0	0	0	0	110.8	W479 L482 A483 E486 N490 A491 N496 K497 A498	W479-V494 HydrophobicContact CE3-CG1 3.81Å; W479-V494 HydrophobicContact CZ3-CG1 4.31Å; L482-V494 HydrophobicContact CB-CG1 4.31Å; L482-V494 HydrophobicContact CD2-CB 4.32Å; L482-V494 HydrophobicContact CD2-CG1 3.87Å; L482-V494 HydrophobicContact CD2-CG2 3.55Å; L482-V494 HydrophobicContact CG-CG1 4.48Å; A483-V494 HydrophobicContact CB-CG1 4.01Å; E486-V494 WeakPolarHBondContact OE2-CG2 3.49Å; N490-V494 VanDerWaalsContact O-CG2 3.3Å; N490-V494 WeakPolarHBondContact O-CG2 3.36Å; N490-V494 PolarHBondContact O-N 3.33Å; A491-V494 PolarHBondContact O-N 2.87Å; V494-N496 VanDerWaalsContact C-N 3.26Å; V494-N496 PolarHBondContact O-N 2.79Å; V494-K497 PolarHBondContact O-N 3.21Å; V494-A498 VanDerWaalsContact O-CB 3.3Å; V494-A498 WeakPolarHBondContact O-CB 3.26Å; V494-A498 PolarHBondContact O-N 2.86Å
495	L	93.1	Very high	90.8	Very high	3 Å²	3	64.2 Å²	64.2	2%	0.016	31%	0.314	C	S	.	.	H	α-helix	trans	-70	-20.6	176.9	-66.2	168.5	0	0	0	112.8	L480 A483 A491 R499 V508 T511 A512 L515	L480-L495 HydrophobicContact CD2-CD2 4.25Å; A483-L495 HydrophobicContact CB-CD1 4.1Å; A483-L495 HydrophobicContact CB-CD2 3.7Å; A483-L495 HydrophobicContact CB-CG 3.71Å; A491-L495 WeakPolarHBondContact O-CB 3.44Å; A491-L495 VanDerWaalsContact O-CG 3.24Å; A491-L495 WeakPolarHBondContact O-CG 3.25Å; A491-L495 PolarHBondContact O-N 2.92Å; L495-R499 VanDerWaalsContact O-CG 3.3Å; L495-R499 WeakPolarHBondContact O-CG 3.41Å; L495-R499 PolarHBondContact O-N 3.01Å; L495-R499 PolarHBondContact O-NE 3.06Å; L495-R499 VanDerWaalsContact O-NE 3.08Å; L495-V508 HydrophobicContact CB-CG1 4.46Å; L495-V508 HydrophobicContact CD2-CG1 3.81Å; L495-T511 HydrophobicContact CD1-CG2 4.34Å; L495-T511 HydrophobicContact CD2-CG2 4.13Å; L495-A512 HydrophobicContact CD1-CB 3.97Å; L495-L515 HydrophobicContact CD1-CD2 3.92Å
496	N	92.2	Very high	90.9	Very high	72 Å²	72	63 Å²	63	39%	0.385	31%	0.305	S	S	.	.	H	α-helix	trans	-70.5	-54.6	166.4	-66.8	-8.1	0	0	0	110.7	R492 K493 V494 A498 R499 E500	R492-N496 PolarHBondContact O-N 3.25Å; R492-N496 PolarHBondContact O-OD1 3.16Å; K493-N496 WeakPolarHBondContact O-CB 3.27Å; K493-N496 PolarHBondContact O-N 3.11Å; V494-N496 VanDerWaalsContact C-N 3.26Å; V494-N496 PolarHBondContact O-N 2.79Å; N496-A498 VanDerWaalsContact C-N 3.26Å; N496-A498 PolarHBondContact O-N 3.08Å; N496-R499 PolarHBondContact O-N 3.44Å; N496-R499 PolarHBondContact OD1-NH2 3.21Å; N496-E500 PolarHBondContact O-N 2.83Å
497	K	92.5	Very high	91.1	Very high	120 Å²	120	64.1 Å²	64.1	52%	0.522	31%	0.31	S	S	.	.	H	α-helix	trans	-56.5	-38.3	176.5	-70.5	179.7	175.9	-173.7	0	112.7	W479 K493 V494 R499 E500 N501	W479-K497 HydrophobicContact CH2-CB 3.9Å; W479-K497 HydrophobicContact CZ3-CB 3.84Å; K493-K497 WeakPolarHBondContact O-CG 3.36Å; K493-K497 PolarHBondContact O-N 3.27Å; V494-K497 PolarHBondContact O-N 3.21Å; K497-R499 VanDerWaalsContact C-N 3.34Å; K497-R499 PolarHBondContact O-N 3.24Å; K497-E500 PolarHBondContact O-N 3.44Å; K497-N501 PolarHBondContact O-N 3.45Å; K497-N501 PolarHBondContact O-ND2 2.68Å
498	A	92.9	Very high	91.1	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.3	-37.1	176	0	0	0	0	0	112.1	W479 V494 N496 I502 V508	W479-A498 HydrophobicContact CB-CB 3.71Å; W479-A498 HydrophobicContact CD2-CB 3.7Å; W479-A498 HydrophobicContact CE3-CB 3.92Å; W479-A498 HydrophobicContact CG-CB 3.6Å; V494-A498 VanDerWaalsContact O-CB 3.3Å; V494-A498 WeakPolarHBondContact O-CB 3.26Å; V494-A498 PolarHBondContact O-N 2.86Å; N496-A498 VanDerWaalsContact C-N 3.26Å; N496-A498 PolarHBondContact O-N 3.08Å; A498-I502 WeakPolarHBondContact O-CA 3.49Å; A498-I502 WeakPolarHBondContact O-CB 3.31Å; A498-I502 PolarHBondContact O-N 3.37Å; A498-V508 HydrophobicContact CB-CG1 3.72Å; A498-V508 HydrophobicContact CB-CG2 4.27Å
499	R	91.2	Very high	91.3	Very high	66 Å²	66	58 Å²	58	25%	0.249	28%	0.276	C	S	.	.	H	α-helix	trans	-74.8	-29.8	174.9	-73.8	-178.7	-68.3	170.1	1.2	113.4	L495 N496 K497 I502 P503 V508 W509	L495-R499 VanDerWaalsContact O-CG 3.3Å; L495-R499 WeakPolarHBondContact O-CG 3.41Å; L495-R499 PolarHBondContact O-N 3.01Å; L495-R499 PolarHBondContact O-NE 3.06Å; L495-R499 VanDerWaalsContact O-NE 3.08Å; N496-R499 PolarHBondContact O-N 3.44Å; N496-R499 PolarHBondContact OD1-NH2 3.21Å; K497-R499 VanDerWaalsContact C-N 3.34Å; K497-R499 PolarHBondContact O-N 3.24Å; R499-I502 CarbonylContact O-C 3.51Å; R499-P503 VanDerWaalsContact O-CA 3.3Å; R499-P503 WeakPolarHBondContact O-CA 3.16Å; R499-P503 WeakPolarHBondContact O-CB 3.12Å; R499-V508 HydrophobicContact CG-CB 4.28Å; R499-V508 HydrophobicContact CG-CG1 3.61Å; R499-W509 VanDerWaalsContact CD-CE2 3.49Å
500	E	90.6	Very high	91.4	Very high	148 Å²	148	51.9 Å²	51.9	69%	0.692	25%	0.248	S	C	*	.	H	α-helix	trans	-67.6	-44.5	172.6	-71.1	165.3	-174.4	0	0	110.9	N496 K497	N496-E500 PolarHBondContact O-N 2.83Å; K497-E500 PolarHBondContact O-N 3.44Å
501	N	90.9	Very high	91.4	Very high	84 Å²	84	50.3 Å²	50.3	45%	0.449	24%	0.24	S	C	.	.	H	α-helix	trans	-77.1	-33.1	177.8	-69.8	-51.2	0	0	0	113.6	W479 K497	W479-N501 VanDerWaalsContact CZ2-ND2 3.28Å; W479-N501 WeakPolarHBondContact CZ2-ND2 3.41Å; K497-N501 PolarHBondContact O-N 3.45Å; K497-N501 PolarHBondContact O-ND2 2.68Å
502	I	89.4	Confident	91.4	Very high	14 Å²	14	50.7 Å²	50.7	7%	0.072	24%	0.243	C	C	.	.			trans	-133	73.2	-174.4	-42.3	176.5	0	0	0	109.8	T474 V476 A498 R499 T504 D505	T474-I502 WeakPolarHBondContact O-CD1 3.27Å; V476-I502 HydrophobicContact CB-CD1 4.42Å; V476-I502 HydrophobicContact CG2-CD1 3.68Å; V476-I502 HydrophobicContact CG2-CG2 4Å; A498-I502 WeakPolarHBondContact O-CA 3.49Å; A498-I502 WeakPolarHBondContact O-CB 3.31Å; A498-I502 PolarHBondContact O-N 3.37Å; R499-I502 CarbonylContact O-C 3.51Å; I502-T504 VanDerWaalsContact C-N 3.26Å; I502-T504 PolarHBondContact O-N 2.91Å; I502-D505 HydrophobicContact CG2-CB 3.79Å
503	P	88.3	Confident	91.4	Very high	52 Å²	52	45.5 Å²	45.5	34%	0.338	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-13	-177.2	31.6	-37.3	0	0	0	113.6	R499 N539	R499-P503 VanDerWaalsContact O-CA 3.3Å; R499-P503 WeakPolarHBondContact O-CA 3.16Å; R499-P503 WeakPolarHBondContact O-CB 3.12Å; P503-N539 PolarHBondContact O-ND2 2.92Å
504	T	89.4	Confident	91.3	Very high	79 Å²	79	42.8 Å²	42.8	49%	0.485	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-11.4	-176.4	50.7	0	0	0	0	114.6	I502 L536 N539 V541	I502-T504 VanDerWaalsContact C-N 3.26Å; I502-T504 PolarHBondContact O-N 2.91Å; T504-L536 VanDerWaalsContact O-CD2 3.28Å; T504-L536 WeakPolarHBondContact O-CD2 3.42Å; T504-N539 HydrophobicContact CG2-CB 4.48Å; T504-V541 HydrophobicContact CG2-CG2 4.24Å
505	D	89.1	Confident	91.2	Very high	25 Å²	25	43.3 Å²	43.3	13%	0.134	21%	0.214	C	C	.	.			trans	-91.4	139.4	-177.7	176.7	47.2	0	0	0	113.1	V476 I502 H507 V508	V476-D505 VanDerWaalsContact CG1-OD2 3.28Å; V476-D505 WeakPolarHBondContact CG1-OD2 3.3Å; V476-D505 HydrophobicContact CG2-CB 3.89Å; I502-D505 HydrophobicContact CG2-CB 3.79Å; D505-H507 VanDerWaalsContact CG-N 3.29Å; D505-H507 IonicContact OD1-CD2 3.07Å; D505-H507 PolarHBondContact OD1-CD2 2.88Å; D505-H507 VanDerWaalsContact OD1-CD2 3.3Å; D505-H507 IonicContact OD1-CG 3.17Å; D505-H507 PolarHBondContact OD1-N 2.98Å; D505-H507 VanDerWaalsContact OD1-N 3.12Å; D505-H507 WeakPolarHBondContact OD2-CA 3.42Å; D505-H507 WeakPolarHBondContact OD2-CB 3.37Å; D505-H507 PolarHBondContact OD2-N 3.34Å; D505-V508 WeakPolarHBondContact OD2-CG2 3.48Å; D505-V508 PolarHBondContact OD2-N 2.76Å
506	R	90.4	Very high	91.1	Very high	45 Å²	45	43.5 Å²	43.5	17%	0.17	22%	0.215	C	C	.	.	S	Bend	trans	-84.3	-30.4	174.5	60.1	-177.5	146.6	58.8	19.6	113.3	V508 W509 L510 L536 W548 D551	R506-V508 VanDerWaalsContact C-N 3.32Å; R506-V508 PolarHBondContact O-N 2.92Å; R506-W509 WeakPolarHBondContact O-CB 3.27Å; R506-W509 PolarHBondContact O-N 3.47Å; R506-L510 WeakPolarHBondContact O-CG 3.49Å; R506-L510 PolarHBondContact O-N 3.11Å; R506-L536 HydrophobicContact CB-CD1 3.69Å; R506-W548 HydrophobicContact CB-CH2 4.37Å; R506-W548 HydrophobicContact CB-CZ2 4.1Å; R506-D551 WeakPolarHBondContact CD-OD2 3.35Å; R506-D551 IonicContact CZ-OD2 2.73Å; R506-D551 IonicContact NE-OD2 2.69Å; R506-D551 IonicContact NH1-OD1 2.72Å; R506-D551 PolarHBondContact NH1-OD1 3.33Å; R506-D551 IonicContact NH1-OD2 2.74Å; R506-D551 PolarHBondContact NH1-OD2 3.39Å
507	H	92	Very high	91	Very high	68 Å²	68	41.1 Å²	41.1	32%	0.315	20%	0.202	S	C	.	.	H	α-helix	trans	-65	-33.8	-174.3	-61.4	-76.5	0	0	0	112.5	V476 L480 D505 W509 L510 T511 D551	V476-H507 HydrophobicContact CG1-CB 4.35Å; L480-H507 HydrophobicContact CD1-CB 3.86Å; D505-H507 VanDerWaalsContact CG-N 3.29Å; D505-H507 IonicContact OD1-CD2 3.07Å; D505-H507 PolarHBondContact OD1-CD2 2.88Å; D505-H507 VanDerWaalsContact OD1-CD2 3.3Å; D505-H507 IonicContact OD1-CG 3.17Å; D505-H507 PolarHBondContact OD1-N 2.98Å; D505-H507 VanDerWaalsContact OD1-N 3.12Å; D505-H507 WeakPolarHBondContact OD2-CA 3.42Å; D505-H507 WeakPolarHBondContact OD2-CB 3.37Å; D505-H507 PolarHBondContact OD2-N 3.34Å; H507-W509 VanDerWaalsContact C-N 3.31Å; H507-W509 PolarHBondContact O-N 2.9Å; H507-L510 PolarHBondContact O-N 3.3Å; H507-T511 WeakPolarHBondContact O-CB 3.33Å; H507-T511 PolarHBondContact O-N 2.89Å; H507-T511 PolarHBondContact O-OG1 3.08Å; H507-D551 IonicContact CE1-OD1 2.74Å; H507-D551 PolarHBondContact CE1-OD1 2.97Å; H507-D551 IonicContact CE1-OD2 3.5Å; H507-D551 IonicContact ND1-OD1 3.53Å
508	V	92.1	Very high	90.9	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-57	-42.5	171.1	-171.6	0	0	0	0	112.3	V476 L480 L495 A498 R499 D505 R506 A512	V476-V508 HydrophobicContact CG1-CG2 4.33Å; L480-V508 HydrophobicContact CD2-CB 4.49Å; L480-V508 HydrophobicContact CD2-CG2 4.23Å; L495-V508 HydrophobicContact CB-CG1 4.46Å; L495-V508 HydrophobicContact CD2-CG1 3.81Å; A498-V508 HydrophobicContact CB-CG1 3.72Å; A498-V508 HydrophobicContact CB-CG2 4.27Å; R499-V508 HydrophobicContact CG-CB 4.28Å; R499-V508 HydrophobicContact CG-CG1 3.61Å; D505-V508 WeakPolarHBondContact OD2-CG2 3.48Å; D505-V508 PolarHBondContact OD2-N 2.76Å; R506-V508 VanDerWaalsContact C-N 3.32Å; R506-V508 PolarHBondContact O-N 2.92Å; V508-A512 PolarHBondContact O-N 3.12Å
509	W	92.7	Very high	90.6	Very high	22 Å²	22	43.5 Å²	43.5	8%	0.083	23%	0.227	C	C	.	.	H	α-helix	trans	-69.8	-39.5	177.2	-70.8	92.7	0	0	0	112.9	R499 R506 H507 A512 A513 I528 R531 A532	R499-W509 VanDerWaalsContact CD-CE2 3.49Å; R506-W509 WeakPolarHBondContact O-CB 3.27Å; R506-W509 PolarHBondContact O-N 3.47Å; H507-W509 VanDerWaalsContact C-N 3.31Å; H507-W509 PolarHBondContact O-N 2.9Å; W509-A512 WeakPolarHBondContact O-CB 3.42Å; W509-A512 PolarHBondContact O-N 3.4Å; W509-A513 PolarHBondContact O-N 3.32Å; W509-I528 HydrophobicContact CE3-CG2 4.1Å; W509-R531 HydrophobicContact CH2-CB 4.06Å; W509-R531 HydrophobicContact CZ3-CB 3.61Å; W509-A532 HydrophobicContact CB-CB 3.43Å; W509-A532 VanDerWaalsContact CB-CB 3.43Å; W509-A532 HydrophobicContact CD2-CB 3.51Å; W509-A532 HydrophobicContact CE3-CB 3.66Å; W509-A532 HydrophobicContact CG-CB 3.42Å; W509-A532 VanDerWaalsContact CG-CB 3.42Å
510	L	92	Very high	90.3	Very high	7 Å²	7	42.9 Å²	42.9	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-69.9	-36.1	178.7	-61.2	-173.3	0	0	0	111.8	R506 H507 A513 K514 W548 D551 I567	R506-L510 WeakPolarHBondContact O-CG 3.49Å; R506-L510 PolarHBondContact O-N 3.11Å; H507-L510 PolarHBondContact O-N 3.3Å; L510-A513 PolarHBondContact O-N 3Å; L510-K514 WeakPolarHBondContact O-CG 3.29Å; L510-K514 PolarHBondContact O-N 2.74Å; L510-W548 HydrophobicContact CD2-CE3 4.33Å; L510-W548 HydrophobicContact CD2-CZ3 3.88Å; L510-D551 HydrophobicContact CD1-CB 3.43Å; L510-D551 VanDerWaalsContact CD1-CB 3.43Å; L510-I567 HydrophobicContact CD1-CD1 4.41Å; L510-I567 HydrophobicContact CD2-CD1 3.78Å; L510-I567 HydrophobicContact CD2-CG1 3.86Å
511	T	91.3	Very high	90.1	Very high	22 Å²	22	38.8 Å²	38.8	14%	0.135	22%	0.224	C	C	.	.	H	α-helix	trans	-65.6	-38.2	170.4	-63.4	0	0	0	0	111.8	L480 L495 H507 A513 K514 L515	L480-T511 HydrophobicContact CD2-CG2 4.16Å; L495-T511 HydrophobicContact CD1-CG2 4.34Å; L495-T511 HydrophobicContact CD2-CG2 4.13Å; H507-T511 WeakPolarHBondContact O-CB 3.33Å; H507-T511 PolarHBondContact O-N 2.89Å; H507-T511 PolarHBondContact O-OG1 3.08Å; T511-A513 VanDerWaalsContact C-N 3.31Å; T511-A513 PolarHBondContact O-N 3.13Å; T511-K514 PolarHBondContact O-N 2.98Å; T511-L515 WeakPolarHBondContact O-CB 3.1Å; T511-L515 PolarHBondContact O-N 2.98Å
512	A	91.6	Very high	89.9	Confident	9 Å²	9	38 Å²	38	7%	0.074	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-39	171.5	0	0	0	0	0	112.3	L495 V508 W509 L515 E516 I528	L495-A512 HydrophobicContact CD1-CB 3.97Å; V508-A512 PolarHBondContact O-N 3.12Å; W509-A512 WeakPolarHBondContact O-CB 3.42Å; W509-A512 PolarHBondContact O-N 3.4Å; A512-L515 PolarHBondContact O-N 3.4Å; A512-E516 WeakPolarHBondContact O-CG 3.25Å; A512-E516 PolarHBondContact O-N 3.06Å; A512-E516 VanDerWaalsContact O-N 3.12Å; A512-I528 HydrophobicContact CB-CG2 4.27Å
513	A	92.1	Very high	89.8	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67	-42.8	176.2	0	0	0	0	0	111.9	W509 L510 T511 L515 E516 E517 V525 I528 V529 T563	W509-A513 PolarHBondContact O-N 3.32Å; L510-A513 PolarHBondContact O-N 3Å; T511-A513 VanDerWaalsContact C-N 3.31Å; T511-A513 PolarHBondContact O-N 3.13Å; A513-L515 VanDerWaalsContact C-N 3.34Å; A513-E516 PolarHBondContact O-N 3.16Å; A513-E517 PolarHBondContact O-N 3.45Å; A513-V525 HydrophobicContact CB-CG1 4.34Å; A513-I528 HydrophobicContact CB-CB 4.47Å; A513-I528 HydrophobicContact CB-CG2 3.97Å; A513-V529 HydrophobicContact CB-CG2 4.1Å; A513-T563 HydrophobicContact CB-CG2 3.67Å; A513-T563 WeakPolarHBondContact O-CG2 3.47Å
514	K	90.7	Very high	89.8	Confident	50 Å²	50	42 Å²	42	22%	0.217	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-37.2	174.3	-69.9	176.2	-175.2	-172.7	0	112.1	L510 T511 E517 A518 D554 A555 N560 T563	L510-K514 WeakPolarHBondContact O-CG 3.29Å; L510-K514 PolarHBondContact O-N 2.74Å; T511-K514 PolarHBondContact O-N 2.98Å; K514-E517 PolarHBondContact O-N 3.35Å; K514-A518 WeakPolarHBondContact O-CB 3.46Å; K514-A518 PolarHBondContact O-N 3.31Å; K514-D554 PolarHBondContact NZ-O 3.04Å; K514-D554 VanDerWaalsContact NZ-O 3.13Å; K514-A555 VanDerWaalsContact NZ-CA 3.34Å; K514-N560 HydrophobicContact CG-CB 4.25Å; K514-T563 HydrophobicContact CG-CG2 4.12Å
515	L	90	Very high	89.9	Confident	24 Å²	24	38.3 Å²	38.3	13%	0.126	22%	0.222	C	C	.	.	H	α-helix	trans	-63.3	-45.1	175.6	-177.3	70	0	0	0	111.7	Y488 A491 R492 L495 T511 A512 A513 H519	Y488-L515 HydrophobicContact CD2-CD1 4.44Å; Y488-L515 HydrophobicContact CD2-CD2 4.28Å; Y488-L515 HydrophobicContact CD2-CG 4.1Å; A491-L515 HydrophobicContact CB-CD1 4.28Å; A491-L515 HydrophobicContact CB-CD2 3.72Å; R492-L515 HydrophobicContact CG-CD2 3.94Å; L495-L515 HydrophobicContact CD1-CD2 3.92Å; T511-L515 WeakPolarHBondContact O-CB 3.1Å; T511-L515 PolarHBondContact O-N 2.98Å; A512-L515 PolarHBondContact O-N 3.4Å; A513-L515 VanDerWaalsContact C-N 3.34Å; L515-H519 PolarHBondContact O-N 2.69Å; L515-H519 PolarHBondContact O-ND1 3.3Å
516	E	91.2	Very high	89.8	Confident	7 Å²	7	39.5 Å²	39.5	3%	0.033	23%	0.227	C	C	.	.	H	α-helix	trans	-68.1	-34.9	176.6	-66.9	-65.5	171.9	0	0	112.4	Y488 R492 A512 A513 H519 G520 N521 M524 V525 I528	Y488-E516 PolarHBondContact OH-OE1 2.88Å; Y488-E516 PolarHBondContact OH-OE2 2.94Å; Y488-E516 VanDerWaalsContact OH-OE2 3.05Å; R492-E516 IonicContact CZ-OE1 3.49Å; R492-E516 IonicContact NE-OE1 2.7Å; R492-E516 IonicContact NH1-OE1 3.44Å; R492-E516 PolarHBondContact NH1-OE1 3.32Å; A512-E516 WeakPolarHBondContact O-CG 3.25Å; A512-E516 PolarHBondContact O-N 3.06Å; A512-E516 VanDerWaalsContact O-N 3.12Å; A513-E516 PolarHBondContact O-N 3.16Å; E516-H519 PolarHBondContact O-N 3.11Å; E516-G520 PolarHBondContact O-N 3.15Å; E516-N521 HydrophobicContact CB-CB 4.13Å; E516-N521 PolarHBondContact O-N 3.33Å; E516-N521 VanDerWaalsContact OE2-CB 3.24Å; E516-N521 WeakPolarHBondContact OE2-CB 3.19Å; E516-N521 PolarHBondContact OE2-ND2 2.98Å; E516-M524 HydrophobicContact CG-CB 4.49Å; E516-M524 HydrophobicContact CG-CG 4.11Å; E516-V525 HydrophobicContact CB-CG2 4.19Å; E516-I528 HydrophobicContact CB-CD1 4.37Å; E516-I528 HydrophobicContact CG-CD1 3.49Å; E516-I528 VanDerWaalsContact CG-CD1 3.49Å
517	E	91.5	Very high	89.9	Confident	22 Å²	22	42.9 Å²	42.9	10%	0.103	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-48.3	173.7	-177.1	170.9	-176.9	0	0	111.7	A513 K514 H519 G520 V525 N560 P561 I562 T563	A513-E517 PolarHBondContact O-N 3.45Å; K514-E517 PolarHBondContact O-N 3.35Å; E517-H519 PolarHBondContact O-N 3.01Å; E517-H519 VanDerWaalsContact O-N 3.11Å; E517-G520 PolarHBondContact O-N 3.39Å; E517-V525 HydrophobicContact CB-CG2 3.98Å; E517-N560 WeakPolarHBondContact OE1-CA 3.5Å; E517-N560 WeakPolarHBondContact OE2-CB 3.38Å; E517-P561 WeakPolarHBondContact OE1-CD 3.39Å; E517-I562 HydrophobicContact CG-CB 4.21Å; E517-I562 WeakPolarHBondContact OE1-CB 3.43Å; E517-I562 PolarHBondContact OE1-N 3.37Å; E517-T563 HydrophobicContact CB-CG2 4.19Å; E517-T563 VanDerWaalsContact OE2-CB 3.23Å; E517-T563 WeakPolarHBondContact OE2-CB 3.28Å; E517-T563 WeakPolarHBondContact OE2-CG2 3.35Å; E517-T563 PolarHBondContact OE2-N 3.18Å; E517-T563 PolarHBondContact OE2-OG1 3.17Å
518	A	88.8	Confident	89.9	Confident	75 Å²	75	40.2 Å²	40.2	62%	0.62	23%	0.23	S	C	*	.	H	α-helix	trans	-60.4	-21.8	178.1	0	0	0	0	0	114	K514	K514-A518 WeakPolarHBondContact O-CB 3.46Å; K514-A518 PolarHBondContact O-N 3.31Å
519	H	87.1	Confident	89.9	Confident	95 Å²	95	40.2 Å²	40.2	44%	0.44	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	11	176.6	-64.9	82.3	0	0	0	113.4	Y488 L515 E516 E517 N521	Y488-H519 HydrophobicContact CD2-CB 4.27Å; Y488-H519 AromaticContact CD2-CD2 3.97Å; Y488-H519 AromaticContact CD2-CE1 3.9Å; Y488-H519 AromaticContact CD2-CG 3.66Å; Y488-H519 AromaticContact CD2-ND1 3.6Å; Y488-H519 HydrophobicContact CE2-CB 4.23Å; Y488-H519 AromaticContact CG-CD2 3.96Å; L515-H519 PolarHBondContact O-N 2.69Å; L515-H519 PolarHBondContact O-ND1 3.3Å; E516-H519 PolarHBondContact O-N 3.11Å; E517-H519 PolarHBondContact O-N 3.01Å; E517-H519 VanDerWaalsContact O-N 3.11Å; H519-N521 PolarHBondContact O-N 3.32Å
520	G	84.2	Confident	89.8	Confident	52 Å²	52	43 Å²	43	54%	0.536	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.5	6.3	174.7	0	0	0	0	0	115.8	E516 E517 V522	E516-G520 PolarHBondContact O-N 3.15Å; E517-G520 PolarHBondContact O-N 3.39Å; G520-V522 PolarHBondContact O-N 3.32Å
521	N	88	Confident	89.8	Confident	62 Å²	62	49.3 Å²	49.3	33%	0.332	27%	0.268	S	S	.	.			trans	-82.4	50.9	-177.7	-70.6	-34.4	0	0	0	112.9	Y488 E516 H519 P523 M524 V525	Y488-N521 PolarHBondContact OH-ND2 2.8Å; E516-N521 HydrophobicContact CB-CB 4.13Å; E516-N521 PolarHBondContact O-N 3.33Å; E516-N521 VanDerWaalsContact OE2-CB 3.24Å; E516-N521 WeakPolarHBondContact OE2-CB 3.19Å; E516-N521 PolarHBondContact OE2-ND2 2.98Å; H519-N521 PolarHBondContact O-N 3.32Å; N521-P523 VanDerWaalsContact C-CD 3.48Å; N521-M524 HydrophobicContact CB-CB 4.19Å; N521-M524 WeakPolarHBondContact O-CA 3.14Å; N521-M524 VanDerWaalsContact O-CB 3.32Å; N521-M524 WeakPolarHBondContact O-CB 3.24Å; N521-M524 PolarHBondContact O-N 3.5Å; N521-V525 PolarHBondContact O-N 2.88Å
522	V	85.3	Confident	89.7	Confident	69 Å²	69	48.2 Å²	48.2	42%	0.418	26%	0.261	S	S	.	.	H	α-helix	trans	-39.6	-52.6	-179.3	177.3	0	0	0	0	114.9	G520 M524 V525 I562	G520-V522 PolarHBondContact O-N 3.32Å; V522-M524 PolarHBondContact O-N 3.02Å; V522-V525 WeakPolarHBondContact O-CB 3.5Å; V522-V525 PolarHBondContact O-N 3.37Å; V522-I562 HydrophobicContact CB-CD1 4.48Å; V522-I562 HydrophobicContact CG1-CD1 4.17Å; V522-I562 HydrophobicContact CG1-CG2 4.08Å; V522-I562 HydrophobicContact CG2-CD1 3.64Å
523	P	87.8	Confident	89.7	Confident	94 Å²	94	48.4 Å²	48.4	61%	0.61	26%	0.261	S	S	*	.	H	α-helix	trans	-70.8	-14.8	-177.6	29.4	-37.1	0	0	0	114	N521	N521-P523 VanDerWaalsContact C-CD 3.48Å
524	M	88.7	Confident	89.6	Confident	55 Å²	55	55.1 Å²	55.1	27%	0.271	29%	0.29	S	S	.	.	H	α-helix	trans	-81.9	-34.3	176.4	-169.6	55.2	177.8	0	0	111.5	E516 N521 V522 H526 K527 I528	E516-M524 HydrophobicContact CG-CB 4.49Å; E516-M524 HydrophobicContact CG-CG 4.11Å; N521-M524 HydrophobicContact CB-CB 4.19Å; N521-M524 WeakPolarHBondContact O-CA 3.14Å; N521-M524 VanDerWaalsContact O-CB 3.32Å; N521-M524 WeakPolarHBondContact O-CB 3.24Å; N521-M524 PolarHBondContact O-N 3.5Å; V522-M524 PolarHBondContact O-N 3.02Å; M524-H526 VanDerWaalsContact C-N 3.32Å; M524-H526 PolarHBondContact O-N 3.31Å; M524-K527 PolarHBondContact O-N 3.21Å; M524-K527 VanDerWaalsContact O-N 3.12Å; M524-K527 HydrophobicContact SD-CB 4.28Å; M524-K527 HydrophobicContact SD-CD 4.41Å; M524-I528 HydrophobicContact CE-CD1 4.25Å; M524-I528 HydrophobicContact CE-CG1 4Å; M524-I528 HydrophobicContact CG-CD1 3.98Å; M524-I528 HydrophobicContact CG-CG1 4.21Å; M524-I528 WeakPolarHBondContact O-CG1 3.39Å; M524-I528 PolarHBondContact O-N 3.4Å; M524-I528 HydrophobicContact SD-CG1 4.47Å
525	V	90.5	Very high	89.6	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-49.4	-52.1	175.7	178.1	0	0	0	0	111.1	A513 E516 E517 N521 V522 K527 I528 V529 I562 T563	A513-V525 HydrophobicContact CB-CG1 4.34Å; E516-V525 HydrophobicContact CB-CG2 4.19Å; E517-V525 HydrophobicContact CB-CG2 3.98Å; N521-V525 PolarHBondContact O-N 2.88Å; V522-V525 WeakPolarHBondContact O-CB 3.5Å; V522-V525 PolarHBondContact O-N 3.37Å; V525-K527 PolarHBondContact O-N 2.91Å; V525-I528 PolarHBondContact O-N 2.7Å; V525-V529 PolarHBondContact O-N 3.46Å; V525-V529 VanDerWaalsContact O-N 3.09Å; V525-I562 HydrophobicContact CG1-CG2 4.37Å; V525-T563 HydrophobicContact CG1-CG2 3.48Å; V525-T563 VanDerWaalsContact CG1-CG2 3.48Å
526	H	88.5	Confident	89.6	Confident	51 Å²	51	53.4 Å²	53.4	24%	0.236	29%	0.286	C	S	.	.	H	α-helix	trans	-62.4	-42.4	-178.6	-165.9	36.6	0	0	0	112.5	M524 I528 V529 E530 S566 K569	M524-H526 VanDerWaalsContact C-N 3.32Å; M524-H526 PolarHBondContact O-N 3.31Å; H526-I528 VanDerWaalsContact C-N 3.33Å; H526-I528 PolarHBondContact O-N 3.1Å; H526-V529 PolarHBondContact O-N 2.99Å; H526-E530 IonicContact CE1-OE1 3.38Å; H526-E530 IonicContact NE2-OE1 3.64Å; H526-E530 PolarHBondContact O-N 3.4Å; H526-S566 WeakPolarHBondContact CA-OG 3.39Å; H526-S566 PolarHBondContact ND1-OG 3.4Å; H526-K569 PolarHBondContact NE2-NZ 2.9Å
527	K	92.1	Very high	89.5	Confident	115 Å²	115	59.7 Å²	59.7	50%	0.5	31%	0.31	S	S	.	.	H	α-helix	trans	-65.5	-33.8	177.2	-64.8	173.9	-176.5	175.8	0	112.3	M524 V525 R531	M524-K527 PolarHBondContact O-N 3.21Å; M524-K527 VanDerWaalsContact O-N 3.12Å; M524-K527 HydrophobicContact SD-CB 4.28Å; M524-K527 HydrophobicContact SD-CD 4.41Å; V525-K527 PolarHBondContact O-N 2.91Å; K527-R531 WeakPolarHBondContact O-CB 3.44Å; K527-R531 WeakPolarHBondContact O-CD 3.25Å; K527-R531 WeakPolarHBondContact O-CG 3.46Å; K527-R531 PolarHBondContact O-N 3.2Å; K527-R531 VanDerWaalsContact O-N 3.08Å
528	I	92.6	Very high	89.5	Confident	12 Å²	12	62.3 Å²	62.3	6%	0.062	34%	0.335	C	S	.	.	H	α-helix	trans	-68.4	-46.8	176.2	-71.4	175.4	0	0	0	110.4	W509 A512 A513 E516 M524 V525 H526 R531 A532	W509-I528 HydrophobicContact CE3-CG2 4.1Å; A512-I528 HydrophobicContact CB-CG2 4.27Å; A513-I528 HydrophobicContact CB-CB 4.47Å; A513-I528 HydrophobicContact CB-CG2 3.97Å; E516-I528 HydrophobicContact CB-CD1 4.37Å; E516-I528 HydrophobicContact CG-CD1 3.49Å; E516-I528 VanDerWaalsContact CG-CD1 3.49Å; M524-I528 HydrophobicContact CE-CD1 4.25Å; M524-I528 HydrophobicContact CE-CG1 4Å; M524-I528 HydrophobicContact CG-CD1 3.98Å; M524-I528 HydrophobicContact CG-CG1 4.21Å; M524-I528 WeakPolarHBondContact O-CG1 3.39Å; M524-I528 PolarHBondContact O-N 3.4Å; M524-I528 HydrophobicContact SD-CG1 4.47Å; V525-I528 PolarHBondContact O-N 2.7Å; H526-I528 VanDerWaalsContact C-N 3.33Å; H526-I528 PolarHBondContact O-N 3.1Å; I528-R531 PolarHBondContact O-N 3.47Å; I528-A532 WeakPolarHBondContact O-CB 3.17Å; I528-A532 PolarHBondContact O-N 3.03Å
529	V	91	Very high	89.4	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-63.3	-43.3	179.3	177.2	0	0	0	0	111.3	A513 V525 H526 R531 A532 V533 I567 S570	A513-V529 HydrophobicContact CB-CG2 4.1Å; V525-V529 PolarHBondContact O-N 3.46Å; V525-V529 VanDerWaalsContact O-N 3.09Å; H526-V529 PolarHBondContact O-N 2.99Å; V529-R531 VanDerWaalsContact C-N 3.35Å; V529-R531 PolarHBondContact O-N 3.09Å; V529-A532 WeakPolarHBondContact O-CB 3.36Å; V529-A532 PolarHBondContact O-N 3.33Å; V529-V533 WeakPolarHBondContact O-CG2 3.46Å; V529-V533 PolarHBondContact O-N 3.43Å; V529-I567 HydrophobicContact CG1-CG1 4.36Å; V529-I567 HydrophobicContact CG2-CG1 4.28Å; V529-S570 VanDerWaalsContact CG1-OG 3.24Å; V529-S570 WeakPolarHBondContact CG1-OG 3.4Å
530	E	90.5	Very high	89.3	Confident	79 Å²	79	65.3 Å²	65.3	37%	0.369	34%	0.341	S	S	.	.	H	α-helix	trans	-62.1	-39.5	173.9	-73.7	-172.4	177.9	0	0	113.2	H526 K534	H526-E530 IonicContact CE1-OE1 3.38Å; H526-E530 IonicContact NE2-OE1 3.64Å; H526-E530 PolarHBondContact O-N 3.4Å; E530-K534 WeakPolarHBondContact O-CG 3.45Å; E530-K534 PolarHBondContact O-N 3.48Å; E530-K534 VanDerWaalsContact O-N 3.07Å
531	R	91.6	Very high	89.3	Confident	140 Å²	140	65.3 Å²	65.3	53%	0.528	33%	0.33	S	S	.	.	H	α-helix	trans	-67.1	-36.7	175.3	-75.2	168.7	-177.2	-171.9	-0.5	111.7	W509 K527 I528 V529 K534 S535	W509-R531 HydrophobicContact CH2-CB 4.06Å; W509-R531 HydrophobicContact CZ3-CB 3.61Å; K527-R531 WeakPolarHBondContact O-CB 3.44Å; K527-R531 WeakPolarHBondContact O-CD 3.25Å; K527-R531 WeakPolarHBondContact O-CG 3.46Å; K527-R531 PolarHBondContact O-N 3.2Å; K527-R531 VanDerWaalsContact O-N 3.08Å; I528-R531 PolarHBondContact O-N 3.47Å; V529-R531 VanDerWaalsContact C-N 3.35Å; V529-R531 PolarHBondContact O-N 3.09Å; R531-K534 PolarHBondContact O-N 3.02Å; R531-S535 VanDerWaalsContact O-CB 3.27Å; R531-S535 WeakPolarHBondContact O-CB 3.42Å; R531-S535 PolarHBondContact O-N 3.47Å
532	A	91	Very high	88.9	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-60.3	-53.4	175	0	0	0	0	0	110.9	W509 I528 V529 K534 S535 L536 W548	W509-A532 HydrophobicContact CB-CB 3.43Å; W509-A532 VanDerWaalsContact CB-CB 3.43Å; W509-A532 HydrophobicContact CD2-CB 3.51Å; W509-A532 HydrophobicContact CE3-CB 3.66Å; W509-A532 HydrophobicContact CG-CB 3.42Å; W509-A532 VanDerWaalsContact CG-CB 3.42Å; I528-A532 WeakPolarHBondContact O-CB 3.17Å; I528-A532 PolarHBondContact O-N 3.03Å; V529-A532 WeakPolarHBondContact O-CB 3.36Å; V529-A532 PolarHBondContact O-N 3.33Å; A532-K534 VanDerWaalsContact C-N 3.3Å; A532-K534 PolarHBondContact O-N 3.15Å; A532-S535 PolarHBondContact O-N 3.06Å; A532-L536 WeakPolarHBondContact O-CB 3.42Å; A532-L536 WeakPolarHBondContact O-CD1 3.38Å; A532-L536 VanDerWaalsContact O-CG 3.26Å; A532-L536 WeakPolarHBondContact O-CG 3.43Å; A532-L536 PolarHBondContact O-N 3.42Å; A532-W548 HydrophobicContact CB-CH2 4.19Å
533	V	89.8	Confident	88.9	Confident	12 Å²	12	68.2 Å²	68.2	7%	0.073	34%	0.338	C	S	.	.	H	α-helix	trans	-55.3	-43.7	176.7	165.4	0	0	0	0	111.7	V529 R537 I543 W548 F574	V529-V533 WeakPolarHBondContact O-CG2 3.46Å; V529-V533 PolarHBondContact O-N 3.43Å; V533-R537 WeakPolarHBondContact O-CB 3.46Å; V533-R537 PolarHBondContact O-N 2.93Å; V533-I543 HydrophobicContact CG1-CD1 3.83Å; V533-W548 HydrophobicContact CG2-CH2 3.82Å; V533-W548 HydrophobicContact CG2-CZ2 4.27Å; V533-W548 HydrophobicContact CG2-CZ3 4.23Å; V533-F574 HydrophobicContact CG1-CE2 3.79Å; V533-F574 HydrophobicContact CG1-CZ 3.98Å
534	K	90.4	Very high	88.7	Confident	141 Å²	141	67.3 Å²	67.3	61%	0.613	33%	0.328	S	S	*	.	H	α-helix	trans	-67	-45	176.6	-73.2	169.5	-178.8	168.7	0	112.6	E530 R531 A532 A538	E530-K534 WeakPolarHBondContact O-CG 3.45Å; E530-K534 PolarHBondContact O-N 3.48Å; E530-K534 VanDerWaalsContact O-N 3.07Å; R531-K534 PolarHBondContact O-N 3.02Å; A532-K534 VanDerWaalsContact C-N 3.3Å; A532-K534 PolarHBondContact O-N 3.15Å; K534-A538 WeakPolarHBondContact O-CB 3.47Å; K534-A538 PolarHBondContact O-N 3.16Å
535	S	90.7	Very high	88.6	Confident	35 Å²	35	66.5 Å²	66.5	25%	0.245	32%	0.322	C	S	.	.	H	α-helix	trans	-66	-43.6	-179.5	-169.9	0	0	0	0	112.1	R531 A532 A538 N539	R531-S535 VanDerWaalsContact O-CB 3.27Å; R531-S535 WeakPolarHBondContact O-CB 3.42Å; R531-S535 PolarHBondContact O-N 3.47Å; A532-S535 PolarHBondContact O-N 3.06Å; S535-A538 WeakPolarHBondContact O-CB 3.33Å; S535-A538 PolarHBondContact O-N 3.43Å; S535-N539 VanDerWaalsContact O-CG 3.24Å; S535-N539 PolarHBondContact O-N 2.98Å; S535-N539 PolarHBondContact O-ND2 2.93Å; S535-N539 VanDerWaalsContact O-ND2 3.17Å
536	L	90	Very high	88.5	Confident	3 Å²	3	71.1 Å²	71.1	2%	0.016	35%	0.347	C	S	.	.	H	α-helix	trans	-67	-39.9	-179.8	-69.3	164.9	0	0	0	111.1	T504 R506 A532 A538 N539 M540 V541 W548	T504-L536 VanDerWaalsContact O-CD2 3.28Å; T504-L536 WeakPolarHBondContact O-CD2 3.42Å; R506-L536 HydrophobicContact CB-CD1 3.69Å; A532-L536 WeakPolarHBondContact O-CB 3.42Å; A532-L536 WeakPolarHBondContact O-CD1 3.38Å; A532-L536 VanDerWaalsContact O-CG 3.26Å; A532-L536 WeakPolarHBondContact O-CG 3.43Å; A532-L536 PolarHBondContact O-N 3.42Å; L536-A538 PolarHBondContact O-N 2.95Å; L536-N539 CarbonylContact O-C 3.57Å; L536-N539 PolarHBondContact O-N 3.38Å; L536-M540 PolarHBondContact O-N 3.33Å; L536-V541 HydrophobicContact CB-CB 4.3Å; L536-V541 HydrophobicContact CD2-CB 4.48Å; L536-V541 HydrophobicContact CD2-CG2 4.46Å; L536-V541 WeakPolarHBondContact O-CB 3.4Å; L536-V541 PolarHBondContact O-N 2.86Å; L536-W548 HydrophobicContact CD1-CH2 3.86Å; L536-W548 HydrophobicContact CD1-CZ2 3.51Å
537	R	88.8	Confident	88.5	Confident	139 Å²	139	72.5 Å²	72.5	53%	0.525	35%	0.353	S	S	.	.	H	α-helix	trans	-62.5	-40.1	171.4	-172.6	179.1	-63.8	-176.5	-0.4	112.4	V533 N539 M540	V533-R537 WeakPolarHBondContact O-CB 3.46Å; V533-R537 PolarHBondContact O-N 2.93Å; R537-N539 VanDerWaalsContact C-N 3.28Å; R537-N539 PolarHBondContact O-N 2.84Å; R537-M540 PolarHBondContact O-N 3.31Å; R537-M540 VanDerWaalsContact O-N 3.14Å
538	A	91.3	Very high	88.5	Confident	77 Å²	77	67.2 Å²	67.2	64%	0.636	33%	0.33	S	S	*	.	H	α-helix	trans	-64.7	-33.8	175	0	0	0	0	0	112.3	K534 S535 L536 M540	K534-A538 WeakPolarHBondContact O-CB 3.47Å; K534-A538 PolarHBondContact O-N 3.16Å; S535-A538 WeakPolarHBondContact O-CB 3.33Å; S535-A538 PolarHBondContact O-N 3.43Å; L536-A538 PolarHBondContact O-N 2.95Å; A538-M540 PolarHBondContact O-N 3.27Å
539	N	88.2	Confident	88.4	Confident	58 Å²	58	67.1 Å²	67.1	31%	0.31	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	16.1	174.2	-61.6	-28.9	0	0	0	113.3	P503 T504 S535 L536 R537 V541	P503-N539 PolarHBondContact O-ND2 2.92Å; T504-N539 HydrophobicContact CG2-CB 4.48Å; S535-N539 VanDerWaalsContact O-CG 3.24Å; S535-N539 PolarHBondContact O-N 2.98Å; S535-N539 PolarHBondContact O-ND2 2.93Å; S535-N539 VanDerWaalsContact O-ND2 3.17Å; L536-N539 CarbonylContact O-C 3.57Å; L536-N539 PolarHBondContact O-N 3.38Å; R537-N539 VanDerWaalsContact C-N 3.28Å; R537-N539 PolarHBondContact O-N 2.84Å; N539-V541 PolarHBondContact O-N 2.88Å
540	M	84.2	Confident	88.4	Confident	175 Å²	175	73.1 Å²	73.1	86%	0.862	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	25.2	178.4	-60.6	178.2	-78.2	0	0	115.1	L536 R537 A538	L536-M540 PolarHBondContact O-N 3.33Å; R537-M540 PolarHBondContact O-N 3.31Å; R537-M540 VanDerWaalsContact O-N 3.14Å; A538-M540 PolarHBondContact O-N 3.27Å
541	V	84.2	Confident	88.5	Confident	53 Å²	53	70 Å²	70	32%	0.321	34%	0.342	S	S	.	.			trans	-88.4	118.5	174.2	-177	0	0	0	0	109.7	T504 L536 N539	T504-V541 HydrophobicContact CG2-CG2 4.24Å; L536-V541 HydrophobicContact CB-CB 4.3Å; L536-V541 HydrophobicContact CD2-CB 4.48Å; L536-V541 HydrophobicContact CD2-CG2 4.46Å; L536-V541 WeakPolarHBondContact O-CB 3.4Å; L536-V541 PolarHBondContact O-N 2.86Å; N539-V541 PolarHBondContact O-N 2.88Å
542	E	80.4	Confident	88.5	Confident	161 Å²	161	63.4 Å²	63.4	75%	0.752	32%	0.317	S	S	*	.			trans	-65.8	137.5	175.8	-66.9	-175.2	170.6	0	0	111.8	N544	E542-N544 PolarHBondContact O-N 3.34Å
543	I	84.4	Confident	88.5	Confident	31 Å²	31	63.8 Å²	63.8	16%	0.159	32%	0.319	C	S	.	.			trans	-85.7	83.3	-176.9	-60.2	160.4	0	0	0	108	V533 R545 V571 F574	V533-I543 HydrophobicContact CG1-CD1 3.83Å; I543-R545 PolarHBondContact O-N 2.97Å; I543-V571 HydrophobicContact CG2-CG1 4.18Å; I543-V571 HydrophobicContact CG2-CG2 4.44Å; I543-F574 HydrophobicContact CD1-CD2 4.25Å; I543-F574 HydrophobicContact CD1-CE2 4.16Å; I543-F574 HydrophobicContact CG2-CD2 3.93Å
544	N	84.9	Confident	88.5	Confident	75 Å²	75	67 Å²	67	40%	0.401	34%	0.335	S	S	.	.			trans	-63.7	93.3	174.8	-74.7	-35.3	0	0	0	110.8	E542 D546 Q547 W548	E542-N544 PolarHBondContact O-N 3.34Å; N544-D546 VanDerWaalsContact C-N 3.26Å; N544-D546 PolarHBondContact O-N 3Å; N544-D546 VanDerWaalsContact O-N 3.11Å; N544-Q547 HydrophobicContact CB-CB 4.05Å; N544-Q547 HydrophobicContact CB-CG 3.8Å; N544-Q547 PolarHBondContact ND2-OE1 3.11Å; N544-Q547 WeakPolarHBondContact O-CB 3.48Å; N544-Q547 PolarHBondContact O-N 3.15Å; N544-W548 PolarHBondContact O-N 2.88Å
545	R	86.2	Confident	88.5	Confident	38 Å²	38	60.2 Å²	60.2	14%	0.143	31%	0.306	C	S	.	.	H	α-helix	trans	-39.6	-52.6	-178	-175.4	-173.3	157.3	-75.9	-3.2	112.9	I543 Q547 W548 L549 V571 F574 D588	I543-R545 PolarHBondContact O-N 2.97Å; R545-Q547 VanDerWaalsContact C-N 3.32Å; R545-Q547 PolarHBondContact O-N 3.22Å; R545-W548 PolarHBondContact O-N 3.32Å; R545-L549 HydrophobicContact CG-CD1 4.3Å; R545-L549 WeakPolarHBondContact O-CG 3.15Å; R545-L549 PolarHBondContact O-N 3.15Å; R545-V571 HydrophobicContact CB-CG1 4.46Å; R545-V571 HydrophobicContact CG-CG1 4.27Å; R545-F574 WeakPolarHBondContact CD-O 3.42Å; R545-D588 IonicContact CZ-OD1 3.94Å; R545-D588 IonicContact CZ-OD2 3.55Å; R545-D588 IonicContact NH2-OD1 3.3Å; R545-D588 PolarHBondContact NH2-OD1 2.75Å; R545-D588 IonicContact NH2-OD2 2.7Å; R545-D588 PolarHBondContact NH2-OD2 3.32Å
546	D	87.1	Confident	88.5	Confident	98 Å²	98	60.1 Å²	60.1	52%	0.524	30%	0.302	S	S	.	.	H	α-helix	trans	-66.5	-29.4	-176.3	-54.9	-12.9	0	0	0	114	N544 K550	N544-D546 VanDerWaalsContact C-N 3.26Å; N544-D546 PolarHBondContact O-N 3Å; N544-D546 VanDerWaalsContact O-N 3.11Å; D546-K550 VanDerWaalsContact O-CG 3.29Å; D546-K550 WeakPolarHBondContact O-CG 3.49Å; D546-K550 PolarHBondContact O-N 3.48Å
547	Q	90	Very high	88.5	Confident	80 Å²	80	67.1 Å²	67.1	37%	0.374	33%	0.332	S	S	.	.	H	α-helix	trans	-70.1	-43	175.9	-65.8	-179.1	-10.5	0	0	110.5	N544 R545 K550 D551	N544-Q547 HydrophobicContact CB-CB 4.05Å; N544-Q547 HydrophobicContact CB-CG 3.8Å; N544-Q547 PolarHBondContact ND2-OE1 3.11Å; N544-Q547 WeakPolarHBondContact O-CB 3.48Å; N544-Q547 PolarHBondContact O-N 3.15Å; R545-Q547 VanDerWaalsContact C-N 3.32Å; R545-Q547 PolarHBondContact O-N 3.22Å; Q547-K550 WeakPolarHBondContact O-CB 3.4Å; Q547-K550 PolarHBondContact O-N 3.27Å; Q547-D551 VanDerWaalsContact O-CG 3.28Å; Q547-D551 PolarHBondContact O-N 3.42Å
548	W	92.3	Very high	88.4	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.015	33%	0.33	C	S	.	.	H	α-helix	trans	-69.1	-34.8	176.6	-74.8	83	0	0	0	112.8	R506 L510 A532 V533 L536 N544 R545 D551 A552 I567 V571	R506-W548 HydrophobicContact CB-CH2 4.37Å; R506-W548 HydrophobicContact CB-CZ2 4.1Å; L510-W548 HydrophobicContact CD2-CE3 4.33Å; L510-W548 HydrophobicContact CD2-CZ3 3.88Å; A532-W548 HydrophobicContact CB-CH2 4.19Å; V533-W548 HydrophobicContact CG2-CH2 3.82Å; V533-W548 HydrophobicContact CG2-CZ2 4.27Å; V533-W548 HydrophobicContact CG2-CZ3 4.23Å; L536-W548 HydrophobicContact CD1-CH2 3.86Å; L536-W548 HydrophobicContact CD1-CZ2 3.51Å; N544-W548 PolarHBondContact O-N 2.88Å; R545-W548 PolarHBondContact O-N 3.32Å; W548-D551 PolarHBondContact O-N 2.84Å; W548-A552 PolarHBondContact O-N 3.12Å; W548-I567 HydrophobicContact CB-CG2 4.35Å; W548-I567 HydrophobicContact CE3-CG2 4.03Å; W548-I567 WeakPolarHBondContact O-CG2 3.45Å; W548-V571 HydrophobicContact CB-CB 4.24Å; W548-V571 HydrophobicContact CB-CG1 3.84Å; W548-V571 HydrophobicContact CB-CG2 3.9Å; W548-V571 HydrophobicContact CD2-CG2 3.85Å; W548-V571 HydrophobicContact CE3-CG2 3.86Å; W548-V571 HydrophobicContact CG-CG1 4.26Å; W548-V571 HydrophobicContact CG-CG2 3.92Å
549	L	90.4	Very high	88.2	Confident	9 Å²	9	62.4 Å²	62.4	5%	0.047	33%	0.329	C	S	.	.	H	α-helix	trans	-67.9	-35.6	173.1	-65.4	-173.1	0	0	0	111.6	R545 A552 M553 V568 F592	R545-L549 HydrophobicContact CG-CD1 4.3Å; R545-L549 WeakPolarHBondContact O-CG 3.15Å; R545-L549 PolarHBondContact O-N 3.15Å; L549-A552 WeakPolarHBondContact O-CB 3.3Å; L549-A552 PolarHBondContact O-N 2.9Å; L549-M553 WeakPolarHBondContact O-CG 3.12Å; L549-M553 PolarHBondContact O-N 3.37Å; L549-M553 VanDerWaalsContact O-N 3.1Å; L549-V568 HydrophobicContact CD2-CG2 4.24Å; L549-F592 HydrophobicContact CB-CE1 4.38Å; L549-F592 HydrophobicContact CB-CZ 3.92Å; L549-F592 HydrophobicContact CD1-CZ 4.06Å; L549-F592 HydrophobicContact CD2-CZ 4Å; L549-F592 HydrophobicContact CG-CZ 4.17Å
550	K	91.2	Very high	88.2	Confident	127 Å²	127	60.8 Å²	60.8	55%	0.552	32%	0.32	S	S	*	.	H	α-helix	trans	-63.4	-45.8	168.3	-74.2	169.6	-177.7	176.1	0	112	D546 Q547 A552 M553 D554	D546-K550 VanDerWaalsContact O-CG 3.29Å; D546-K550 WeakPolarHBondContact O-CG 3.49Å; D546-K550 PolarHBondContact O-N 3.48Å; Q547-K550 WeakPolarHBondContact O-CB 3.4Å; Q547-K550 PolarHBondContact O-N 3.27Å; K550-A552 PolarHBondContact O-N 3.41Å; K550-M553 HydrophobicContact CB-CE 4.38Å; K550-M553 HydrophobicContact CG-CE 3.9Å; K550-M553 PolarHBondContact O-N 3.18Å; K550-M553 VanDerWaalsContact O-N 3.1Å; K550-D554 PolarHBondContact O-N 3.04Å
551	D	91.1	Very high	88.5	Confident	15 Å²	15	54.6 Å²	54.6	8%	0.08	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-30.7	176.4	-69.2	-32.1	0	0	0	112.8	R506 H507 L510 Q547 W548 A555	R506-D551 WeakPolarHBondContact CD-OD2 3.35Å; R506-D551 IonicContact CZ-OD2 2.73Å; R506-D551 IonicContact NE-OD2 2.69Å; R506-D551 IonicContact NH1-OD1 2.72Å; R506-D551 PolarHBondContact NH1-OD1 3.33Å; R506-D551 IonicContact NH1-OD2 2.74Å; R506-D551 PolarHBondContact NH1-OD2 3.39Å; H507-D551 IonicContact CE1-OD1 2.74Å; H507-D551 PolarHBondContact CE1-OD1 2.97Å; H507-D551 IonicContact CE1-OD2 3.5Å; H507-D551 IonicContact ND1-OD1 3.53Å; L510-D551 HydrophobicContact CD1-CB 3.43Å; L510-D551 VanDerWaalsContact CD1-CB 3.43Å; Q547-D551 VanDerWaalsContact O-CG 3.28Å; Q547-D551 PolarHBondContact O-N 3.42Å; W548-D551 PolarHBondContact O-N 2.84Å; D551-A555 PolarHBondContact O-N 3.03Å
552	A	92.1	Very high	88.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-69.3	-44.9	172.2	0	0	0	0	0	112.1	W548 L549 K550 D554 A555 E556 C564 I567 V568	W548-A552 PolarHBondContact O-N 3.12Å; L549-A552 WeakPolarHBondContact O-CB 3.3Å; L549-A552 PolarHBondContact O-N 2.9Å; K550-A552 PolarHBondContact O-N 3.41Å; A552-D554 VanDerWaalsContact C-N 3.28Å; A552-D554 PolarHBondContact O-N 2.68Å; A552-A555 WeakPolarHBondContact O-CA 3.04Å; A552-A555 VanDerWaalsContact O-CB 3.3Å; A552-A555 WeakPolarHBondContact O-CB 3.48Å; A552-A555 PolarHBondContact O-N 2.91Å; A552-E556 PolarHBondContact O-N 3.38Å; A552-C564 HydrophobicContact CB-CB 4.21Å; A552-C564 VanDerWaalsContact O-CB 3.27Å; A552-C564 WeakPolarHBondContact O-CB 3.47Å; A552-I567 HydrophobicContact CB-CB 4.09Å; A552-I567 HydrophobicContact CB-CD1 4.43Å; A552-I567 HydrophobicContact CB-CG2 3.85Å; A552-V568 HydrophobicContact CB-CG2 3.97Å
553	M	90.8	Very high	89.2	Confident	9 Å²	9	47.2 Å²	47.2	4%	0.044	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-37.3	173.8	-66.4	-174.5	-71.7	0	0	112	L549 K550 A555 E556 K557 F592 Q595 A597	L549-M553 WeakPolarHBondContact O-CG 3.12Å; L549-M553 PolarHBondContact O-N 3.37Å; L549-M553 VanDerWaalsContact O-N 3.1Å; K550-M553 HydrophobicContact CB-CE 4.38Å; K550-M553 HydrophobicContact CG-CE 3.9Å; K550-M553 PolarHBondContact O-N 3.18Å; K550-M553 VanDerWaalsContact O-N 3.1Å; M553-A555 VanDerWaalsContact C-N 3.25Å; M553-A555 PolarHBondContact O-N 3.15Å; M553-E556 PolarHBondContact O-N 3.26Å; M553-K557 VanDerWaalsContact O-CG 3.31Å; M553-K557 WeakPolarHBondContact O-CG 3.43Å; M553-K557 PolarHBondContact O-N 3.04Å; M553-F592 HydrophobicContact CE-CE1 4.3Å; M553-F592 HydrophobicContact CG-CD1 3.72Å; M553-F592 HydrophobicContact CG-CE1 3.57Å; M553-F592 HydrophobicContact SD-CD1 3.57Å; M553-F592 VanDerWaalsContact SD-CD1 3.57Å; M553-F592 HydrophobicContact SD-CE1 3.68Å; M553-Q595 VanDerWaalsContact CE-OE1 3.3Å; M553-Q595 HydrophobicContact SD-CB 4.19Å; M553-Q595 PolarHBondContact SD-OE1 3.45Å; M553-A597 HydrophobicContact CB-CB 4.48Å; M553-A597 HydrophobicContact CG-CB 3.79Å; M553-A597 HydrophobicContact SD-CB 4.19Å
554	D	90.1	Very high	89.6	Confident	78 Å²	78	45.7 Å²	45.7	42%	0.417	25%	0.248	S	C	.	.	H	α-helix	trans	-78.1	-8.3	175.1	-65.5	-17.5	0	0	0	112.9	K514 K550 A552 K557 A558	K514-D554 PolarHBondContact NZ-O 3.04Å; K514-D554 VanDerWaalsContact NZ-O 3.13Å; K550-D554 PolarHBondContact O-N 3.04Å; A552-D554 VanDerWaalsContact C-N 3.28Å; A552-D554 PolarHBondContact O-N 2.68Å; D554-K557 IonicContact OD1-NZ 3.58Å; D554-K557 PolarHBondContact OD1-NZ 2.82Å; D554-A558 WeakPolarHBondContact O-CB 3.43Å
555	A	90.2	Very high	89.8	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-82.4	-43.8	163.1	0	0	0	0	0	111.4	K514 D551 A552 M553 A558 G559 N560 C564	K514-A555 VanDerWaalsContact NZ-CA 3.34Å; D551-A555 PolarHBondContact O-N 3.03Å; A552-A555 WeakPolarHBondContact O-CA 3.04Å; A552-A555 VanDerWaalsContact O-CB 3.3Å; A552-A555 WeakPolarHBondContact O-CB 3.48Å; A552-A555 PolarHBondContact O-N 2.91Å; M553-A555 VanDerWaalsContact C-N 3.25Å; M553-A555 PolarHBondContact O-N 3.15Å; A555-A558 CarbonylContact O-C 3.58Å; A555-A558 WeakPolarHBondContact O-CA 3.39Å; A555-A558 WeakPolarHBondContact O-CB 3.39Å; A555-A558 PolarHBondContact O-N 3.08Å; A555-A558 VanDerWaalsContact O-N 3.12Å; A555-G559 PolarHBondContact O-N 2.95Å; A555-N560 PolarHBondContact O-N 3.46Å; A555-C564 HydrophobicContact CB-CB 4.01Å
556	E	89.7	Confident	90	Very high	33 Å²	33	44.4 Å²	44.4	15%	0.154	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-48.8	175.8	-173.7	174.2	167.2	0	0	111.8	A552 M553 A558 G559 C564 A597 Y598 E599 C600	A552-E556 PolarHBondContact O-N 3.38Å; M553-E556 PolarHBondContact O-N 3.26Å; E556-A558 PolarHBondContact O-N 3.42Å; E556-A558 VanDerWaalsContact O-N 3.15Å; E556-G559 PolarHBondContact O-N 3.15Å; E556-C564 HydrophobicContact CB-CB 4.38Å; E556-A597 VanDerWaalsContact OE1-C 3.24Å; E556-A597 WeakPolarHBondContact OE1-CA 3.45Å; E556-A597 VanDerWaalsContact OE2-C 3.27Å; E556-A597 WeakPolarHBondContact OE2-CA 3.37Å; E556-A597 WeakPolarHBondContact OE2-CB 3.43Å; E556-Y598 PolarHBondContact OE1-N 3.18Å; E556-E599 VanDerWaalsContact CD-N 3.32Å; E556-E599 HydrophobicContact CG-CB 4.09Å; E556-E599 HydrophobicContact CG-CG 4.48Å; E556-E599 PolarHBondContact OE1-N 3.19Å; E556-E599 PolarHBondContact OE2-N 3.43Å; E556-C600 PolarHBondContact OE2-N 3.29Å; E556-C600 PolarHBondContact OE2-SG 3.32Å
557	K	90.2	Very high	90.2	Very high	149 Å²	149	39.8 Å²	39.8	65%	0.648	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-25.7	173.8	-68.6	170.4	-162.9	157.3	0	113.5	M553 D554 G559	M553-K557 VanDerWaalsContact O-CG 3.31Å; M553-K557 WeakPolarHBondContact O-CG 3.43Å; M553-K557 PolarHBondContact O-N 3.04Å; D554-K557 IonicContact OD1-NZ 3.58Å; D554-K557 PolarHBondContact OD1-NZ 2.82Å; K557-G559 VanDerWaalsContact C-N 3.28Å
558	A	87.7	Confident	90.3	Very high	58 Å²	58	36 Å²	36	48%	0.479	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	6.6	175.9	0	0	0	0	0	113.1	D554 A555 E556 N560	D554-A558 WeakPolarHBondContact O-CB 3.43Å; A555-A558 CarbonylContact O-C 3.58Å; A555-A558 WeakPolarHBondContact O-CA 3.39Å; A555-A558 WeakPolarHBondContact O-CB 3.39Å; A555-A558 PolarHBondContact O-N 3.08Å; A555-A558 VanDerWaalsContact O-N 3.12Å; E556-A558 PolarHBondContact O-N 3.42Å; E556-A558 VanDerWaalsContact O-N 3.15Å; A558-N560 PolarHBondContact O-ND2 3.08Å
559	G	87.4	Confident	90.1	Very high	60 Å²	60	41.1 Å²	41.1	62%	0.619	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	76	21.6	179.3	0	0	0	0	0	114.8	A555 E556 K557 P561	A555-G559 PolarHBondContact O-N 2.95Å; E556-G559 PolarHBondContact O-N 3.15Å; K557-G559 VanDerWaalsContact C-N 3.28Å; G559-P561 VanDerWaalsContact C-CD 3.46Å; G559-P561 WeakPolarHBondContact O-CD 2.9Å
560	N	88.2	Confident	89.9	Confident	24 Å²	24	41.8 Å²	41.8	13%	0.128	23%	0.228	C	C	.	.			trans	-115.1	76.5	-177	-68.8	-89.5	0	0	0	110.6	K514 E517 A555 A558 T563 C564	K514-N560 HydrophobicContact CG-CB 4.25Å; E517-N560 WeakPolarHBondContact OE1-CA 3.5Å; E517-N560 WeakPolarHBondContact OE2-CB 3.38Å; A555-N560 PolarHBondContact O-N 3.46Å; A558-N560 PolarHBondContact O-ND2 3.08Å; N560-T563 VanDerWaalsContact CB-OG1 3.3Å; N560-T563 WeakPolarHBondContact CB-OG1 3.47Å; N560-T563 PolarHBondContact O-OG1 2.99Å; N560-C564 PolarHBondContact O-N 3.05Å
561	P	89	Confident	89.7	Confident	45 Å²	45	35.8 Å²	35.8	29%	0.292	20%	0.202	S	C	.	.	H	α-helix	trans	-70.9	-31.5	-174.7	29.1	-36.8	0	0	0	114.3	E517 G559 C564 Q565 E599	E517-P561 WeakPolarHBondContact OE1-CD 3.39Å; G559-P561 VanDerWaalsContact C-CD 3.46Å; G559-P561 WeakPolarHBondContact O-CD 2.9Å; P561-C564 PolarHBondContact O-N 2.96Å; P561-C564 PolarHBondContact O-SG 3.47Å; P561-Q565 WeakPolarHBondContact O-CB 3.4Å; P561-Q565 VanDerWaalsContact O-CG 3.25Å; P561-Q565 WeakPolarHBondContact O-CG 3.05Å; P561-Q565 PolarHBondContact O-N 3.18Å; P561-E599 HydrophobicContact CB-CB 4.29Å; P561-E599 HydrophobicContact CB-CG 3.98Å
562	I	90.8	Very high	89.3	Confident	57 Å²	57	35 Å²	35	29%	0.292	20%	0.198	S	C	.	.	H	α-helix	trans	-72.3	-39.4	-175.5	-57.5	177.5	0	0	0	110.4	E517 V522 V525 S566	E517-I562 HydrophobicContact CG-CB 4.21Å; E517-I562 WeakPolarHBondContact OE1-CB 3.43Å; E517-I562 PolarHBondContact OE1-N 3.37Å; V522-I562 HydrophobicContact CB-CD1 4.48Å; V522-I562 HydrophobicContact CG1-CD1 4.17Å; V522-I562 HydrophobicContact CG1-CG2 4.08Å; V522-I562 HydrophobicContact CG2-CD1 3.64Å; V525-I562 HydrophobicContact CG1-CG2 4.37Å; I562-S566 WeakPolarHBondContact O-CB 3.24Å; I562-S566 PolarHBondContact O-N 3.2Å
563	T	90.3	Very high	88.8	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	21%	0.213	C	C	.	.	H	α-helix	trans	-62	-45.7	170.7	45.3	0	0	0	0	111.4	A513 K514 E517 V525 N560 Q565 S566 I567	A513-T563 HydrophobicContact CB-CG2 3.67Å; A513-T563 WeakPolarHBondContact O-CG2 3.47Å; K514-T563 HydrophobicContact CG-CG2 4.12Å; E517-T563 HydrophobicContact CB-CG2 4.19Å; E517-T563 VanDerWaalsContact OE2-CB 3.23Å; E517-T563 WeakPolarHBondContact OE2-CB 3.28Å; E517-T563 WeakPolarHBondContact OE2-CG2 3.35Å; E517-T563 PolarHBondContact OE2-N 3.18Å; E517-T563 PolarHBondContact OE2-OG1 3.17Å; V525-T563 HydrophobicContact CG1-CG2 3.48Å; V525-T563 VanDerWaalsContact CG1-CG2 3.48Å; N560-T563 VanDerWaalsContact CB-OG1 3.3Å; N560-T563 WeakPolarHBondContact CB-OG1 3.47Å; N560-T563 PolarHBondContact O-OG1 2.99Å; T563-Q565 PolarHBondContact O-N 2.86Å; T563-S566 PolarHBondContact O-N 3.1Å; T563-I567 WeakPolarHBondContact O-CB 3.23Å; T563-I567 WeakPolarHBondContact O-CD1 3.33Å; T563-I567 WeakPolarHBondContact O-CG1 3.36Å; T563-I567 PolarHBondContact O-N 2.77Å
564	C	91	Very high	88.4	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.2	-45	178.3	90.2	0	0	0	0	111.5	A552 A555 E556 N560 P561 S566 I567 V568	A552-C564 HydrophobicContact CB-CB 4.21Å; A552-C564 VanDerWaalsContact O-CB 3.27Å; A552-C564 WeakPolarHBondContact O-CB 3.47Å; A555-C564 HydrophobicContact CB-CB 4.01Å; E556-C564 HydrophobicContact CB-CB 4.38Å; N560-C564 PolarHBondContact O-N 3.05Å; P561-C564 PolarHBondContact O-N 2.96Å; P561-C564 PolarHBondContact O-SG 3.47Å; C564-S566 VanDerWaalsContact C-N 3.34Å; C564-S566 PolarHBondContact O-N 3.23Å; C564-I567 PolarHBondContact O-N 2.99Å; C564-V568 WeakPolarHBondContact O-CG2 3.41Å; C564-V568 PolarHBondContact O-N 3.37Å
565	Q	90.1	Very high	87.7	Confident	76 Å²	76	39.5 Å²	39.5	36%	0.355	25%	0.247	S	C	.	.	H	α-helix	trans	-60.3	-41.7	176.1	-70.7	174.2	11.8	0	0	111.9	P561 T563 K569 E599 A603	P561-Q565 WeakPolarHBondContact O-CB 3.4Å; P561-Q565 VanDerWaalsContact O-CG 3.25Å; P561-Q565 WeakPolarHBondContact O-CG 3.05Å; P561-Q565 PolarHBondContact O-N 3.18Å; T563-Q565 PolarHBondContact O-N 2.86Å; Q565-K569 VanDerWaalsContact O-CB 3.23Å; Q565-K569 WeakPolarHBondContact O-CB 3.45Å; Q565-K569 PolarHBondContact O-N 3.42Å; Q565-E599 PolarHBondContact NE2-OE2 3.45Å; Q565-A603 HydrophobicContact CB-CB 4.12Å; Q565-A603 HydrophobicContact CG-CB 3.99Å
566	S	90.7	Very high	87.2	Confident	9 Å²	9	40.6 Å²	40.6	6%	0.063	25%	0.252	C	S	.	.	H	α-helix	trans	-68.7	-39.1	176.2	-177.4	0	0	0	0	113	H526 I562 T563 C564 S570	H526-S566 WeakPolarHBondContact CA-OG 3.39Å; H526-S566 PolarHBondContact ND1-OG 3.4Å; I562-S566 WeakPolarHBondContact O-CB 3.24Å; I562-S566 PolarHBondContact O-N 3.2Å; T563-S566 PolarHBondContact O-N 3.1Å; C564-S566 VanDerWaalsContact C-N 3.34Å; C564-S566 PolarHBondContact O-N 3.23Å; S566-S570 WeakPolarHBondContact O-CB 3.49Å; S566-S570 PolarHBondContact O-N 3.42Å; S566-S570 PolarHBondContact O-OG 3.31Å
567	I	91.8	Very high	86.8	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-61.6	-55	176.5	-68.1	158.9	0	0	0	109	L510 V529 W548 A552 T563 C564 K569 S570 V571	L510-I567 HydrophobicContact CD1-CD1 4.41Å; L510-I567 HydrophobicContact CD2-CD1 3.78Å; L510-I567 HydrophobicContact CD2-CG1 3.86Å; V529-I567 HydrophobicContact CG1-CG1 4.36Å; V529-I567 HydrophobicContact CG2-CG1 4.28Å; W548-I567 HydrophobicContact CB-CG2 4.35Å; W548-I567 HydrophobicContact CE3-CG2 4.03Å; W548-I567 WeakPolarHBondContact O-CG2 3.45Å; A552-I567 HydrophobicContact CB-CB 4.09Å; A552-I567 HydrophobicContact CB-CD1 4.43Å; A552-I567 HydrophobicContact CB-CG2 3.85Å; T563-I567 WeakPolarHBondContact O-CB 3.23Å; T563-I567 WeakPolarHBondContact O-CD1 3.33Å; T563-I567 WeakPolarHBondContact O-CG1 3.36Å; T563-I567 PolarHBondContact O-N 2.77Å; C564-I567 PolarHBondContact O-N 2.99Å; I567-K569 PolarHBondContact O-N 2.97Å; I567-S570 PolarHBondContact O-N 3Å; I567-S570 VanDerWaalsContact O-N 3.08Å; I567-S570 PolarHBondContact O-OG 2.95Å; I567-V571 PolarHBondContact O-N 3.35Å
568	V	90.9	Very high	86.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-55.2	-52.8	178.6	173.6	0	0	0	0	110.5	L549 A552 C564 S570 V571 I572 C600 A603 V604	L549-V568 HydrophobicContact CD2-CG2 4.24Å; A552-V568 HydrophobicContact CB-CG2 3.97Å; C564-V568 WeakPolarHBondContact O-CG2 3.41Å; C564-V568 PolarHBondContact O-N 3.37Å; V568-S570 PolarHBondContact O-N 3.19Å; V568-S570 VanDerWaalsContact O-N 3.15Å; V568-V571 PolarHBondContact O-N 3.18Å; V568-V571 VanDerWaalsContact O-N 3.15Å; V568-I572 HydrophobicContact CG1-CB 4.35Å; V568-I572 HydrophobicContact CG1-CD1 4.3Å; V568-I572 VanDerWaalsContact O-CB 3.26Å; V568-I572 WeakPolarHBondContact O-CB 3.41Å; V568-I572 PolarHBondContact O-N 3.19Å; V568-C600 HydrophobicContact CG2-CB 4.37Å; V568-A603 HydrophobicContact CB-CB 3.81Å; V568-A603 HydrophobicContact CG1-CB 3.77Å; V568-A603 HydrophobicContact CG2-CB 4.36Å; V568-V604 HydrophobicContact CG1-CG2 3.72Å
569	K	88.8	Confident	85.8	Confident	113 Å²	113	50.3 Å²	50.3	49%	0.491	29%	0.294	S	S	.	.	H	α-helix	trans	-53.8	-38.2	178.2	-177.3	-170.7	171	-160.6	0	112.8	H526 Q565 I567	H526-K569 PolarHBondContact NE2-NZ 2.9Å; Q565-K569 VanDerWaalsContact O-CB 3.23Å; Q565-K569 WeakPolarHBondContact O-CB 3.45Å; Q565-K569 PolarHBondContact O-N 3.42Å; I567-K569 PolarHBondContact O-N 2.97Å
570	S	84.9	Confident	85.8	Confident	23 Å²	23	51.6 Å²	51.6	16%	0.161	29%	0.287	C	S	.	.	H	α-helix	trans	-79.8	-30.8	-178.7	69.2	0	0	0	0	114.1	V529 S566 I567 V568 F574	V529-S570 VanDerWaalsContact CG1-OG 3.24Å; V529-S570 WeakPolarHBondContact CG1-OG 3.4Å; S566-S570 WeakPolarHBondContact O-CB 3.49Å; S566-S570 PolarHBondContact O-N 3.42Å; S566-S570 PolarHBondContact O-OG 3.31Å; I567-S570 PolarHBondContact O-N 3Å; I567-S570 VanDerWaalsContact O-N 3.08Å; I567-S570 PolarHBondContact O-OG 2.95Å; V568-S570 PolarHBondContact O-N 3.19Å; V568-S570 VanDerWaalsContact O-N 3.15Å; S570-F574 WeakPolarHBondContact O-CE2 3.31Å
571	V	87.2	Confident	85.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-103.7	-26	-170.5	179.9	0	0	0	0	114	I543 R545 W548 I567 V568 G573 F574	I543-V571 HydrophobicContact CG2-CG1 4.18Å; I543-V571 HydrophobicContact CG2-CG2 4.44Å; R545-V571 HydrophobicContact CB-CG1 4.46Å; R545-V571 HydrophobicContact CG-CG1 4.27Å; W548-V571 HydrophobicContact CB-CB 4.24Å; W548-V571 HydrophobicContact CB-CG1 3.84Å; W548-V571 HydrophobicContact CB-CG2 3.9Å; W548-V571 HydrophobicContact CD2-CG2 3.85Å; W548-V571 HydrophobicContact CE3-CG2 3.86Å; W548-V571 HydrophobicContact CG-CG1 4.26Å; W548-V571 HydrophobicContact CG-CG2 3.92Å; I567-V571 PolarHBondContact O-N 3.35Å; V568-V571 PolarHBondContact O-N 3.18Å; V568-V571 VanDerWaalsContact O-N 3.15Å; V571-G573 PolarHBondContact O-N 3.21Å; V571-F574 HydrophobicContact CG1-CD2 4.48Å; V571-F574 PolarHBondContact O-N 2.71Å
572	I	84.2	Confident	85.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-21.3	-170.9	-149.1	-167	0	0	0	114.1	V568 I576 W585 V604 H607	V568-I572 HydrophobicContact CG1-CB 4.35Å; V568-I572 HydrophobicContact CG1-CD1 4.3Å; V568-I572 VanDerWaalsContact O-CB 3.26Å; V568-I572 WeakPolarHBondContact O-CB 3.41Å; V568-I572 PolarHBondContact O-N 3.19Å; I572-I576 WeakPolarHBondContact O-CD1 3.06Å; I572-W585 HydrophobicContact CD1-CB 4.15Å; I572-W585 HydrophobicContact CD1-CD2 4.14Å; I572-W585 HydrophobicContact CD1-CG 3.61Å; I572-W585 VanDerWaalsContact CG1-CD1 3.45Å; I572-W585 HydrophobicContact CG1-CG 4.22Å; I572-W585 HydrophobicContact CG2-CZ2 4.26Å; I572-W585 PolarHBondContact O-NE1 3.18Å; I572-V604 HydrophobicContact CD1-CB 4.04Å; I572-V604 HydrophobicContact CD1-CG1 3.66Å; I572-V604 HydrophobicContact CD1-CG2 3.72Å; I572-H607 HydrophobicContact CG2-CB 4.49Å; I572-H607 WeakPolarHBondContact CG2-ND1 3.42Å
573	G	81.5	Confident	85.5	Confident	30 Å²	30	59.1 Å²	59.1	31%	0.309	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-5.3	175.9	0	0	0	0	0	115.7	V571	V571-G573 PolarHBondContact O-N 3.21Å
574	F	81.8	Confident	85.5	Confident	64 Å²	64	60.5 Å²	60.5	28%	0.281	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	136.3	179.2	-66.1	-47.9	0	0	0	111.9	V533 I543 R545 S570 V571	V533-F574 HydrophobicContact CG1-CE2 3.79Å; V533-F574 HydrophobicContact CG1-CZ 3.98Å; I543-F574 HydrophobicContact CD1-CD2 4.25Å; I543-F574 HydrophobicContact CD1-CE2 4.16Å; I543-F574 HydrophobicContact CG2-CD2 3.93Å; R545-F574 WeakPolarHBondContact CD-O 3.42Å; S570-F574 WeakPolarHBondContact O-CE2 3.31Å; V571-F574 HydrophobicContact CG1-CD2 4.48Å; V571-F574 PolarHBondContact O-N 2.71Å
575	G	75.5	Confident	85.6	Confident	87 Å²	87	60.8 Å²	60.8	90%	0.897	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	16.7	176.2	0	0	0	0	0	115.3
576	I	79.2	Confident	85.6	Confident	23 Å²	23	58.2 Å²	58.2	12%	0.118	30%	0.303	C	S	.	.			trans	-131.6	127.4	179	-56.1	159.4	0	0	0	110.9	I572 D580 R581 T584	I572-I576 WeakPolarHBondContact O-CD1 3.06Å; I576-D580 HydrophobicContact CG2-CB 4.3Å; I576-R581 HydrophobicContact CB-CG 4.2Å; I576-R581 HydrophobicContact CG2-CB 4.35Å; I576-R581 HydrophobicContact CG2-CG 3.81Å; I576-R581 PolarHBondContact O-NE 2.66Å; I576-T584 HydrophobicContact CD1-CG2 4.41Å; I576-T584 WeakPolarHBondContact CD1-OG1 3.38Å; I576-T584 HydrophobicContact CG1-CG2 4.48Å; I576-T584 HydrophobicContact CG2-CG2 4Å
577	D	80.9	Confident	85.6	Confident	128 Å²	128	62 Å²	62	68%	0.684	32%	0.32	S	S	*	.			trans	-64.7	147.5	175.4	-67	-40.3	0	0	0	112.2	E579 D580 R581	D577-E579 PolarHBondContact O-N 3.29Å; D577-E579 VanDerWaalsContact O-N 3.1Å; D577-D580 PolarHBondContact O-N 3.3Å; D577-D580 VanDerWaalsContact O-N 3.12Å; D577-R581 WeakPolarHBondContact O-CG 3.42Å; D577-R581 PolarHBondContact O-N 2.68Å; D577-R581 VanDerWaalsContact O-N 3.12Å
578	E	79.5	Confident	85.4	Confident	133 Å²	133	62.4 Å²	62.4	62%	0.621	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-30.3	-165.4	-47.9	-134.7	120.5	0	0	113.7	R581	E578-R581 VanDerWaalsContact CD-NH1 3.3Å; E578-R581 IonicContact OE1-CZ 3.76Å; E578-R581 IonicContact OE1-NH1 3.23Å; E578-R581 PolarHBondContact OE1-NH1 3.44Å; E578-R581 IonicContact OE1-NH2 3.37Å; E578-R581 PolarHBondContact OE1-NH2 2.7Å
579	E	78.9	Confident	85.4	Confident	182 Å²	182	62.4 Å²	62.4	85%	0.85	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-44.4	179	-56.9	-169.6	174.5	0	0	112	D577	D577-E579 PolarHBondContact O-N 3.29Å; D577-E579 VanDerWaalsContact O-N 3.1Å
580	D	86.5	Confident	85.5	Confident	87 Å²	87	62.7 Å²	62.7	47%	0.465	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-19.7	-174.9	-85.8	-35.2	0	0	0	114	I576 D577 K582 R583 T584	I576-D580 HydrophobicContact CG2-CB 4.3Å; D577-D580 PolarHBondContact O-N 3.3Å; D577-D580 VanDerWaalsContact O-N 3.12Å; D580-K582 CarbonylContact O-C 3.4Å; D580-K582 PolarHBondContact O-N 3.34Å; D580-R583 WeakPolarHBondContact O-CA 3.34Å; D580-R583 WeakPolarHBondContact O-CB 3.28Å; D580-R583 PolarHBondContact O-N 2.91Å; D580-T584 PolarHBondContact O-N 2.94Å; D580-T584 PolarHBondContact O-OG1 2.81Å
581	R	86.5	Confident	85.6	Confident	65 Å²	65	66.1 Å²	66.1	25%	0.245	34%	0.34	C	S	.	.	H	α-helix	trans	-40.6	-45.7	177.4	-80	177.5	-168.6	156.3	6.2	113.4	I576 D577 E578 T584 W585 F612	I576-R581 HydrophobicContact CB-CG 4.2Å; I576-R581 HydrophobicContact CG2-CB 4.35Å; I576-R581 HydrophobicContact CG2-CG 3.81Å; I576-R581 PolarHBondContact O-NE 2.66Å; D577-R581 WeakPolarHBondContact O-CG 3.42Å; D577-R581 PolarHBondContact O-N 2.68Å; D577-R581 VanDerWaalsContact O-N 3.12Å; E578-R581 VanDerWaalsContact CD-NH1 3.3Å; E578-R581 IonicContact OE1-CZ 3.76Å; E578-R581 IonicContact OE1-NH1 3.23Å; E578-R581 PolarHBondContact OE1-NH1 3.44Å; E578-R581 IonicContact OE1-NH2 3.37Å; E578-R581 PolarHBondContact OE1-NH2 2.7Å; R581-T584 WeakPolarHBondContact CA-OG1 3.34Å; R581-T584 PolarHBondContact O-OG1 2.97Å; R581-W585 HydrophobicContact CB-CD2 4.33Å; R581-W585 HydrophobicContact CB-CE3 4.42Å; R581-W585 HydrophobicContact CB-CH2 3.94Å; R581-W585 HydrophobicContact CB-CZ2 3.83Å; R581-W585 HydrophobicContact CB-CZ3 4.21Å; R581-W585 HydrophobicContact CG-CH2 4.2Å; R581-W585 HydrophobicContact CG-CZ2 3.82Å; R581-W585 VanDerWaalsContact O-CB 3.32Å; R581-W585 WeakPolarHBondContact O-CB 3.18Å; R581-W585 PolarHBondContact O-N 2.92Å; R581-F612 HydrophobicContact CB-CE2 4.39Å; R581-F612 HydrophobicContact CB-CZ 4.34Å
582	K	87.3	Confident	85.8	Confident	62 Å²	62	66.3 Å²	66.3	27%	0.27	34%	0.341	S	S	.	.	H	α-helix	trans	-60.4	-49.2	179	-175.1	-141.4	173	-167.4	0	111	D580 M586 F612 K615 S617 V618	D580-K582 CarbonylContact O-C 3.4Å; D580-K582 PolarHBondContact O-N 3.34Å; K582-M586 VanDerWaalsContact O-CG 3.31Å; K582-M586 WeakPolarHBondContact O-CG 3.42Å; K582-M586 PolarHBondContact O-N 3.28Å; K582-F612 HydrophobicContact CB-CD2 4.05Å; K582-F612 HydrophobicContact CB-CE2 3.63Å; K582-F612 HydrophobicContact CB-CZ 4.03Å; K582-F612 HydrophobicContact CG-CD2 4.19Å; K582-F612 HydrophobicContact CG-CE2 4.28Å; K582-K615 HydrophobicContact CD-CD 4.08Å; K582-S617 WeakPolarHBondContact CE-OG 3.19Å; K582-S617 PolarHBondContact NZ-OG 3.35Å; K582-V618 HydrophobicContact CG-CG2 4.25Å
583	R	88.7	Confident	86	Confident	157 Å²	157	68.5 Å²	68.5	59%	0.592	35%	0.352	S	S	*	.	H	α-helix	trans	-65.6	-51.7	-176.8	178.2	-179.1	172.7	-175.1	-5.7	110.5	D580 W585 M586 E587	D580-R583 WeakPolarHBondContact O-CA 3.34Å; D580-R583 WeakPolarHBondContact O-CB 3.28Å; D580-R583 PolarHBondContact O-N 2.91Å; R583-W585 VanDerWaalsContact C-N 3.31Å; R583-W585 PolarHBondContact O-N 3.38Å; R583-M586 PolarHBondContact O-N 3.49Å; R583-M586 VanDerWaalsContact O-N 3.1Å; R583-E587 IonicContact CZ-OE1 2.86Å; R583-E587 IonicContact NE-OE1 3.1Å; R583-E587 PolarHBondContact NE-OE1 2.86Å; R583-E587 IonicContact NH2-OE1 2.9Å; R583-E587 PolarHBondContact NH2-OE1 2.97Å; R583-E587 VanDerWaalsContact NH2-OE1 3.09Å; R583-E587 PolarHBondContact O-N 3.29Å; R583-E587 VanDerWaalsContact O-N 3.09Å
584	T	90.2	Very high	86.4	Confident	31 Å²	31	71.3 Å²	71.3	19%	0.19	37%	0.372	C	S	.	.	H	α-helix	trans	-56.8	-44.9	-179.7	55.7	0	0	0	0	111.2	I576 D580 R581 M586 E587 D588	I576-T584 HydrophobicContact CD1-CG2 4.41Å; I576-T584 WeakPolarHBondContact CD1-OG1 3.38Å; I576-T584 HydrophobicContact CG1-CG2 4.48Å; I576-T584 HydrophobicContact CG2-CG2 4Å; D580-T584 PolarHBondContact O-N 2.94Å; D580-T584 PolarHBondContact O-OG1 2.81Å; R581-T584 WeakPolarHBondContact CA-OG1 3.34Å; R581-T584 PolarHBondContact O-OG1 2.97Å; T584-M586 VanDerWaalsContact C-N 3.3Å; T584-M586 PolarHBondContact O-N 3.02Å; T584-E587 CarbonylContact O-C 3.56Å; T584-E587 PolarHBondContact O-N 3.47Å; T584-E587 VanDerWaalsContact O-N 3.15Å; T584-D588 WeakPolarHBondContact O-CB 3.41Å; T584-D588 PolarHBondContact O-N 2.79Å
585	W	92.1	Very high	86.7	Confident	5 Å²	5	73.3 Å²	73.3	2%	0.019	38%	0.383	C	S	.	.	H	α-helix	trans	-66.6	-27.7	-179.7	-60.9	-16.4	0	0	0	113.7	I572 R581 R583 D588 A589 V604 H607 A608 T611 F612	I572-W585 HydrophobicContact CD1-CB 4.15Å; I572-W585 HydrophobicContact CD1-CD2 4.14Å; I572-W585 HydrophobicContact CD1-CG 3.61Å; I572-W585 VanDerWaalsContact CG1-CD1 3.45Å; I572-W585 HydrophobicContact CG1-CG 4.22Å; I572-W585 HydrophobicContact CG2-CZ2 4.26Å; I572-W585 PolarHBondContact O-NE1 3.18Å; R581-W585 HydrophobicContact CB-CD2 4.33Å; R581-W585 HydrophobicContact CB-CE3 4.42Å; R581-W585 HydrophobicContact CB-CH2 3.94Å; R581-W585 HydrophobicContact CB-CZ2 3.83Å; R581-W585 HydrophobicContact CB-CZ3 4.21Å; R581-W585 HydrophobicContact CG-CH2 4.2Å; R581-W585 HydrophobicContact CG-CZ2 3.82Å; R581-W585 VanDerWaalsContact O-CB 3.32Å; R581-W585 WeakPolarHBondContact O-CB 3.18Å; R581-W585 PolarHBondContact O-N 2.92Å; R583-W585 VanDerWaalsContact C-N 3.31Å; R583-W585 PolarHBondContact O-N 3.38Å; W585-D588 WeakPolarHBondContact CA-OD2 3.44Å; W585-A589 WeakPolarHBondContact O-CB 3.36Å; W585-A589 PolarHBondContact O-N 3.31Å; W585-V604 HydrophobicContact CB-CG1 4.01Å; W585-V604 WeakPolarHBondContact O-CG1 3.32Å; W585-H607 AromaticContact CH2-CE1 3.55Å; W585-H607 AromaticContact CH2-ND1 3.58Å; W585-H607 AromaticContact CZ2-CE1 3.78Å; W585-H607 AromaticContact CZ2-ND1 3.81Å; W585-H607 AromaticContact CZ3-ND1 3.85Å; W585-A608 HydrophobicContact CE3-CB 3.99Å; W585-T611 HydrophobicContact CH2-CG2 4.18Å; W585-T611 HydrophobicContact CZ3-CG2 4.22Å; W585-T611 VanDerWaalsContact CZ3-OG1 3.25Å; W585-T611 WeakPolarHBondContact CZ3-OG1 3.42Å; W585-F612 HydrophobicContact CE3-CD2 4.39Å; W585-F612 AromaticContact CE3-CE2 3.97Å; W585-F612 HydrophobicContact CE3-CE2 3.97Å; W585-F612 HydrophobicContact CH2-CE2 4.46Å; W585-F612 HydrophobicContact CZ3-CD2 4.08Å; W585-F612 AromaticContact CZ3-CE2 3.56Å; W585-F612 HydrophobicContact CZ3-CE2 3.56Å; W585-F612 HydrophobicContact CZ3-CZ 4.48Å
586	M	90.6	Very high	87.2	Confident	22 Å²	22	70.8 Å²	70.8	11%	0.108	36%	0.357	C	S	.	.	H	α-helix	trans	-72.3	-44.6	171.6	-58	-51.6	-65	0	0	110.9	K582 R583 T584 D588 A589 E590 Y605 V618 P621	K582-M586 VanDerWaalsContact O-CG 3.31Å; K582-M586 WeakPolarHBondContact O-CG 3.42Å; K582-M586 PolarHBondContact O-N 3.28Å; R583-M586 PolarHBondContact O-N 3.49Å; R583-M586 VanDerWaalsContact O-N 3.1Å; T584-M586 VanDerWaalsContact C-N 3.3Å; T584-M586 PolarHBondContact O-N 3.02Å; M586-D588 VanDerWaalsContact C-N 3.26Å; M586-D588 PolarHBondContact O-N 3.38Å; M586-A589 PolarHBondContact O-N 2.62Å; M586-E590 WeakPolarHBondContact O-CG 3.29Å; M586-E590 PolarHBondContact O-N 2.98Å; M586-Y605 HydrophobicContact CE-CE1 3.82Å; M586-Y605 HydrophobicContact SD-CE1 4.4Å; M586-V618 HydrophobicContact SD-CB 4.48Å; M586-V618 HydrophobicContact SD-CG1 4.26Å; M586-V618 HydrophobicContact SD-CG2 4.25Å; M586-P621 HydrophobicContact CE-CB 3.53Å; M586-P621 HydrophobicContact CE-CG 3.53Å
587	E	89.6	Confident	87.7	Confident	90 Å²	90	70 Å²	70	42%	0.421	35%	0.354	S	S	.	.	H	α-helix	trans	-60.7	-36.6	175.6	-67	173.7	177.9	0	0	111.1	R583 T584 M591	R583-E587 IonicContact CZ-OE1 2.86Å; R583-E587 IonicContact NE-OE1 3.1Å; R583-E587 PolarHBondContact NE-OE1 2.86Å; R583-E587 IonicContact NH2-OE1 2.9Å; R583-E587 PolarHBondContact NH2-OE1 2.97Å; R583-E587 VanDerWaalsContact NH2-OE1 3.09Å; R583-E587 PolarHBondContact O-N 3.29Å; R583-E587 VanDerWaalsContact O-N 3.09Å; T584-E587 CarbonylContact O-C 3.56Å; T584-E587 PolarHBondContact O-N 3.47Å; T584-E587 VanDerWaalsContact O-N 3.15Å; E587-M591 WeakPolarHBondContact O-CB 3.35Å; E587-M591 PolarHBondContact O-N 3Å
588	D	89.1	Confident	88.1	Confident	9 Å²	9	68.2 Å²	68.2	5%	0.048	34%	0.338	C	S	.	.	H	α-helix	trans	-65.4	-47.9	173.6	-63.9	-37.1	0	0	0	112.8	R545 T584 W585 M586 E590 M591 F592	R545-D588 IonicContact CZ-OD1 3.94Å; R545-D588 IonicContact CZ-OD2 3.55Å; R545-D588 IonicContact NH2-OD1 3.3Å; R545-D588 PolarHBondContact NH2-OD1 2.75Å; R545-D588 IonicContact NH2-OD2 2.7Å; R545-D588 PolarHBondContact NH2-OD2 3.32Å; T584-D588 WeakPolarHBondContact O-CB 3.41Å; T584-D588 PolarHBondContact O-N 2.79Å; W585-D588 WeakPolarHBondContact CA-OD2 3.44Å; M586-D588 VanDerWaalsContact C-N 3.26Å; M586-D588 PolarHBondContact O-N 3.38Å; D588-E590 VanDerWaalsContact C-N 3.28Å; D588-E590 PolarHBondContact O-N 3.43Å; D588-M591 WeakPolarHBondContact O-CB 3.17Å; D588-M591 PolarHBondContact O-N 2.78Å; D588-M591 VanDerWaalsContact O-N 3.16Å; D588-F592 HydrophobicContact CB-CD2 4.45Å; D588-F592 HydrophobicContact CB-CE2 4.24Å; D588-F592 WeakPolarHBondContact O-CD2 3.22Å; D588-F592 WeakPolarHBondContact O-CG 3.38Å; D588-F592 PolarHBondContact O-N 3.45Å
589	A	90.6	Very high	88.6	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-61.5	-41	178.1	0	0	0	0	0	110.7	W585 M586 F592 I593 V604 Y605	W585-A589 WeakPolarHBondContact O-CB 3.36Å; W585-A589 PolarHBondContact O-N 3.31Å; M586-A589 PolarHBondContact O-N 2.62Å; A589-F592 PolarHBondContact O-N 3.24Å; A589-I593 WeakPolarHBondContact O-CB 3.07Å; A589-I593 VanDerWaalsContact O-CD1 3.3Å; A589-I593 WeakPolarHBondContact O-CD1 3.22Å; A589-I593 WeakPolarHBondContact O-CG1 3.45Å; A589-I593 PolarHBondContact O-N 2.97Å; A589-V604 HydrophobicContact CB-CB 4.33Å; A589-V604 HydrophobicContact CB-CG1 3.92Å; A589-Y605 HydrophobicContact CB-CD1 4.41Å; A589-Y605 HydrophobicContact CB-CE1 3.78Å; A589-Y605 HydrophobicContact CB-CE2 3.93Å
590	E	89.7	Confident	89.1	Confident	118 Å²	118	55.5 Å²	55.5	55%	0.551	28%	0.279	S	S	*	.	H	α-helix	trans	-63.9	-40.3	173.4	-71.3	176.9	-168.4	0	0	112	M586 D588 I593 A594	M586-E590 WeakPolarHBondContact O-CG 3.29Å; M586-E590 PolarHBondContact O-N 2.98Å; D588-E590 VanDerWaalsContact C-N 3.28Å; D588-E590 PolarHBondContact O-N 3.43Å; E590-I593 PolarHBondContact O-N 3.31Å; E590-A594 WeakPolarHBondContact O-CB 3.21Å; E590-A594 PolarHBondContact O-N 2.96Å
591	M	89	Confident	89.4	Confident	95 Å²	95	51.3 Å²	51.3	47%	0.468	26%	0.257	S	S	.	.	H	α-helix	trans	-62.7	-43.3	174.1	-168	-162.3	-50.5	0	0	112.3	E587 D588 A594 Q595	E587-M591 WeakPolarHBondContact O-CB 3.35Å; E587-M591 PolarHBondContact O-N 3Å; D588-M591 WeakPolarHBondContact O-CB 3.17Å; D588-M591 PolarHBondContact O-N 2.78Å; D588-M591 VanDerWaalsContact O-N 3.16Å; M591-A594 PolarHBondContact O-N 3.42Å; M591-Q595 WeakPolarHBondContact O-CG 3.33Å; M591-Q595 PolarHBondContact O-N 2.92Å
592	F	89.6	Confident	89.6	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.018	25%	0.254	C	S	.	.	H	α-helix	trans	-65.2	-42.9	176.3	-73.9	-54.4	0	0	0	111.9	L549 M553 D588 A589 A594 Q595 G596 A597 C600 A601 V604	L549-F592 HydrophobicContact CB-CE1 4.38Å; L549-F592 HydrophobicContact CB-CZ 3.92Å; L549-F592 HydrophobicContact CD1-CZ 4.06Å; L549-F592 HydrophobicContact CD2-CZ 4Å; L549-F592 HydrophobicContact CG-CZ 4.17Å; M553-F592 HydrophobicContact CE-CE1 4.3Å; M553-F592 HydrophobicContact CG-CD1 3.72Å; M553-F592 HydrophobicContact CG-CE1 3.57Å; M553-F592 HydrophobicContact SD-CD1 3.57Å; M553-F592 VanDerWaalsContact SD-CD1 3.57Å; M553-F592 HydrophobicContact SD-CE1 3.68Å; D588-F592 HydrophobicContact CB-CD2 4.45Å; D588-F592 HydrophobicContact CB-CE2 4.24Å; D588-F592 WeakPolarHBondContact O-CD2 3.22Å; D588-F592 WeakPolarHBondContact O-CG 3.38Å; D588-F592 PolarHBondContact O-N 3.45Å; A589-F592 PolarHBondContact O-N 3.24Å; F592-A594 VanDerWaalsContact C-N 3.32Å; F592-A594 PolarHBondContact O-N 3.48Å; F592-Q595 CarbonylContact O-C 3.51Å; F592-Q595 PolarHBondContact O-N 3.39Å; F592-G596 PolarHBondContact O-N 2.97Å; F592-A597 HydrophobicContact CB-CB 4.28Å; F592-A597 HydrophobicContact CD1-CB 4.05Å; F592-A597 PolarHBondContact O-N 3.02Å; F592-C600 HydrophobicContact CB-CB 4.39Å; F592-C600 HydrophobicContact CD1-CB 3.66Å; F592-C600 HydrophobicContact CD2-CB 4.15Å; F592-C600 HydrophobicContact CE1-CB 3.88Å; F592-C600 HydrophobicContact CE2-CB 4.35Å; F592-C600 HydrophobicContact CG-CB 3.82Å; F592-C600 HydrophobicContact CZ-CB 4.22Å; F592-A601 HydrophobicContact CB-CB 4.04Å; F592-V604 HydrophobicContact CD2-CG2 3.76Å; F592-V604 HydrophobicContact CE2-CG2 3.59Å
593	I	90	Very high	89.8	Confident	46 Å²	46	48.3 Å²	48.3	24%	0.236	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-42.8	174.1	-67.4	160.1	0	0	0	110.6	A589 E590 Q595 G596 A601 Y605 F625	A589-I593 WeakPolarHBondContact O-CB 3.07Å; A589-I593 VanDerWaalsContact O-CD1 3.3Å; A589-I593 WeakPolarHBondContact O-CD1 3.22Å; A589-I593 WeakPolarHBondContact O-CG1 3.45Å; A589-I593 PolarHBondContact O-N 2.97Å; E590-I593 PolarHBondContact O-N 3.31Å; I593-Q595 VanDerWaalsContact C-N 3.31Å; I593-Q595 PolarHBondContact O-N 2.85Å; I593-G596 PolarHBondContact O-N 2.7Å; I593-A601 HydrophobicContact CG1-CB 3.99Å; I593-Y605 HydrophobicContact CD1-CE2 4.29Å; I593-F625 HydrophobicContact CD1-CD2 3.51Å; I593-F625 HydrophobicContact CD1-CE2 4.14Å; I593-F625 HydrophobicContact CD1-CG 4.34Å; I593-F625 HydrophobicContact CG1-CD2 3.68Å; I593-F625 HydrophobicContact CG1-CE2 3.79Å
594	A	89.6	Confident	89.9	Confident	89 Å²	89	40.9 Å²	40.9	74%	0.736	22%	0.218	S	C	*	.	H	α-helix	trans	-65.3	-31.1	177.3	0	0	0	0	0	113.3	E590 M591 F592	E590-A594 WeakPolarHBondContact O-CB 3.21Å; E590-A594 PolarHBondContact O-N 2.96Å; M591-A594 PolarHBondContact O-N 3.42Å; F592-A594 VanDerWaalsContact C-N 3.32Å; F592-A594 PolarHBondContact O-N 3.48Å
595	Q	88	Confident	90	Very high	106 Å²	106	40 Å²	40	50%	0.495	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-1.4	175.2	-68.1	-176.1	54.2	0	0	113.9	M553 M591 F592 I593	M553-Q595 VanDerWaalsContact CE-OE1 3.3Å; M553-Q595 HydrophobicContact SD-CB 4.19Å; M553-Q595 PolarHBondContact SD-OE1 3.45Å; M591-Q595 WeakPolarHBondContact O-CG 3.33Å; M591-Q595 PolarHBondContact O-N 2.92Å; F592-Q595 CarbonylContact O-C 3.51Å; F592-Q595 PolarHBondContact O-N 3.39Å; I593-Q595 VanDerWaalsContact C-N 3.31Å; I593-Q595 PolarHBondContact O-N 2.85Å
596	G	86.7	Confident	89.9	Confident	35 Å²	35	41.9 Å²	41.9	36%	0.361	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	17.8	-179.7	0	0	0	0	0	115.3	F592 I593 Y598	F592-G596 PolarHBondContact O-N 2.97Å; I593-G596 PolarHBondContact O-N 2.7Å; G596-Y598 PolarHBondContact O-N 3.03Å
597	A	87.9	Confident	89.9	Confident	7 Å²	7	42.9 Å²	42.9	6%	0.058	23%	0.232	C	C	.	.			trans	-95.2	78.5	179.1	0	0	0	0	0	110.8	M553 E556 F592 C600 A601	M553-A597 HydrophobicContact CB-CB 4.48Å; M553-A597 HydrophobicContact CG-CB 3.79Å; M553-A597 HydrophobicContact SD-CB 4.19Å; E556-A597 VanDerWaalsContact OE1-C 3.24Å; E556-A597 WeakPolarHBondContact OE1-CA 3.45Å; E556-A597 VanDerWaalsContact OE2-C 3.27Å; E556-A597 WeakPolarHBondContact OE2-CA 3.37Å; E556-A597 WeakPolarHBondContact OE2-CB 3.43Å; F592-A597 HydrophobicContact CB-CB 4.28Å; F592-A597 HydrophobicContact CD1-CB 4.05Å; F592-A597 PolarHBondContact O-N 3.02Å; A597-C600 HydrophobicContact CB-CB 4.04Å; A597-A601 PolarHBondContact O-N 2.92Å; A597-A601 VanDerWaalsContact O-N 3.15Å
598	Y	90.8	Very high	89.9	Confident	90 Å²	90	38.7 Å²	38.7	35%	0.353	21%	0.213	S	C	.	.	H	α-helix	trans	-73.2	-35.2	-173.1	-52	-59.1	0	0	0	113.1	E556 G596 A601 R602 F625 H629	E556-Y598 PolarHBondContact OE1-N 3.18Å; G596-Y598 PolarHBondContact O-N 3.03Å; Y598-A601 PolarHBondContact O-N 3.3Å; Y598-R602 WeakPolarHBondContact O-CG 3.39Å; Y598-R602 PolarHBondContact O-N 2.89Å; Y598-F625 HydrophobicContact CD1-CE2 4.12Å; Y598-F625 WeakPolarHBondContact O-CZ 3.19Å; Y598-H629 HydrophobicContact CD1-CB 4.22Å; Y598-H629 AromaticContact CD1-CG 3.82Å; Y598-H629 AromaticContact CD1-ND1 3.76Å; Y598-H629 AromaticContact CE1-CE1 3.39Å; Y598-H629 WeakPolarHBondContact CE1-CE1 3.4Å; Y598-H629 AromaticContact CE1-CG 3.81Å; Y598-H629 AromaticContact CE1-ND1 3.27Å; Y598-H629 VanDerWaalsContact CE1-ND1 3.27Å; Y598-H629 WeakPolarHBondContact CE1-ND1 3.41Å; Y598-H629 AromaticContact CE1-NE2 3.98Å; Y598-H629 HydrophobicContact CG-CB 4.5Å; Y598-H629 AromaticContact CZ-CE1 3.89Å; Y598-H629 AromaticContact CZ-ND1 3.64Å
599	E	89.3	Confident	90	Very high	47 Å²	47	39 Å²	39	22%	0.22	21%	0.214	C	C	.	.	H	α-helix	trans	-71.9	-35.7	177.3	-67.1	-59.8	138	0	0	111.9	E556 P561 Q565 R602 A603	E556-E599 VanDerWaalsContact CD-N 3.32Å; E556-E599 HydrophobicContact CG-CB 4.09Å; E556-E599 HydrophobicContact CG-CG 4.48Å; E556-E599 PolarHBondContact OE1-N 3.19Å; E556-E599 PolarHBondContact OE2-N 3.43Å; P561-E599 HydrophobicContact CB-CB 4.29Å; P561-E599 HydrophobicContact CB-CG 3.98Å; Q565-E599 PolarHBondContact NE2-OE2 3.45Å; E599-R602 WeakPolarHBondContact O-CB 3.47Å; E599-R602 PolarHBondContact O-N 3.1Å; E599-R602 IonicContact OE1-CZ 2.81Å; E599-R602 IonicContact OE1-NE 2.71Å; E599-R602 IonicContact OE1-NH1 3.2Å; E599-R602 PolarHBondContact OE1-NH1 3.34Å; E599-A603 PolarHBondContact O-N 3.37Å
600	C	90.1	Very high	89.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-59.7	-47.6	167.9	-65.2	0	0	0	0	110.8	E556 V568 F592 A597 R602 A603 V604	E556-C600 PolarHBondContact OE2-N 3.29Å; E556-C600 PolarHBondContact OE2-SG 3.32Å; V568-C600 HydrophobicContact CG2-CB 4.37Å; F592-C600 HydrophobicContact CB-CB 4.39Å; F592-C600 HydrophobicContact CD1-CB 3.66Å; F592-C600 HydrophobicContact CD2-CB 4.15Å; F592-C600 HydrophobicContact CE1-CB 3.88Å; F592-C600 HydrophobicContact CE2-CB 4.35Å; F592-C600 HydrophobicContact CG-CB 3.82Å; F592-C600 HydrophobicContact CZ-CB 4.22Å; A597-C600 HydrophobicContact CB-CB 4.04Å; C600-R602 PolarHBondContact O-N 2.87Å; C600-A603 WeakPolarHBondContact O-CB 3.35Å; C600-A603 PolarHBondContact O-N 3.45Å; C600-A603 VanDerWaalsContact O-N 3.15Å; C600-V604 WeakPolarHBondContact O-CG2 3.41Å; C600-V604 PolarHBondContact O-N 2.78Å
601	A	91.9	Very high	89.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-40	176.7	0	0	0	0	0	112.7	F592 I593 A597 Y598 A603 V604 Y605 F625	F592-A601 HydrophobicContact CB-CB 4.04Å; I593-A601 HydrophobicContact CG1-CB 3.99Å; A597-A601 PolarHBondContact O-N 2.92Å; A597-A601 VanDerWaalsContact O-N 3.15Å; Y598-A601 PolarHBondContact O-N 3.3Å; A601-A603 PolarHBondContact O-N 3.31Å; A601-V604 WeakPolarHBondContact O-CB 3.41Å; A601-V604 PolarHBondContact O-N 3.05Å; A601-Y605 HydrophobicContact CB-CE2 4.49Å; A601-Y605 WeakPolarHBondContact O-CD2 3.43Å; A601-Y605 PolarHBondContact O-N 2.71Å; A601-F625 HydrophobicContact CB-CE2 3.93Å; A601-F625 HydrophobicContact CB-CZ 4.05Å
602	R	91.4	Very high	89.8	Confident	52 Å²	52	41.9 Å²	41.9	20%	0.196	23%	0.228	C	C	.	.	H	α-helix	trans	-57.6	-46.3	171.6	-77.6	178.6	175.1	112.5	17.2	112.3	Y598 E599 C600 V604 Y605 A606 F625 E626 H629 G630	Y598-R602 WeakPolarHBondContact O-CG 3.39Å; Y598-R602 PolarHBondContact O-N 2.89Å; E599-R602 WeakPolarHBondContact O-CB 3.47Å; E599-R602 PolarHBondContact O-N 3.1Å; E599-R602 IonicContact OE1-CZ 2.81Å; E599-R602 IonicContact OE1-NE 2.71Å; E599-R602 IonicContact OE1-NH1 3.2Å; E599-R602 PolarHBondContact OE1-NH1 3.34Å; C600-R602 PolarHBondContact O-N 2.87Å; R602-V604 VanDerWaalsContact C-N 3.33Å; R602-V604 PolarHBondContact O-N 3.15Å; R602-Y605 PolarHBondContact O-N 2.86Å; R602-A606 VanDerWaalsContact O-CB 3.28Å; R602-A606 WeakPolarHBondContact O-CB 3.48Å; R602-A606 PolarHBondContact O-N 3.28Å; R602-F625 HydrophobicContact CG-CE1 3.55Å; R602-F625 HydrophobicContact CG-CZ 3.95Å; R602-E626 WeakPolarHBondContact CG-OE1 3.29Å; R602-E626 IonicContact CZ-OE1 3.72Å; R602-E626 IonicContact CZ-OE2 3.89Å; R602-E626 IonicContact NE-OE1 2.65Å; R602-E626 PolarHBondContact NE-OE1 3.46Å; R602-E626 IonicContact NE-OE2 3.27Å; R602-E626 PolarHBondContact NE-OE2 2.72Å; R602-E626 IonicContact NH2-OE1 3.4Å; R602-E626 IonicContact NH2-OE2 3.69Å; R602-E626 PolarHBondContact NH2-OE2 3.38Å; R602-H629 VanDerWaalsContact NH2-C 3.34Å; R602-H629 PolarHBondContact NH2-O 3.47Å; R602-G630 VanDerWaalsContact NH2-CA 3.32Å
603	A	90.6	Very high	89.7	Confident	11 Å²	11	44 Å²	44	9%	0.091	24%	0.242	C	C	.	.	H	α-helix	trans	-60.6	-42.6	177.6	0	0	0	0	0	111.9	Q565 V568 E599 C600 A601 H607	Q565-A603 HydrophobicContact CB-CB 4.12Å; Q565-A603 HydrophobicContact CG-CB 3.99Å; V568-A603 HydrophobicContact CB-CB 3.81Å; V568-A603 HydrophobicContact CG1-CB 3.77Å; V568-A603 HydrophobicContact CG2-CB 4.36Å; E599-A603 PolarHBondContact O-N 3.37Å; C600-A603 WeakPolarHBondContact O-CB 3.35Å; C600-A603 PolarHBondContact O-N 3.45Å; C600-A603 VanDerWaalsContact O-N 3.15Å; A601-A603 PolarHBondContact O-N 3.31Å; A603-H607 WeakPolarHBondContact O-CB 3.47Å; A603-H607 PolarHBondContact O-N 2.82Å
604	V	92	Very high	89.4	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-53.1	174.9	175.8	0	0	0	0	110.8	V568 I572 W585 A589 F592 C600 A601 R602 A606 H607 A608	V568-V604 HydrophobicContact CG1-CG2 3.72Å; I572-V604 HydrophobicContact CD1-CB 4.04Å; I572-V604 HydrophobicContact CD1-CG1 3.66Å; I572-V604 HydrophobicContact CD1-CG2 3.72Å; W585-V604 HydrophobicContact CB-CG1 4.01Å; W585-V604 WeakPolarHBondContact O-CG1 3.32Å; A589-V604 HydrophobicContact CB-CB 4.33Å; A589-V604 HydrophobicContact CB-CG1 3.92Å; F592-V604 HydrophobicContact CD2-CG2 3.76Å; F592-V604 HydrophobicContact CE2-CG2 3.59Å; C600-V604 WeakPolarHBondContact O-CG2 3.41Å; C600-V604 PolarHBondContact O-N 2.78Å; A601-V604 WeakPolarHBondContact O-CB 3.41Å; A601-V604 PolarHBondContact O-N 3.05Å; R602-V604 VanDerWaalsContact C-N 3.33Å; R602-V604 PolarHBondContact O-N 3.15Å; V604-A606 PolarHBondContact O-N 2.92Å; V604-H607 PolarHBondContact O-N 2.93Å; V604-A608 WeakPolarHBondContact O-CB 3.49Å; V604-A608 PolarHBondContact O-N 3.38Å
605	Y	91.7	Very high	89.2	Confident	13 Å²	13	49.7 Å²	49.7	5%	0.051	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-44	-180	-72.7	-53.5	0	0	0	112.2	M586 A589 I593 A601 R602 H607 A608 I609 P621 A622 F625	M586-Y605 HydrophobicContact CE-CE1 3.82Å; M586-Y605 HydrophobicContact SD-CE1 4.4Å; A589-Y605 HydrophobicContact CB-CD1 4.41Å; A589-Y605 HydrophobicContact CB-CE1 3.78Å; A589-Y605 HydrophobicContact CB-CE2 3.93Å; I593-Y605 HydrophobicContact CD1-CE2 4.29Å; A601-Y605 HydrophobicContact CB-CE2 4.49Å; A601-Y605 WeakPolarHBondContact O-CD2 3.43Å; A601-Y605 PolarHBondContact O-N 2.71Å; R602-Y605 PolarHBondContact O-N 2.86Å; Y605-H607 VanDerWaalsContact C-N 3.27Å; Y605-H607 PolarHBondContact O-N 2.94Å; Y605-A608 PolarHBondContact O-N 3.21Å; Y605-I609 VanDerWaalsContact O-CB 3.3Å; Y605-I609 WeakPolarHBondContact O-CB 3.38Å; Y605-I609 WeakPolarHBondContact O-CD1 3.27Å; Y605-I609 VanDerWaalsContact O-CG1 3.25Å; Y605-I609 WeakPolarHBondContact O-CG1 3.38Å; Y605-I609 PolarHBondContact O-N 2.98Å; Y605-P621 HydrophobicContact CE1-CB 4.28Å; Y605-A622 HydrophobicContact CD1-CB 3.84Å; Y605-A622 HydrophobicContact CD2-CB 4.45Å; Y605-A622 HydrophobicContact CE1-CB 4.39Å; Y605-A622 HydrophobicContact CG-CB 3.89Å; Y605-F625 HydrophobicContact CD2-CB 4.4Å; Y605-F625 AromaticContact CD2-CD1 3.87Å; Y605-F625 HydrophobicContact CD2-CD1 3.87Å; Y605-F625 HydrophobicContact CD2-CE1 4.41Å; Y605-F625 HydrophobicContact CD2-CG 4.1Å; Y605-F625 HydrophobicContact CE2-CB 3.69Å; Y605-F625 AromaticContact CE2-CD1 3.86Å; Y605-F625 HydrophobicContact CE2-CD1 3.86Å; Y605-F625 HydrophobicContact CE2-CD2 4.09Å; Y605-F625 AromaticContact CE2-CG 3.59Å; Y605-F625 HydrophobicContact CE2-CG 3.59Å
606	A	90.8	Very high	89.2	Confident	45 Å²	45	51.2 Å²	51.2	37%	0.372	26%	0.256	S	S	.	.	H	α-helix	trans	-62.6	-32.3	177.1	0	0	0	0	0	112.8	R602 V604 K610	R602-A606 VanDerWaalsContact O-CB 3.28Å; R602-A606 WeakPolarHBondContact O-CB 3.48Å; R602-A606 PolarHBondContact O-N 3.28Å; V604-A606 PolarHBondContact O-N 2.92Å; A606-K610 WeakPolarHBondContact O-CD 3.25Å; A606-K610 VanDerWaalsContact O-CG 3.26Å; A606-K610 WeakPolarHBondContact O-CG 3.5Å; A606-K610 PolarHBondContact O-N 3.28Å
607	H	89.1	Confident	89.2	Confident	43 Å²	43	51.7 Å²	51.7	20%	0.199	25%	0.254	C	S	.	.	H	α-helix	trans	-74.1	-44.8	173	-170.3	-93.7	0	0	0	112.1	I572 W585 A603 V604 Y605 I609 K610 T611	I572-H607 HydrophobicContact CG2-CB 4.49Å; I572-H607 WeakPolarHBondContact CG2-ND1 3.42Å; W585-H607 AromaticContact CH2-CE1 3.55Å; W585-H607 AromaticContact CH2-ND1 3.58Å; W585-H607 AromaticContact CZ2-CE1 3.78Å; W585-H607 AromaticContact CZ2-ND1 3.81Å; W585-H607 AromaticContact CZ3-ND1 3.85Å; A603-H607 WeakPolarHBondContact O-CB 3.47Å; A603-H607 PolarHBondContact O-N 2.82Å; V604-H607 PolarHBondContact O-N 2.93Å; Y605-H607 VanDerWaalsContact C-N 3.27Å; Y605-H607 PolarHBondContact O-N 2.94Å; H607-I609 VanDerWaalsContact C-N 3.34Å; H607-I609 PolarHBondContact O-N 3.31Å; H607-K610 PolarHBondContact O-N 3.46Å; H607-T611 PolarHBondContact O-N 3.07Å; H607-T611 PolarHBondContact O-OG1 3.2Å
608	A	90.5	Very high	89.3	Confident	2 Å²	2	51.3 Å²	51.3	2%	0.017	25%	0.251	C	S	.	.	H	α-helix	trans	-64.7	-35	178.6	0	0	0	0	0	112.9	W585 V604 Y605 T611 F612 V618	W585-A608 HydrophobicContact CE3-CB 3.99Å; V604-A608 WeakPolarHBondContact O-CB 3.49Å; V604-A608 PolarHBondContact O-N 3.38Å; Y605-A608 PolarHBondContact O-N 3.21Å; A608-T611 WeakPolarHBondContact CA-OG1 3.48Å; A608-T611 PolarHBondContact O-OG1 2.91Å; A608-T611 VanDerWaalsContact O-OG1 3.05Å; A608-F612 WeakPolarHBondContact O-CB 3.26Å; A608-F612 PolarHBondContact O-N 3.2Å; A608-V618 HydrophobicContact CB-CG1 3.77Å
609	I	90.9	Very high	89.3	Confident	15 Å²	15	47.1 Å²	47.1	8%	0.077	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-45.3	175.1	-77.2	165	0	0	0	111.2	Y605 H607 T611 P613 V618 W619 A622	Y605-I609 VanDerWaalsContact O-CB 3.3Å; Y605-I609 WeakPolarHBondContact O-CB 3.38Å; Y605-I609 WeakPolarHBondContact O-CD1 3.27Å; Y605-I609 VanDerWaalsContact O-CG1 3.25Å; Y605-I609 WeakPolarHBondContact O-CG1 3.38Å; Y605-I609 PolarHBondContact O-N 2.98Å; H607-I609 VanDerWaalsContact C-N 3.34Å; H607-I609 PolarHBondContact O-N 3.31Å; I609-T611 PolarHBondContact O-N 3.14Å; I609-P613 WeakPolarHBondContact O-CA 3.37Å; I609-V618 HydrophobicContact CG1-CG1 4.15Å; I609-W619 HydrophobicContact CB-CH2 4.37Å; I609-W619 HydrophobicContact CD1-CE3 3.83Å; I609-W619 HydrophobicContact CD1-CH2 4.38Å; I609-W619 HydrophobicContact CD1-CZ3 3.73Å; I609-W619 HydrophobicContact CG1-CD2 4.28Å; I609-W619 HydrophobicContact CG1-CE3 4Å; I609-W619 HydrophobicContact CG1-CH2 4.28Å; I609-W619 HydrophobicContact CG1-CZ2 4.5Å; I609-W619 HydrophobicContact CG1-CZ3 4.02Å; I609-W619 HydrophobicContact CG2-CE3 4.49Å; I609-W619 HydrophobicContact CG2-CH2 3.25Å; I609-W619 HydrophobicContact CG2-CZ2 3.58Å; I609-W619 HydrophobicContact CG2-CZ3 3.77Å; I609-A622 HydrophobicContact CD1-CB 4.09Å
610	K	89.6	Confident	89.4	Confident	174 Å²	174	46.3 Å²	46.3	76%	0.757	23%	0.231	S	C	*	.	H	α-helix	trans	-65.1	-28.2	180	-75.2	171.4	-174.8	173.8	0	113.3	A606 H607	A606-K610 WeakPolarHBondContact O-CD 3.25Å; A606-K610 VanDerWaalsContact O-CG 3.26Å; A606-K610 WeakPolarHBondContact O-CG 3.5Å; A606-K610 PolarHBondContact O-N 3.28Å; H607-K610 PolarHBondContact O-N 3.46Å
611	T	88.9	Confident	89.4	Confident	62 Å²	62	48.1 Å²	48.1	38%	0.38	24%	0.243	S	C	.	.	H	α-helix	trans	-93.4	-33	-178.6	45.1	0	0	0	0	113.1	W585 H607 A608 I609 P613	W585-T611 HydrophobicContact CH2-CG2 4.18Å; W585-T611 HydrophobicContact CZ3-CG2 4.22Å; W585-T611 VanDerWaalsContact CZ3-OG1 3.25Å; W585-T611 WeakPolarHBondContact CZ3-OG1 3.42Å; H607-T611 PolarHBondContact O-N 3.07Å; H607-T611 PolarHBondContact O-OG1 3.2Å; A608-T611 WeakPolarHBondContact CA-OG1 3.48Å; A608-T611 PolarHBondContact O-OG1 2.91Å; A608-T611 VanDerWaalsContact O-OG1 3.05Å; I609-T611 PolarHBondContact O-N 3.14Å; T611-P613 VanDerWaalsContact C-CD 3.44Å; T611-P613 WeakPolarHBondContact O-CD 3.49Å
612	F	87.5	Confident	89.3	Confident	38 Å²	38	48.1 Å²	48.1	17%	0.167	24%	0.243	C	C	.	.			trans	-125.9	60.7	-179.3	-59.2	-61.7	0	0	0	113.5	R581 K582 W585 A608 E614 K615 V618	R581-F612 HydrophobicContact CB-CE2 4.39Å; R581-F612 HydrophobicContact CB-CZ 4.34Å; K582-F612 HydrophobicContact CB-CD2 4.05Å; K582-F612 HydrophobicContact CB-CE2 3.63Å; K582-F612 HydrophobicContact CB-CZ 4.03Å; K582-F612 HydrophobicContact CG-CD2 4.19Å; K582-F612 HydrophobicContact CG-CE2 4.28Å; W585-F612 HydrophobicContact CE3-CD2 4.39Å; W585-F612 AromaticContact CE3-CE2 3.97Å; W585-F612 HydrophobicContact CE3-CE2 3.97Å; W585-F612 HydrophobicContact CH2-CE2 4.46Å; W585-F612 HydrophobicContact CZ3-CD2 4.08Å; W585-F612 AromaticContact CZ3-CE2 3.56Å; W585-F612 HydrophobicContact CZ3-CE2 3.56Å; W585-F612 HydrophobicContact CZ3-CZ 4.48Å; A608-F612 WeakPolarHBondContact O-CB 3.26Å; A608-F612 PolarHBondContact O-N 3.2Å; F612-E614 VanDerWaalsContact C-N 3.25Å; F612-E614 PolarHBondContact O-N 2.84Å; F612-E614 VanDerWaalsContact O-N 3.13Å; F612-K615 HydrophobicContact CB-CD 4.14Å; F612-K615 HydrophobicContact CB-CG 4.45Å; F612-K615 HydrophobicContact CD1-CD 4.3Å; F612-K615 HydrophobicContact CG-CD 4.33Å; F612-K615 PolarHBondContact O-N 3.24Å; F612-V618 HydrophobicContact CB-CG2 4.5Å
613	P	86.8	Confident	89.2	Confident	47 Å²	47	45.7 Å²	45.7	31%	0.305	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-22.9	-171.7	25.1	-35.3	0	0	0	114.9	I609 T611 W619 K645 C646	I609-P613 WeakPolarHBondContact O-CA 3.37Å; T611-P613 VanDerWaalsContact C-CD 3.44Å; T611-P613 WeakPolarHBondContact O-CD 3.49Å; P613-W619 PolarHBondContact O-NE1 3.5Å; P613-K645 HydrophobicContact CB-CB 4.3Å; P613-K645 HydrophobicContact CB-CD 4.27Å; P613-K645 HydrophobicContact CB-CG 4.13Å; P613-K645 VanDerWaalsContact O-CB 3.3Å; P613-K645 WeakPolarHBondContact O-CB 3.49Å; P613-C646 PolarHBondContact O-SG 3.08Å
614	E	84.3	Confident	89.1	Confident	166 Å²	166	48.6 Å²	48.6	78%	0.776	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-8.1	-174.5	-57.9	-175.9	165.6	0	0	114.5	F612 K616 C646	F612-E614 VanDerWaalsContact C-N 3.25Å; F612-E614 PolarHBondContact O-N 2.84Å; F612-E614 VanDerWaalsContact O-N 3.13Å; E614-K616 PolarHBondContact O-N 2.94Å; E614-C646 PolarHBondContact O-SG 2.94Å; E614-C646 VanDerWaalsContact O-SG 3.34Å
615	K	85.2	Confident	89	Confident	90 Å²	90	48.8 Å²	48.8	39%	0.391	25%	0.246	S	C	.	.			trans	-93.8	102.7	-169.8	-66.4	-177.2	-174.2	168.2	0	111.5	K582 F612 S617 V618	K582-K615 HydrophobicContact CD-CD 4.08Å; F612-K615 HydrophobicContact CB-CD 4.14Å; F612-K615 HydrophobicContact CB-CG 4.45Å; F612-K615 HydrophobicContact CD1-CD 4.3Å; F612-K615 HydrophobicContact CG-CD 4.33Å; F612-K615 PolarHBondContact O-N 3.24Å; K615-S617 PolarHBondContact O-N 3.19Å; K615-V618 HydrophobicContact CB-CG2 4.25Å; K615-V618 PolarHBondContact O-N 2.95Å
616	K	86.6	Confident	88.9	Confident	137 Å²	137	48.8 Å²	48.8	60%	0.596	25%	0.247	S	C	*	.	H	α-helix	trans	-46.2	-31.1	175.6	72.9	176.4	-178.1	178.7	0	114.9	E614 V618 L620 A649	E614-K616 PolarHBondContact O-N 2.94Å; K616-V618 VanDerWaalsContact C-N 3.28Å; K616-V618 PolarHBondContact O-N 2.86Å; K616-L620 WeakPolarHBondContact O-CB 3.47Å; K616-L620 WeakPolarHBondContact O-CG 3.35Å; K616-L620 PolarHBondContact O-N 3.17Å; K616-A649 HydrophobicContact CB-CB 4.25Å
617	S	87.1	Confident	88.7	Confident	45 Å²	45	53.3 Å²	53.3	32%	0.315	25%	0.254	S	S	.	.	H	α-helix	trans	-73.1	-11.5	-178.8	61.7	0	0	0	0	114.9	K582 K615 P621	K582-S617 WeakPolarHBondContact CE-OG 3.19Å; K582-S617 PolarHBondContact NZ-OG 3.35Å; K615-S617 PolarHBondContact O-N 3.19Å; S617-P621 WeakPolarHBondContact O-CD 3.13Å; S617-P621 WeakPolarHBondContact O-CG 3.34Å
618	V	90.4	Very high	88.5	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-93.6	-45.7	173	-177.6	0	0	0	0	109.1	K582 M586 A608 I609 F612 K615 K616 L620 P621 A622	K582-V618 HydrophobicContact CG-CG2 4.25Å; M586-V618 HydrophobicContact SD-CB 4.48Å; M586-V618 HydrophobicContact SD-CG1 4.26Å; M586-V618 HydrophobicContact SD-CG2 4.25Å; A608-V618 HydrophobicContact CB-CG1 3.77Å; I609-V618 HydrophobicContact CG1-CG1 4.15Å; F612-V618 HydrophobicContact CB-CG2 4.5Å; K615-V618 HydrophobicContact CB-CG2 4.25Å; K615-V618 PolarHBondContact O-N 2.95Å; K616-V618 VanDerWaalsContact C-N 3.28Å; K616-V618 PolarHBondContact O-N 2.86Å; V618-L620 PolarHBondContact O-N 2.83Å; V618-P621 WeakPolarHBondContact O-CD 3.34Å; V618-A622 WeakPolarHBondContact O-CB 3.42Å; V618-A622 PolarHBondContact O-N 3.33Å; V618-A622 VanDerWaalsContact O-N 3.16Å
619	W	91.8	Very high	88.1	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.008	29%	0.29	C	S	.	.	H	α-helix	trans	-61.7	-40.9	176.9	-67.5	109.8	0	0	0	114.2	I609 P613 A622 A623 I638 E641 A642 K645 L652	I609-W619 HydrophobicContact CB-CH2 4.37Å; I609-W619 HydrophobicContact CD1-CE3 3.83Å; I609-W619 HydrophobicContact CD1-CH2 4.38Å; I609-W619 HydrophobicContact CD1-CZ3 3.73Å; I609-W619 HydrophobicContact CG1-CD2 4.28Å; I609-W619 HydrophobicContact CG1-CE3 4Å; I609-W619 HydrophobicContact CG1-CH2 4.28Å; I609-W619 HydrophobicContact CG1-CZ2 4.5Å; I609-W619 HydrophobicContact CG1-CZ3 4.02Å; I609-W619 HydrophobicContact CG2-CE3 4.49Å; I609-W619 HydrophobicContact CG2-CH2 3.25Å; I609-W619 HydrophobicContact CG2-CZ2 3.58Å; I609-W619 HydrophobicContact CG2-CZ3 3.77Å; P613-W619 PolarHBondContact O-NE1 3.5Å; W619-A622 PolarHBondContact O-N 3.41Å; W619-A623 VanDerWaalsContact O-CB 3.29Å; W619-A623 WeakPolarHBondContact O-CB 3.44Å; W619-A623 PolarHBondContact O-N 3.07Å; W619-I638 HydrophobicContact CE3-CG2 4.24Å; W619-I638 HydrophobicContact CZ3-CG2 4.23Å; W619-I638 WeakPolarHBondContact CZ3-O 3.49Å; W619-E641 HydrophobicContact CH2-CB 3.7Å; W619-E641 HydrophobicContact CZ3-CB 4.02Å; W619-A642 HydrophobicContact CB-CB 4.25Å; W619-A642 HydrophobicContact CD2-CB 3.53Å; W619-A642 HydrophobicContact CE3-CB 3.29Å; W619-A642 HydrophobicContact CG-CB 4Å; W619-A642 HydrophobicContact CH2-CB 4.3Å; W619-A642 HydrophobicContact CZ3-CB 3.7Å; W619-K645 HydrophobicContact CZ2-CB 4.08Å; W619-K645 HydrophobicContact CZ2-CG 4.02Å; W619-L652 HydrophobicContact CB-CD1 3.7Å; W619-L652 HydrophobicContact CB-CD2 4.18Å; W619-L652 HydrophobicContact CG-CD1 4.37Å
620	L	90.2	Very high	87.6	Confident	30 Å²	30	62.2 Å²	62.2	16%	0.157	30%	0.3	C	S	.	.	H	α-helix	trans	-63.8	-50.7	-178.8	-78.8	168	0	0	0	112.5	K616 V618 A623 H624 I651 L652 M655	K616-L620 WeakPolarHBondContact O-CB 3.47Å; K616-L620 WeakPolarHBondContact O-CG 3.35Å; K616-L620 PolarHBondContact O-N 3.17Å; V618-L620 PolarHBondContact O-N 2.83Å; L620-A623 PolarHBondContact O-N 3.03Å; L620-H624 WeakPolarHBondContact O-CB 3.27Å; L620-H624 PolarHBondContact O-CD2 3.04Å; L620-H624 VanDerWaalsContact O-CG 3.3Å; L620-H624 PolarHBondContact O-N 3.23Å; L620-I651 HydrophobicContact CD2-CB 3.99Å; L620-I651 HydrophobicContact CD2-CG2 3.55Å; L620-L652 HydrophobicContact CD2-CD2 3.65Å; L620-L652 HydrophobicContact CD2-CG 4.03Å; L620-L652 HydrophobicContact CG-CD2 4.04Å; L620-L652 HydrophobicContact CG-CG 4.34Å; L620-M655 HydrophobicContact CD2-SD 4.19Å
621	P	89.5	Confident	87.3	Confident	37 Å²	37	58.2 Å²	58.2	24%	0.24	29%	0.29	C	S	.	.	H	α-helix	trans	-63.9	-38.9	173.9	-26.5	38.6	0	0	0	113.4	M586 Y605 S617 V618 A623 H624 F625	M586-P621 HydrophobicContact CE-CB 3.53Å; M586-P621 HydrophobicContact CE-CG 3.53Å; Y605-P621 HydrophobicContact CE1-CB 4.28Å; S617-P621 WeakPolarHBondContact O-CD 3.13Å; S617-P621 WeakPolarHBondContact O-CG 3.34Å; V618-P621 WeakPolarHBondContact O-CD 3.34Å; P621-A623 PolarHBondContact O-N 2.83Å; P621-H624 CarbonylContact O-C 3.59Å; P621-H624 PolarHBondContact O-N 3.22Å; P621-F625 VanDerWaalsContact O-CB 3.27Å; P621-F625 WeakPolarHBondContact O-CB 3.45Å; P621-F625 PolarHBondContact O-N 3.09Å
622	A	90.4	Very high	86.9	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.008	29%	0.289	C	S	.	.	H	α-helix	trans	-60	-45.7	175.3	0	0	0	0	0	112.1	Y605 I609 V618 W619 F625 E626	Y605-A622 HydrophobicContact CD1-CB 3.84Å; Y605-A622 HydrophobicContact CD2-CB 4.45Å; Y605-A622 HydrophobicContact CE1-CB 4.39Å; Y605-A622 HydrophobicContact CG-CB 3.89Å; I609-A622 HydrophobicContact CD1-CB 4.09Å; V618-A622 WeakPolarHBondContact O-CB 3.42Å; V618-A622 PolarHBondContact O-N 3.33Å; V618-A622 VanDerWaalsContact O-N 3.16Å; W619-A622 PolarHBondContact O-N 3.41Å; A622-F625 WeakPolarHBondContact O-CB 3.33Å; A622-F625 PolarHBondContact O-N 3.37Å; A622-E626 PolarHBondContact O-N 3.31Å
623	A	89.6	Confident	86.9	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-69.2	-32.1	175.8	0	0	0	0	0	112.7	W619 L620 P621 R627 L635 L639 L652 M655	W619-A623 VanDerWaalsContact O-CB 3.29Å; W619-A623 WeakPolarHBondContact O-CB 3.44Å; W619-A623 PolarHBondContact O-N 3.07Å; L620-A623 PolarHBondContact O-N 3.03Å; P621-A623 PolarHBondContact O-N 2.83Å; A623-R627 VanDerWaalsContact O-CB 3.23Å; A623-R627 WeakPolarHBondContact O-CB 3.44Å; A623-R627 PolarHBondContact O-N 3.43Å; A623-L635 HydrophobicContact CB-CD1 4.19Å; A623-L635 VanDerWaalsContact O-CD1 3.27Å; A623-L635 WeakPolarHBondContact O-CD1 3.35Å; A623-L639 HydrophobicContact CB-CD2 3.85Å; A623-L639 HydrophobicContact CB-CG 4.43Å; A623-L652 HydrophobicContact CB-CD2 4.36Å; A623-M655 HydrophobicContact CB-CE 3.56Å
624	H	88.4	Confident	86.9	Confident	72 Å²	72	63.8 Å²	63.8	33%	0.333	31%	0.309	S	S	.	.	H	α-helix	trans	-70.6	-33.2	171.6	-74.5	-40	0	0	0	112.9	L620 P621 K628	L620-H624 WeakPolarHBondContact O-CB 3.27Å; L620-H624 PolarHBondContact O-CD2 3.04Å; L620-H624 VanDerWaalsContact O-CG 3.3Å; L620-H624 PolarHBondContact O-N 3.23Å; P621-H624 CarbonylContact O-C 3.59Å; P621-H624 PolarHBondContact O-N 3.22Å; H624-K628 WeakPolarHBondContact O-CG 3.29Å; H624-K628 PolarHBondContact O-N 3.08Å
625	F	89.9	Confident	87.1	Confident	6 Å²	6	56.7 Å²	56.7	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-67.3	-52.3	175.1	164	-95.8	0	0	0	111	I593 Y598 A601 R602 Y605 P621 A622 R627 K628 H629	I593-F625 HydrophobicContact CD1-CD2 3.51Å; I593-F625 HydrophobicContact CD1-CE2 4.14Å; I593-F625 HydrophobicContact CD1-CG 4.34Å; I593-F625 HydrophobicContact CG1-CD2 3.68Å; I593-F625 HydrophobicContact CG1-CE2 3.79Å; Y598-F625 HydrophobicContact CD1-CE2 4.12Å; Y598-F625 WeakPolarHBondContact O-CZ 3.19Å; A601-F625 HydrophobicContact CB-CE2 3.93Å; A601-F625 HydrophobicContact CB-CZ 4.05Å; R602-F625 HydrophobicContact CG-CE1 3.55Å; R602-F625 HydrophobicContact CG-CZ 3.95Å; Y605-F625 HydrophobicContact CD2-CB 4.4Å; Y605-F625 AromaticContact CD2-CD1 3.87Å; Y605-F625 HydrophobicContact CD2-CD1 3.87Å; Y605-F625 HydrophobicContact CD2-CE1 4.41Å; Y605-F625 HydrophobicContact CD2-CG 4.1Å; Y605-F625 HydrophobicContact CE2-CB 3.69Å; Y605-F625 AromaticContact CE2-CD1 3.86Å; Y605-F625 HydrophobicContact CE2-CD1 3.86Å; Y605-F625 HydrophobicContact CE2-CD2 4.09Å; Y605-F625 AromaticContact CE2-CG 3.59Å; Y605-F625 HydrophobicContact CE2-CG 3.59Å; P621-F625 VanDerWaalsContact O-CB 3.27Å; P621-F625 WeakPolarHBondContact O-CB 3.45Å; P621-F625 PolarHBondContact O-N 3.09Å; A622-F625 WeakPolarHBondContact O-CB 3.33Å; A622-F625 PolarHBondContact O-N 3.37Å; F625-R627 VanDerWaalsContact C-N 3.27Å; F625-R627 PolarHBondContact O-N 3.4Å; F625-K628 WeakPolarHBondContact O-CA 3.33Å; F625-K628 WeakPolarHBondContact O-CB 3.28Å; F625-K628 PolarHBondContact O-N 3.12Å; F625-H629 AromaticContact CD2-CD2 3.75Å; F625-H629 HydrophobicContact CE2-CB 4.15Å; F625-H629 AromaticContact CE2-CD2 3.87Å; F625-H629 HydrophobicContact CZ-CB 4.35Å; F625-H629 PolarHBondContact O-N 3.43Å
626	E	89.1	Confident	87.2	Confident	13 Å²	13	53.5 Å²	53.5	6%	0.061	26%	0.263	C	S	.	.	H	α-helix	trans	-66.8	-28.7	177.1	-65.6	-62.4	174.4	0	0	112.3	R602 A622 K628 G630 L635 I638	R602-E626 WeakPolarHBondContact CG-OE1 3.29Å; R602-E626 IonicContact CZ-OE1 3.72Å; R602-E626 IonicContact CZ-OE2 3.89Å; R602-E626 IonicContact NE-OE1 2.65Å; R602-E626 PolarHBondContact NE-OE1 3.46Å; R602-E626 IonicContact NE-OE2 3.27Å; R602-E626 PolarHBondContact NE-OE2 2.72Å; R602-E626 IonicContact NH2-OE1 3.4Å; R602-E626 IonicContact NH2-OE2 3.69Å; R602-E626 PolarHBondContact NH2-OE2 3.38Å; A622-E626 PolarHBondContact O-N 3.31Å; E626-K628 PolarHBondContact O-N 3.33Å; E626-G630 WeakPolarHBondContact O-CA 3.38Å; E626-G630 PolarHBondContact O-N 3.36Å; E626-G630 WeakPolarHBondContact OE2-CA 3.41Å; E626-L635 HydrophobicContact CB-CB 4.2Å; E626-L635 HydrophobicContact CB-CD1 4.21Å; E626-I638 HydrophobicContact CG-CD1 3.72Å
627	R	86.1	Confident	87.4	Confident	139 Å²	139	50.5 Å²	50.5	53%	0.525	26%	0.256	S	S	.	.	H	α-helix	trans	-64.8	-22.1	170	-166.9	-172.4	71	166.1	5.7	113.3	A623 F625 L635	A623-R627 VanDerWaalsContact O-CB 3.23Å; A623-R627 WeakPolarHBondContact O-CB 3.44Å; A623-R627 PolarHBondContact O-N 3.43Å; F625-R627 VanDerWaalsContact C-N 3.27Å; F625-R627 PolarHBondContact O-N 3.4Å; R627-L635 HydrophobicContact CB-CD1 4.38Å; R627-L635 HydrophobicContact CB-CD2 4.04Å; R627-L635 HydrophobicContact CG-CD2 4.2Å
628	K	85.1	Confident	87.6	Confident	155 Å²	155	49.9 Å²	49.9	67%	0.674	25%	0.249	S	C	*	.	H	α-helix	trans	-96.5	-42	178.6	-75.3	178.5	176.2	-175.6	0	113.3	H624 F625 E626	H624-K628 WeakPolarHBondContact O-CG 3.29Å; H624-K628 PolarHBondContact O-N 3.08Å; F625-K628 WeakPolarHBondContact O-CA 3.33Å; F625-K628 WeakPolarHBondContact O-CB 3.28Å; F625-K628 PolarHBondContact O-N 3.12Å; E626-K628 PolarHBondContact O-N 3.33Å
629	H	83.8	Confident	87.6	Confident	65 Å²	65	49.9 Å²	49.9	30%	0.301	25%	0.249	S	C	.	.	H	α-helix	trans	-123.5	-2.7	-168.4	-56	-77	0	0	0	113.7	Y598 R602 F625	Y598-H629 HydrophobicContact CD1-CB 4.22Å; Y598-H629 AromaticContact CD1-CG 3.82Å; Y598-H629 AromaticContact CD1-ND1 3.76Å; Y598-H629 AromaticContact CE1-CE1 3.39Å; Y598-H629 WeakPolarHBondContact CE1-CE1 3.4Å; Y598-H629 AromaticContact CE1-CG 3.81Å; Y598-H629 AromaticContact CE1-ND1 3.27Å; Y598-H629 VanDerWaalsContact CE1-ND1 3.27Å; Y598-H629 WeakPolarHBondContact CE1-ND1 3.41Å; Y598-H629 AromaticContact CE1-NE2 3.98Å; Y598-H629 HydrophobicContact CG-CB 4.5Å; Y598-H629 AromaticContact CZ-CE1 3.89Å; Y598-H629 AromaticContact CZ-ND1 3.64Å; R602-H629 VanDerWaalsContact NH2-C 3.34Å; R602-H629 PolarHBondContact NH2-O 3.47Å; F625-H629 AromaticContact CD2-CD2 3.75Å; F625-H629 HydrophobicContact CE2-CB 4.15Å; F625-H629 AromaticContact CE2-CD2 3.87Å; F625-H629 HydrophobicContact CZ-CB 4.35Å; F625-H629 PolarHBondContact O-N 3.43Å
630	G	78.8	Confident	87.5	Confident	28 Å²	28	55.3 Å²	55.3	29%	0.289	27%	0.274	S	S	.	.	S	Bend	trans	-93.1	164.8	-171.6	0	0	0	0	0	115.5	R602 E626	R602-G630 VanDerWaalsContact NH2-CA 3.32Å; E626-G630 WeakPolarHBondContact O-CA 3.38Å; E626-G630 PolarHBondContact O-N 3.36Å; E626-G630 WeakPolarHBondContact OE2-CA 3.41Å
631	T	84.2	Confident	87.5	Confident	89 Å²	89	59 Å²	59	55%	0.546	29%	0.29	S	S	.	.			trans	-71.6	147.9	156.1	67.3	0	0	0	0	108.7	E633 A634 L635	T631-E633 PolarHBondContact O-N 3.35Å; T631-A634 PolarHBondContact O-N 2.83Å; T631-A634 WeakPolarHBondContact OG1-CB 3.43Å; T631-A634 PolarHBondContact OG1-N 2.84Å; T631-L635 PolarHBondContact O-N 3.15Å; T631-L635 VanDerWaalsContact O-N 3.12Å
632	R	81.2	Confident	87.5	Confident	91 Å²	91	57.2 Å²	57.2	34%	0.343	28%	0.279	S	S	.	.	H	α-helix	trans	-55.8	-37.3	175	-176.3	-167.1	165.7	82.2	29.1	112.3	L635 E636 S659 L662 S663	R632-L635 PolarHBondContact O-N 3.45Å; R632-E636 IonicContact CZ-OE1 2.65Å; R632-E636 VanDerWaalsContact CZ-OE1 3.28Å; R632-E636 IonicContact NE-OE1 2.68Å; R632-E636 PolarHBondContact NE-OE1 2.86Å; R632-E636 IonicContact NH2-OE1 3.43Å; R632-E636 PolarHBondContact NH2-OE1 3.34Å; R632-E636 WeakPolarHBondContact O-CG 3.11Å; R632-E636 PolarHBondContact O-N 3.38Å; R632-S659 PolarHBondContact NH1-O 3.22Å; R632-S659 PolarHBondContact NH2-O 3.13Å; R632-L662 PolarHBondContact NH1-O 2.92Å; R632-S663 VanDerWaalsContact NH1-N 3.12Å; R632-S663 VanDerWaalsContact NH2-CB 3.26Å; R632-S663 PolarHBondContact NH2-OG 2.92Å
633	E	86.7	Confident	87.3	Confident	150 Å²	150	58 Å²	58	70%	0.701	28%	0.284	S	S	*	.	H	α-helix	trans	-66.5	-43.4	178.4	-63.9	173.9	175.5	0	0	111.6	T631 L635 E636 T637	T631-E633 PolarHBondContact O-N 3.35Å; E633-L635 VanDerWaalsContact C-N 3.3Å; E633-L635 PolarHBondContact O-N 2.66Å; E633-E636 PolarHBondContact O-N 3.39Å; E633-E636 VanDerWaalsContact O-N 3.1Å; E633-T637 PolarHBondContact O-N 2.76Å; E633-T637 PolarHBondContact O-OG1 3.29Å
634	A	86.8	Confident	87.2	Confident	24 Å²	24	62 Å²	62	20%	0.198	31%	0.311	C	S	.	.	H	α-helix	trans	-62.7	-36.2	174.8	0	0	0	0	0	112.4	T631 T637 I638	T631-A634 PolarHBondContact O-N 2.83Å; T631-A634 WeakPolarHBondContact OG1-CB 3.43Å; T631-A634 PolarHBondContact OG1-N 2.84Å; A634-T637 PolarHBondContact O-OG1 3.28Å; A634-T637 VanDerWaalsContact O-OG1 3.08Å; A634-I638 WeakPolarHBondContact O-CB 3.14Å; A634-I638 WeakPolarHBondContact O-CG1 3.09Å; A634-I638 PolarHBondContact O-N 2.79Å
635	L	88	Confident	87.2	Confident	16 Å²	16	64.3 Å²	64.3	8%	0.084	32%	0.32	C	S	.	.	H	α-helix	trans	-64.8	-40.7	172	178.6	63.7	0	0	0	111.8	A623 E626 R627 T631 R632 E633 L639	A623-L635 HydrophobicContact CB-CD1 4.19Å; A623-L635 VanDerWaalsContact O-CD1 3.27Å; A623-L635 WeakPolarHBondContact O-CD1 3.35Å; E626-L635 HydrophobicContact CB-CB 4.2Å; E626-L635 HydrophobicContact CB-CD1 4.21Å; R627-L635 HydrophobicContact CB-CD1 4.38Å; R627-L635 HydrophobicContact CB-CD2 4.04Å; R627-L635 HydrophobicContact CG-CD2 4.2Å; T631-L635 PolarHBondContact O-N 3.15Å; T631-L635 VanDerWaalsContact O-N 3.12Å; R632-L635 PolarHBondContact O-N 3.45Å; E633-L635 VanDerWaalsContact C-N 3.3Å; E633-L635 PolarHBondContact O-N 2.66Å; L635-L639 HydrophobicContact CD1-CD1 3.73Å; L635-L639 HydrophobicContact CD1-CG 4.11Å; L635-L639 HydrophobicContact CG-CD1 3.78Å; L635-L639 HydrophobicContact CG-CG 4.5Å; L635-L639 VanDerWaalsContact O-CB 3.27Å; L635-L639 WeakPolarHBondContact O-CB 3.47Å; L635-L639 WeakPolarHBondContact O-CD1 3.49Å; L635-L639 WeakPolarHBondContact O-CG 3.22Å; L635-L639 PolarHBondContact O-N 3.35Å
636	E	88.5	Confident	86.9	Confident	24 Å²	24	64.5 Å²	64.5	11%	0.112	32%	0.322	C	S	.	.	H	α-helix	trans	-69	-41.3	179.1	-73	177.9	-167.7	0	0	112.4	R632 E633 L639 E640 Y656 K660	R632-E636 IonicContact CZ-OE1 2.65Å; R632-E636 VanDerWaalsContact CZ-OE1 3.28Å; R632-E636 IonicContact NE-OE1 2.68Å; R632-E636 PolarHBondContact NE-OE1 2.86Å; R632-E636 IonicContact NH2-OE1 3.43Å; R632-E636 PolarHBondContact NH2-OE1 3.34Å; R632-E636 WeakPolarHBondContact O-CG 3.11Å; R632-E636 PolarHBondContact O-N 3.38Å; E633-E636 PolarHBondContact O-N 3.39Å; E633-E636 VanDerWaalsContact O-N 3.1Å; E636-L639 PolarHBondContact O-N 2.95Å; E636-E640 WeakPolarHBondContact O-CB 3.47Å; E636-E640 PolarHBondContact O-N 2.89Å; E636-Y656 HydrophobicContact CB-CE2 4.31Å; E636-Y656 HydrophobicContact CG-CE2 4.37Å; E636-K660 VanDerWaalsContact OE2-CE 3.25Å; E636-K660 WeakPolarHBondContact OE2-CE 3.39Å; E636-K660 IonicContact OE2-NZ 3.54Å; E636-K660 PolarHBondContact OE2-NZ 3.1Å
637	T	90.4	Very high	86.7	Confident	74 Å²	74	66.7 Å²	66.7	45%	0.454	34%	0.338	S	S	.	.	H	α-helix	trans	-66.2	-45.1	175.8	55.9	0	0	0	0	112.1	E633 A634 L639 E640 E641	E633-T637 PolarHBondContact O-N 2.76Å; E633-T637 PolarHBondContact O-OG1 3.29Å; A634-T637 PolarHBondContact O-OG1 3.28Å; A634-T637 VanDerWaalsContact O-OG1 3.08Å; T637-L639 VanDerWaalsContact C-N 3.29Å; T637-L639 PolarHBondContact O-N 3.2Å; T637-E640 PolarHBondContact O-N 3.04Å; T637-E641 PolarHBondContact O-N 3.25Å
638	I	90.3	Very high	86.5	Confident	31 Å²	31	68.9 Å²	68.9	16%	0.159	35%	0.351	C	S	.	.	H	α-helix	trans	-62.9	-37.3	176.3	-78.3	162.1	0	0	0	111.1	W619 E626 A634 A642	W619-I638 HydrophobicContact CE3-CG2 4.24Å; W619-I638 HydrophobicContact CZ3-CG2 4.23Å; W619-I638 WeakPolarHBondContact CZ3-O 3.49Å; E626-I638 HydrophobicContact CG-CD1 3.72Å; A634-I638 WeakPolarHBondContact O-CB 3.14Å; A634-I638 WeakPolarHBondContact O-CG1 3.09Å; A634-I638 PolarHBondContact O-N 2.79Å; I638-A642 WeakPolarHBondContact O-CB 2.97Å; I638-A642 PolarHBondContact O-N 2.92Å
639	L	89.9	Confident	86.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-71.8	-34.5	176.6	-74.6	170.4	0	0	0	113	A623 L635 E636 T637 A642 V643 L652 M655 Y656	A623-L639 HydrophobicContact CB-CD2 3.85Å; A623-L639 HydrophobicContact CB-CG 4.43Å; L635-L639 HydrophobicContact CD1-CD1 3.73Å; L635-L639 HydrophobicContact CD1-CG 4.11Å; L635-L639 HydrophobicContact CG-CD1 3.78Å; L635-L639 HydrophobicContact CG-CG 4.5Å; L635-L639 VanDerWaalsContact O-CB 3.27Å; L635-L639 WeakPolarHBondContact O-CB 3.47Å; L635-L639 WeakPolarHBondContact O-CD1 3.49Å; L635-L639 WeakPolarHBondContact O-CG 3.22Å; L635-L639 PolarHBondContact O-N 3.35Å; E636-L639 PolarHBondContact O-N 2.95Å; T637-L639 VanDerWaalsContact C-N 3.29Å; T637-L639 PolarHBondContact O-N 3.2Å; L639-A642 PolarHBondContact O-N 3.42Å; L639-V643 VanDerWaalsContact O-CB 3.28Å; L639-V643 WeakPolarHBondContact O-CB 3.39Å; L639-V643 VanDerWaalsContact O-CG2 3.31Å; L639-V643 WeakPolarHBondContact O-CG2 3.3Å; L639-V643 PolarHBondContact O-N 3.18Å; L639-L652 HydrophobicContact CD2-CD2 4.09Å; L639-M655 HydrophobicContact CD1-CB 4.23Å; L639-M655 HydrophobicContact CD2-CB 4.08Å; L639-Y656 HydrophobicContact CB-CD2 3.83Å; L639-Y656 HydrophobicContact CB-CG 3.93Å; L639-Y656 HydrophobicContact CD1-CD2 4.34Å
640	E	90.4	Very high	86.7	Confident	117 Å²	117	62.4 Å²	62.4	55%	0.547	33%	0.326	S	S	.	.	H	α-helix	trans	-64.4	-47.4	172.2	-179.4	166.5	-145.9	0	0	111.6	E636 T637 A642 V643 S644 Y656	E636-E640 WeakPolarHBondContact O-CB 3.47Å; E636-E640 PolarHBondContact O-N 2.89Å; T637-E640 PolarHBondContact O-N 3.04Å; E640-A642 PolarHBondContact O-N 3.44Å; E640-V643 PolarHBondContact O-N 2.93Å; E640-S644 PolarHBondContact O-N 3.26Å; E640-S644 VanDerWaalsContact O-N 3.09Å; E640-Y656 HydrophobicContact CB-CE1 4.5Å
641	E	89.5	Confident	87.2	Confident	106 Å²	106	65.7 Å²	65.7	50%	0.495	34%	0.336	S	S	.	.	H	α-helix	trans	-59.4	-46.4	172.5	-69.7	-170.3	174.5	0	0	111.3	W619 T637 V643 S644 K645	W619-E641 HydrophobicContact CH2-CB 3.7Å; W619-E641 HydrophobicContact CZ3-CB 4.02Å; T637-E641 PolarHBondContact O-N 3.25Å; E641-V643 VanDerWaalsContact C-N 3.34Å; E641-V643 PolarHBondContact O-N 2.87Å; E641-S644 PolarHBondContact O-N 3.3Å; E641-S644 VanDerWaalsContact O-N 3.14Å; E641-S644 PolarHBondContact O-OG 2.86Å; E641-K645 PolarHBondContact O-N 3.25Å; E641-K645 VanDerWaalsContact O-N 3.16Å
642	A	89.7	Confident	87.5	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-60.3	-43.1	-179.3	0	0	0	0	0	112.2	W619 I638 L639 E640 S644 K645 C646 L652	W619-A642 HydrophobicContact CB-CB 4.25Å; W619-A642 HydrophobicContact CD2-CB 3.53Å; W619-A642 HydrophobicContact CE3-CB 3.29Å; W619-A642 HydrophobicContact CG-CB 4Å; W619-A642 HydrophobicContact CH2-CB 4.3Å; W619-A642 HydrophobicContact CZ3-CB 3.7Å; I638-A642 WeakPolarHBondContact O-CB 2.97Å; I638-A642 PolarHBondContact O-N 2.92Å; L639-A642 PolarHBondContact O-N 3.42Å; E640-A642 PolarHBondContact O-N 3.44Å; A642-S644 VanDerWaalsContact C-N 3.33Å; A642-K645 PolarHBondContact O-N 3.06Å; A642-C646 WeakPolarHBondContact O-CA 3.43Å; A642-C646 WeakPolarHBondContact O-CB 3.16Å; A642-C646 PolarHBondContact O-N 3.47Å; A642-L652 HydrophobicContact CB-CD1 4.12Å
643	V	87.4	Confident	88	Confident	19 Å²	19	57.8 Å²	57.8	12%	0.115	30%	0.296	C	S	.	.	H	α-helix	trans	-61.6	-41.3	175.8	153.5	0	0	0	0	111.3	L639 E640 E641 K645 W653 Y656	L639-V643 VanDerWaalsContact O-CB 3.28Å; L639-V643 WeakPolarHBondContact O-CB 3.39Å; L639-V643 VanDerWaalsContact O-CG2 3.31Å; L639-V643 WeakPolarHBondContact O-CG2 3.3Å; L639-V643 PolarHBondContact O-N 3.18Å; E640-V643 PolarHBondContact O-N 2.93Å; E641-V643 VanDerWaalsContact C-N 3.34Å; E641-V643 PolarHBondContact O-N 2.87Å; V643-K645 VanDerWaalsContact C-N 3.31Å; V643-K645 PolarHBondContact O-N 3.48Å; V643-W653 HydrophobicContact CB-CH2 4.42Å; V643-W653 HydrophobicContact CB-CZ2 4.48Å; V643-W653 HydrophobicContact CB-CZ3 4.47Å; V643-W653 HydrophobicContact CG1-CD2 4.34Å; V643-W653 HydrophobicContact CG1-CE3 4.05Å; V643-W653 HydrophobicContact CG1-CH2 3.22Å; V643-W653 HydrophobicContact CG1-CZ2 3.52Å; V643-W653 HydrophobicContact CG1-CZ3 3.49Å; V643-W653 VanDerWaalsContact CG1-CZ3 3.49Å; V643-W653 HydrophobicContact CG2-CD2 3.81Å; V643-W653 HydrophobicContact CG2-CE3 3.8Å; V643-W653 HydrophobicContact CG2-CG 4.36Å; V643-W653 HydrophobicContact CG2-CH2 4.43Å; V643-W653 HydrophobicContact CG2-CZ2 4.41Å; V643-W653 HydrophobicContact CG2-CZ3 4.12Å; V643-Y656 HydrophobicContact CG2-CD1 4.25Å
644	S	87.9	Confident	88.1	Confident	82 Å²	82	52.8 Å²	52.8	57%	0.573	27%	0.274	S	S	*	.	H	α-helix	trans	-65.5	-31.8	178.8	81.4	0	0	0	0	113.5	E640 E641 A642	E640-S644 PolarHBondContact O-N 3.26Å; E640-S644 VanDerWaalsContact O-N 3.09Å; E641-S644 PolarHBondContact O-N 3.3Å; E641-S644 VanDerWaalsContact O-N 3.14Å; E641-S644 PolarHBondContact O-OG 2.86Å; A642-S644 VanDerWaalsContact C-N 3.33Å
645	K	87.9	Confident	88.2	Confident	121 Å²	121	52.8 Å²	52.8	53%	0.526	27%	0.27	S	S	.	.	H	α-helix	trans	-96.5	-32.1	-177.3	-58.8	-57.6	-177.2	-178.9	0	113.9	P613 W619 E641 A642 V643 P647	P613-K645 HydrophobicContact CB-CB 4.3Å; P613-K645 HydrophobicContact CB-CD 4.27Å; P613-K645 HydrophobicContact CB-CG 4.13Å; P613-K645 VanDerWaalsContact O-CB 3.3Å; P613-K645 WeakPolarHBondContact O-CB 3.49Å; W619-K645 HydrophobicContact CZ2-CB 4.08Å; W619-K645 HydrophobicContact CZ2-CG 4.02Å; E641-K645 PolarHBondContact O-N 3.25Å; E641-K645 VanDerWaalsContact O-N 3.16Å; A642-K645 PolarHBondContact O-N 3.06Å; V643-K645 VanDerWaalsContact C-N 3.31Å; V643-K645 PolarHBondContact O-N 3.48Å; K645-P647 VanDerWaalsContact C-CD 3.41Å; K645-P647 WeakPolarHBondContact O-CD 3.45Å
646	C	83.9	Confident	88.3	Confident	10 Å²	10	53.2 Å²	53.2	7%	0.068	27%	0.271	C	S	.	.			trans	-122.2	61.1	-174.5	-74.8	0	0	0	0	112.2	P613 E614 A642 K648 A649 L652	P613-C646 PolarHBondContact O-SG 3.08Å; E614-C646 PolarHBondContact O-SG 2.94Å; E614-C646 VanDerWaalsContact O-SG 3.34Å; A642-C646 WeakPolarHBondContact O-CA 3.43Å; A642-C646 WeakPolarHBondContact O-CB 3.16Å; A642-C646 PolarHBondContact O-N 3.47Å; C646-K648 PolarHBondContact O-N 3.01Å; C646-K648 VanDerWaalsContact O-N 3.12Å; C646-A649 HydrophobicContact CB-CB 4.13Å; C646-A649 WeakPolarHBondContact O-CB 3.34Å; C646-A649 PolarHBondContact O-N 2.79Å; C646-L652 HydrophobicContact CB-CD1 4.37Å
647	P	83.5	Confident	88.4	Confident	60 Å²	60	52.3 Å²	52.3	39%	0.39	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-27.4	-172.7	24.6	-35.1	0	0	0	113.9	K645 A649 W653 N680	K645-P647 VanDerWaalsContact C-CD 3.41Å; K645-P647 WeakPolarHBondContact O-CD 3.45Å; P647-A649 VanDerWaalsContact C-N 3.26Å; P647-A649 PolarHBondContact O-N 2.83Å; P647-W653 PolarHBondContact O-NE1 2.75Å; P647-N680 PolarHBondContact O-ND2 3.11Å
648	K	83.5	Confident	88.3	Confident	184 Å²	184	52 Å²	52	80%	0.8	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-3	178.7	-60.6	-176.8	-178.9	178.7	0	114.6	C646 E650	C646-K648 PolarHBondContact O-N 3.01Å; C646-K648 VanDerWaalsContact O-N 3.12Å; K648-E650 PolarHBondContact O-N 3.41Å
649	A	85.1	Confident	88.2	Confident	14 Å²	14	50.9 Å²	50.9	12%	0.116	26%	0.255	C	S	.	.			trans	-92	80.6	-173.9	0	0	0	0	0	111.5	K616 C646 P647 I651 L652	K616-A649 HydrophobicContact CB-CB 4.25Å; C646-A649 HydrophobicContact CB-CB 4.13Å; C646-A649 WeakPolarHBondContact O-CB 3.34Å; C646-A649 PolarHBondContact O-N 2.79Å; P647-A649 VanDerWaalsContact C-N 3.26Å; P647-A649 PolarHBondContact O-N 2.83Å; A649-I651 PolarHBondContact O-N 3.37Å; A649-I651 VanDerWaalsContact O-N 3.09Å; A649-L652 HydrophobicContact CB-CB 4.45Å; A649-L652 HydrophobicContact CB-CD1 3.69Å; A649-L652 HydrophobicContact CB-CG 4.19Å; A649-L652 WeakPolarHBondContact O-CB 3.26Å; A649-L652 PolarHBondContact O-N 2.68Å
650	E	87.3	Confident	88.1	Confident	70 Å²	70	53 Å²	53	33%	0.327	26%	0.264	S	S	.	.	H	α-helix	trans	-47.9	-40.7	-176.5	-58.3	177.1	-160.3	0	0	113.9	K648 L652 W653 L654 S683 I686	K648-E650 PolarHBondContact O-N 3.41Å; E650-L652 VanDerWaalsContact C-N 3.28Å; E650-L652 PolarHBondContact O-N 3.44Å; E650-W653 WeakPolarHBondContact O-CB 3.46Å; E650-W653 PolarHBondContact O-N 2.69Å; E650-L654 VanDerWaalsContact O-CG 3.29Å; E650-L654 WeakPolarHBondContact O-CG 3.34Å; E650-L654 PolarHBondContact O-N 3.23Å; E650-S683 VanDerWaalsContact CD-CB 3.45Å; E650-S683 WeakPolarHBondContact OE2-CB 3.09Å; E650-S683 PolarHBondContact OE2-OG 2.93Å; E650-I686 HydrophobicContact CB-CD1 4.37Å; E650-I686 HydrophobicContact CG-CD1 4.2Å
651	I	89.2	Confident	88	Confident	98 Å²	98	50 Å²	50	50%	0.503	25%	0.248	S	C	.	.	H	α-helix	trans	-61.2	-35.3	-179.9	-57.3	172.7	0	0	0	112	L620 A649 L654 M655	L620-I651 HydrophobicContact CD2-CB 3.99Å; L620-I651 HydrophobicContact CD2-CG2 3.55Å; A649-I651 PolarHBondContact O-N 3.37Å; A649-I651 VanDerWaalsContact O-N 3.09Å; I651-L654 PolarHBondContact O-N 2.97Å; I651-M655 HydrophobicContact CG2-SD 4.32Å; I651-M655 WeakPolarHBondContact O-CB 3.44Å; I651-M655 WeakPolarHBondContact O-CG 3.22Å; I651-M655 PolarHBondContact O-N 2.88Å
652	L	90.1	Very high	87.8	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-70.8	-40.2	178.9	-65.7	170	0	0	0	111	W619 L620 A623 L639 A642 C646 A649 E650 L654 M655 Y656	W619-L652 HydrophobicContact CB-CD1 3.7Å; W619-L652 HydrophobicContact CB-CD2 4.18Å; W619-L652 HydrophobicContact CG-CD1 4.37Å; L620-L652 HydrophobicContact CD2-CD2 3.65Å; L620-L652 HydrophobicContact CD2-CG 4.03Å; L620-L652 HydrophobicContact CG-CD2 4.04Å; L620-L652 HydrophobicContact CG-CG 4.34Å; A623-L652 HydrophobicContact CB-CD2 4.36Å; L639-L652 HydrophobicContact CD2-CD2 4.09Å; A642-L652 HydrophobicContact CB-CD1 4.12Å; C646-L652 HydrophobicContact CB-CD1 4.37Å; A649-L652 HydrophobicContact CB-CB 4.45Å; A649-L652 HydrophobicContact CB-CD1 3.69Å; A649-L652 HydrophobicContact CB-CG 4.19Å; A649-L652 WeakPolarHBondContact O-CB 3.26Å; A649-L652 PolarHBondContact O-N 2.68Å; E650-L652 VanDerWaalsContact C-N 3.28Å; E650-L652 PolarHBondContact O-N 3.44Å; L652-L654 VanDerWaalsContact C-N 3.34Å; L652-L654 PolarHBondContact O-N 3.13Å; L652-M655 PolarHBondContact O-N 3.31Å; L652-Y656 WeakPolarHBondContact O-CB 3.3Å; L652-Y656 PolarHBondContact O-N 2.65Å
653	W	91.3	Very high	87.5	Confident	13 Å²	13	53.5 Å²	53.5	5%	0.049	27%	0.274	C	S	.	.	H	α-helix	trans	-58.9	-44.7	170.4	-70.3	105.3	0	0	0	112.2	V643 P647 E650 Y656 A657 I672 L675 A676 S679	V643-W653 HydrophobicContact CB-CH2 4.42Å; V643-W653 HydrophobicContact CB-CZ2 4.48Å; V643-W653 HydrophobicContact CB-CZ3 4.47Å; V643-W653 HydrophobicContact CG1-CD2 4.34Å; V643-W653 HydrophobicContact CG1-CE3 4.05Å; V643-W653 HydrophobicContact CG1-CH2 3.22Å; V643-W653 HydrophobicContact CG1-CZ2 3.52Å; V643-W653 HydrophobicContact CG1-CZ3 3.49Å; V643-W653 VanDerWaalsContact CG1-CZ3 3.49Å; V643-W653 HydrophobicContact CG2-CD2 3.81Å; V643-W653 HydrophobicContact CG2-CE3 3.8Å; V643-W653 HydrophobicContact CG2-CG 4.36Å; V643-W653 HydrophobicContact CG2-CH2 4.43Å; V643-W653 HydrophobicContact CG2-CZ2 4.41Å; V643-W653 HydrophobicContact CG2-CZ3 4.12Å; P647-W653 PolarHBondContact O-NE1 2.75Å; E650-W653 WeakPolarHBondContact O-CB 3.46Å; E650-W653 PolarHBondContact O-N 2.69Å; W653-Y656 PolarHBondContact O-N 2.68Å; W653-A657 WeakPolarHBondContact O-CB 3.34Å; W653-A657 PolarHBondContact O-N 3.23Å; W653-I672 HydrophobicContact CE3-CG2 3.93Å; W653-I672 HydrophobicContact CZ3-CG2 4.3Å; W653-L675 HydrophobicContact CH2-CB 3.65Å; W653-L675 HydrophobicContact CZ3-CB 3.59Å; W653-A676 HydrophobicContact CB-CB 3.93Å; W653-A676 HydrophobicContact CD2-CB 3.61Å; W653-A676 HydrophobicContact CE3-CB 3.59Å; W653-A676 HydrophobicContact CG-CB 3.81Å; W653-A676 HydrophobicContact CZ3-CB 4.22Å; W653-S679 WeakPolarHBondContact CZ2-OG 3.49Å
654	L	90.2	Very high	87.3	Confident	45 Å²	45	55.3 Å²	55.3	24%	0.236	30%	0.297	C	S	.	.	H	α-helix	trans	-64.9	-38.3	177.5	-66.6	172.5	0	0	0	112.1	E650 I651 L652 K658 D685 I686 A689	E650-L654 VanDerWaalsContact O-CG 3.29Å; E650-L654 WeakPolarHBondContact O-CG 3.34Å; E650-L654 PolarHBondContact O-N 3.23Å; I651-L654 PolarHBondContact O-N 2.97Å; L652-L654 VanDerWaalsContact C-N 3.34Å; L652-L654 PolarHBondContact O-N 3.13Å; L654-K658 VanDerWaalsContact O-CB 3.23Å; L654-K658 WeakPolarHBondContact O-CB 3.13Å; L654-K658 PolarHBondContact O-N 3.27Å; L654-D685 HydrophobicContact CD1-CB 3.96Å; L654-I686 HydrophobicContact CD2-CG1 4.4Å; L654-A689 HydrophobicContact CD2-CB 3.28Å
655	M	87.4	Confident	87.3	Confident	24 Å²	24	54.4 Å²	54.4	12%	0.118	29%	0.286	C	S	.	.	H	α-helix	trans	-65.3	-40.6	172.5	-75.9	179.8	64.2	0	0	111.8	L620 A623 L639 I651 L652 K658 S659	L620-M655 HydrophobicContact CD2-SD 4.19Å; A623-M655 HydrophobicContact CB-CE 3.56Å; L639-M655 HydrophobicContact CD1-CB 4.23Å; L639-M655 HydrophobicContact CD2-CB 4.08Å; I651-M655 HydrophobicContact CG2-SD 4.32Å; I651-M655 WeakPolarHBondContact O-CB 3.44Å; I651-M655 WeakPolarHBondContact O-CG 3.22Å; I651-M655 PolarHBondContact O-N 2.88Å; L652-M655 PolarHBondContact O-N 3.31Å; M655-K658 PolarHBondContact O-N 3.02Å; M655-S659 WeakPolarHBondContact O-CB 3.34Å; M655-S659 PolarHBondContact O-N 2.7Å
656	Y	90.6	Very high	87.3	Confident	24 Å²	24	49.8 Å²	49.8	9%	0.094	27%	0.267	C	S	.	.	H	α-helix	trans	-69.4	-44.8	179.6	-168.3	-154.2	0	0	0	112	E636 L639 E640 V643 L652 W653 S659 K660 I672	E636-Y656 HydrophobicContact CB-CE2 4.31Å; E636-Y656 HydrophobicContact CG-CE2 4.37Å; L639-Y656 HydrophobicContact CB-CD2 3.83Å; L639-Y656 HydrophobicContact CB-CG 3.93Å; L639-Y656 HydrophobicContact CD1-CD2 4.34Å; E640-Y656 HydrophobicContact CB-CE1 4.5Å; V643-Y656 HydrophobicContact CG2-CD1 4.25Å; L652-Y656 WeakPolarHBondContact O-CB 3.3Å; L652-Y656 PolarHBondContact O-N 2.65Å; W653-Y656 PolarHBondContact O-N 2.68Å; Y656-S659 WeakPolarHBondContact O-CB 3.27Å; Y656-S659 PolarHBondContact O-N 3.46Å; Y656-K660 HydrophobicContact CE2-CG 4.17Å; Y656-K660 PolarHBondContact O-N 2.96Å; Y656-I672 HydrophobicContact CD1-CB 4.34Å; Y656-I672 HydrophobicContact CD1-CD1 3.6Å; Y656-I672 HydrophobicContact CD1-CG1 3.79Å; Y656-I672 HydrophobicContact CD1-CG2 3.57Å; Y656-I672 HydrophobicContact CD2-CD1 3.92Å; Y656-I672 HydrophobicContact CE1-CD1 3.47Å; Y656-I672 VanDerWaalsContact CE1-CD1 3.47Å; Y656-I672 HydrophobicContact CE1-CG1 3.61Å; Y656-I672 HydrophobicContact CE1-CG2 4.25Å; Y656-I672 HydrophobicContact CE2-CD1 3.77Å; Y656-I672 HydrophobicContact CG-CD1 3.81Å; Y656-I672 HydrophobicContact CG-CG1 4.45Å; Y656-I672 HydrophobicContact CG-CG2 4.07Å
657	A	91	Very high	87.6	Confident	5 Å²	5	55.6 Å²	55.6	4%	0.041	29%	0.294	C	S	.	.	H	α-helix	trans	-61.6	-42.8	173.4	0	0	0	0	0	112.2	W653 W661 S669 I672 L673	W653-A657 WeakPolarHBondContact O-CB 3.34Å; W653-A657 PolarHBondContact O-N 3.23Å; A657-W661 VanDerWaalsContact O-CB 3.24Å; A657-W661 WeakPolarHBondContact O-CB 3.41Å; A657-W661 PolarHBondContact O-N 3.14Å; A657-S669 PolarHBondContact O-OG 3.15Å; A657-I672 HydrophobicContact CB-CG2 4.25Å; A657-L673 HydrophobicContact CB-CD1 4.28Å; A657-L673 HydrophobicContact CB-CD2 3.75Å; A657-L673 HydrophobicContact CB-CG 3.77Å
658	K	87.6	Confident	88	Confident	67 Å²	67	53.2 Å²	53.2	29%	0.291	28%	0.28	S	S	.	.	H	α-helix	trans	-65.9	-38	174.7	-172.6	177.9	-179.7	-177.3	0	111.5	L654 M655 W661 L662 E947	L654-K658 VanDerWaalsContact O-CB 3.23Å; L654-K658 WeakPolarHBondContact O-CB 3.13Å; L654-K658 PolarHBondContact O-N 3.27Å; M655-K658 PolarHBondContact O-N 3.02Å; K658-W661 HydrophobicContact CG-CE3 4.47Å; K658-L662 HydrophobicContact CG-CD1 4.13Å; K658-L662 VanDerWaalsContact O-CG 3.3Å; K658-L662 WeakPolarHBondContact O-CG 3.43Å; K658-L662 PolarHBondContact O-N 3Å; K658-L662 VanDerWaalsContact O-N 3.09Å; K658-E947 IonicContact NZ-OE1 3.76Å; K658-E947 PolarHBondContact NZ-OE1 3.27Å; K658-E947 IonicContact NZ-OE2 2.74Å; K658-E947 PolarHBondContact NZ-OE2 3.19Å
659	S	88.1	Confident	88.3	Confident	9 Å²	9	44.5 Å²	44.5	6%	0.063	24%	0.242	C	C	.	.	H	α-helix	trans	-57.7	-66.5	174.5	-171.8	0	0	0	0	109.8	R632 M655 Y656 W661 L662 S663	R632-S659 PolarHBondContact NH1-O 3.22Å; R632-S659 PolarHBondContact NH2-O 3.13Å; M655-S659 WeakPolarHBondContact O-CB 3.34Å; M655-S659 PolarHBondContact O-N 2.7Å; Y656-S659 WeakPolarHBondContact O-CB 3.27Å; Y656-S659 PolarHBondContact O-N 3.46Å; S659-W661 PolarHBondContact O-N 3.47Å; S659-W661 VanDerWaalsContact O-N 3.11Å; S659-L662 WeakPolarHBondContact O-CA 3.47Å; S659-L662 WeakPolarHBondContact O-CB 3.21Å; S659-L662 PolarHBondContact O-N 3.02Å; S659-S663 PolarHBondContact O-N 3.35Å
660	K	88.8	Confident	88.5	Confident	45 Å²	45	46.4 Å²	46.4	20%	0.196	25%	0.246	C	C	.	.	H	α-helix	trans	-55.3	-33.2	-179.7	-71.4	-63.6	-169.3	-178.7	0	113.7	E636 Y656 L662 S663 D665 I672	E636-K660 VanDerWaalsContact OE2-CE 3.25Å; E636-K660 WeakPolarHBondContact OE2-CE 3.39Å; E636-K660 IonicContact OE2-NZ 3.54Å; E636-K660 PolarHBondContact OE2-NZ 3.1Å; Y656-K660 HydrophobicContact CE2-CG 4.17Å; Y656-K660 PolarHBondContact O-N 2.96Å; K660-L662 PolarHBondContact O-N 3.39Å; K660-S663 PolarHBondContact O-N 2.86Å; K660-S663 PolarHBondContact O-OG 2.94Å; K660-D665 CarbonylContact O-C 3.52Å; K660-D665 PolarHBondContact O-N 2.9Å; K660-D665 VanDerWaalsContact O-N 3.15Å; K660-I672 HydrophobicContact CB-CD1 4.13Å; K660-I672 HydrophobicContact CG-CD1 3.43Å; K660-I672 VanDerWaalsContact CG-CD1 3.43Å
661	W	89.1	Confident	88.8	Confident	53 Å²	53	49.7 Å²	49.7	20%	0.201	26%	0.26	C	S	.	.	H	α-helix	trans	-64.8	-38.9	174.5	176.8	36.3	0	0	0	112.5	A657 K658 S659 S663 G664 L693 E696	A657-W661 VanDerWaalsContact O-CB 3.24Å; A657-W661 WeakPolarHBondContact O-CB 3.41Å; A657-W661 PolarHBondContact O-N 3.14Å; K658-W661 HydrophobicContact CG-CE3 4.47Å; S659-W661 PolarHBondContact O-N 3.47Å; S659-W661 VanDerWaalsContact O-N 3.11Å; W661-S663 VanDerWaalsContact C-N 3.26Å; W661-S663 PolarHBondContact O-N 3.34Å; W661-G664 PolarHBondContact O-N 3.44Å; W661-L693 HydrophobicContact CB-CD1 3.98Å; W661-L693 VanDerWaalsContact CD1-CD1 3.43Å; W661-L693 HydrophobicContact CD2-CD1 3.86Å; W661-L693 HydrophobicContact CG-CD1 3.46Å; W661-L693 VanDerWaalsContact CG-CD1 3.46Å; W661-E696 WeakPolarHBondContact CH2-OE2 3.3Å; W661-E696 HydrophobicContact CZ2-CB 4.2Å; W661-E696 WeakPolarHBondContact CZ2-OE2 3.35Å
662	L	84.7	Confident	88.9	Confident	117 Å²	117	45.5 Å²	45.5	61%	0.613	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-7	175.3	-69.3	170.1	0	0	0	114.8	R632 K658 S659 K660 G664	R632-L662 PolarHBondContact NH1-O 2.92Å; K658-L662 HydrophobicContact CG-CD1 4.13Å; K658-L662 VanDerWaalsContact O-CG 3.3Å; K658-L662 WeakPolarHBondContact O-CG 3.43Å; K658-L662 PolarHBondContact O-N 3Å; K658-L662 VanDerWaalsContact O-N 3.09Å; S659-L662 WeakPolarHBondContact O-CA 3.47Å; S659-L662 WeakPolarHBondContact O-CB 3.21Å; S659-L662 PolarHBondContact O-N 3.02Å; K660-L662 PolarHBondContact O-N 3.39Å; L662-G664 VanDerWaalsContact C-N 3.32Å
663	S	83.1	Confident	88.8	Confident	62 Å²	62	45.8 Å²	45.8	43%	0.434	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-5	164.8	41.7	0	0	0	0	112.7	R632 S659 K660 W661 D665	R632-S663 VanDerWaalsContact NH1-N 3.12Å; R632-S663 VanDerWaalsContact NH2-CB 3.26Å; R632-S663 PolarHBondContact NH2-OG 2.92Å; S659-S663 PolarHBondContact O-N 3.35Å; K660-S663 PolarHBondContact O-N 2.86Å; K660-S663 PolarHBondContact O-OG 2.94Å; W661-S663 VanDerWaalsContact C-N 3.26Å; W661-S663 PolarHBondContact O-N 3.34Å; S663-D665 VanDerWaalsContact C-N 3.27Å
664	G	82.9	Confident	88.8	Confident	58 Å²	58	47.4 Å²	47.4	60%	0.598	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	-1	-164.2	0	0	0	0	0	113.7	W661 L662 V666	W661-G664 PolarHBondContact O-N 3.44Å; L662-G664 VanDerWaalsContact C-N 3.32Å; G664-V666 PolarHBondContact O-N 2.94Å
665	D	88.1	Confident	88.8	Confident	63 Å²	63	49.5 Å²	49.5	34%	0.337	27%	0.267	S	S	.	.			trans	-79.9	73.4	173.7	-173.6	15.3	0	0	0	111.8	K660 S663 Q667 G668 S669	K660-D665 CarbonylContact O-C 3.52Å; K660-D665 PolarHBondContact O-N 2.9Å; K660-D665 VanDerWaalsContact O-N 3.15Å; S663-D665 VanDerWaalsContact C-N 3.27Å; D665-Q667 PolarHBondContact O-N 3.31Å; D665-Q667 PolarHBondContact OD1-N 3.26Å; D665-G668 VanDerWaalsContact CG-N 3.28Å; D665-G668 PolarHBondContact O-N 3.1Å; D665-G668 PolarHBondContact OD1-N 2.92Å; D665-G668 VanDerWaalsContact OD2-CA 3.27Å; D665-G668 WeakPolarHBondContact OD2-CA 3.28Å; D665-G668 PolarHBondContact OD2-N 3.12Å; D665-S669 PolarHBondContact O-N 2.98Å
666	V	88.4	Confident	88.9	Confident	23 Å²	23	48.3 Å²	48.3	14%	0.139	26%	0.261	C	S	.	.	H	α-helix	trans	-60.7	-32.2	173.6	-176	0	0	0	0	111.1	G664 R670 L693 N697	G664-V666 PolarHBondContact O-N 2.94Å; V666-R670 WeakPolarHBondContact O-CG 3.16Å; V666-R670 PolarHBondContact O-N 3.33Å; V666-L693 HydrophobicContact CG1-CD1 4.33Å; V666-L693 HydrophobicContact CG1-CG 4.45Å; V666-N697 WeakPolarHBondContact CG1-ND2 3.49Å; V666-N697 WeakPolarHBondContact CG2-OD1 3.36Å
667	Q	90.3	Very high	88.8	Confident	133 Å²	133	49.1 Å²	49.1	62%	0.621	27%	0.265	S	S	*	.	H	α-helix	trans	-73.7	-42.5	-178.9	-62.1	-166.3	17	0	0	111.8	D665 R670 K671	D665-Q667 PolarHBondContact O-N 3.31Å; D665-Q667 PolarHBondContact OD1-N 3.26Å; Q667-R670 PolarHBondContact O-N 3.41Å; Q667-K671 WeakPolarHBondContact O-CG 3.45Å; Q667-K671 PolarHBondContact O-N 3.36Å
668	G	90.3	Very high	88.6	Confident	9 Å²	9	56.3 Å²	56.3	9%	0.093	30%	0.298	C	S	.	.	H	α-helix	trans	-60.1	-45.3	170.6	0	0	0	0	0	111.8	D665 R670 K671 I672	D665-G668 VanDerWaalsContact CG-N 3.28Å; D665-G668 PolarHBondContact O-N 3.1Å; D665-G668 PolarHBondContact OD1-N 2.92Å; D665-G668 VanDerWaalsContact OD2-CA 3.27Å; D665-G668 WeakPolarHBondContact OD2-CA 3.28Å; D665-G668 PolarHBondContact OD2-N 3.12Å; G668-R670 VanDerWaalsContact C-N 3.35Å; G668-R670 PolarHBondContact O-N 2.93Å; G668-K671 PolarHBondContact O-N 3.05Å; G668-K671 VanDerWaalsContact O-N 3.14Å; G668-I672 WeakPolarHBondContact O-CG1 3.47Å; G668-I672 PolarHBondContact O-N 3.32Å
669	S	90.5	Very high	88.5	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.014	30%	0.298	C	S	.	.	H	α-helix	trans	-58.1	-43.6	175.3	-168.4	0	0	0	0	112.4	A657 D665 I672 L673	A657-S669 PolarHBondContact O-OG 3.15Å; D665-S669 PolarHBondContact O-N 2.98Å; S669-I672 PolarHBondContact O-N 2.74Å; S669-L673 WeakPolarHBondContact O-CG 3.35Å; S669-L673 PolarHBondContact O-N 3.25Å
670	R	90.4	Very high	88.3	Confident	54 Å²	54	55.6 Å²	55.6	20%	0.204	30%	0.3	C	S	.	.	H	α-helix	trans	-60.7	-44	172.6	-74.9	172.3	178.8	131.1	5.1	113.2	V666 Q667 G668 I672 L673 A674 L693 E694 Q699	V666-R670 WeakPolarHBondContact O-CG 3.16Å; V666-R670 PolarHBondContact O-N 3.33Å; Q667-R670 PolarHBondContact O-N 3.41Å; G668-R670 VanDerWaalsContact C-N 3.35Å; G668-R670 PolarHBondContact O-N 2.93Å; R670-I672 VanDerWaalsContact C-N 3.34Å; R670-L673 PolarHBondContact O-N 3.29Å; R670-A674 WeakPolarHBondContact O-CB 3.12Å; R670-A674 PolarHBondContact O-N 2.73Å; R670-L693 HydrophobicContact CG-CD2 3.87Å; R670-E694 IonicContact CZ-OE1 2.66Å; R670-E694 IonicContact CZ-OE2 3.61Å; R670-E694 IonicContact NE-OE1 2.68Å; R670-E694 PolarHBondContact NE-OE1 2.87Å; R670-E694 IonicContact NE-OE2 3.59Å; R670-E694 PolarHBondContact NE-OE2 2.99Å; R670-E694 IonicContact NH2-OE1 3.89Å; R670-E694 IonicContact NH2-OE2 3.47Å; R670-E694 PolarHBondContact NH2-OE2 3.35Å; R670-Q699 VanDerWaalsContact NH2-NE2 3.16Å
671	K	92.1	Very high	87.9	Confident	139 Å²	139	56.9 Å²	56.9	60%	0.604	31%	0.313	S	S	*	.	H	α-helix	trans	-61.2	-43.3	177.2	-72	170.6	-177.6	175.9	0	111.1	Q667 G668 A674 L675	Q667-K671 WeakPolarHBondContact O-CG 3.45Å; Q667-K671 PolarHBondContact O-N 3.36Å; G668-K671 PolarHBondContact O-N 3.05Å; G668-K671 VanDerWaalsContact O-N 3.14Å; K671-A674 WeakPolarHBondContact O-CB 3.23Å; K671-A674 PolarHBondContact O-N 2.77Å; K671-L675 WeakPolarHBondContact O-CG 3.44Å; K671-L675 PolarHBondContact O-N 2.78Å
672	I	91.5	Very high	87.4	Confident	9 Å²	9	60.1 Å²	60.1	5%	0.046	33%	0.334	C	S	.	.	H	α-helix	trans	-63.4	-44.7	176.9	-68.4	161.6	0	0	0	111	W653 Y656 A657 K660 G668 S669 R670 A674 L675 A676	W653-I672 HydrophobicContact CE3-CG2 3.93Å; W653-I672 HydrophobicContact CZ3-CG2 4.3Å; Y656-I672 HydrophobicContact CD1-CB 4.34Å; Y656-I672 HydrophobicContact CD1-CD1 3.6Å; Y656-I672 HydrophobicContact CD1-CG1 3.79Å; Y656-I672 HydrophobicContact CD1-CG2 3.57Å; Y656-I672 HydrophobicContact CD2-CD1 3.92Å; Y656-I672 HydrophobicContact CE1-CD1 3.47Å; Y656-I672 VanDerWaalsContact CE1-CD1 3.47Å; Y656-I672 HydrophobicContact CE1-CG1 3.61Å; Y656-I672 HydrophobicContact CE1-CG2 4.25Å; Y656-I672 HydrophobicContact CE2-CD1 3.77Å; Y656-I672 HydrophobicContact CG-CD1 3.81Å; Y656-I672 HydrophobicContact CG-CG1 4.45Å; Y656-I672 HydrophobicContact CG-CG2 4.07Å; A657-I672 HydrophobicContact CB-CG2 4.25Å; K660-I672 HydrophobicContact CB-CD1 4.13Å; K660-I672 HydrophobicContact CG-CD1 3.43Å; K660-I672 VanDerWaalsContact CG-CD1 3.43Å; G668-I672 WeakPolarHBondContact O-CG1 3.47Å; G668-I672 PolarHBondContact O-N 3.32Å; S669-I672 PolarHBondContact O-N 2.74Å; R670-I672 VanDerWaalsContact C-N 3.34Å; I672-A674 VanDerWaalsContact C-N 3.31Å; I672-A674 PolarHBondContact O-N 3.04Å; I672-L675 PolarHBondContact O-N 2.8Å; I672-A676 WeakPolarHBondContact O-CB 3.45Å; I672-A676 PolarHBondContact O-N 3.18Å
673	L	89.5	Confident	87.4	Confident	7 Å²	7	54.8 Å²	54.8	4%	0.037	31%	0.307	C	S	.	.	H	α-helix	trans	-65.5	-33.6	176	-70.2	170.1	0	0	0	112.3	A657 S669 R670 A676 F677 I686 A689 A690 L693	A657-L673 HydrophobicContact CB-CD1 4.28Å; A657-L673 HydrophobicContact CB-CD2 3.75Å; A657-L673 HydrophobicContact CB-CG 3.77Å; S669-L673 WeakPolarHBondContact O-CG 3.35Å; S669-L673 PolarHBondContact O-N 3.25Å; R670-L673 PolarHBondContact O-N 3.29Å; L673-A676 WeakPolarHBondContact O-CB 3.3Å; L673-A676 PolarHBondContact O-N 2.95Å; L673-F677 WeakPolarHBondContact O-CD2 3.4Å; L673-F677 WeakPolarHBondContact O-CG 3.42Å; L673-F677 PolarHBondContact O-N 3.41Å; L673-I686 HydrophobicContact CD2-CG2 4.12Å; L673-A689 HydrophobicContact CD2-CB 4.49Å; L673-A690 HydrophobicContact CD1-CB 4.11Å; L673-L693 HydrophobicContact CD1-CD2 3.81Å
674	A	89.9	Confident	87.6	Confident	48 Å²	48	55.1 Å²	55.1	40%	0.397	30%	0.301	S	S	.	.	H	α-helix	trans	-63.4	-41.2	172.3	0	0	0	0	0	112.5	R670 K671 I672 A676 F677 Q678	R670-A674 WeakPolarHBondContact O-CB 3.12Å; R670-A674 PolarHBondContact O-N 2.73Å; K671-A674 WeakPolarHBondContact O-CB 3.23Å; K671-A674 PolarHBondContact O-N 2.77Å; I672-A674 VanDerWaalsContact C-N 3.31Å; I672-A674 PolarHBondContact O-N 3.04Å; A674-A676 VanDerWaalsContact C-N 3.34Å; A674-F677 PolarHBondContact O-N 3.22Å; A674-Q678 WeakPolarHBondContact O-CG 3.32Å; A674-Q678 PolarHBondContact O-N 2.88Å; A674-Q678 VanDerWaalsContact O-N 3.16Å
675	L	90.5	Very high	87.8	Confident	88 Å²	88	55.4 Å²	55.4	46%	0.461	29%	0.289	S	S	.	.	H	α-helix	trans	-67.1	-34.4	171.6	-65	169.7	0	0	0	112	W653 K671 I672 Q678 S679	W653-L675 HydrophobicContact CH2-CB 3.65Å; W653-L675 HydrophobicContact CZ3-CB 3.59Å; K671-L675 WeakPolarHBondContact O-CG 3.44Å; K671-L675 PolarHBondContact O-N 2.78Å; I672-L675 PolarHBondContact O-N 2.8Å; L675-Q678 PolarHBondContact O-N 3.22Å; L675-S679 PolarHBondContact O-N 3.4Å; L675-S679 VanDerWaalsContact O-N 3.14Å; L675-S679 PolarHBondContact O-OG 2.97Å; L675-S679 VanDerWaalsContact O-OG 3.05Å
676	A	89.6	Confident	87.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-65.3	-37.2	174.4	0	0	0	0	0	111.9	W653 I672 L673 A674 S679 N680 I686	W653-A676 HydrophobicContact CB-CB 3.93Å; W653-A676 HydrophobicContact CD2-CB 3.61Å; W653-A676 HydrophobicContact CE3-CB 3.59Å; W653-A676 HydrophobicContact CG-CB 3.81Å; W653-A676 HydrophobicContact CZ3-CB 4.22Å; I672-A676 WeakPolarHBondContact O-CB 3.45Å; I672-A676 PolarHBondContact O-N 3.18Å; L673-A676 WeakPolarHBondContact O-CB 3.3Å; L673-A676 PolarHBondContact O-N 2.95Å; A674-A676 VanDerWaalsContact C-N 3.34Å; A676-S679 WeakPolarHBondContact CA-OG 3.33Å; A676-S679 PolarHBondContact O-N 2.89Å; A676-S679 PolarHBondContact O-OG 3.3Å; A676-N680 PolarHBondContact O-N 3.35Å; A676-I686 HydrophobicContact CB-CD1 3.97Å; A676-I686 HydrophobicContact CB-CG2 3.93Å
677	F	87.9	Confident	88	Confident	41 Å²	41	52.3 Å²	52.3	18%	0.18	27%	0.27	C	S	.	.	H	α-helix	trans	-68.4	-35	172.3	-70.9	-55.9	0	0	0	113.2	L673 A674 S679 P681 I686 W687 A690	L673-F677 WeakPolarHBondContact O-CD2 3.4Å; L673-F677 WeakPolarHBondContact O-CG 3.42Å; L673-F677 PolarHBondContact O-N 3.41Å; A674-F677 PolarHBondContact O-N 3.22Å; F677-S679 VanDerWaalsContact C-N 3.3Å; F677-S679 PolarHBondContact O-N 2.91Å; F677-P681 WeakPolarHBondContact O-CA 3.48Å; F677-I686 HydrophobicContact CD1-CG2 3.82Å; F677-I686 HydrophobicContact CE1-CB 4.31Å; F677-I686 HydrophobicContact CE1-CG2 3.57Å; F677-I686 HydrophobicContact CE2-CG2 4.45Å; F677-I686 HydrophobicContact CG-CG2 4.36Å; F677-I686 HydrophobicContact CZ-CG2 3.91Å; F677-W687 HydrophobicContact CD1-CD2 4.3Å; F677-W687 HydrophobicContact CD1-CZ2 4.17Å; F677-W687 HydrophobicContact CE1-CB 4.45Å; F677-W687 AromaticContact CE1-CD2 3.39Å; F677-W687 HydrophobicContact CE1-CD2 3.39Å; F677-W687 AromaticContact CE1-CE2 3.56Å; F677-W687 AromaticContact CE1-CE3 3.69Å; F677-W687 HydrophobicContact CE1-CE3 3.69Å; F677-W687 AromaticContact CE1-CG 3.76Å; F677-W687 HydrophobicContact CE1-CG 3.76Å; F677-W687 HydrophobicContact CE1-CH2 4.26Å; F677-W687 HydrophobicContact CE1-CZ2 4Å; F677-W687 HydrophobicContact CE1-CZ3 4.12Å; F677-W687 AromaticContact CE1-NE1 3.94Å; F677-W687 AromaticContact CZ-CD2 3.87Å; F677-W687 HydrophobicContact CZ-CD2 3.87Å; F677-W687 AromaticContact CZ-CE3 3.67Å; F677-W687 HydrophobicContact CZ-CE3 3.67Å; F677-W687 HydrophobicContact CZ-CG 4.4Å; F677-W687 HydrophobicContact CZ-CH2 4.49Å; F677-W687 HydrophobicContact CZ-CZ3 4.01Å; F677-A690 HydrophobicContact CE2-CB 3.99Å; F677-A690 HydrophobicContact CZ-CB 3.77Å
678	Q	87	Confident	87.9	Confident	155 Å²	155	46.8 Å²	46.8	72%	0.724	25%	0.245	S	C	*	.	H	α-helix	trans	-65.5	-33.9	175	-71.3	175.4	2.7	0	0	112.3	A674 L675	A674-Q678 WeakPolarHBondContact O-CG 3.32Å; A674-Q678 PolarHBondContact O-N 2.88Å; A674-Q678 VanDerWaalsContact O-N 3.16Å; L675-Q678 PolarHBondContact O-N 3.22Å
679	S	85.4	Confident	87.8	Confident	42 Å²	42	47.6 Å²	47.6	29%	0.294	25%	0.251	S	S	.	.	H	α-helix	trans	-86.2	-35.3	178.3	49.6	0	0	0	0	113.7	W653 L675 A676 F677	W653-S679 WeakPolarHBondContact CZ2-OG 3.49Å; L675-S679 PolarHBondContact O-N 3.4Å; L675-S679 VanDerWaalsContact O-N 3.14Å; L675-S679 PolarHBondContact O-OG 2.97Å; L675-S679 VanDerWaalsContact O-OG 3.05Å; A676-S679 WeakPolarHBondContact CA-OG 3.33Å; A676-S679 PolarHBondContact O-N 2.89Å; A676-S679 PolarHBondContact O-OG 3.3Å; F677-S679 VanDerWaalsContact C-N 3.3Å; F677-S679 PolarHBondContact O-N 2.91Å
680	N	85.7	Confident	87.7	Confident	19 Å²	19	47.8 Å²	47.8	10%	0.102	25%	0.252	C	S	.	.			trans	-136.1	75.1	-174.6	-55.6	-73.3	0	0	0	111.4	P647 A676 N682 S683 I686	P647-N680 PolarHBondContact O-ND2 3.11Å; A676-N680 PolarHBondContact O-N 3.35Å; N680-N682 VanDerWaalsContact C-N 3.25Å; N680-N682 PolarHBondContact O-N 2.93Å; N680-S683 PolarHBondContact O-N 3.06Å; N680-I686 HydrophobicContact CB-CD1 3.84Å
681	P	78.6	Confident	87.7	Confident	72 Å²	72	45.7 Å²	45.7	47%	0.468	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.3	-174.7	23.7	-34.1	0	0	0	114.1	F677 W687	F677-P681 WeakPolarHBondContact O-CA 3.48Å; P681-W687 PolarHBondContact O-NE1 2.76Å; P681-W687 VanDerWaalsContact O-NE1 3.13Å
682	N	80	Confident	87.5	Confident	122 Å²	122	43.9 Å²	43.9	65%	0.652	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	0.9	-171.6	-59.2	2	0	0	0	113.8	N680 E684	N680-N682 VanDerWaalsContact C-N 3.25Å; N680-N682 PolarHBondContact O-N 2.93Å; N682-E684 PolarHBondContact O-N 2.91Å
683	S	84.5	Confident	87.3	Confident	5 Å²	5	43.7 Å²	43.7	4%	0.035	24%	0.237	C	C	.	.			trans	-74.1	112.7	-175.2	170.1	0	0	0	0	112.3	E650 N680 D685 I686 W687	E650-S683 VanDerWaalsContact CD-CB 3.45Å; E650-S683 WeakPolarHBondContact OE2-CB 3.09Å; E650-S683 PolarHBondContact OE2-OG 2.93Å; N680-S683 PolarHBondContact O-N 3.06Å; S683-D685 VanDerWaalsContact C-N 3.28Å; S683-D685 PolarHBondContact O-N 3.12Å; S683-D685 PolarHBondContact OG-N 3.2Å; S683-I686 PolarHBondContact O-N 3.23Å; S683-I686 WeakPolarHBondContact OG-CG1 3.27Å; S683-I686 PolarHBondContact OG-N 3.21Å; S683-W687 PolarHBondContact O-N 3.19Å
684	E	85.8	Confident	87.3	Confident	69 Å²	69	44.1 Å²	44.1	32%	0.322	24%	0.238	S	C	.	.	H	α-helix	trans	-56.7	-40.3	172.7	-65	-173.1	-150.2	0	0	112.5	N682 W687 L688 S716 I719	N682-E684 PolarHBondContact O-N 2.91Å; E684-W687 PolarHBondContact O-N 3.05Å; E684-L688 WeakPolarHBondContact O-CB 3.48Å; E684-L688 WeakPolarHBondContact O-CG 3.21Å; E684-L688 PolarHBondContact O-N 3.11Å; E684-S716 VanDerWaalsContact OE1-CB 3.26Å; E684-S716 WeakPolarHBondContact OE1-CB 3.47Å; E684-S716 PolarHBondContact OE1-OG 3.33Å; E684-S716 VanDerWaalsContact OE2-CB 3.25Å; E684-S716 WeakPolarHBondContact OE2-CB 3.22Å; E684-S716 PolarHBondContact OE2-OG 2.91Å; E684-I719 HydrophobicContact CB-CD1 4.34Å; E684-I719 HydrophobicContact CG-CD1 4.13Å
685	D	87.9	Confident	87.1	Confident	63 Å²	63	42.5 Å²	42.5	34%	0.337	22%	0.224	S	C	.	.	H	α-helix	trans	-71.7	-34.2	-175.1	-81.4	-46.6	0	0	0	112.5	L654 S683 L688 A689 R718	L654-D685 HydrophobicContact CD1-CB 3.96Å; S683-D685 VanDerWaalsContact C-N 3.28Å; S683-D685 PolarHBondContact O-N 3.12Å; S683-D685 PolarHBondContact OG-N 3.2Å; D685-L688 PolarHBondContact O-N 2.82Å; D685-A689 VanDerWaalsContact O-CB 3.28Å; D685-A689 WeakPolarHBondContact O-CB 3.04Å; D685-A689 PolarHBondContact O-N 3.3Å; D685-R718 IonicContact OD1-CZ 2.87Å; D685-R718 IonicContact OD1-NH1 2.76Å; D685-R718 PolarHBondContact OD1-NH1 2.9Å; D685-R718 IonicContact OD1-NH2 2.63Å; D685-R718 PolarHBondContact OD1-NH2 2.98Å; D685-R718 IonicContact OD2-NH1 3.67Å
686	I	89.9	Confident	86.9	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66.9	-44.5	172.9	-63.3	170.2	0	0	0	110.4	E650 L654 L673 A676 F677 N680 S683 L688 A689 A690	E650-I686 HydrophobicContact CB-CD1 4.37Å; E650-I686 HydrophobicContact CG-CD1 4.2Å; L654-I686 HydrophobicContact CD2-CG1 4.4Å; L673-I686 HydrophobicContact CD2-CG2 4.12Å; A676-I686 HydrophobicContact CB-CD1 3.97Å; A676-I686 HydrophobicContact CB-CG2 3.93Å; F677-I686 HydrophobicContact CD1-CG2 3.82Å; F677-I686 HydrophobicContact CE1-CB 4.31Å; F677-I686 HydrophobicContact CE1-CG2 3.57Å; F677-I686 HydrophobicContact CE2-CG2 4.45Å; F677-I686 HydrophobicContact CG-CG2 4.36Å; F677-I686 HydrophobicContact CZ-CG2 3.91Å; N680-I686 HydrophobicContact CB-CD1 3.84Å; S683-I686 PolarHBondContact O-N 3.23Å; S683-I686 WeakPolarHBondContact OG-CG1 3.27Å; S683-I686 PolarHBondContact OG-N 3.21Å; I686-L688 VanDerWaalsContact C-N 3.35Å; I686-L688 PolarHBondContact O-N 2.75Å; I686-A689 PolarHBondContact O-N 3.43Å; I686-A690 PolarHBondContact O-N 2.65Å
687	W	90.3	Very high	86.7	Confident	22 Å²	22	44.6 Å²	44.6	8%	0.083	23%	0.233	C	C	.	.	H	α-helix	trans	-56.8	-47.6	173.5	-79.5	111.8	0	0	0	111.8	F677 P681 S683 E684 A689 A690 V691 L706 K709 A710	F677-W687 HydrophobicContact CD1-CD2 4.3Å; F677-W687 HydrophobicContact CD1-CZ2 4.17Å; F677-W687 HydrophobicContact CE1-CB 4.45Å; F677-W687 AromaticContact CE1-CD2 3.39Å; F677-W687 HydrophobicContact CE1-CD2 3.39Å; F677-W687 AromaticContact CE1-CE2 3.56Å; F677-W687 AromaticContact CE1-CE3 3.69Å; F677-W687 HydrophobicContact CE1-CE3 3.69Å; F677-W687 AromaticContact CE1-CG 3.76Å; F677-W687 HydrophobicContact CE1-CG 3.76Å; F677-W687 HydrophobicContact CE1-CH2 4.26Å; F677-W687 HydrophobicContact CE1-CZ2 4Å; F677-W687 HydrophobicContact CE1-CZ3 4.12Å; F677-W687 AromaticContact CE1-NE1 3.94Å; F677-W687 AromaticContact CZ-CD2 3.87Å; F677-W687 HydrophobicContact CZ-CD2 3.87Å; F677-W687 AromaticContact CZ-CE3 3.67Å; F677-W687 HydrophobicContact CZ-CE3 3.67Å; F677-W687 HydrophobicContact CZ-CG 4.4Å; F677-W687 HydrophobicContact CZ-CH2 4.49Å; F677-W687 HydrophobicContact CZ-CZ3 4.01Å; P681-W687 PolarHBondContact O-NE1 2.76Å; P681-W687 VanDerWaalsContact O-NE1 3.13Å; S683-W687 PolarHBondContact O-N 3.19Å; E684-W687 PolarHBondContact O-N 3.05Å; W687-A689 VanDerWaalsContact C-N 3.34Å; W687-A689 PolarHBondContact O-N 2.88Å; W687-A690 PolarHBondContact O-N 3.32Å; W687-V691 VanDerWaalsContact O-CG2 3.28Å; W687-V691 WeakPolarHBondContact O-CG2 3.33Å; W687-V691 PolarHBondContact O-N 2.68Å; W687-L706 HydrophobicContact CE3-CD2 4.48Å; W687-L706 HydrophobicContact CZ3-CB 4.47Å; W687-L706 HydrophobicContact CZ3-CD2 3.85Å; W687-K709 HydrophobicContact CH2-CB 3.73Å; W687-K709 HydrophobicContact CZ3-CB 3.95Å; W687-A710 HydrophobicContact CB-CB 3.99Å; W687-A710 HydrophobicContact CD2-CB 3.71Å; W687-A710 HydrophobicContact CE3-CB 3.75Å; W687-A710 HydrophobicContact CG-CB 3.82Å; W687-A710 HydrophobicContact CZ3-CB 4.49Å
688	L	88.8	Confident	86.5	Confident	17 Å²	17	45.7 Å²	45.7	9%	0.089	25%	0.246	C	C	.	.	H	α-helix	trans	-69	-29.6	-179.8	-68.9	177.9	0	0	0	113.3	E684 D685 I686 K692 R718 I719 K722	E684-L688 WeakPolarHBondContact O-CB 3.48Å; E684-L688 WeakPolarHBondContact O-CG 3.21Å; E684-L688 PolarHBondContact O-N 3.11Å; D685-L688 PolarHBondContact O-N 2.82Å; I686-L688 VanDerWaalsContact C-N 3.35Å; I686-L688 PolarHBondContact O-N 2.75Å; L688-K692 WeakPolarHBondContact O-CB 3.44Å; L688-K692 PolarHBondContact O-N 3.35Å; L688-R718 HydrophobicContact CD1-CG 3.77Å; L688-R718 VanDerWaalsContact CD1-NE 3.32Å; L688-I719 HydrophobicContact CD2-CG1 4.02Å; L688-I719 HydrophobicContact CG-CG1 4.26Å; L688-K722 HydrophobicContact CD2-CB 3.78Å; L688-K722 HydrophobicContact CD2-CD 4.43Å; L688-K722 HydrophobicContact CD2-CG 3.67Å
689	A	87.2	Confident	86.6	Confident	26 Å²	26	41.3 Å²	41.3	22%	0.215	23%	0.226	C	C	.	.	H	α-helix	trans	-72.2	-40.1	173.2	0	0	0	0	0	112.5	L654 L673 D685 I686 W687 K692 L693	L654-A689 HydrophobicContact CD2-CB 3.28Å; L673-A689 HydrophobicContact CD2-CB 4.49Å; D685-A689 VanDerWaalsContact O-CB 3.28Å; D685-A689 WeakPolarHBondContact O-CB 3.04Å; D685-A689 PolarHBondContact O-N 3.3Å; I686-A689 PolarHBondContact O-N 3.43Å; W687-A689 VanDerWaalsContact C-N 3.34Å; W687-A689 PolarHBondContact O-N 2.88Å; A689-K692 WeakPolarHBondContact O-CB 3.31Å; A689-K692 PolarHBondContact O-N 3.13Å; A689-L693 WeakPolarHBondContact O-CB 3.23Å; A689-L693 PolarHBondContact O-N 2.91Å
690	A	89.8	Confident	86.7	Confident	5 Å²	5	41.4 Å²	41.4	4%	0.041	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-42.9	172.7	0	0	0	0	0	111.7	L673 F677 I686 W687 K692 L693 E694 L706	L673-A690 HydrophobicContact CD1-CB 4.11Å; F677-A690 HydrophobicContact CE2-CB 3.99Å; F677-A690 HydrophobicContact CZ-CB 3.77Å; I686-A690 PolarHBondContact O-N 2.65Å; W687-A690 PolarHBondContact O-N 3.32Å; A690-K692 VanDerWaalsContact C-N 3.35Å; A690-K692 PolarHBondContact O-N 3.15Å; A690-L693 PolarHBondContact O-N 2.92Å; A690-E694 PolarHBondContact O-N 3.45Å; A690-L706 HydrophobicContact CB-CD1 4.11Å
691	V	90.1	Very high	86.9	Confident	10 Å²	10	47.8 Å²	47.8	6%	0.061	25%	0.25	C	S	.	.	H	α-helix	trans	-63	-40.8	174	173.1	0	0	0	0	111.4	W687 S695 L706 L707	W687-V691 VanDerWaalsContact O-CG2 3.28Å; W687-V691 WeakPolarHBondContact O-CG2 3.33Å; W687-V691 PolarHBondContact O-N 2.68Å; V691-S695 VanDerWaalsContact O-CB 3.25Å; V691-S695 WeakPolarHBondContact O-CB 3.49Å; V691-S695 PolarHBondContact O-N 3.01Å; V691-S695 PolarHBondContact O-OG 3.24Å; V691-L706 HydrophobicContact CG2-CB 4Å; V691-L707 HydrophobicContact CB-CG 4.43Å; V691-L707 HydrophobicContact CG1-CD1 3.81Å; V691-L707 HydrophobicContact CG1-CD2 4.07Å; V691-L707 HydrophobicContact CG1-CG 3.86Å; V691-L707 HydrophobicContact CG2-CD1 4.46Å; V691-L707 HydrophobicContact CG2-CD2 3.88Å; V691-L707 HydrophobicContact CG2-CG 3.65Å
692	K	88	Confident	87.4	Confident	101 Å²	101	50.7 Å²	50.7	44%	0.439	25%	0.252	S	S	.	.	H	α-helix	trans	-58.2	-52.9	174.1	-175.4	-178.8	176.7	-177.3	0	110.8	L688 A689 A690 E694 S695 E696	L688-K692 WeakPolarHBondContact O-CB 3.44Å; L688-K692 PolarHBondContact O-N 3.35Å; A689-K692 WeakPolarHBondContact O-CB 3.31Å; A689-K692 PolarHBondContact O-N 3.13Å; A690-K692 VanDerWaalsContact C-N 3.35Å; A690-K692 PolarHBondContact O-N 3.15Å; K692-E694 PolarHBondContact O-N 3.12Å; K692-S695 PolarHBondContact O-N 3.04Å; K692-S695 VanDerWaalsContact O-N 3.17Å; K692-S695 PolarHBondContact O-OG 3.17Å; K692-E696 WeakPolarHBondContact CE-OE1 3.28Å; K692-E696 WeakPolarHBondContact CG-OE1 3.41Å; K692-E696 IonicContact NZ-OE1 2.85Å; K692-E696 PolarHBondContact O-N 2.85Å
693	L	87.7	Confident	87.9	Confident	6 Å²	6	44.9 Å²	44.9	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-55.4	-48.3	179.6	-176.2	70	0	0	0	112.1	W661 V666 R670 L673 A689 A690 N697	W661-L693 HydrophobicContact CB-CD1 3.98Å; W661-L693 VanDerWaalsContact CD1-CD1 3.43Å; W661-L693 HydrophobicContact CD2-CD1 3.86Å; W661-L693 HydrophobicContact CG-CD1 3.46Å; W661-L693 VanDerWaalsContact CG-CD1 3.46Å; V666-L693 HydrophobicContact CG1-CD1 4.33Å; V666-L693 HydrophobicContact CG1-CG 4.45Å; R670-L693 HydrophobicContact CG-CD2 3.87Å; L673-L693 HydrophobicContact CD1-CD2 3.81Å; A689-L693 WeakPolarHBondContact O-CB 3.23Å; A689-L693 PolarHBondContact O-N 2.91Å; A690-L693 PolarHBondContact O-N 2.92Å; L693-N697 WeakPolarHBondContact O-CB 3.37Å; L693-N697 PolarHBondContact O-N 2.86Å; L693-N697 PolarHBondContact O-ND2 2.89Å
694	E	89	Confident	88.1	Confident	15 Å²	15	47.5 Å²	47.5	7%	0.07	23%	0.23	C	C	.	.	H	α-helix	trans	-70.2	-33.9	179.2	-62.9	-57.4	167.5	0	0	112.9	R670 A690 K692 S698 Q699 R702 A703 L706	R670-E694 IonicContact CZ-OE1 2.66Å; R670-E694 IonicContact CZ-OE2 3.61Å; R670-E694 IonicContact NE-OE1 2.68Å; R670-E694 PolarHBondContact NE-OE1 2.87Å; R670-E694 IonicContact NE-OE2 3.59Å; R670-E694 PolarHBondContact NE-OE2 2.99Å; R670-E694 IonicContact NH2-OE1 3.89Å; R670-E694 IonicContact NH2-OE2 3.47Å; R670-E694 PolarHBondContact NH2-OE2 3.35Å; A690-E694 PolarHBondContact O-N 3.45Å; K692-E694 PolarHBondContact O-N 3.12Å; E694-S698 PolarHBondContact O-N 3.44Å; E694-Q699 PolarHBondContact O-N 3.3Å; E694-Q699 WeakPolarHBondContact OE2-CB 3.37Å; E694-Q699 PolarHBondContact OE2-OE1 3.38Å; E694-R702 HydrophobicContact CG-CB 4.26Å; E694-A703 HydrophobicContact CB-CB 3.99Å; E694-L706 HydrophobicContact CG-CD1 3.72Å
695	S	86.5	Confident	88.4	Confident	15 Å²	15	49.2 Å²	49.2	11%	0.105	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-43.7	178.8	70.3	0	0	0	0	112.4	V691 K692 S698 F700 W964	V691-S695 VanDerWaalsContact O-CB 3.25Å; V691-S695 WeakPolarHBondContact O-CB 3.49Å; V691-S695 PolarHBondContact O-N 3.01Å; V691-S695 PolarHBondContact O-OG 3.24Å; K692-S695 PolarHBondContact O-N 3.04Å; K692-S695 VanDerWaalsContact O-N 3.17Å; K692-S695 PolarHBondContact O-OG 3.17Å; S695-S698 PolarHBondContact O-N 3.05Å; S695-S698 VanDerWaalsContact O-N 3.16Å; S695-F700 WeakPolarHBondContact O-CE1 3.34Å; S695-W964 WeakPolarHBondContact O-CH2 3.35Å
696	E	84.7	Confident	88.5	Confident	77 Å²	77	48 Å²	48	36%	0.36	23%	0.234	S	C	.	.	H	α-helix	trans	-73	-33	-179.3	-68.7	-177.9	-137.1	0	0	111.7	W661 K692 S698	W661-E696 WeakPolarHBondContact CH2-OE2 3.3Å; W661-E696 HydrophobicContact CZ2-CB 4.2Å; W661-E696 WeakPolarHBondContact CZ2-OE2 3.35Å; K692-E696 WeakPolarHBondContact CE-OE1 3.28Å; K692-E696 WeakPolarHBondContact CG-OE1 3.41Å; K692-E696 IonicContact NZ-OE1 2.85Å; K692-E696 PolarHBondContact O-N 2.85Å; E696-S698 PolarHBondContact O-N 3.35Å
697	N	85.4	Confident	88.5	Confident	54 Å²	54	48 Å²	48	29%	0.289	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	12.2	171.1	-68.3	-67.3	0	0	0	114.1	V666 L693 Q699	V666-N697 WeakPolarHBondContact CG1-ND2 3.49Å; V666-N697 WeakPolarHBondContact CG2-OD1 3.36Å; L693-N697 WeakPolarHBondContact O-CB 3.37Å; L693-N697 PolarHBondContact O-N 2.86Å; L693-N697 PolarHBondContact O-ND2 2.89Å; N697-Q699 PolarHBondContact O-N 2.9Å
698	S	84.2	Confident	88.5	Confident	64 Å²	64	52.7 Å²	52.7	45%	0.448	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	22.8	177.6	-58.1	0	0	0	0	116.1	E694 S695 E696 F700	E694-S698 PolarHBondContact O-N 3.44Å; S695-S698 PolarHBondContact O-N 3.05Å; S695-S698 VanDerWaalsContact O-N 3.16Å; E696-S698 PolarHBondContact O-N 3.35Å; S698-F700 VanDerWaalsContact C-N 3.32Å; S698-F700 WeakPolarHBondContact O-CD2 3.38Å; S698-F700 PolarHBondContact O-N 3.46Å
699	Q	88.2	Confident	88.5	Confident	64 Å²	64	57.9 Å²	57.9	30%	0.299	28%	0.277	S	S	.	.			trans	-94.7	61.5	177.5	-60.8	-167.6	14	0	0	110.8	R670 E694 N697 E701 R702 A703	R670-Q699 VanDerWaalsContact NH2-NE2 3.16Å; E694-Q699 PolarHBondContact O-N 3.3Å; E694-Q699 WeakPolarHBondContact OE2-CB 3.37Å; E694-Q699 PolarHBondContact OE2-OE1 3.38Å; N697-Q699 PolarHBondContact O-N 2.9Å; Q699-E701 VanDerWaalsContact C-N 3.32Å; Q699-E701 PolarHBondContact O-N 2.81Å; Q699-R702 HydrophobicContact CB-CB 4.4Å; Q699-R702 PolarHBondContact O-N 3Å; Q699-R702 VanDerWaalsContact O-N 3.09Å; Q699-A703 PolarHBondContact O-N 3.34Å
700	F	88.2	Confident	88.6	Confident	43 Å²	43	56.7 Å²	56.7	19%	0.189	27%	0.267	C	S	.	.	H	α-helix	trans	-60.2	-36.3	-170.1	-54.1	-58.7	0	0	0	113.9	S695 S698 R702 A703 R704 L726 L730 W964	S695-F700 WeakPolarHBondContact O-CE1 3.34Å; S698-F700 VanDerWaalsContact C-N 3.32Å; S698-F700 WeakPolarHBondContact O-CD2 3.38Å; S698-F700 PolarHBondContact O-N 3.46Å; F700-R702 VanDerWaalsContact C-N 3.34Å; F700-R702 PolarHBondContact O-N 3.27Å; F700-A703 CarbonylContact O-C 3.23Å; F700-A703 WeakPolarHBondContact O-CB 3.47Å; F700-A703 PolarHBondContact O-N 2.98Å; F700-R704 WeakPolarHBondContact O-CG 3.35Å; F700-R704 PolarHBondContact O-N 3.4Å; F700-L726 HydrophobicContact CD1-CD1 4.24Å; F700-L730 HydrophobicContact CB-CD1 3.99Å; F700-L730 HydrophobicContact CB-CD2 4.25Å; F700-L730 HydrophobicContact CD1-CD2 3.92Å; F700-L730 HydrophobicContact CD2-CD2 3.74Å; F700-L730 HydrophobicContact CE1-CD2 4.21Å; F700-L730 HydrophobicContact CE2-CD2 4.04Å; F700-L730 HydrophobicContact CG-CD1 4.26Å; F700-L730 HydrophobicContact CG-CD2 3.68Å; F700-L730 HydrophobicContact CZ-CD2 4.27Å; F700-W964 AromaticContact CE1-CH2 3.85Å; F700-W964 HydrophobicContact CE1-CH2 3.85Å; F700-W964 AromaticContact CE1-CZ2 3.84Å; F700-W964 HydrophobicContact CE1-CZ2 3.84Å; F700-W964 HydrophobicContact CZ-CZ2 4.24Å
701	E	90.2	Very high	88.5	Confident	154 Å²	154	57.9 Å²	57.9	72%	0.72	27%	0.27	S	S	*	.	H	α-helix	trans	-61.6	-40.8	175.8	-62.4	179.6	172.4	0	0	112.4	Q699 R704 L705	Q699-E701 VanDerWaalsContact C-N 3.32Å; Q699-E701 PolarHBondContact O-N 2.81Å; E701-R704 WeakPolarHBondContact O-CB 3.46Å; E701-R704 PolarHBondContact O-N 2.98Å; E701-L705 WeakPolarHBondContact O-CG 3.44Å; E701-L705 PolarHBondContact O-N 2.99Å
702	R	88.7	Confident	88.3	Confident	133 Å²	133	63.6 Å²	63.6	50%	0.502	30%	0.301	S	S	.	.	H	α-helix	trans	-68	-41.6	174.4	-69.5	-177.5	176.1	175.5	-7.9	110.9	E694 Q699 F700 R704 L705 L706	E694-R702 HydrophobicContact CG-CB 4.26Å; Q699-R702 HydrophobicContact CB-CB 4.4Å; Q699-R702 PolarHBondContact O-N 3Å; Q699-R702 VanDerWaalsContact O-N 3.09Å; F700-R702 VanDerWaalsContact C-N 3.34Å; F700-R702 PolarHBondContact O-N 3.27Å; R702-R704 VanDerWaalsContact C-N 3.32Å; R702-R704 PolarHBondContact O-N 3.5Å; R702-L705 PolarHBondContact O-N 3.32Å; R702-L706 WeakPolarHBondContact O-CB 3.3Å; R702-L706 VanDerWaalsContact O-CG 3.31Å; R702-L706 WeakPolarHBondContact O-CG 3.49Å; R702-L706 PolarHBondContact O-N 3.08Å
703	A	89.8	Confident	88.1	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-41.5	173.6	0	0	0	0	0	112.1	E694 Q699 F700 L706 L707 L726	E694-A703 HydrophobicContact CB-CB 3.99Å; Q699-A703 PolarHBondContact O-N 3.34Å; F700-A703 CarbonylContact O-C 3.23Å; F700-A703 WeakPolarHBondContact O-CB 3.47Å; F700-A703 PolarHBondContact O-N 2.98Å; A703-L706 PolarHBondContact O-N 3.37Å; A703-L707 WeakPolarHBondContact O-CB 3.24Å; A703-L707 WeakPolarHBondContact O-CD1 3.33Å; A703-L707 WeakPolarHBondContact O-CG 3.23Å; A703-L707 PolarHBondContact O-N 3.12Å; A703-L726 HydrophobicContact CB-CD2 3.72Å
704	R	90.6	Very high	87.6	Confident	59 Å²	59	62.2 Å²	62.2	22%	0.223	31%	0.305	C	S	.	.	H	α-helix	trans	-60.5	-46.9	173	-74.9	177.7	171.7	159.1	0.9	112.2	F700 E701 R702 L707 K708 L726 E727 E732	F700-R704 WeakPolarHBondContact O-CG 3.35Å; F700-R704 PolarHBondContact O-N 3.4Å; E701-R704 WeakPolarHBondContact O-CB 3.46Å; E701-R704 PolarHBondContact O-N 2.98Å; R702-R704 VanDerWaalsContact C-N 3.32Å; R702-R704 PolarHBondContact O-N 3.5Å; R704-L707 PolarHBondContact O-N 3.04Å; R704-K708 WeakPolarHBondContact O-CG 3.48Å; R704-K708 PolarHBondContact O-N 2.89Å; R704-L726 HydrophobicContact CG-CD2 4.02Å; R704-E727 WeakPolarHBondContact CG-OE1 3.41Å; R704-E727 IonicContact CZ-OE2 2.68Å; R704-E727 IonicContact NE-OE1 2.78Å; R704-E727 PolarHBondContact NE-OE1 3.25Å; R704-E727 VanDerWaalsContact NE-OE1 3.13Å; R704-E727 IonicContact NE-OE2 3.78Å; R704-E727 PolarHBondContact NE-OE2 3.37Å; R704-E727 IonicContact NH2-OE2 3.04Å; R704-E727 PolarHBondContact NH2-OE2 3.39Å; R704-E732 IonicContact CZ-OE1 2.66Å; R704-E732 IonicContact CZ-OE2 3.56Å; R704-E732 IonicContact NH1-OE1 3.12Å; R704-E732 IonicContact NH2-OE1 3.34Å; R704-E732 PolarHBondContact NH2-OE1 3.45Å; R704-E732 IonicContact NH2-OE2 3.33Å; R704-E732 PolarHBondContact NH2-OE2 3.43Å
705	L	91.3	Very high	87.2	Confident	105 Å²	105	64.9 Å²	64.9	55%	0.55	32%	0.323	S	S	.	.	H	α-helix	trans	-64.1	-42.4	177.7	-72	170.4	0	0	0	112.1	E701 R702 K708 K709	E701-L705 WeakPolarHBondContact O-CG 3.44Å; E701-L705 PolarHBondContact O-N 2.99Å; R702-L705 PolarHBondContact O-N 3.32Å; L705-K708 PolarHBondContact O-N 3.44Å; L705-K709 WeakPolarHBondContact O-CG 3.35Å; L705-K709 PolarHBondContact O-N 2.96Å
706	L	89.8	Confident	87.2	Confident	37 Å²	37	64.9 Å²	64.9	19%	0.194	32%	0.324	C	S	.	.	H	α-helix	trans	-62.4	-43.2	173.8	-70.9	171.3	0	0	0	111.2	W687 A690 V691 E694 R702 A703 K708 K709 A710	W687-L706 HydrophobicContact CE3-CD2 4.48Å; W687-L706 HydrophobicContact CZ3-CB 4.47Å; W687-L706 HydrophobicContact CZ3-CD2 3.85Å; A690-L706 HydrophobicContact CB-CD1 4.11Å; V691-L706 HydrophobicContact CG2-CB 4Å; E694-L706 HydrophobicContact CG-CD1 3.72Å; R702-L706 WeakPolarHBondContact O-CB 3.3Å; R702-L706 VanDerWaalsContact O-CG 3.31Å; R702-L706 WeakPolarHBondContact O-CG 3.49Å; R702-L706 PolarHBondContact O-N 3.08Å; A703-L706 PolarHBondContact O-N 3.37Å; L706-K708 VanDerWaalsContact C-N 3.35Å; L706-K708 PolarHBondContact O-N 3.11Å; L706-K709 PolarHBondContact O-N 3.36Å; L706-A710 VanDerWaalsContact O-CB 3.24Å; L706-A710 WeakPolarHBondContact O-CB 3.13Å; L706-A710 PolarHBondContact O-N 2.69Å
707	L	89.4	Confident	87.3	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-68.3	-28.9	176.3	-79.5	162.5	0	0	0	113.8	V691 A703 R704 R711 I719 K722 L726	V691-L707 HydrophobicContact CB-CG 4.43Å; V691-L707 HydrophobicContact CG1-CD1 3.81Å; V691-L707 HydrophobicContact CG1-CD2 4.07Å; V691-L707 HydrophobicContact CG1-CG 3.86Å; V691-L707 HydrophobicContact CG2-CD1 4.46Å; V691-L707 HydrophobicContact CG2-CD2 3.88Å; V691-L707 HydrophobicContact CG2-CG 3.65Å; A703-L707 WeakPolarHBondContact O-CB 3.24Å; A703-L707 WeakPolarHBondContact O-CD1 3.33Å; A703-L707 WeakPolarHBondContact O-CG 3.23Å; A703-L707 PolarHBondContact O-N 3.12Å; R704-L707 PolarHBondContact O-N 3.04Å; L707-R711 WeakPolarHBondContact O-CG 3.21Å; L707-R711 PolarHBondContact O-N 3.05Å; L707-R711 PolarHBondContact O-NE 3.48Å; L707-I719 HydrophobicContact CD2-CG2 4.24Å; L707-K722 HydrophobicContact CD2-CB 4.35Å; L707-L726 HydrophobicContact CD1-CB 3.98Å; L707-L726 HydrophobicContact CD1-CD2 3.48Å; L707-L726 VanDerWaalsContact CD1-CD2 3.48Å; L707-L726 HydrophobicContact CD1-CG 4.36Å
708	K	90.4	Very high	87.5	Confident	120 Å²	120	65 Å²	65	52%	0.522	32%	0.323	S	S	.	.	H	α-helix	trans	-65.8	-56.2	170.1	-75.1	177.2	179	-175.8	0	109.3	R704 L705 L706 A710 R711 D712	R704-K708 WeakPolarHBondContact O-CG 3.48Å; R704-K708 PolarHBondContact O-N 2.89Å; L705-K708 PolarHBondContact O-N 3.44Å; L706-K708 VanDerWaalsContact C-N 3.35Å; L706-K708 PolarHBondContact O-N 3.11Å; K708-A710 VanDerWaalsContact C-N 3.29Å; K708-A710 PolarHBondContact O-N 3.16Å; K708-R711 WeakPolarHBondContact O-CB 3.21Å; K708-R711 PolarHBondContact O-N 2.78Å; K708-D712 PolarHBondContact O-N 2.8Å
709	K	89.2	Confident	87.8	Confident	126 Å²	126	62 Å²	62	55%	0.548	30%	0.301	S	S	.	.	H	α-helix	trans	-55.3	-40.5	176.3	-69.1	-178.1	176	-171.6	0	113.6	W687 L705 L706 R711 D712 S713	W687-K709 HydrophobicContact CH2-CB 3.73Å; W687-K709 HydrophobicContact CZ3-CB 3.95Å; L705-K709 WeakPolarHBondContact O-CG 3.35Å; L705-K709 PolarHBondContact O-N 2.96Å; L706-K709 PolarHBondContact O-N 3.36Å; K709-R711 VanDerWaalsContact C-N 3.33Å; K709-R711 PolarHBondContact O-N 3.27Å; K709-D712 PolarHBondContact O-N 3.02Å; K709-S713 WeakPolarHBondContact O-CB 3.19Å; K709-S713 PolarHBondContact O-N 3.4Å; K709-S713 PolarHBondContact O-OG 3.29Å
710	A	88.8	Confident	87.9	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-64.8	-35	177.9	0	0	0	0	0	112.5	W687 L706 K708 D712 A714 I719	W687-A710 HydrophobicContact CB-CB 3.99Å; W687-A710 HydrophobicContact CD2-CB 3.71Å; W687-A710 HydrophobicContact CE3-CB 3.75Å; W687-A710 HydrophobicContact CG-CB 3.82Å; W687-A710 HydrophobicContact CZ3-CB 4.49Å; L706-A710 VanDerWaalsContact O-CB 3.24Å; L706-A710 WeakPolarHBondContact O-CB 3.13Å; L706-A710 PolarHBondContact O-N 2.69Å; K708-A710 VanDerWaalsContact C-N 3.29Å; K708-A710 PolarHBondContact O-N 3.16Å; A710-D712 VanDerWaalsContact C-N 3.33Å; A710-A714 CarbonylContact O-C 3.52Å; A710-A714 VanDerWaalsContact O-C 3.23Å; A710-A714 WeakPolarHBondContact O-CA 3.28Å; A710-A714 PolarHBondContact O-N 3.17Å; A710-I719 HydrophobicContact CB-CD1 4.23Å; A710-I719 HydrophobicContact CB-CG2 3.88Å
711	R	87.7	Confident	88.1	Confident	30 Å²	30	60.2 Å²	60.2	11%	0.113	29%	0.292	C	S	.	.	H	α-helix	trans	-66.7	-35.6	173.2	-78.5	173.5	-85.1	174.6	-14.1	112.1	L707 K708 K709 P715 I719 W720	L707-R711 WeakPolarHBondContact O-CG 3.21Å; L707-R711 PolarHBondContact O-N 3.05Å; L707-R711 PolarHBondContact O-NE 3.48Å; K708-R711 WeakPolarHBondContact O-CB 3.21Å; K708-R711 PolarHBondContact O-N 2.78Å; K709-R711 VanDerWaalsContact C-N 3.33Å; K709-R711 PolarHBondContact O-N 3.27Å; R711-P715 WeakPolarHBondContact O-CB 3.14Å; R711-I719 HydrophobicContact CG-CG2 3.96Å; R711-W720 HydrophobicContact CB-CZ2 4.29Å; R711-W720 HydrophobicContact CG-CD2 4.15Å; R711-W720 HydrophobicContact CG-CE3 4.45Å; R711-W720 HydrophobicContact CG-CH2 4.33Å; R711-W720 HydrophobicContact CG-CZ2 4Å
712	D	87.1	Confident	88	Confident	131 Å²	131	57.2 Å²	57.2	70%	0.701	28%	0.277	S	S	*	.	H	α-helix	trans	-77	-39.6	179	-50.6	-37	0	0	0	111.9	K708 K709 A710	K708-D712 PolarHBondContact O-N 2.8Å; K709-D712 PolarHBondContact O-N 3.02Å; A710-D712 VanDerWaalsContact C-N 3.33Å
713	S	82.7	Confident	88.1	Confident	64 Å²	64	50.9 Å²	50.9	45%	0.448	25%	0.253	S	S	.	.	H	α-helix	trans	-87.8	-33.8	-173	-56.5	0	0	0	0	114	K709	K709-S713 WeakPolarHBondContact O-CB 3.19Å; K709-S713 PolarHBondContact O-N 3.4Å; K709-S713 PolarHBondContact O-OG 3.29Å
714	A	78.1	Confident	88.2	Confident	14 Å²	14	50.9 Å²	50.9	12%	0.116	25%	0.253	C	S	.	.	S	Bend	trans	-145.1	67.5	-178.5	0	0	0	0	0	110.2	A710 S716 I719	A710-A714 CarbonylContact O-C 3.52Å; A710-A714 VanDerWaalsContact O-C 3.23Å; A710-A714 WeakPolarHBondContact O-CA 3.28Å; A710-A714 PolarHBondContact O-N 3.17Å; A714-S716 PolarHBondContact O-N 2.93Å; A714-I719 HydrophobicContact CB-CD1 4.31Å; A714-I719 WeakPolarHBondContact O-CD1 3.04Å
715	P	79.9	Confident	88.1	Confident	70 Å²	70	51 Å²	51	46%	0.455	26%	0.256	S	S	.	.			trans	-59.2	114.1	179.8	23.7	-33.1	0	0	0	110.5	R711 Y747	R711-P715 WeakPolarHBondContact O-CB 3.14Å; P715-Y747 PolarHBondContact O-OH 2.72Å
716	S	86.6	Confident	88	Confident	16 Å²	16	46.5 Å²	46.5	11%	0.112	23%	0.232	C	C	.	.			trans	-142.8	141.1	178.7	160.2	0	0	0	0	109.6	E684 A714 R718 I719 W720	E684-S716 VanDerWaalsContact OE1-CB 3.26Å; E684-S716 WeakPolarHBondContact OE1-CB 3.47Å; E684-S716 PolarHBondContact OE1-OG 3.33Å; E684-S716 VanDerWaalsContact OE2-CB 3.25Å; E684-S716 WeakPolarHBondContact OE2-CB 3.22Å; E684-S716 PolarHBondContact OE2-OG 2.91Å; A714-S716 PolarHBondContact O-N 2.93Å; S716-R718 PolarHBondContact O-N 2.72Å; S716-R718 PolarHBondContact OG-N 3.1Å; S716-I719 PolarHBondContact O-N 2.82Å; S716-W720 VanDerWaalsContact O-CD1 3.3Å; S716-W720 PolarHBondContact O-N 3.4Å; S716-W720 VanDerWaalsContact O-N 3.08Å
717	A	87.3	Confident	88	Confident	27 Å²	27	45.5 Å²	45.5	22%	0.223	23%	0.226	C	C	.	.	H	α-helix	trans	-54.5	-27.6	176.5	0	0	0	0	0	112.5	M721 Y747 A750	A717-M721 WeakPolarHBondContact O-CB 3.39Å; A717-M721 PolarHBondContact O-N 3.25Å; A717-Y747 HydrophobicContact CB-CD1 4.45Å; A717-Y747 HydrophobicContact CB-CD2 4.06Å; A717-Y747 HydrophobicContact CB-CG 3.89Å; A717-A750 HydrophobicContact CB-CB 3.78Å
718	R	88.7	Confident	88.1	Confident	107 Å²	107	46 Å²	46	40%	0.404	23%	0.228	S	C	.	.	H	α-helix	trans	-70.2	-35.1	175.6	-170.1	-179	173	-157.5	-10	112.5	D685 L688 S716 M721 K722	D685-R718 IonicContact OD1-CZ 2.87Å; D685-R718 IonicContact OD1-NH1 2.76Å; D685-R718 PolarHBondContact OD1-NH1 2.9Å; D685-R718 IonicContact OD1-NH2 2.63Å; D685-R718 PolarHBondContact OD1-NH2 2.98Å; D685-R718 IonicContact OD2-NH1 3.67Å; L688-R718 HydrophobicContact CD1-CG 3.77Å; L688-R718 VanDerWaalsContact CD1-NE 3.32Å; S716-R718 PolarHBondContact O-N 2.72Å; S716-R718 PolarHBondContact OG-N 3.1Å; R718-M721 HydrophobicContact CG-CE 4.24Å; R718-K722 WeakPolarHBondContact O-CB 3.39Å; R718-K722 VanDerWaalsContact O-CG 3.26Å; R718-K722 WeakPolarHBondContact O-CG 3.41Å; R718-K722 PolarHBondContact O-N 3.03Å; R718-K722 VanDerWaalsContact O-N 3.13Å
719	I	91	Very high	87.9	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-74.1	-43.9	175.8	-69.9	167.9	0	0	0	110	E684 L688 L707 A710 R711 A714 S716 M721 K722 S723	E684-I719 HydrophobicContact CB-CD1 4.34Å; E684-I719 HydrophobicContact CG-CD1 4.13Å; L688-I719 HydrophobicContact CD2-CG1 4.02Å; L688-I719 HydrophobicContact CG-CG1 4.26Å; L707-I719 HydrophobicContact CD2-CG2 4.24Å; A710-I719 HydrophobicContact CB-CD1 4.23Å; A710-I719 HydrophobicContact CB-CG2 3.88Å; R711-I719 HydrophobicContact CG-CG2 3.96Å; A714-I719 HydrophobicContact CB-CD1 4.31Å; A714-I719 WeakPolarHBondContact O-CD1 3.04Å; S716-I719 PolarHBondContact O-N 2.82Å; I719-M721 VanDerWaalsContact C-N 3.34Å; I719-M721 PolarHBondContact O-N 3.14Å; I719-K722 CarbonylContact O-C 3.31Å; I719-K722 PolarHBondContact O-N 2.8Å; I719-S723 PolarHBondContact O-N 3.07Å; I719-S723 PolarHBondContact O-OG 2.89Å
720	W	91.3	Very high	87.7	Confident	35 Å²	35	37.2 Å²	37.2	13%	0.133	19%	0.194	C	C	.	.	H	α-helix	trans	-57.9	-43.5	171.9	-73.8	104.5	0	0	0	112.7	R711 S716 K722 S723 A724 L739 Q742 Y747 L753	R711-W720 HydrophobicContact CB-CZ2 4.29Å; R711-W720 HydrophobicContact CG-CD2 4.15Å; R711-W720 HydrophobicContact CG-CE3 4.45Å; R711-W720 HydrophobicContact CG-CH2 4.33Å; R711-W720 HydrophobicContact CG-CZ2 4Å; S716-W720 VanDerWaalsContact O-CD1 3.3Å; S716-W720 PolarHBondContact O-N 3.4Å; S716-W720 VanDerWaalsContact O-N 3.08Å; W720-K722 VanDerWaalsContact C-N 3.26Å; W720-K722 PolarHBondContact O-N 2.87Å; W720-S723 WeakPolarHBondContact CA-OG 3.45Å; W720-S723 PolarHBondContact O-N 2.92Å; W720-S723 PolarHBondContact O-OG 3.28Å; W720-A724 WeakPolarHBondContact O-CB 3.32Å; W720-A724 PolarHBondContact O-N 2.93Å; W720-L739 HydrophobicContact CZ3-CD2 4.24Å; W720-Q742 HydrophobicContact CE3-CB 4.48Å; W720-Q742 HydrophobicContact CH2-CB 4.07Å; W720-Q742 HydrophobicContact CZ3-CB 3.72Å; W720-Y747 AromaticContact CD1-CD2 3.86Å; W720-Y747 AromaticContact CD1-CE2 3.76Å; W720-Y747 AromaticContact NE1-CE2 3.9Å; W720-L753 HydrophobicContact CB-CD1 4.39Å; W720-L753 HydrophobicContact CB-CD2 4.22Å
721	M	90.8	Very high	87.6	Confident	34 Å²	34	43.3 Å²	43.3	17%	0.167	23%	0.226	C	C	.	.	H	α-helix	trans	-60.5	-36.2	174.3	179.4	-157	69.5	0	0	111.9	A717 R718 I719 K725 K752 L753 I756	A717-M721 WeakPolarHBondContact O-CB 3.39Å; A717-M721 PolarHBondContact O-N 3.25Å; R718-M721 HydrophobicContact CG-CE 4.24Å; I719-M721 VanDerWaalsContact C-N 3.34Å; I719-M721 PolarHBondContact O-N 3.14Å; M721-K725 WeakPolarHBondContact O-CB 3.28Å; M721-K725 PolarHBondContact O-N 2.92Å; M721-K752 HydrophobicContact CG-CB 4.18Å; M721-K752 HydrophobicContact SD-CB 3.78Å; M721-K752 HydrophobicContact SD-CD 3.59Å; M721-K752 VanDerWaalsContact SD-CD 3.59Å; M721-K752 HydrophobicContact SD-CG 4.25Å; M721-L753 HydrophobicContact CB-CD2 3.97Å; M721-I756 HydrophobicContact CB-CD1 4.39Å; M721-I756 HydrophobicContact CG-CD1 3.44Å; M721-I756 VanDerWaalsContact CG-CD1 3.44Å
722	K	89.3	Confident	87.8	Confident	92 Å²	92	46.1 Å²	46.1	40%	0.4	24%	0.241	S	C	.	.	H	α-helix	trans	-78.7	-32.8	179.4	-77.4	-82.9	-174.2	171.6	0	113	L688 L707 R718 I719 W720 L726	L688-K722 HydrophobicContact CD2-CB 3.78Å; L688-K722 HydrophobicContact CD2-CD 4.43Å; L688-K722 HydrophobicContact CD2-CG 3.67Å; L707-K722 HydrophobicContact CD2-CB 4.35Å; R718-K722 WeakPolarHBondContact O-CB 3.39Å; R718-K722 VanDerWaalsContact O-CG 3.26Å; R718-K722 WeakPolarHBondContact O-CG 3.41Å; R718-K722 PolarHBondContact O-N 3.03Å; R718-K722 VanDerWaalsContact O-N 3.13Å; I719-K722 CarbonylContact O-C 3.31Å; I719-K722 PolarHBondContact O-N 2.8Å; W720-K722 VanDerWaalsContact C-N 3.26Å; W720-K722 PolarHBondContact O-N 2.87Å; K722-L726 PolarHBondContact O-N 2.86Å
723	S	90.2	Very high	87.9	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-69	-45.3	171.1	57.2	0	0	0	0	111.8	I719 W720 K725 L726 E727	I719-S723 PolarHBondContact O-N 3.07Å; I719-S723 PolarHBondContact O-OG 2.89Å; W720-S723 WeakPolarHBondContact CA-OG 3.45Å; W720-S723 PolarHBondContact O-N 2.92Å; W720-S723 PolarHBondContact O-OG 3.28Å; S723-K725 VanDerWaalsContact C-N 3.32Å; S723-K725 PolarHBondContact O-N 3.19Å; S723-L726 PolarHBondContact O-N 3.48Å; S723-L726 VanDerWaalsContact O-N 3.14Å; S723-E727 PolarHBondContact O-N 2.65Å
724	A	91.3	Very high	88.3	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-56.5	-45.6	171.4	0	0	0	0	0	111.8	W720 L726 E727 W728 L739 V740 I756	W720-A724 WeakPolarHBondContact O-CB 3.32Å; W720-A724 PolarHBondContact O-N 2.93Å; A724-L726 VanDerWaalsContact C-N 3.34Å; A724-L726 PolarHBondContact O-N 3.16Å; A724-E727 PolarHBondContact O-N 3.05Å; A724-W728 VanDerWaalsContact O-CB 3.26Å; A724-W728 WeakPolarHBondContact O-CB 3.48Å; A724-W728 PolarHBondContact O-N 2.78Å; A724-L739 HydrophobicContact CB-CB 4.41Å; A724-V740 HydrophobicContact CB-CG2 3.62Å; A724-I756 HydrophobicContact CB-CG2 4.26Å
725	K	89.7	Confident	88.9	Confident	62 Å²	62	44.8 Å²	44.8	27%	0.27	23%	0.231	S	C	.	.	H	α-helix	trans	-64.4	-33.3	176.8	-174.7	165.8	-177.8	170	0	113.1	M721 S723 W728 C729	M721-K725 WeakPolarHBondContact O-CB 3.28Å; M721-K725 PolarHBondContact O-N 2.92Å; S723-K725 VanDerWaalsContact C-N 3.32Å; S723-K725 PolarHBondContact O-N 3.19Å; K725-W728 PolarHBondContact O-N 3.36Å; K725-C729 WeakPolarHBondContact O-CB 3.3Å; K725-C729 PolarHBondContact O-N 3.13Å; K725-C729 PolarHBondContact O-SG 3.41Å
726	L	88.7	Confident	89.5	Confident	10 Å²	10	41.5 Å²	41.5	5%	0.052	21%	0.21	C	C	.	.	H	α-helix	trans	-64.8	-50.4	177.3	-177.8	66.2	0	0	0	111.3	F700 A703 R704 L707 K722 S723 A724 W728 C729 L730	F700-L726 HydrophobicContact CD1-CD1 4.24Å; A703-L726 HydrophobicContact CB-CD2 3.72Å; R704-L726 HydrophobicContact CG-CD2 4.02Å; L707-L726 HydrophobicContact CD1-CB 3.98Å; L707-L726 HydrophobicContact CD1-CD2 3.48Å; L707-L726 VanDerWaalsContact CD1-CD2 3.48Å; L707-L726 HydrophobicContact CD1-CG 4.36Å; K722-L726 PolarHBondContact O-N 2.86Å; S723-L726 PolarHBondContact O-N 3.48Å; S723-L726 VanDerWaalsContact O-N 3.14Å; A724-L726 VanDerWaalsContact C-N 3.34Å; A724-L726 PolarHBondContact O-N 3.16Å; L726-W728 VanDerWaalsContact C-N 3.27Å; L726-W728 PolarHBondContact O-N 2.99Å; L726-C729 WeakPolarHBondContact O-CB 3.42Å; L726-C729 PolarHBondContact O-N 2.87Å; L726-C729 VanDerWaalsContact O-N 3.16Å; L726-L730 HydrophobicContact CD1-CD1 4.46Å; L726-L730 HydrophobicContact CG-CD1 4.22Å; L726-L730 WeakPolarHBondContact O-CG 3.24Å; L726-L730 PolarHBondContact O-N 3.2Å
727	E	90.6	Very high	89.7	Confident	15 Å²	15	41 Å²	41	7%	0.07	21%	0.206	C	C	.	.	H	α-helix	trans	-65.7	-34.2	178.9	-51.5	-52.4	172.3	0	0	111.6	R704 S723 A724 C729 L730 N731 E732 A735 A736 L739	R704-E727 WeakPolarHBondContact CG-OE1 3.41Å; R704-E727 IonicContact CZ-OE2 2.68Å; R704-E727 IonicContact NE-OE1 2.78Å; R704-E727 PolarHBondContact NE-OE1 3.25Å; R704-E727 VanDerWaalsContact NE-OE1 3.13Å; R704-E727 IonicContact NE-OE2 3.78Å; R704-E727 PolarHBondContact NE-OE2 3.37Å; R704-E727 IonicContact NH2-OE2 3.04Å; R704-E727 PolarHBondContact NH2-OE2 3.39Å; S723-E727 PolarHBondContact O-N 2.65Å; A724-E727 PolarHBondContact O-N 3.05Å; E727-C729 PolarHBondContact O-N 2.98Å; E727-L730 CarbonylContact O-C 3.23Å; E727-L730 PolarHBondContact O-N 3.27Å; E727-L730 VanDerWaalsContact O-N 3.07Å; E727-N731 PolarHBondContact O-N 2.8Å; E727-E732 HydrophobicContact CB-CB 4.36Å; E727-E732 PolarHBondContact O-N 2.88Å; E727-A735 HydrophobicContact CG-CB 4.49Å; E727-A736 HydrophobicContact CB-CB 4.01Å; E727-L739 HydrophobicContact CB-CD1 4.5Å; E727-L739 HydrophobicContact CG-CD1 3.51Å
728	W	90.7	Very high	90	Very high	11 Å²	11	43.4 Å²	43.4	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-62.6	-40.7	172.9	-164.5	20.3	0	0	0	112.5	A724 K725 L726 L730 N731 A736 I756 Q759 I760 I961	A724-W728 VanDerWaalsContact O-CB 3.26Å; A724-W728 WeakPolarHBondContact O-CB 3.48Å; A724-W728 PolarHBondContact O-N 2.78Å; K725-W728 PolarHBondContact O-N 3.36Å; L726-W728 VanDerWaalsContact C-N 3.27Å; L726-W728 PolarHBondContact O-N 2.99Å; W728-L730 PolarHBondContact O-N 3.27Å; W728-N731 PolarHBondContact O-N 3.03Å; W728-A736 HydrophobicContact CB-CB 4.23Å; W728-I756 HydrophobicContact CE3-CG2 3.96Å; W728-I756 HydrophobicContact CZ3-CG1 4.19Å; W728-I756 HydrophobicContact CZ3-CG2 4.17Å; W728-Q759 HydrophobicContact CH2-CB 3.52Å; W728-Q759 HydrophobicContact CH2-CG 4.38Å; W728-Q759 HydrophobicContact CZ2-CB 3.64Å; W728-I760 HydrophobicContact CD2-CD1 4.41Å; W728-I760 HydrophobicContact CD2-CG1 3.81Å; W728-I760 HydrophobicContact CG-CD1 4.3Å; W728-I760 HydrophobicContact CG-CG1 3.88Å; W728-I760 HydrophobicContact CZ2-CG1 4.1Å; W728-I961 HydrophobicContact CD2-CD1 3.64Å; W728-I961 HydrophobicContact CD2-CG1 4.16Å; W728-I961 HydrophobicContact CE3-CD1 4.32Å; W728-I961 HydrophobicContact CE3-CG1 4.39Å; W728-I961 HydrophobicContact CG-CD1 3.96Å; W728-I961 HydrophobicContact CH2-CD1 4.24Å; W728-I961 HydrophobicContact CH2-CG1 4.43Å; W728-I961 HydrophobicContact CZ2-CD1 3.57Å; W728-I961 HydrophobicContact CZ2-CG1 4.24Å
729	C	85.8	Confident	90.2	Very high	17 Å²	17	39 Å²	39	12%	0.115	20%	0.2	C	C	.	.	H	α-helix	trans	-66.7	-16.2	172.8	-76.1	0	0	0	0	114.2	K725 L726 E727 I961 W964	K725-C729 WeakPolarHBondContact O-CB 3.3Å; K725-C729 PolarHBondContact O-N 3.13Å; K725-C729 PolarHBondContact O-SG 3.41Å; L726-C729 WeakPolarHBondContact O-CB 3.42Å; L726-C729 PolarHBondContact O-N 2.87Å; L726-C729 VanDerWaalsContact O-N 3.16Å; E727-C729 PolarHBondContact O-N 2.98Å; C729-I961 HydrophobicContact CB-CG2 4.34Å; C729-W964 HydrophobicContact CB-CD2 4.23Å; C729-W964 HydrophobicContact CB-CG 4.24Å; C729-W964 HydrophobicContact CB-CZ2 4.32Å; C729-W964 VanDerWaalsContact SG-CD1 3.55Å; C729-W964 VanDerWaalsContact SG-CG 3.51Å
730	L	86.7	Confident	90.2	Very high	46 Å²	46	39.1 Å²	39.1	24%	0.241	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	4.4	177.2	-63.6	169.8	0	0	0	112.6	F700 L726 E727 W728 E732	F700-L730 HydrophobicContact CB-CD1 3.99Å; F700-L730 HydrophobicContact CB-CD2 4.25Å; F700-L730 HydrophobicContact CD1-CD2 3.92Å; F700-L730 HydrophobicContact CD2-CD2 3.74Å; F700-L730 HydrophobicContact CE1-CD2 4.21Å; F700-L730 HydrophobicContact CE2-CD2 4.04Å; F700-L730 HydrophobicContact CG-CD1 4.26Å; F700-L730 HydrophobicContact CG-CD2 3.68Å; F700-L730 HydrophobicContact CZ-CD2 4.27Å; L726-L730 HydrophobicContact CD1-CD1 4.46Å; L726-L730 HydrophobicContact CG-CD1 4.22Å; L726-L730 WeakPolarHBondContact O-CG 3.24Å; L726-L730 PolarHBondContact O-N 3.2Å; E727-L730 CarbonylContact O-C 3.23Å; E727-L730 PolarHBondContact O-N 3.27Å; E727-L730 VanDerWaalsContact O-N 3.07Å; W728-L730 PolarHBondContact O-N 3.27Å; L730-E732 PolarHBondContact O-N 2.99Å
731	N	86.7	Confident	90.3	Very high	129 Å²	129	41.8 Å²	41.8	69%	0.69	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	14.6	-173.8	-56.9	-33	0	0	0	115.1	E727 W728 L733	E727-N731 PolarHBondContact O-N 2.8Å; W728-N731 PolarHBondContact O-N 3.03Å; N731-L733 PolarHBondContact O-N 3.11Å
732	E	90.5	Very high	90.3	Very high	89 Å²	89	44.6 Å²	44.6	42%	0.416	23%	0.225	S	C	.	.			trans	-81.9	68	172.9	-73.1	-177.3	-149.8	0	0	110	R704 E727 L730 D734 A735 A736	R704-E732 IonicContact CZ-OE1 2.66Å; R704-E732 IonicContact CZ-OE2 3.56Å; R704-E732 IonicContact NH1-OE1 3.12Å; R704-E732 IonicContact NH2-OE1 3.34Å; R704-E732 PolarHBondContact NH2-OE1 3.45Å; R704-E732 IonicContact NH2-OE2 3.33Å; R704-E732 PolarHBondContact NH2-OE2 3.43Å; E727-E732 HydrophobicContact CB-CB 4.36Å; E727-E732 PolarHBondContact O-N 2.88Å; L730-E732 PolarHBondContact O-N 2.99Å; E732-D734 VanDerWaalsContact C-N 3.33Å; E732-D734 PolarHBondContact O-N 2.88Å; E732-A735 HydrophobicContact CB-CB 4.25Å; E732-A735 PolarHBondContact O-N 3.36Å; E732-A736 WeakPolarHBondContact O-CB 3.38Å; E732-A736 PolarHBondContact O-N 3.11Å
733	L	89.1	Confident	90.3	Very high	39 Å²	39	40.2 Å²	40.2	20%	0.204	21%	0.206	C	C	.	.	H	α-helix	trans	-62.5	-35.3	-168.8	-55.6	-173.9	0	0	0	113.4	N731 A736 I737 I760 K764	N731-L733 PolarHBondContact O-N 3.11Å; L733-A736 PolarHBondContact O-N 3.13Å; L733-I737 WeakPolarHBondContact O-CD1 3.26Å; L733-I737 VanDerWaalsContact O-CG1 3.3Å; L733-I737 WeakPolarHBondContact O-CG1 3.33Å; L733-I737 PolarHBondContact O-N 3.33Å; L733-I760 HydrophobicContact CB-CG2 3.95Å; L733-I760 HydrophobicContact CD2-CG2 4.23Å; L733-K764 VanDerWaalsContact CB-CE 3.43Å; L733-K764 HydrophobicContact CB-CG 4.5Å; L733-K764 HydrophobicContact CD1-CG 3.78Å
734	D	91.8	Very high	90.3	Very high	105 Å²	105	40.8 Å²	40.8	56%	0.561	21%	0.209	S	C	*	.	H	α-helix	trans	-67.5	-49.6	177.3	-69	-77.1	0	0	0	111.9	E732 A736 I737 D738 K764	E732-D734 VanDerWaalsContact C-N 3.33Å; E732-D734 PolarHBondContact O-N 2.88Å; D734-A736 VanDerWaalsContact C-N 3.27Å; D734-A736 PolarHBondContact O-N 2.95Å; D734-I737 WeakPolarHBondContact O-CB 3.49Å; D734-I737 PolarHBondContact O-N 2.91Å; D734-I737 VanDerWaalsContact O-N 3.12Å; D734-D738 PolarHBondContact O-N 3.48Å; D734-K764 IonicContact OD1-NZ 3.45Å; D734-K764 PolarHBondContact OD1-NZ 3.24Å; D734-K764 IonicContact OD2-NZ 3.83Å; D734-K764 PolarHBondContact OD2-NZ 2.94Å
735	A	91.2	Very high	90.2	Very high	37 Å²	37	45.3 Å²	45.3	31%	0.306	24%	0.241	S	C	.	.	H	α-helix	trans	-59.5	-39.4	174.1	0	0	0	0	0	111.5	E727 E732 D738 L739	E727-A735 HydrophobicContact CG-CB 4.49Å; E732-A735 HydrophobicContact CB-CB 4.25Å; E732-A735 PolarHBondContact O-N 3.36Å; A735-D738 PolarHBondContact O-N 2.84Å; A735-L739 WeakPolarHBondContact O-CB 3.37Å; A735-L739 VanDerWaalsContact O-CG 3.24Å; A735-L739 WeakPolarHBondContact O-CG 3.24Å; A735-L739 PolarHBondContact O-N 2.94Å
736	A	91.3	Very high	90	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-43.3	174.7	0	0	0	0	0	112.3	E727 W728 E732 L733 D734 L739 V740 I760	E727-A736 HydrophobicContact CB-CB 4.01Å; W728-A736 HydrophobicContact CB-CB 4.23Å; E732-A736 WeakPolarHBondContact O-CB 3.38Å; E732-A736 PolarHBondContact O-N 3.11Å; L733-A736 PolarHBondContact O-N 3.13Å; D734-A736 VanDerWaalsContact C-N 3.27Å; D734-A736 PolarHBondContact O-N 2.95Å; A736-L739 PolarHBondContact O-N 3.4Å; A736-V740 WeakPolarHBondContact O-CG2 3.39Å; A736-V740 PolarHBondContact O-N 3.29Å; A736-I760 HydrophobicContact CB-CD1 3.73Å
737	I	92	Very high	90	Very high	5 Å²	5	48.5 Å²	48.5	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-44.1	175.2	-75	161.6	0	0	0	111.1	L733 D734 V740 K741 I760 Y761 K764	L733-I737 WeakPolarHBondContact O-CD1 3.26Å; L733-I737 VanDerWaalsContact O-CG1 3.3Å; L733-I737 WeakPolarHBondContact O-CG1 3.33Å; L733-I737 PolarHBondContact O-N 3.33Å; D734-I737 WeakPolarHBondContact O-CB 3.49Å; D734-I737 PolarHBondContact O-N 2.91Å; D734-I737 VanDerWaalsContact O-N 3.12Å; I737-V740 WeakPolarHBondContact O-CB 3.39Å; I737-V740 PolarHBondContact O-N 2.65Å; I737-V740 VanDerWaalsContact O-N 3.15Å; I737-K741 HydrophobicContact CG2-CD 3.96Å; I737-K741 HydrophobicContact CG2-CG 4.41Å; I737-K741 WeakPolarHBondContact O-CG 3.3Å; I737-K741 PolarHBondContact O-N 2.83Å; I737-I760 HydrophobicContact CD1-CG2 3.76Å; I737-I760 HydrophobicContact CG1-CB 4.25Å; I737-I760 HydrophobicContact CG1-CD1 4.43Å; I737-I760 HydrophobicContact CG1-CG2 3.7Å; I737-Y761 HydrophobicContact CD1-CD1 4.12Å; I737-Y761 HydrophobicContact CD1-CE1 3.71Å; I737-Y761 HydrophobicContact CD1-CE2 4.24Å; I737-Y761 HydrophobicContact CG1-CE2 4.18Å; I737-Y761 HydrophobicContact CG2-CE2 4.18Å; I737-Y761 WeakPolarHBondContact CG2-OH 3.04Å; I737-K764 HydrophobicContact CD1-CD 3.98Å
738	D	93.1	Very high	89.8	Confident	78 Å²	78	52.3 Å²	52.3	42%	0.417	28%	0.282	S	S	.	.	H	α-helix	trans	-67.8	-36.8	-179.1	-71.1	-18.7	0	0	0	111.9	D734 A735 V740 K741 Q742	D734-D738 PolarHBondContact O-N 3.48Å; A735-D738 PolarHBondContact O-N 2.84Å; D738-V740 VanDerWaalsContact C-N 3.35Å; D738-K741 PolarHBondContact O-N 3.49Å; D738-K741 IonicContact OD1-NZ 3.67Å; D738-Q742 WeakPolarHBondContact O-CB 3.24Å; D738-Q742 VanDerWaalsContact O-CG 3.25Å; D738-Q742 WeakPolarHBondContact O-CG 3.32Å; D738-Q742 PolarHBondContact O-N 2.95Å
739	L	92	Very high	89.6	Confident	16 Å²	16	58.2 Å²	58.2	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-64.1	-36.6	169.7	-69.7	177.6	0	0	0	112.7	W720 A724 E727 A735 A736 G743	W720-L739 HydrophobicContact CZ3-CD2 4.24Å; A724-L739 HydrophobicContact CB-CB 4.41Å; E727-L739 HydrophobicContact CB-CD1 4.5Å; E727-L739 HydrophobicContact CG-CD1 3.51Å; A735-L739 WeakPolarHBondContact O-CB 3.37Å; A735-L739 VanDerWaalsContact O-CG 3.24Å; A735-L739 WeakPolarHBondContact O-CG 3.24Å; A735-L739 PolarHBondContact O-N 2.94Å; A736-L739 PolarHBondContact O-N 3.4Å; L739-G743 PolarHBondContact O-N 3.06Å
740	V	92	Very high	89.7	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.006	32%	0.315	C	S	.	.	H	α-helix	trans	-65.6	-45.8	172.4	168.7	0	0	0	0	110.6	A724 A736 I737 D738 G743 L744 L753 I756 I760	A724-V740 HydrophobicContact CB-CG2 3.62Å; A736-V740 WeakPolarHBondContact O-CG2 3.39Å; A736-V740 PolarHBondContact O-N 3.29Å; I737-V740 WeakPolarHBondContact O-CB 3.39Å; I737-V740 PolarHBondContact O-N 2.65Å; I737-V740 VanDerWaalsContact O-N 3.15Å; D738-V740 VanDerWaalsContact C-N 3.35Å; V740-G743 PolarHBondContact O-N 3.29Å; V740-L744 HydrophobicContact CG1-CD1 3.72Å; V740-L744 HydrophobicContact CG1-CG 4.21Å; V740-L744 VanDerWaalsContact O-CB 3.31Å; V740-L744 WeakPolarHBondContact O-CB 3.23Å; V740-L744 VanDerWaalsContact O-CG 3.23Å; V740-L744 WeakPolarHBondContact O-CG 3.32Å; V740-L744 PolarHBondContact O-N 3.16Å; V740-L753 HydrophobicContact CG1-CB 4.44Å; V740-L753 WeakPolarHBondContact CG1-O 3.42Å; V740-I756 HydrophobicContact CG2-CB 4.4Å; V740-I756 HydrophobicContact CG2-CG2 3.89Å; V740-I760 HydrophobicContact CG2-CD1 4.49Å
741	K	92.2	Very high	89.9	Confident	91 Å²	91	57.7 Å²	57.7	40%	0.396	32%	0.315	S	S	.	.	H	α-helix	trans	-61.3	-45.6	177.8	-71.9	167.5	-178.2	165.3	0	111.9	I737 D738 L744 S745 F773	I737-K741 HydrophobicContact CG2-CD 3.96Å; I737-K741 HydrophobicContact CG2-CG 4.41Å; I737-K741 WeakPolarHBondContact O-CG 3.3Å; I737-K741 PolarHBondContact O-N 2.83Å; D738-K741 PolarHBondContact O-N 3.49Å; D738-K741 IonicContact OD1-NZ 3.67Å; K741-L744 PolarHBondContact O-N 2.95Å; K741-S745 PolarHBondContact O-N 3.24Å; K741-F773 HydrophobicContact CG-CZ 4.18Å
742	Q	91.1	Very high	90	Very high	94 Å²	94	57.7 Å²	57.7	44%	0.439	31%	0.308	S	S	.	.	H	α-helix	trans	-61.4	-48.4	174.5	-71.5	168.7	20.6	0	0	111.5	W720 D738 L744 S745 A746	W720-Q742 HydrophobicContact CE3-CB 4.48Å; W720-Q742 HydrophobicContact CH2-CB 4.07Å; W720-Q742 HydrophobicContact CZ3-CB 3.72Å; D738-Q742 WeakPolarHBondContact O-CB 3.24Å; D738-Q742 VanDerWaalsContact O-CG 3.25Å; D738-Q742 WeakPolarHBondContact O-CG 3.32Å; D738-Q742 PolarHBondContact O-N 2.95Å; Q742-L744 VanDerWaalsContact C-N 3.28Å; Q742-L744 PolarHBondContact O-N 3.25Å; Q742-S745 PolarHBondContact O-N 3.08Å; Q742-S745 PolarHBondContact O-OG 2.82Å; Q742-A746 PolarHBondContact O-N 3.07Å
743	G	89.7	Confident	90.1	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.3	-37.3	176.4	0	0	0	0	0	112.8	L739 V740 A746 Y747 L753	L739-G743 PolarHBondContact O-N 3.06Å; V740-G743 PolarHBondContact O-N 3.29Å; G743-A746 PolarHBondContact O-N 2.92Å; G743-Y747 WeakPolarHBondContact O-CB 3.28Å; G743-Y747 PolarHBondContact O-N 2.81Å; G743-L753 VanDerWaalsContact C-CD1 3.45Å
744	L	89.4	Confident	90.3	Very high	11 Å²	11	51.9 Å²	51.9	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-70.1	-37.3	175.6	-75.8	173.6	0	0	0	112.3	V740 K741 Q742 A746 Y747 E748 L753 W754 F773	V740-L744 HydrophobicContact CG1-CD1 3.72Å; V740-L744 HydrophobicContact CG1-CG 4.21Å; V740-L744 VanDerWaalsContact O-CB 3.31Å; V740-L744 WeakPolarHBondContact O-CB 3.23Å; V740-L744 VanDerWaalsContact O-CG 3.23Å; V740-L744 WeakPolarHBondContact O-CG 3.32Å; V740-L744 PolarHBondContact O-N 3.16Å; K741-L744 PolarHBondContact O-N 2.95Å; Q742-L744 VanDerWaalsContact C-N 3.28Å; Q742-L744 PolarHBondContact O-N 3.25Å; L744-A746 PolarHBondContact O-N 2.81Å; L744-Y747 CarbonylContact O-C 3.58Å; L744-Y747 VanDerWaalsContact O-C 3.31Å; L744-Y747 PolarHBondContact O-N 3.04Å; L744-E748 WeakPolarHBondContact O-CA 3.34Å; L744-E748 VanDerWaalsContact O-CG 3.3Å; L744-E748 WeakPolarHBondContact O-CG 3.27Å; L744-E748 PolarHBondContact O-N 3.35Å; L744-L753 HydrophobicContact CD2-CB 3.58Å; L744-L753 HydrophobicContact CD2-CD1 4.2Å; L744-L753 HydrophobicContact CG-CB 3.87Å; L744-L753 HydrophobicContact CG-CD1 4.33Å; L744-W754 HydrophobicContact CD1-CD2 3.89Å; L744-W754 HydrophobicContact CD1-CE3 3.84Å; L744-W754 HydrophobicContact CD1-CH2 3.93Å; L744-W754 HydrophobicContact CD1-CZ2 3.97Å; L744-W754 HydrophobicContact CD1-CZ3 3.87Å; L744-W754 HydrophobicContact CD2-CD2 3.87Å; L744-W754 VanDerWaalsContact CD2-CE2 3.46Å; L744-W754 HydrophobicContact CD2-CG 4.02Å; L744-W754 HydrophobicContact CD2-CZ2 3.92Å; L744-W754 HydrophobicContact CG-CZ2 4.43Å; L744-F773 HydrophobicContact CD1-CE1 4.19Å
745	S	89.2	Confident	90.3	Very high	95 Å²	95	48.3 Å²	48.3	66%	0.664	26%	0.26	S	S	*	.	H	α-helix	trans	-64.6	-24.7	175.1	64.8	0	0	0	0	113.8	K741 Q742	K741-S745 PolarHBondContact O-N 3.24Å; Q742-S745 PolarHBondContact O-N 3.08Å; Q742-S745 PolarHBondContact O-OG 2.82Å
746	A	87.1	Confident	90.3	Very high	60 Å²	60	47.2 Å²	47.2	50%	0.496	25%	0.249	S	C	.	.	H	α-helix	trans	-89	-35.1	171.5	0	0	0	0	0	113	Q742 G743 L744	Q742-A746 PolarHBondContact O-N 3.07Å; G743-A746 PolarHBondContact O-N 2.92Å; L744-A746 PolarHBondContact O-N 2.81Å
747	Y	87.3	Confident	90.3	Very high	79 Å²	79	47.2 Å²	47.2	31%	0.31	25%	0.249	S	C	.	.			trans	-135.5	72.4	-172.5	-60.5	-69.7	0	0	0	111.5	P715 A717 W720 G743 L744 D749 A750	P715-Y747 PolarHBondContact O-OH 2.72Å; A717-Y747 HydrophobicContact CB-CD1 4.45Å; A717-Y747 HydrophobicContact CB-CD2 4.06Å; A717-Y747 HydrophobicContact CB-CG 3.89Å; W720-Y747 AromaticContact CD1-CD2 3.86Å; W720-Y747 AromaticContact CD1-CE2 3.76Å; W720-Y747 AromaticContact NE1-CE2 3.9Å; G743-Y747 WeakPolarHBondContact O-CB 3.28Å; G743-Y747 PolarHBondContact O-N 2.81Å; L744-Y747 CarbonylContact O-C 3.58Å; L744-Y747 VanDerWaalsContact O-C 3.31Å; L744-Y747 PolarHBondContact O-N 3.04Å; Y747-D749 PolarHBondContact O-N 3.17Å; Y747-A750 WeakPolarHBondContact O-CB 3.3Å; Y747-A750 PolarHBondContact O-N 2.84Å
748	E	87.3	Confident	90.2	Very high	96 Å²	96	47 Å²	47	45%	0.449	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-33.3	-179.1	-58.5	-151.6	137.8	0	0	112.9	L744 A750 W754 K780	L744-E748 WeakPolarHBondContact O-CA 3.34Å; L744-E748 VanDerWaalsContact O-CG 3.3Å; L744-E748 WeakPolarHBondContact O-CG 3.27Å; L744-E748 PolarHBondContact O-N 3.35Å; E748-A750 PolarHBondContact O-N 3.18Å; E748-W754 PolarHBondContact O-NE1 3.14Å; E748-K780 HydrophobicContact CB-CD 3.91Å; E748-K780 IonicContact OE1-NZ 2.69Å; E748-K780 PolarHBondContact OE1-NZ 3.02Å; E748-K780 IonicContact OE2-NZ 2.71Å; E748-K780 PolarHBondContact OE2-NZ 3.23Å
749	D	86.7	Confident	90.1	Very high	134 Å²	134	45.8 Å²	45.8	72%	0.717	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-1.1	-178.1	-66.9	-27.8	0	0	0	114.1	Y747 P751 C781	Y747-D749 PolarHBondContact O-N 3.17Å; D749-P751 WeakPolarHBondContact O-CD 3.27Å; D749-C781 VanDerWaalsContact C-SG 3.51Å; D749-C781 PolarHBondContact O-SG 3.05Å; D749-C781 VanDerWaalsContact O-SG 3.38Å
750	A	88.3	Confident	90	Very high	16 Å²	16	45 Å²	45	13%	0.132	24%	0.236	C	C	.	.			trans	-87.1	95.7	-175.7	0	0	0	0	0	112.5	A717 Y747 E748 K752 L753	A717-A750 HydrophobicContact CB-CB 3.78Å; Y747-A750 WeakPolarHBondContact O-CB 3.3Å; Y747-A750 PolarHBondContact O-N 2.84Å; E748-A750 PolarHBondContact O-N 3.18Å; A750-K752 PolarHBondContact O-N 3Å; A750-K752 VanDerWaalsContact O-N 3.07Å; A750-L753 HydrophobicContact CB-CD1 4.04Å; A750-L753 HydrophobicContact CB-CG 4.17Å; A750-L753 PolarHBondContact O-N 3.1Å; A750-L753 VanDerWaalsContact O-N 3.09Å
751	P	90.1	Very high	90	Very high	37 Å²	37	45.3 Å²	45.3	24%	0.24	24%	0.237	C	C	.	.	H	α-helix	trans	-63.3	-24.9	-175.8	28.2	-38.4	0	0	0	113.1	D749 L753 W754 M755 C781 S784	D749-P751 WeakPolarHBondContact O-CD 3.27Å; P751-L753 VanDerWaalsContact C-N 3.3Å; P751-L753 PolarHBondContact O-N 2.84Å; P751-W754 PolarHBondContact O-N 2.86Å; P751-M755 VanDerWaalsContact O-CG 3.31Å; P751-M755 WeakPolarHBondContact O-CG 3.05Å; P751-M755 PolarHBondContact O-N 2.93Å; P751-C781 HydrophobicContact CB-CB 4.11Å; P751-S784 VanDerWaalsContact CB-CB 3.42Å; P751-S784 WeakPolarHBondContact CB-OG 3.43Å
752	K	88.8	Confident	89.8	Confident	128 Å²	128	42.2 Å²	42.2	56%	0.557	23%	0.225	S	C	*	.	H	α-helix	trans	-66.7	-30	178.9	-64.2	-178.5	-176.9	173.4	0	112.8	M721 A750 M755 I756	M721-K752 HydrophobicContact CG-CB 4.18Å; M721-K752 HydrophobicContact SD-CB 3.78Å; M721-K752 HydrophobicContact SD-CD 3.59Å; M721-K752 VanDerWaalsContact SD-CD 3.59Å; M721-K752 HydrophobicContact SD-CG 4.25Å; A750-K752 PolarHBondContact O-N 3Å; A750-K752 VanDerWaalsContact O-N 3.07Å; K752-M755 HydrophobicContact CB-CE 4.18Å; K752-M755 HydrophobicContact CG-CE 3.7Å; K752-I756 WeakPolarHBondContact O-CG1 3.14Å; K752-I756 PolarHBondContact O-N 2.78Å; K752-I756 VanDerWaalsContact O-N 3.13Å
753	L	92.4	Very high	89.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-72.3	-44.3	173.6	-66.7	179.9	0	0	0	110.8	W720 M721 V740 G743 L744 A750 P751 M755 I756 G757	W720-L753 HydrophobicContact CB-CD1 4.39Å; W720-L753 HydrophobicContact CB-CD2 4.22Å; M721-L753 HydrophobicContact CB-CD2 3.97Å; V740-L753 HydrophobicContact CG1-CB 4.44Å; V740-L753 WeakPolarHBondContact CG1-O 3.42Å; G743-L753 VanDerWaalsContact C-CD1 3.45Å; L744-L753 HydrophobicContact CD2-CB 3.58Å; L744-L753 HydrophobicContact CD2-CD1 4.2Å; L744-L753 HydrophobicContact CG-CB 3.87Å; L744-L753 HydrophobicContact CG-CD1 4.33Å; A750-L753 HydrophobicContact CB-CD1 4.04Å; A750-L753 HydrophobicContact CB-CG 4.17Å; A750-L753 PolarHBondContact O-N 3.1Å; A750-L753 VanDerWaalsContact O-N 3.09Å; P751-L753 VanDerWaalsContact C-N 3.3Å; P751-L753 PolarHBondContact O-N 2.84Å; L753-M755 VanDerWaalsContact C-N 3.31Å; L753-M755 PolarHBondContact O-N 3.46Å; L753-I756 PolarHBondContact O-N 3.05Å; L753-G757 PolarHBondContact O-N 2.69Å
754	W	93.5	Very high	89.6	Confident	7 Å²	7	45.3 Å²	45.3	3%	0.027	24%	0.238	C	C	.	.	H	α-helix	trans	-57.4	-41.8	172.8	-68.4	109.7	0	0	0	112.7	L744 E748 P751 G758 F773 Q776 K780 L787	L744-W754 HydrophobicContact CD1-CD2 3.89Å; L744-W754 HydrophobicContact CD1-CE3 3.84Å; L744-W754 HydrophobicContact CD1-CH2 3.93Å; L744-W754 HydrophobicContact CD1-CZ2 3.97Å; L744-W754 HydrophobicContact CD1-CZ3 3.87Å; L744-W754 HydrophobicContact CD2-CD2 3.87Å; L744-W754 VanDerWaalsContact CD2-CE2 3.46Å; L744-W754 HydrophobicContact CD2-CG 4.02Å; L744-W754 HydrophobicContact CD2-CZ2 3.92Å; L744-W754 HydrophobicContact CG-CZ2 4.43Å; E748-W754 PolarHBondContact O-NE1 3.14Å; P751-W754 PolarHBondContact O-N 2.86Å; W754-G758 PolarHBondContact O-N 3.11Å; W754-F773 HydrophobicContact CE3-CB 4.45Å; W754-F773 AromaticContact CE3-CD1 3.88Å; W754-F773 HydrophobicContact CE3-CD1 3.88Å; W754-F773 AromaticContact CZ3-CD1 3.81Å; W754-F773 HydrophobicContact CZ3-CD1 3.81Å; W754-F773 HydrophobicContact CZ3-CE1 4.28Å; W754-F773 HydrophobicContact CZ3-CG 4.37Å; W754-Q776 HydrophobicContact CE3-CB 4.39Å; W754-Q776 HydrophobicContact CH2-CB 3.69Å; W754-Q776 HydrophobicContact CZ2-CB 4.49Å; W754-Q776 HydrophobicContact CZ3-CB 3.62Å; W754-K780 HydrophobicContact CZ2-CD 3.9Å; W754-L787 HydrophobicContact CB-CD1 3.82Å; W754-L787 HydrophobicContact CB-CD2 4.13Å
755	M	90.9	Very high	89.4	Confident	29 Å²	29	47 Å²	47	14%	0.143	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-47.6	175.7	-70.9	-171.3	-70.8	0	0	112.3	P751 K752 L753 G758 Q759 P786 L787 L790	P751-M755 VanDerWaalsContact O-CG 3.31Å; P751-M755 WeakPolarHBondContact O-CG 3.05Å; P751-M755 PolarHBondContact O-N 2.93Å; K752-M755 HydrophobicContact CB-CE 4.18Å; K752-M755 HydrophobicContact CG-CE 3.7Å; L753-M755 VanDerWaalsContact C-N 3.31Å; L753-M755 PolarHBondContact O-N 3.46Å; M755-G758 PolarHBondContact O-N 3.15Å; M755-Q759 WeakPolarHBondContact O-CB 3.4Å; M755-Q759 VanDerWaalsContact O-CG 3.24Å; M755-Q759 WeakPolarHBondContact O-CG 3.27Å; M755-Q759 PolarHBondContact O-N 3.3Å; M755-P786 HydrophobicContact CE-CB 4.36Å; M755-P786 HydrophobicContact SD-CB 3.65Å; M755-L787 HydrophobicContact CB-CD1 4.46Å; M755-L787 HydrophobicContact CG-CB 4.06Å; M755-L787 HydrophobicContact CG-CD1 3.57Å; M755-L787 HydrophobicContact CG-CG 4.42Å; M755-L787 HydrophobicContact SD-CB 4.46Å; M755-L790 HydrophobicContact CB-CD1 3.82Å; M755-L790 HydrophobicContact CG-CD1 3.67Å; M755-L790 HydrophobicContact SD-CD1 3.69Å
756	I	91.1	Very high	89.4	Confident	14 Å²	14	45.9 Å²	45.9	7%	0.072	25%	0.245	C	C	.	.	H	α-helix	trans	-63	-46.7	178.5	-69.8	171.9	0	0	0	110.7	M721 A724 W728 V740 K752 L753 G758 Q759 I760	M721-I756 HydrophobicContact CB-CD1 4.39Å; M721-I756 HydrophobicContact CG-CD1 3.44Å; M721-I756 VanDerWaalsContact CG-CD1 3.44Å; A724-I756 HydrophobicContact CB-CG2 4.26Å; W728-I756 HydrophobicContact CE3-CG2 3.96Å; W728-I756 HydrophobicContact CZ3-CG1 4.19Å; W728-I756 HydrophobicContact CZ3-CG2 4.17Å; V740-I756 HydrophobicContact CG2-CB 4.4Å; V740-I756 HydrophobicContact CG2-CG2 3.89Å; K752-I756 WeakPolarHBondContact O-CG1 3.14Å; K752-I756 PolarHBondContact O-N 2.78Å; K752-I756 VanDerWaalsContact O-N 3.13Å; L753-I756 PolarHBondContact O-N 3.05Å; I756-G758 PolarHBondContact O-N 3.47Å; I756-Q759 PolarHBondContact O-N 3.19Å; I756-I760 HydrophobicContact CG2-CD1 3.61Å; I756-I760 HydrophobicContact CG2-CG1 4.25Å; I756-I760 VanDerWaalsContact O-CG1 3.29Å; I756-I760 WeakPolarHBondContact O-CG1 3.36Å; I756-I760 PolarHBondContact O-N 3.43Å
757	G	91.2	Very high	89.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-56.2	-52.3	176.4	0	0	0	0	0	112	L753 Q759 I760 Y761	L753-G757 PolarHBondContact O-N 2.69Å; G757-Q759 VanDerWaalsContact C-N 3.29Å; G757-Q759 PolarHBondContact O-N 3.38Å; G757-I760 PolarHBondContact O-N 3.12Å; G757-Y761 WeakPolarHBondContact O-CD2 3.42Å; G757-Y761 PolarHBondContact O-N 2.8Å
758	G	91.1	Very high	89.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59	-36.1	177.3	0	0	0	0	0	113.7	W754 M755 I756 D762 Y774	W754-G758 PolarHBondContact O-N 3.11Å; M755-G758 PolarHBondContact O-N 3.15Å; I756-G758 PolarHBondContact O-N 3.47Å; G758-D762 WeakPolarHBondContact O-CB 3.41Å; G758-D762 PolarHBondContact O-N 3.15Å; G758-Y774 VanDerWaalsContact C-OH 3.23Å; G758-Y774 PolarHBondContact O-OH 3.39Å
759	Q	90.2	Very high	89.5	Confident	54 Å²	54	48.3 Å²	48.3	25%	0.252	25%	0.25	S	C	.	.	H	α-helix	trans	-74.1	-34.4	176.4	-72	178.3	-45.7	0	0	113.4	W728 M755 I756 G757 Q763 Y774 L790	W728-Q759 HydrophobicContact CH2-CB 3.52Å; W728-Q759 HydrophobicContact CH2-CG 4.38Å; W728-Q759 HydrophobicContact CZ2-CB 3.64Å; M755-Q759 WeakPolarHBondContact O-CB 3.4Å; M755-Q759 VanDerWaalsContact O-CG 3.24Å; M755-Q759 WeakPolarHBondContact O-CG 3.27Å; M755-Q759 PolarHBondContact O-N 3.3Å; I756-Q759 PolarHBondContact O-N 3.19Å; G757-Q759 VanDerWaalsContact C-N 3.29Å; G757-Q759 PolarHBondContact O-N 3.38Å; Q759-Q763 WeakPolarHBondContact O-CG 3.38Å; Q759-Q763 PolarHBondContact O-N 3.23Å; Q759-Y774 PolarHBondContact N-OH 2.89Å; Q759-L790 HydrophobicContact CG-CD1 4.36Å
760	I	91.2	Very high	89.7	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-42.8	173.2	-63	159	0	0	0	110	W728 L733 A736 I737 V740 I756 G757 Q763 K764	W728-I760 HydrophobicContact CD2-CD1 4.41Å; W728-I760 HydrophobicContact CD2-CG1 3.81Å; W728-I760 HydrophobicContact CG-CD1 4.3Å; W728-I760 HydrophobicContact CG-CG1 3.88Å; W728-I760 HydrophobicContact CZ2-CG1 4.1Å; L733-I760 HydrophobicContact CB-CG2 3.95Å; L733-I760 HydrophobicContact CD2-CG2 4.23Å; A736-I760 HydrophobicContact CB-CD1 3.73Å; I737-I760 HydrophobicContact CD1-CG2 3.76Å; I737-I760 HydrophobicContact CG1-CB 4.25Å; I737-I760 HydrophobicContact CG1-CD1 4.43Å; I737-I760 HydrophobicContact CG1-CG2 3.7Å; V740-I760 HydrophobicContact CG2-CD1 4.49Å; I756-I760 HydrophobicContact CG2-CD1 3.61Å; I756-I760 HydrophobicContact CG2-CG1 4.25Å; I756-I760 VanDerWaalsContact O-CG1 3.29Å; I756-I760 WeakPolarHBondContact O-CG1 3.36Å; I756-I760 PolarHBondContact O-N 3.43Å; G757-I760 PolarHBondContact O-N 3.12Å; I760-Q763 PolarHBondContact O-N 2.8Å; I760-K764 PolarHBondContact O-N 2.94Å
761	Y	91.7	Very high	89.8	Confident	6 Å²	6	44.6 Å²	44.6	2%	0.024	22%	0.222	C	C	.	.	H	α-helix	trans	-67.2	-37.6	176.4	-75.2	-66.2	0	0	0	113	I737 G757 Q763 K764 G765 N766 E769 F773	I737-Y761 HydrophobicContact CD1-CD1 4.12Å; I737-Y761 HydrophobicContact CD1-CE1 3.71Å; I737-Y761 HydrophobicContact CD1-CE2 4.24Å; I737-Y761 HydrophobicContact CG1-CE2 4.18Å; I737-Y761 HydrophobicContact CG2-CE2 4.18Å; I737-Y761 WeakPolarHBondContact CG2-OH 3.04Å; G757-Y761 WeakPolarHBondContact O-CD2 3.42Å; G757-Y761 PolarHBondContact O-N 2.8Å; Y761-Q763 VanDerWaalsContact C-N 3.27Å; Y761-Q763 PolarHBondContact O-N 3.24Å; Y761-K764 PolarHBondContact O-N 3.11Å; Y761-G765 PolarHBondContact O-N 3.15Å; Y761-G765 VanDerWaalsContact O-N 3.12Å; Y761-N766 HydrophobicContact CD1-CB 4.09Å; Y761-N766 PolarHBondContact O-N 3.3Å; Y761-N766 VanDerWaalsContact O-N 3.11Å; Y761-E769 HydrophobicContact CD1-CB 3.56Å; Y761-E769 HydrophobicContact CD1-CG 4.37Å; Y761-E769 WeakPolarHBondContact CD1-OE2 3.37Å; Y761-E769 HydrophobicContact CD2-CB 4.37Å; Y761-E769 HydrophobicContact CE1-CB 3.66Å; Y761-E769 HydrophobicContact CE1-CG 4.1Å; Y761-E769 WeakPolarHBondContact CE1-OE1 3.21Å; Y761-E769 WeakPolarHBondContact CE1-OE2 3.27Å; Y761-E769 HydrophobicContact CE2-CB 4.48Å; Y761-E769 HydrophobicContact CG-CB 3.91Å; Y761-E769 PolarHBondContact OH-OE1 2.89Å; Y761-F773 AromaticContact CD2-CD2 3.83Å; Y761-F773 HydrophobicContact CD2-CD2 3.83Å; Y761-F773 HydrophobicContact CD2-CE2 4.11Å; Y761-F773 HydrophobicContact CD2-CG 4.12Å; Y761-F773 HydrophobicContact CE2-CD1 4.33Å; Y761-F773 AromaticContact CE2-CD2 3.44Å; Y761-F773 HydrophobicContact CE2-CD2 3.44Å; Y761-F773 VanDerWaalsContact CE2-CD2 3.44Å; Y761-F773 HydrophobicContact CE2-CE1 4.17Å; Y761-F773 AromaticContact CE2-CE2 3.25Å; Y761-F773 HydrophobicContact CE2-CE2 3.25Å; Y761-F773 HydrophobicContact CE2-CG 4.01Å; Y761-F773 AromaticContact CE2-CZ 3.65Å; Y761-F773 HydrophobicContact CE2-CZ 3.65Å; Y761-F773 AromaticContact CZ-CE2 3.78Å
762	D	88.1	Confident	89.8	Confident	27 Å²	27	45.1 Å²	45.1	14%	0.144	23%	0.227	C	C	.	.	H	α-helix	trans	-57.5	-39.6	170.3	-165	60.3	0	0	0	111.1	G758 G765 C794 K797 H798	G758-D762 WeakPolarHBondContact O-CB 3.41Å; G758-D762 PolarHBondContact O-N 3.15Å; D762-G765 PolarHBondContact O-N 3.37Å; D762-C794 PolarHBondContact OD1-SG 3.39Å; D762-K797 IonicContact OD2-NZ 3.5Å; D762-K797 PolarHBondContact OD2-NZ 2.83Å; D762-H798 IonicContact OD1-CE1 3.64Å; D762-H798 PolarHBondContact OD1-CE1 3.32Å
763	Q	87.6	Confident	89.9	Confident	95 Å²	95	40.1 Å²	40.1	44%	0.444	21%	0.205	S	C	.	.	H	α-helix	trans	-75.8	-30.7	176.3	-73.8	178.6	-3	0	0	114.6	Q759 I760 Y761 G765 I961	Q759-Q763 WeakPolarHBondContact O-CG 3.38Å; Q759-Q763 PolarHBondContact O-N 3.23Å; I760-Q763 PolarHBondContact O-N 2.8Å; Y761-Q763 VanDerWaalsContact C-N 3.27Å; Y761-Q763 PolarHBondContact O-N 3.24Å; Q763-G765 PolarHBondContact O-N 3.37Å; Q763-I961 VanDerWaalsContact NE2-CD1 3.26Å
764	K	88.5	Confident	89.9	Confident	64 Å²	64	40.5 Å²	40.5	28%	0.278	21%	0.207	S	C	.	.	H	α-helix	trans	-70.6	-18.4	170.9	-77.2	-166.2	168.3	-156.3	0	113.1	L733 D734 I737 I760 Y761 N766	L733-K764 VanDerWaalsContact CB-CE 3.43Å; L733-K764 HydrophobicContact CB-CG 4.5Å; L733-K764 HydrophobicContact CD1-CG 3.78Å; D734-K764 IonicContact OD1-NZ 3.45Å; D734-K764 PolarHBondContact OD1-NZ 3.24Å; D734-K764 IonicContact OD2-NZ 3.83Å; D734-K764 PolarHBondContact OD2-NZ 2.94Å; I737-K764 HydrophobicContact CD1-CD 3.98Å; I760-K764 PolarHBondContact O-N 2.94Å; Y761-K764 PolarHBondContact O-N 3.11Å; K764-N766 VanDerWaalsContact C-N 3.32Å
765	G	84.8	Confident	89.7	Confident	45 Å²	45	42.7 Å²	42.7	46%	0.464	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	4.7	-171.5	0	0	0	0	0	114.2	Y761 D762 Q763 L767	Y761-G765 PolarHBondContact O-N 3.15Å; Y761-G765 VanDerWaalsContact O-N 3.12Å; D762-G765 PolarHBondContact O-N 3.37Å; Q763-G765 PolarHBondContact O-N 3.37Å; G765-L767 VanDerWaalsContact C-N 3.33Å; G765-L767 WeakPolarHBondContact O-CG 3.46Å; G765-L767 PolarHBondContact O-N 2.92Å
766	N	89.2	Confident	89.7	Confident	73 Å²	73	45 Å²	45	39%	0.39	23%	0.234	S	C	.	.			trans	-82.7	76.6	-178.7	-73.9	8.7	0	0	0	110.5	Y761 K764 E768 E769 A770	Y761-N766 HydrophobicContact CD1-CB 4.09Å; Y761-N766 PolarHBondContact O-N 3.3Å; Y761-N766 VanDerWaalsContact O-N 3.11Å; K764-N766 VanDerWaalsContact C-N 3.32Å; N766-E768 VanDerWaalsContact C-N 3.3Å; N766-E768 PolarHBondContact O-N 3.43Å; N766-E769 HydrophobicContact CB-CB 4.24Å; N766-E769 HydrophobicContact CB-CG 4.44Å; N766-E769 WeakPolarHBondContact CB-OE2 3.4Å; N766-E769 PolarHBondContact ND2-OE2 3.15Å; N766-E769 PolarHBondContact O-N 3.44Å; N766-A770 PolarHBondContact O-N 2.98Å
767	L	86.3	Confident	89.7	Confident	51 Å²	51	44.3 Å²	44.3	27%	0.267	23%	0.23	S	C	.	.	H	α-helix	trans	-62	-34.5	-171.1	-51	-170.4	0	0	0	113.6	G765 R771 H798	G765-L767 VanDerWaalsContact C-N 3.33Å; G765-L767 WeakPolarHBondContact O-CG 3.46Å; G765-L767 PolarHBondContact O-N 2.92Å; L767-R771 VanDerWaalsContact O-CB 3.31Å; L767-R771 WeakPolarHBondContact O-CB 3.37Å; L767-R771 VanDerWaalsContact O-CG 3.22Å; L767-R771 WeakPolarHBondContact O-CG 3.41Å; L767-R771 PolarHBondContact O-N 2.67Å; L767-H798 HydrophobicContact CD1-CB 4.44Å; L767-H798 VanDerWaalsContact CD1-CD2 3.47Å; L767-H798 WeakPolarHBondContact CD1-CD2 3.37Å; L767-H798 VanDerWaalsContact CD2-CE1 3.43Å; L767-H798 WeakPolarHBondContact CD2-CE1 3.42Å; L767-H798 WeakPolarHBondContact CD2-NE2 3.34Å
768	E	88.7	Confident	89.5	Confident	161 Å²	161	45.2 Å²	45.2	75%	0.752	24%	0.235	S	C	*	.	H	α-helix	trans	-70.2	-41.4	179.9	-59.4	-170.1	163.8	0	0	111.7	N766 R771 S772	N766-E768 VanDerWaalsContact C-N 3.3Å; N766-E768 PolarHBondContact O-N 3.43Å; E768-R771 PolarHBondContact O-N 3.02Å; E768-S772 WeakPolarHBondContact O-CB 3.31Å; E768-S772 PolarHBondContact O-N 3.29Å
769	E	89.9	Confident	89.4	Confident	74 Å²	74	52.9 Å²	52.9	35%	0.346	27%	0.268	S	S	.	.	H	α-helix	trans	-67.7	-43.9	173.6	-65.5	-172.1	101.1	0	0	111.1	Y761 N766 R771 S772 F773	Y761-E769 HydrophobicContact CD1-CB 3.56Å; Y761-E769 HydrophobicContact CD1-CG 4.37Å; Y761-E769 WeakPolarHBondContact CD1-OE2 3.37Å; Y761-E769 HydrophobicContact CD2-CB 4.37Å; Y761-E769 HydrophobicContact CE1-CB 3.66Å; Y761-E769 HydrophobicContact CE1-CG 4.1Å; Y761-E769 WeakPolarHBondContact CE1-OE1 3.21Å; Y761-E769 WeakPolarHBondContact CE1-OE2 3.27Å; Y761-E769 HydrophobicContact CE2-CB 4.48Å; Y761-E769 HydrophobicContact CG-CB 3.91Å; Y761-E769 PolarHBondContact OH-OE1 2.89Å; N766-E769 HydrophobicContact CB-CB 4.24Å; N766-E769 HydrophobicContact CB-CG 4.44Å; N766-E769 WeakPolarHBondContact CB-OE2 3.4Å; N766-E769 PolarHBondContact ND2-OE2 3.15Å; N766-E769 PolarHBondContact O-N 3.44Å; E769-R771 VanDerWaalsContact C-N 3.35Å; E769-R771 PolarHBondContact O-N 2.97Å; E769-S772 WeakPolarHBondContact O-CB 3.37Å; E769-S772 PolarHBondContact O-N 2.97Å; E769-S772 VanDerWaalsContact O-N 3.1Å; E769-F773 WeakPolarHBondContact O-CD2 3.45Å; E769-F773 PolarHBondContact O-N 3.11Å
770	A	90.4	Very high	89.3	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-55.9	-48.8	174.5	0	0	0	0	0	111.4	N766 S772 F773 Y774	N766-A770 PolarHBondContact O-N 2.98Å; A770-S772 PolarHBondContact O-N 3.38Å; A770-F773 PolarHBondContact O-N 3.49Å; A770-Y774 HydrophobicContact CB-CE2 4.42Å; A770-Y774 WeakPolarHBondContact O-CD2 3.47Å; A770-Y774 PolarHBondContact O-N 3.34Å
771	R	89.3	Confident	89	Confident	72 Å²	72	54.6 Å²	54.6	27%	0.272	28%	0.276	S	S	.	.	H	α-helix	trans	-58.9	-43.1	173.7	-78.5	170.3	166.9	144.9	5.2	112.3	L767 E768 E769 S775 E795 C800	L767-R771 VanDerWaalsContact O-CB 3.31Å; L767-R771 WeakPolarHBondContact O-CB 3.37Å; L767-R771 VanDerWaalsContact O-CG 3.22Å; L767-R771 WeakPolarHBondContact O-CG 3.41Å; L767-R771 PolarHBondContact O-N 2.67Å; E768-R771 PolarHBondContact O-N 3.02Å; E769-R771 VanDerWaalsContact C-N 3.35Å; E769-R771 PolarHBondContact O-N 2.97Å; R771-S775 WeakPolarHBondContact O-CB 3.48Å; R771-S775 PolarHBondContact O-N 3.49Å; R771-S775 PolarHBondContact O-OG 2.95Å; R771-E795 WeakPolarHBondContact CG-OE1 3.25Å; R771-E795 IonicContact CZ-OE1 2.84Å; R771-E795 IonicContact CZ-OE2 2.64Å; R771-E795 IonicContact NE-OE1 3.89Å; R771-E795 PolarHBondContact NE-OE1 3.2Å; R771-E795 IonicContact NE-OE2 3.55Å; R771-E795 PolarHBondContact NE-OE2 2.96Å; R771-E795 IonicContact NH2-OE1 3.33Å; R771-E795 IonicContact NH2-OE2 2.65Å; R771-E795 PolarHBondContact NH2-OE2 3.38Å; R771-C800 PolarHBondContact NH2-SG 3.42Å
772	S	90.7	Very high	88.5	Confident	48 Å²	48	56.1 Å²	56.1	34%	0.336	29%	0.287	S	S	.	.	H	α-helix	trans	-59.4	-52.6	176.8	-171.1	0	0	0	0	110.7	E768 E769 A770 Y774 S775 Q776	E768-S772 WeakPolarHBondContact O-CB 3.31Å; E768-S772 PolarHBondContact O-N 3.29Å; E769-S772 WeakPolarHBondContact O-CB 3.37Å; E769-S772 PolarHBondContact O-N 2.97Å; E769-S772 VanDerWaalsContact O-N 3.1Å; A770-S772 PolarHBondContact O-N 3.38Å; S772-Y774 PolarHBondContact O-N 3.08Å; S772-S775 PolarHBondContact O-N 3.44Å; S772-S775 PolarHBondContact O-OG 3.36Å; S772-Q776 WeakPolarHBondContact O-CB 3.21Å; S772-Q776 VanDerWaalsContact O-CG 3.3Å; S772-Q776 WeakPolarHBondContact O-CG 3.3Å; S772-Q776 PolarHBondContact O-N 3.21Å; S772-Q776 PolarHBondContact OG-NE2 3.33Å
773	F	91.5	Very high	88.3	Confident	22 Å²	22	60.8 Å²	60.8	10%	0.096	31%	0.312	C	S	.	.	H	α-helix	trans	-59.5	-48	178.2	-89.9	-101.9	0	0	0	112.7	K741 L744 W754 Y761 E769 A770 S775 Q776 G777	K741-F773 HydrophobicContact CG-CZ 4.18Å; L744-F773 HydrophobicContact CD1-CE1 4.19Å; W754-F773 HydrophobicContact CE3-CB 4.45Å; W754-F773 AromaticContact CE3-CD1 3.88Å; W754-F773 HydrophobicContact CE3-CD1 3.88Å; W754-F773 AromaticContact CZ3-CD1 3.81Å; W754-F773 HydrophobicContact CZ3-CD1 3.81Å; W754-F773 HydrophobicContact CZ3-CE1 4.28Å; W754-F773 HydrophobicContact CZ3-CG 4.37Å; Y761-F773 AromaticContact CD2-CD2 3.83Å; Y761-F773 HydrophobicContact CD2-CD2 3.83Å; Y761-F773 HydrophobicContact CD2-CE2 4.11Å; Y761-F773 HydrophobicContact CD2-CG 4.12Å; Y761-F773 HydrophobicContact CE2-CD1 4.33Å; Y761-F773 AromaticContact CE2-CD2 3.44Å; Y761-F773 HydrophobicContact CE2-CD2 3.44Å; Y761-F773 VanDerWaalsContact CE2-CD2 3.44Å; Y761-F773 HydrophobicContact CE2-CE1 4.17Å; Y761-F773 AromaticContact CE2-CE2 3.25Å; Y761-F773 HydrophobicContact CE2-CE2 3.25Å; Y761-F773 HydrophobicContact CE2-CG 4.01Å; Y761-F773 AromaticContact CE2-CZ 3.65Å; Y761-F773 HydrophobicContact CE2-CZ 3.65Å; Y761-F773 AromaticContact CZ-CE2 3.78Å; E769-F773 WeakPolarHBondContact O-CD2 3.45Å; E769-F773 PolarHBondContact O-N 3.11Å; A770-F773 PolarHBondContact O-N 3.49Å; F773-S775 PolarHBondContact O-N 3.47Å; F773-Q776 PolarHBondContact O-N 3.12Å; F773-G777 PolarHBondContact O-N 2.68Å
774	Y	91.8	Very high	88.3	Confident	8 Å²	8	57.1 Å²	57.1	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-42	175.4	-73.2	-55.7	0	0	0	112	G758 Q759 A770 S772 G777 I778 L787 L790 A791 C794	G758-Y774 VanDerWaalsContact C-OH 3.23Å; G758-Y774 PolarHBondContact O-OH 3.39Å; Q759-Y774 PolarHBondContact N-OH 2.89Å; A770-Y774 HydrophobicContact CB-CE2 4.42Å; A770-Y774 WeakPolarHBondContact O-CD2 3.47Å; A770-Y774 PolarHBondContact O-N 3.34Å; S772-Y774 PolarHBondContact O-N 3.08Å; Y774-G777 PolarHBondContact O-N 3.44Å; Y774-I778 WeakPolarHBondContact O-CB 3.32Å; Y774-I778 WeakPolarHBondContact O-CD1 3.39Å; Y774-I778 WeakPolarHBondContact O-CG1 3.43Å; Y774-I778 PolarHBondContact O-N 3.38Å; Y774-L787 HydrophobicContact CD1-CD1 3.78Å; Y774-L787 HydrophobicContact CE1-CD1 4.18Å; Y774-L790 HydrophobicContact CE1-CB 3.83Å; Y774-A791 HydrophobicContact CD1-CB 4.07Å; Y774-A791 HydrophobicContact CD2-CB 4.49Å; Y774-A791 HydrophobicContact CG-CB 3.89Å; Y774-C794 HydrophobicContact CD2-CB 4.37Å; Y774-C794 HydrophobicContact CE2-CB 3.87Å
775	S	90.1	Very high	88.3	Confident	54 Å²	54	55 Å²	55	38%	0.378	29%	0.288	S	S	.	.	H	α-helix	trans	-68.3	-36.2	-179.6	78.4	0	0	0	0	113.1	R771 S772 F773 K779	R771-S775 WeakPolarHBondContact O-CB 3.48Å; R771-S775 PolarHBondContact O-N 3.49Å; R771-S775 PolarHBondContact O-OG 2.95Å; S772-S775 PolarHBondContact O-N 3.44Å; S772-S775 PolarHBondContact O-OG 3.36Å; F773-S775 PolarHBondContact O-N 3.47Å; S775-K779 WeakPolarHBondContact O-CG 3.28Å; S775-K779 PolarHBondContact O-N 2.81Å
776	Q	90.7	Very high	88.5	Confident	77 Å²	77	55.9 Å²	55.9	36%	0.36	29%	0.286	S	S	.	.	H	α-helix	trans	-68.2	-47.6	173.4	-70.8	179.5	39.9	0	0	110.4	W754 S772 F773 I778 K779 K780	W754-Q776 HydrophobicContact CE3-CB 4.39Å; W754-Q776 HydrophobicContact CH2-CB 3.69Å; W754-Q776 HydrophobicContact CZ2-CB 4.49Å; W754-Q776 HydrophobicContact CZ3-CB 3.62Å; S772-Q776 WeakPolarHBondContact O-CB 3.21Å; S772-Q776 VanDerWaalsContact O-CG 3.3Å; S772-Q776 WeakPolarHBondContact O-CG 3.3Å; S772-Q776 PolarHBondContact O-N 3.21Å; S772-Q776 PolarHBondContact OG-NE2 3.33Å; F773-Q776 PolarHBondContact O-N 3.12Å; Q776-I778 VanDerWaalsContact C-N 3.32Å; Q776-I778 PolarHBondContact O-N 3.46Å; Q776-K779 WeakPolarHBondContact O-CA 3.49Å; Q776-K779 WeakPolarHBondContact O-CB 3.47Å; Q776-K779 PolarHBondContact O-N 2.71Å; Q776-K780 PolarHBondContact O-N 2.56Å
777	G	89.8	Confident	88.6	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.5	-37.5	175.4	0	0	0	0	0	113.5	F773 Y774 K779 K780 C781 L787	F773-G777 PolarHBondContact O-N 2.68Å; Y774-G777 PolarHBondContact O-N 3.44Å; G777-K779 VanDerWaalsContact C-N 3.3Å; G777-K779 PolarHBondContact O-N 2.67Å; G777-K780 PolarHBondContact O-N 3.33Å; G777-C781 WeakPolarHBondContact O-CA 3.35Å; G777-C781 WeakPolarHBondContact O-CB 3.3Å; G777-C781 PolarHBondContact O-N 3.27Å; G777-L787 VanDerWaalsContact C-CD2 3.42Å
778	I	88.3	Confident	88.8	Confident	19 Å²	19	50.1 Å²	50.1	10%	0.097	26%	0.255	C	S	.	.	H	α-helix	trans	-72.3	-21.5	175.4	-69.6	163.1	0	0	0	112.8	Y774 Q776 L787 L788 A791 I807 K814	Y774-I778 WeakPolarHBondContact O-CB 3.32Å; Y774-I778 WeakPolarHBondContact O-CD1 3.39Å; Y774-I778 WeakPolarHBondContact O-CG1 3.43Å; Y774-I778 PolarHBondContact O-N 3.38Å; Q776-I778 VanDerWaalsContact C-N 3.32Å; Q776-I778 PolarHBondContact O-N 3.46Å; I778-L787 HydrophobicContact CG1-CD2 4.39Å; I778-L787 HydrophobicContact CG1-CG 4.35Å; I778-L788 HydrophobicContact CD1-CD2 3.9Å; I778-L788 HydrophobicContact CG1-CD2 3.84Å; I778-L788 HydrophobicContact CG1-CG 4.44Å; I778-L788 HydrophobicContact CG2-CD2 3.85Å; I778-A791 HydrophobicContact CD1-CB 3.61Å; I778-I807 HydrophobicContact CD1-CG2 4.47Å; I778-K814 PolarHBondContact O-NZ 2.83Å; I778-K814 VanDerWaalsContact O-NZ 3.12Å
779	K	88.9	Confident	89	Confident	161 Å²	161	44.4 Å²	44.4	70%	0.7	23%	0.229	S	C	*	.	H	α-helix	trans	-77.4	-46.9	170.9	-73.7	170.1	-179.5	179.6	0	111.2	S775 Q776 G777	S775-K779 WeakPolarHBondContact O-CG 3.28Å; S775-K779 PolarHBondContact O-N 2.81Å; Q776-K779 WeakPolarHBondContact O-CA 3.49Å; Q776-K779 WeakPolarHBondContact O-CB 3.47Å; Q776-K779 PolarHBondContact O-N 2.71Å; G777-K779 VanDerWaalsContact C-N 3.3Å; G777-K779 PolarHBondContact O-N 2.67Å
780	K	88.3	Confident	88.9	Confident	77 Å²	77	43 Å²	43	34%	0.335	22%	0.224	S	C	.	.	H	α-helix	trans	-77.3	-44.9	-178.4	-55.7	-158	-169.7	-166.5	0	113.3	E748 W754 Q776 G777 P782	E748-K780 HydrophobicContact CB-CD 3.91Å; E748-K780 IonicContact OE1-NZ 2.69Å; E748-K780 PolarHBondContact OE1-NZ 3.02Å; E748-K780 IonicContact OE2-NZ 2.71Å; E748-K780 PolarHBondContact OE2-NZ 3.23Å; W754-K780 HydrophobicContact CZ2-CD 3.9Å; Q776-K780 PolarHBondContact O-N 2.56Å; G777-K780 PolarHBondContact O-N 3.33Å; K780-P782 WeakPolarHBondContact O-CD 3.46Å
781	C	84.7	Confident	88.9	Confident	12 Å²	12	43.1 Å²	43.1	8%	0.081	23%	0.225	C	C	.	.			trans	-111.9	60.5	-177.1	-51.5	0	0	0	0	112.1	D749 P751 G777 N783 S784 L787	D749-C781 VanDerWaalsContact C-SG 3.51Å; D749-C781 PolarHBondContact O-SG 3.05Å; D749-C781 VanDerWaalsContact O-SG 3.38Å; P751-C781 HydrophobicContact CB-CB 4.11Å; G777-C781 WeakPolarHBondContact O-CA 3.35Å; G777-C781 WeakPolarHBondContact O-CB 3.3Å; G777-C781 PolarHBondContact O-N 3.27Å; C781-N783 PolarHBondContact O-N 3.25Å; C781-N783 VanDerWaalsContact O-N 3.13Å; C781-S784 WeakPolarHBondContact CB-OG 3.38Å; C781-S784 PolarHBondContact O-N 3.48Å; C781-S784 VanDerWaalsContact O-N 3.13Å; C781-S784 PolarHBondContact O-OG 3.05Å; C781-L787 HydrophobicContact CB-CD2 4.42Å
782	P	81.2	Confident	89	Confident	38 Å²	38	39.9 Å²	39.9	25%	0.247	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-28	-174.1	25.4	-34.8	0	0	0	114.1	K780 S784 K814 N815	K780-P782 WeakPolarHBondContact O-CD 3.46Å; P782-S784 VanDerWaalsContact C-N 3.27Å; P782-S784 PolarHBondContact O-N 2.98Å; P782-K814 HydrophobicContact CB-CD 3.92Å; P782-N815 PolarHBondContact O-ND2 3.07Å
783	N	84.3	Confident	88.9	Confident	126 Å²	126	39.8 Å²	39.8	67%	0.674	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-6.1	-176.3	-56.9	-0.1	0	0	0	112.9	C781 I785	C781-N783 PolarHBondContact O-N 3.25Å; C781-N783 VanDerWaalsContact O-N 3.13Å; N783-I785 PolarHBondContact O-N 2.94Å
784	S	86.9	Confident	88.8	Confident	17 Å²	17	39.1 Å²	39.1	12%	0.119	21%	0.211	C	C	.	.			trans	-85.9	96.2	-173.9	63.9	0	0	0	0	112.5	P751 C781 P782 L787 L788	P751-S784 VanDerWaalsContact CB-CB 3.42Å; P751-S784 WeakPolarHBondContact CB-OG 3.43Å; C781-S784 WeakPolarHBondContact CB-OG 3.38Å; C781-S784 PolarHBondContact O-N 3.48Å; C781-S784 VanDerWaalsContact O-N 3.13Å; C781-S784 PolarHBondContact O-OG 3.05Å; P782-S784 VanDerWaalsContact C-N 3.27Å; P782-S784 PolarHBondContact O-N 2.98Å; S784-L787 WeakPolarHBondContact O-CB 3.43Å; S784-L787 PolarHBondContact O-N 3.38Å; S784-L787 WeakPolarHBondContact OG-CB 3.31Å; S784-L787 WeakPolarHBondContact OG-CD2 3.49Å; S784-L788 PolarHBondContact O-N 3.3Å
785	I	88.8	Confident	88.6	Confident	19 Å²	19	39.5 Å²	39.5	10%	0.097	21%	0.213	C	C	.	.	H	α-helix	trans	-59.5	-48.1	-177.6	-59.3	160	0	0	0	112.7	N783 L787 L788 L789 M818 E820 L821	N783-I785 PolarHBondContact O-N 2.94Å; I785-L787 PolarHBondContact O-N 3.49Å; I785-L787 VanDerWaalsContact O-N 3.09Å; I785-L788 WeakPolarHBondContact O-CB 3.39Å; I785-L788 PolarHBondContact O-N 3.5Å; I785-L789 HydrophobicContact CG2-CD1 3.99Å; I785-L789 HydrophobicContact CG2-CG 4Å; I785-L789 WeakPolarHBondContact O-CG 3.37Å; I785-L789 PolarHBondContact O-N 3.35Å; I785-M818 HydrophobicContact CD1-CB 3.84Å; I785-M818 HydrophobicContact CD1-CE 3.42Å; I785-M818 VanDerWaalsContact CD1-CE 3.42Å; I785-M818 HydrophobicContact CD1-CG 3.78Å; I785-M818 HydrophobicContact CD1-SD 4.33Å; I785-E820 HydrophobicContact CG2-CB 3.81Å; I785-E820 WeakPolarHBondContact CG2-OE2 3.26Å; I785-L821 HydrophobicContact CG1-CD1 4.39Å; I785-L821 HydrophobicContact CG1-CG 4.43Å; I785-L821 HydrophobicContact CG2-CD2 3.79Å; I785-L821 HydrophobicContact CG2-CG 3.8Å
786	P	89.4	Confident	88.6	Confident	65 Å²	65	38.6 Å²	38.6	42%	0.422	20%	0.203	S	C	.	.	H	α-helix	trans	-61.1	-26.5	-178.3	-26.6	37.8	0	0	0	114	M755 L790	M755-P786 HydrophobicContact CE-CB 4.36Å; M755-P786 HydrophobicContact SD-CB 3.65Å; P786-L790 WeakPolarHBondContact O-CB 3.23Å; P786-L790 WeakPolarHBondContact O-CG 3.23Å; P786-L790 PolarHBondContact O-N 3.44Å
787	L	90.5	Very high	88.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-72.5	-42.1	175.2	-176.6	67.1	0	0	0	111.7	W754 M755 Y774 G777 I778 C781 S784 I785 L789 L790 A791	W754-L787 HydrophobicContact CB-CD1 3.82Å; W754-L787 HydrophobicContact CB-CD2 4.13Å; M755-L787 HydrophobicContact CB-CD1 4.46Å; M755-L787 HydrophobicContact CG-CB 4.06Å; M755-L787 HydrophobicContact CG-CD1 3.57Å; M755-L787 HydrophobicContact CG-CG 4.42Å; M755-L787 HydrophobicContact SD-CB 4.46Å; Y774-L787 HydrophobicContact CD1-CD1 3.78Å; Y774-L787 HydrophobicContact CE1-CD1 4.18Å; G777-L787 VanDerWaalsContact C-CD2 3.42Å; I778-L787 HydrophobicContact CG1-CD2 4.39Å; I778-L787 HydrophobicContact CG1-CG 4.35Å; C781-L787 HydrophobicContact CB-CD2 4.42Å; S784-L787 WeakPolarHBondContact O-CB 3.43Å; S784-L787 PolarHBondContact O-N 3.38Å; S784-L787 WeakPolarHBondContact OG-CB 3.31Å; S784-L787 WeakPolarHBondContact OG-CD2 3.49Å; I785-L787 PolarHBondContact O-N 3.49Å; I785-L787 VanDerWaalsContact O-N 3.09Å; L787-L789 VanDerWaalsContact C-N 3.33Å; L787-L790 PolarHBondContact O-N 3.21Å; L787-A791 WeakPolarHBondContact O-CB 3.4Å; L787-A791 PolarHBondContact O-N 3.08Å
788	L	91.6	Very high	88.1	Confident	3 Å²	3	45 Å²	45	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-42.1	172.1	-71.6	163.6	0	0	0	111.3	I778 S784 I785 A791 A792 I807 L821	I778-L788 HydrophobicContact CD1-CD2 3.9Å; I778-L788 HydrophobicContact CG1-CD2 3.84Å; I778-L788 HydrophobicContact CG1-CG 4.44Å; I778-L788 HydrophobicContact CG2-CD2 3.85Å; S784-L788 PolarHBondContact O-N 3.3Å; I785-L788 WeakPolarHBondContact O-CB 3.39Å; I785-L788 PolarHBondContact O-N 3.5Å; L788-A791 PolarHBondContact O-N 2.87Å; L788-A792 WeakPolarHBondContact O-CB 3.35Å; L788-A792 PolarHBondContact O-N 3.38Å; L788-I807 HydrophobicContact CD2-CG2 4.46Å; L788-L821 HydrophobicContact CB-CD2 3.97Å; L788-L821 HydrophobicContact CD1-CD1 4.29Å; L788-L821 HydrophobicContact CD1-CD2 4.15Å
789	L	91	Very high	87.9	Confident	40 Å²	40	47.2 Å²	47.2	21%	0.209	26%	0.258	C	S	.	.	H	α-helix	trans	-63.6	-45.9	177.2	-65.3	-176.9	0	0	0	112.3	I785 L787 A792 S793 L808 E820 L821 A824	I785-L789 HydrophobicContact CG2-CD1 3.99Å; I785-L789 HydrophobicContact CG2-CG 4Å; I785-L789 WeakPolarHBondContact O-CG 3.37Å; I785-L789 PolarHBondContact O-N 3.35Å; L787-L789 VanDerWaalsContact C-N 3.33Å; L789-A792 PolarHBondContact O-N 3.08Å; L789-S793 VanDerWaalsContact O-CB 3.29Å; L789-S793 WeakPolarHBondContact O-CB 3.3Å; L789-S793 PolarHBondContact O-N 2.89Å; L789-S793 PolarHBondContact O-OG 2.76Å; L789-L808 HydrophobicContact CD2-CD2 4.18Å; L789-E820 HydrophobicContact CD1-CB 4.34Å; L789-L821 HydrophobicContact CD2-CD2 4.04Å; L789-A824 HydrophobicContact CD2-CB 3.28Å
790	L	89.8	Confident	87.8	Confident	44 Å²	44	41.3 Å²	41.3	23%	0.23	24%	0.237	C	C	.	.	H	α-helix	trans	-64.9	-39.8	176.1	-76.3	173.1	0	0	0	112.5	M755 Q759 Y774 P786 L787 S793 C794	M755-L790 HydrophobicContact CB-CD1 3.82Å; M755-L790 HydrophobicContact CG-CD1 3.67Å; M755-L790 HydrophobicContact SD-CD1 3.69Å; Q759-L790 HydrophobicContact CG-CD1 4.36Å; Y774-L790 HydrophobicContact CE1-CB 3.83Å; P786-L790 WeakPolarHBondContact O-CB 3.23Å; P786-L790 WeakPolarHBondContact O-CG 3.23Å; P786-L790 PolarHBondContact O-N 3.44Å; L787-L790 PolarHBondContact O-N 3.21Å; L790-S793 PolarHBondContact O-N 3.34Å; L790-C794 VanDerWaalsContact O-CB 3.31Å; L790-C794 WeakPolarHBondContact O-CB 3.32Å; L790-C794 PolarHBondContact O-N 3.44Å
791	A	90.4	Very high	87.8	Confident	4 Å²	4	39.5 Å²	39.5	3%	0.033	23%	0.23	C	C	.	.	H	α-helix	trans	-62.8	-45.3	175.6	0	0	0	0	0	112.2	Y774 I778 L787 L788 C794 E795 I807	Y774-A791 HydrophobicContact CD1-CB 4.07Å; Y774-A791 HydrophobicContact CD2-CB 4.49Å; Y774-A791 HydrophobicContact CG-CB 3.89Å; I778-A791 HydrophobicContact CD1-CB 3.61Å; L787-A791 WeakPolarHBondContact O-CB 3.4Å; L787-A791 PolarHBondContact O-N 3.08Å; L788-A791 PolarHBondContact O-N 2.87Å; A791-C794 PolarHBondContact O-N 3.44Å; A791-E795 PolarHBondContact O-N 2.74Å; A791-E795 VanDerWaalsContact O-N 3.11Å; A791-I807 HydrophobicContact CB-CG2 4.31Å
792	A	90.6	Very high	88.1	Confident	3 Å²	3	45.3 Å²	45.3	3%	0.025	26%	0.259	C	S	.	.	H	α-helix	trans	-64.3	-41.1	175.6	0	0	0	0	0	112	L788 L789 E795 E796 A804 I807 L808	L788-A792 WeakPolarHBondContact O-CB 3.35Å; L788-A792 PolarHBondContact O-N 3.38Å; L789-A792 PolarHBondContact O-N 3.08Å; A792-E795 PolarHBondContact O-N 2.89Å; A792-E796 WeakPolarHBondContact O-CB 3.47Å; A792-E796 PolarHBondContact O-N 3.07Å; A792-A804 WeakPolarHBondContact O-CB 3.44Å; A792-I807 HydrophobicContact CB-CG2 4.2Å; A792-L808 HydrophobicContact CB-CD1 4Å; A792-L808 HydrophobicContact CB-CD2 3.66Å; A792-L808 HydrophobicContact CB-CG 3.6Å
793	S	88.2	Confident	88.5	Confident	47 Å²	47	48.5 Å²	48.5	33%	0.329	27%	0.269	S	S	.	.	H	α-helix	trans	-66.5	-35.9	177.4	-56.7	0	0	0	0	112.1	L789 L790 E796 K797	L789-S793 VanDerWaalsContact O-CB 3.29Å; L789-S793 WeakPolarHBondContact O-CB 3.3Å; L789-S793 PolarHBondContact O-N 2.89Å; L789-S793 PolarHBondContact O-OG 2.76Å; L790-S793 PolarHBondContact O-N 3.34Å; S793-E796 PolarHBondContact O-N 3.48Å; S793-K797 WeakPolarHBondContact O-CG 3.2Å; S793-K797 PolarHBondContact O-N 3.04Å
794	C	88.8	Confident	88.8	Confident	7 Å²	7	42.5 Å²	42.5	5%	0.047	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-45.2	173.7	-176.5	0	0	0	0	111.1	D762 Y774 L790 A791 E796 K797 H798	D762-C794 PolarHBondContact OD1-SG 3.39Å; Y774-C794 HydrophobicContact CD2-CB 4.37Å; Y774-C794 HydrophobicContact CE2-CB 3.87Å; L790-C794 VanDerWaalsContact O-CB 3.31Å; L790-C794 WeakPolarHBondContact O-CB 3.32Å; L790-C794 PolarHBondContact O-N 3.44Å; A791-C794 PolarHBondContact O-N 3.44Å; C794-E796 VanDerWaalsContact C-N 3.33Å; C794-E796 PolarHBondContact O-N 2.76Å; C794-K797 PolarHBondContact O-N 2.98Å; C794-H798 PolarHBondContact O-N 3.4Å; C794-H798 PolarHBondContact O-ND1 2.79Å
795	E	89.5	Confident	89.1	Confident	16 Å²	16	44.6 Å²	44.6	8%	0.075	24%	0.243	C	C	.	.	H	α-helix	trans	-64	-36.6	173.9	-70	-67.2	176.9	0	0	112.7	R771 A791 A792 H798 G799 C800 K803 A804 I807	R771-E795 WeakPolarHBondContact CG-OE1 3.25Å; R771-E795 IonicContact CZ-OE1 2.84Å; R771-E795 IonicContact CZ-OE2 2.64Å; R771-E795 IonicContact NE-OE1 3.89Å; R771-E795 PolarHBondContact NE-OE1 3.2Å; R771-E795 IonicContact NE-OE2 3.55Å; R771-E795 PolarHBondContact NE-OE2 2.96Å; R771-E795 IonicContact NH2-OE1 3.33Å; R771-E795 IonicContact NH2-OE2 2.65Å; R771-E795 PolarHBondContact NH2-OE2 3.38Å; A791-E795 PolarHBondContact O-N 2.74Å; A791-E795 VanDerWaalsContact O-N 3.11Å; A792-E795 PolarHBondContact O-N 2.89Å; E795-H798 CarbonylContact O-C 3.36Å; E795-H798 PolarHBondContact O-N 3.37Å; E795-G799 PolarHBondContact O-N 3.24Å; E795-C800 HydrophobicContact CB-CB 4.31Å; E795-C800 WeakPolarHBondContact O-CA 3.5Å; E795-C800 WeakPolarHBondContact O-CB 3.44Å; E795-C800 PolarHBondContact O-N 2.79Å; E795-C800 VanDerWaalsContact OE2-CB 3.25Å; E795-C800 WeakPolarHBondContact OE2-CB 3.22Å; E795-K803 HydrophobicContact CB-CB 4.27Å; E795-K803 HydrophobicContact CG-CB 4.02Å; E795-K803 WeakPolarHBondContact OE2-CD 3.39Å; E795-A804 HydrophobicContact CB-CB 4.08Å; E795-I807 HydrophobicContact CG-CD1 3.69Å
796	E	88.3	Confident	89.2	Confident	35 Å²	35	45.7 Å²	45.7	16%	0.164	26%	0.255	C	S	.	.	H	α-helix	trans	-65.6	-46.2	177.3	-172.2	-175.3	-167.7	0	0	112.5	A792 S793 C794 H798 G799 A804 R831	A792-E796 WeakPolarHBondContact O-CB 3.47Å; A792-E796 PolarHBondContact O-N 3.07Å; S793-E796 PolarHBondContact O-N 3.48Å; C794-E796 VanDerWaalsContact C-N 3.33Å; C794-E796 PolarHBondContact O-N 2.76Å; E796-H798 PolarHBondContact O-N 3.31Å; E796-G799 PolarHBondContact O-N 3.21Å; E796-A804 HydrophobicContact CB-CB 4.38Å; E796-R831 VanDerWaalsContact CD-NH2 3.32Å; E796-R831 IonicContact OE1-CZ 3.62Å; E796-R831 IonicContact OE1-NE 2.7Å; E796-R831 PolarHBondContact OE1-NE 3.02Å; E796-R831 IonicContact OE1-NH1 3.58Å; E796-R831 PolarHBondContact OE1-NH1 3.02Å; E796-R831 IonicContact OE1-NH2 3.68Å; E796-R831 PolarHBondContact OE1-NH2 3.39Å; E796-R831 VanDerWaalsContact OE1-NH2 3.12Å; E796-R831 IonicContact OE2-CZ 2.71Å; E796-R831 IonicContact OE2-NH1 3.94Å; E796-R831 PolarHBondContact OE2-NH1 3.2Å; E796-R831 IonicContact OE2-NH2 3.45Å; E796-R831 PolarHBondContact OE2-NH2 2.71Å
797	K	85.3	Confident	89.3	Confident	143 Å²	143	44 Å²	44	62%	0.622	24%	0.242	S	C	*	.	H	α-helix	trans	-53.6	-35.1	174	-75.2	177.8	-172.6	-176.1	0	112.5	D762 S793 C794 G799	D762-K797 IonicContact OD2-NZ 3.5Å; D762-K797 PolarHBondContact OD2-NZ 2.83Å; S793-K797 WeakPolarHBondContact O-CG 3.2Å; S793-K797 PolarHBondContact O-N 3.04Å; C794-K797 PolarHBondContact O-N 2.98Å; K797-G799 VanDerWaalsContact C-N 3.3Å; K797-G799 PolarHBondContact O-N 3.12Å
798	H	85.9	Confident	89.4	Confident	69 Å²	69	44.1 Å²	44.1	32%	0.319	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	23.3	-179.3	-60.4	99.8	0	0	0	113.1	D762 L767 C794 E795 E796 C800	D762-H798 IonicContact OD1-CE1 3.64Å; D762-H798 PolarHBondContact OD1-CE1 3.32Å; L767-H798 HydrophobicContact CD1-CB 4.44Å; L767-H798 VanDerWaalsContact CD1-CD2 3.47Å; L767-H798 WeakPolarHBondContact CD1-CD2 3.37Å; L767-H798 VanDerWaalsContact CD2-CE1 3.43Å; L767-H798 WeakPolarHBondContact CD2-CE1 3.42Å; L767-H798 WeakPolarHBondContact CD2-NE2 3.34Å; C794-H798 PolarHBondContact O-N 3.4Å; C794-H798 PolarHBondContact O-ND1 2.79Å; E795-H798 CarbonylContact O-C 3.36Å; E795-H798 PolarHBondContact O-N 3.37Å; E796-H798 PolarHBondContact O-N 3.31Å; H798-C800 PolarHBondContact O-N 3.5Å; H798-C800 PolarHBondContact O-SG 3.12Å
799	G	83	Confident	89.3	Confident	66 Å²	66	48.9 Å²	48.9	68%	0.68	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	0.7	174.3	0	0	0	0	0	115.2	E795 E796 K797 L801	E795-G799 PolarHBondContact O-N 3.24Å; E796-G799 PolarHBondContact O-N 3.21Å; K797-G799 VanDerWaalsContact C-N 3.3Å; K797-G799 PolarHBondContact O-N 3.12Å; G799-L801 PolarHBondContact O-N 3.02Å
800	C	87.1	Confident	89.3	Confident	37 Å²	37	54.4 Å²	54.4	25%	0.25	28%	0.282	C	S	.	.			trans	-85.9	52.8	-173.5	-70.3	0	0	0	0	111.9	R771 E795 H798 I802 K803 A804	R771-C800 PolarHBondContact NH2-SG 3.42Å; E795-C800 HydrophobicContact CB-CB 4.31Å; E795-C800 WeakPolarHBondContact O-CA 3.5Å; E795-C800 WeakPolarHBondContact O-CB 3.44Å; E795-C800 PolarHBondContact O-N 2.79Å; E795-C800 VanDerWaalsContact OE2-CB 3.25Å; E795-C800 WeakPolarHBondContact OE2-CB 3.22Å; H798-C800 PolarHBondContact O-N 3.5Å; H798-C800 PolarHBondContact O-SG 3.12Å; C800-I802 PolarHBondContact O-N 3.38Å; C800-I802 VanDerWaalsContact O-N 3.12Å; C800-K803 HydrophobicContact CB-CB 4.21Å; C800-K803 HydrophobicContact CB-CD 4.04Å; C800-K803 HydrophobicContact CB-CG 4.27Å; C800-K803 WeakPolarHBondContact O-CA 3.21Å; C800-K803 WeakPolarHBondContact O-CB 3.5Å; C800-K803 PolarHBondContact O-N 3.1Å; C800-A804 PolarHBondContact O-N 2.99Å; C800-A804 VanDerWaalsContact O-N 3.08Å
801	L	89.1	Confident	89.2	Confident	38 Å²	38	52.3 Å²	52.3	20%	0.199	27%	0.271	C	S	.	.	H	α-helix	trans	-56.8	-33.6	-172.1	-169.3	146.7	0	0	0	113.4	G799 K803 A804 R805	G799-L801 PolarHBondContact O-N 3.02Å; L801-K803 PolarHBondContact O-N 2.94Å; L801-A804 PolarHBondContact O-N 2.98Å; L801-R805 HydrophobicContact CD2-CG 4.11Å; L801-R805 WeakPolarHBondContact O-CG 3.5Å; L801-R805 PolarHBondContact O-N 3.3Å
802	I	91.1	Very high	89.1	Confident	135 Å²	135	53.6 Å²	53.6	69%	0.692	28%	0.275	S	S	*	.	H	α-helix	trans	-63.1	-39.4	174.1	-58.5	171.4	0	0	0	111.6	C800 A806	C800-I802 PolarHBondContact O-N 3.38Å; C800-I802 VanDerWaalsContact O-N 3.12Å; I802-A806 WeakPolarHBondContact O-CB 3.26Å; I802-A806 PolarHBondContact O-N 3.46Å; I802-A806 VanDerWaalsContact O-N 3.09Å
803	K	89.4	Confident	89	Confident	104 Å²	104	61.2 Å²	61.2	45%	0.452	31%	0.313	S	S	.	.	H	α-helix	trans	-70.2	-40.8	176	-64.1	-177.3	-177.6	172.5	0	111	E795 C800 L801 A806 I807	E795-K803 HydrophobicContact CB-CB 4.27Å; E795-K803 HydrophobicContact CG-CB 4.02Å; E795-K803 WeakPolarHBondContact OE2-CD 3.39Å; C800-K803 HydrophobicContact CB-CB 4.21Å; C800-K803 HydrophobicContact CB-CD 4.04Å; C800-K803 HydrophobicContact CB-CG 4.27Å; C800-K803 WeakPolarHBondContact O-CA 3.21Å; C800-K803 WeakPolarHBondContact O-CB 3.5Å; C800-K803 PolarHBondContact O-N 3.1Å; L801-K803 PolarHBondContact O-N 2.94Å; K803-A806 PolarHBondContact O-N 3.13Å; K803-I807 VanDerWaalsContact O-CG1 3.31Å; K803-I807 WeakPolarHBondContact O-CG1 3.35Å; K803-I807 PolarHBondContact O-N 3.08Å
804	A	91	Very high	89	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-58.3	-48.4	174.9	0	0	0	0	0	111.6	A792 E795 E796 C800 L801 A806 I807 L808	A792-A804 WeakPolarHBondContact O-CB 3.44Å; E795-A804 HydrophobicContact CB-CB 4.08Å; E796-A804 HydrophobicContact CB-CB 4.38Å; C800-A804 PolarHBondContact O-N 2.99Å; C800-A804 VanDerWaalsContact O-N 3.08Å; L801-A804 PolarHBondContact O-N 2.98Å; A804-A806 PolarHBondContact O-N 3.16Å; A804-I807 PolarHBondContact O-N 3.13Å; A804-L808 WeakPolarHBondContact O-CG 3.31Å; A804-L808 PolarHBondContact O-N 3.05Å
805	R	91.7	Very high	88.9	Confident	62 Å²	62	63.7 Å²	63.7	23%	0.234	32%	0.317	C	S	.	.	H	α-helix	trans	-52.2	-53	171.6	-76.4	174.1	170	155.2	-0.3	112	L801 I807 L808 E809 E829 F834	L801-R805 HydrophobicContact CD2-CG 4.11Å; L801-R805 WeakPolarHBondContact O-CG 3.5Å; L801-R805 PolarHBondContact O-N 3.3Å; R805-I807 VanDerWaalsContact C-N 3.32Å; R805-I807 PolarHBondContact O-N 3.11Å; R805-L808 PolarHBondContact O-N 3.38Å; R805-E809 WeakPolarHBondContact O-CB 3.34Å; R805-E809 PolarHBondContact O-N 3.11Å; R805-E829 WeakPolarHBondContact CG-OE1 3.41Å; R805-E829 IonicContact CZ-OE1 2.97Å; R805-E829 IonicContact CZ-OE2 2.71Å; R805-E829 IonicContact NE-OE1 3.28Å; R805-E829 PolarHBondContact NE-OE1 2.9Å; R805-E829 IonicContact NE-OE2 3.33Å; R805-E829 PolarHBondContact NE-OE2 3.13Å; R805-E829 IonicContact NH2-OE1 3.85Å; R805-E829 PolarHBondContact NH2-OE1 3.21Å; R805-E829 IonicContact NH2-OE2 3.45Å; R805-E829 PolarHBondContact NH2-OE2 2.7Å; R805-F834 VanDerWaalsContact NH2-CE2 3.28Å
806	A	92	Very high	88.6	Confident	42 Å²	42	67.2 Å²	67.2	35%	0.347	34%	0.342	S	S	.	.	H	α-helix	trans	-63.8	-33.2	-178.2	0	0	0	0	0	113.4	I802 K803 A804 R810	I802-A806 WeakPolarHBondContact O-CB 3.26Å; I802-A806 PolarHBondContact O-N 3.46Å; I802-A806 VanDerWaalsContact O-N 3.09Å; K803-A806 PolarHBondContact O-N 3.13Å; A804-A806 PolarHBondContact O-N 3.16Å; A806-R810 VanDerWaalsContact O-CB 3.25Å; A806-R810 WeakPolarHBondContact O-CB 3.19Å; A806-R810 PolarHBondContact O-N 2.9Å
807	I	91.6	Very high	88.5	Confident	29 Å²	29	72.2 Å²	72.2	15%	0.149	36%	0.363	C	S	.	.	H	α-helix	trans	-67.7	-45.9	173.2	-70.1	167.7	0	0	0	110.5	I778 L788 A791 A792 E795 K803 A804 R805 R810 G811	I778-I807 HydrophobicContact CD1-CG2 4.47Å; L788-I807 HydrophobicContact CD2-CG2 4.46Å; A791-I807 HydrophobicContact CB-CG2 4.31Å; A792-I807 HydrophobicContact CB-CG2 4.2Å; E795-I807 HydrophobicContact CG-CD1 3.69Å; K803-I807 VanDerWaalsContact O-CG1 3.31Å; K803-I807 WeakPolarHBondContact O-CG1 3.35Å; K803-I807 PolarHBondContact O-N 3.08Å; A804-I807 PolarHBondContact O-N 3.13Å; R805-I807 VanDerWaalsContact C-N 3.32Å; R805-I807 PolarHBondContact O-N 3.11Å; I807-R810 PolarHBondContact O-N 3Å; I807-G811 PolarHBondContact O-N 2.82Å
808	L	91.6	Very high	88.6	Confident	2 Å²	2	69 Å²	69	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-67.6	-39.2	179.2	-68	171.8	0	0	0	112	L789 A792 A804 R805 G811 R812 L821 A824 A825 T828	L789-L808 HydrophobicContact CD2-CD2 4.18Å; A792-L808 HydrophobicContact CB-CD1 4Å; A792-L808 HydrophobicContact CB-CD2 3.66Å; A792-L808 HydrophobicContact CB-CG 3.6Å; A804-L808 WeakPolarHBondContact O-CG 3.31Å; A804-L808 PolarHBondContact O-N 3.05Å; R805-L808 PolarHBondContact O-N 3.38Å; L808-G811 CarbonylContact O-C 3.53Å; L808-G811 WeakPolarHBondContact O-CA 3.3Å; L808-G811 PolarHBondContact O-N 2.97Å; L808-R812 WeakPolarHBondContact O-CG 3.48Å; L808-R812 PolarHBondContact O-N 2.99Å; L808-L821 HydrophobicContact CD2-CD2 4.38Å; L808-A824 HydrophobicContact CD1-CB 4.32Å; L808-A824 HydrophobicContact CD2-CB 4.01Å; L808-A825 HydrophobicContact CB-CB 4.43Å; L808-A825 HydrophobicContact CD1-CB 4.3Å; L808-T828 HydrophobicContact CD1-CG2 3.96Å
809	E	90.4	Very high	88.8	Confident	103 Å²	103	67 Å²	67	48%	0.481	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-50	172	-81.7	175.2	172	0	0	112.2	R805 G811 R812 M813	R805-E809 WeakPolarHBondContact O-CB 3.34Å; R805-E809 PolarHBondContact O-N 3.11Å; E809-G811 PolarHBondContact O-N 2.73Å; E809-R812 PolarHBondContact O-N 3.46Å; E809-R812 IonicContact OE1-NH2 3.87Å; E809-M813 WeakPolarHBondContact O-CG 3.48Å; E809-M813 PolarHBondContact O-N 3.23Å
810	R	90	Very high	89.2	Confident	156 Å²	156	67.5 Å²	67.5	59%	0.589	33%	0.329	S	S	*	.	H	α-helix	trans	-60.3	-35.5	174	-172.5	-179.3	-65.5	151.4	0.2	111.7	A806 I807 K814	A806-R810 VanDerWaalsContact O-CB 3.25Å; A806-R810 WeakPolarHBondContact O-CB 3.19Å; A806-R810 PolarHBondContact O-N 2.9Å; I807-R810 PolarHBondContact O-N 3Å; R810-K814 WeakPolarHBondContact O-CG 3.29Å; R810-K814 PolarHBondContact O-N 3.35Å
811	G	88	Confident	89.4	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.1	-50.7	173	0	0	0	0	0	112.4	I807 L808 E809 M813 K814 N815	I807-G811 PolarHBondContact O-N 2.82Å; L808-G811 CarbonylContact O-C 3.53Å; L808-G811 WeakPolarHBondContact O-CA 3.3Å; L808-G811 PolarHBondContact O-N 2.97Å; E809-G811 PolarHBondContact O-N 2.73Å; G811-M813 VanDerWaalsContact C-N 3.34Å; G811-M813 PolarHBondContact O-N 3.37Å; G811-K814 PolarHBondContact O-N 2.85Å; G811-N815 PolarHBondContact O-N 3.26Å
812	R	88.7	Confident	89.6	Confident	31 Å²	31	65.1 Å²	65.1	12%	0.117	31%	0.312	C	S	.	.	H	α-helix	trans	-63.3	-36.4	177.1	-70.4	-174.5	-60.9	-158.4	-1.2	112.7	L808 E809 N815 P816 L821	L808-R812 WeakPolarHBondContact O-CG 3.48Å; L808-R812 PolarHBondContact O-N 2.99Å; E809-R812 PolarHBondContact O-N 3.46Å; E809-R812 IonicContact OE1-NH2 3.87Å; R812-N815 CarbonylContact O-C 3.55Å; R812-N815 VanDerWaalsContact O-C 3.23Å; R812-P816 VanDerWaalsContact O-CA 3.27Å; R812-P816 WeakPolarHBondContact O-CA 3.44Å; R812-P816 VanDerWaalsContact O-N 3.13Å; R812-L821 HydrophobicContact CG-CB 3.95Å
813	M	89.3	Confident	89.6	Confident	164 Å²	164	59.2 Å²	59.2	81%	0.808	28%	0.282	S	S	*	.	H	α-helix	trans	-69	-35.4	176.1	-70.3	-59	-62.1	0	0	112.7	E809 G811	E809-M813 WeakPolarHBondContact O-CG 3.48Å; E809-M813 PolarHBondContact O-N 3.23Å; G811-M813 VanDerWaalsContact C-N 3.34Å; G811-M813 PolarHBondContact O-N 3.37Å
814	K	87.4	Confident	89.7	Confident	87 Å²	87	55.1 Å²	55.1	38%	0.378	27%	0.267	S	S	.	.	H	α-helix	trans	-74.9	-42.7	174.2	-75.3	-174.8	172.5	-161.4	0	112.4	I778 P782 R810 G811 P816	I778-K814 PolarHBondContact O-NZ 2.83Å; I778-K814 VanDerWaalsContact O-NZ 3.12Å; P782-K814 HydrophobicContact CB-CD 3.92Å; R810-K814 WeakPolarHBondContact O-CG 3.29Å; R810-K814 PolarHBondContact O-N 3.35Å; G811-K814 PolarHBondContact O-N 2.85Å; K814-P816 VanDerWaalsContact C-CD 3.47Å; K814-P816 VanDerWaalsContact O-CD 3.29Å; K814-P816 WeakPolarHBondContact O-CD 3.48Å
815	N	85.7	Confident	89.7	Confident	18 Å²	18	55.3 Å²	55.3	10%	0.096	27%	0.269	C	S	.	.	S	Bend	trans	-119.1	75.1	-176.9	-57	-49	0	0	0	109.2	P782 G811 R812 M818 L821	P782-N815 PolarHBondContact O-ND2 3.07Å; G811-N815 PolarHBondContact O-N 3.26Å; R812-N815 CarbonylContact O-C 3.55Å; R812-N815 VanDerWaalsContact O-C 3.23Å; N815-M818 HydrophobicContact CB-CG 3.99Å; N815-L821 HydrophobicContact CB-CD1 3.96Å
816	P	85.1	Confident	89.7	Confident	90 Å²	90	52.7 Å²	52.7	58%	0.584	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	153.5	178.9	27.7	-35.4	0	0	0	110.9	R812 K814 M818	R812-P816 VanDerWaalsContact O-CA 3.27Å; R812-P816 WeakPolarHBondContact O-CA 3.44Å; R812-P816 VanDerWaalsContact O-N 3.13Å; K814-P816 VanDerWaalsContact C-CD 3.47Å; K814-P816 VanDerWaalsContact O-CD 3.29Å; K814-P816 WeakPolarHBondContact O-CD 3.48Å; P816-M818 PolarHBondContact O-N 2.87Å
817	K	84.3	Confident	89.7	Confident	140 Å²	140	53 Å²	53	61%	0.609	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	20.4	177.6	-51.6	-174.4	179	-172.6	0	116.5	C849	K817-C849 VanDerWaalsContact CA-SG 3.54Å; K817-C849 PolarHBondContact O-SG 3.34Å
818	M	88.6	Confident	89.6	Confident	76 Å²	76	51.8 Å²	51.8	37%	0.374	25%	0.246	S	C	.	.			trans	-91.4	115.4	173.2	-64.1	-50.1	-59.5	0	0	111.6	I785 N815 P816 E820 L821 W822	I785-M818 HydrophobicContact CD1-CB 3.84Å; I785-M818 HydrophobicContact CD1-CE 3.42Å; I785-M818 VanDerWaalsContact CD1-CE 3.42Å; I785-M818 HydrophobicContact CD1-CG 3.78Å; I785-M818 HydrophobicContact CD1-SD 4.33Å; N815-M818 HydrophobicContact CB-CG 3.99Å; P816-M818 PolarHBondContact O-N 2.87Å; M818-E820 PolarHBondContact O-N 3.23Å; M818-L821 HydrophobicContact CB-CD1 4.27Å; M818-L821 PolarHBondContact O-N 2.92Å; M818-W822 PolarHBondContact O-N 2.95Å
819	P	90.5	Very high	89.5	Confident	26 Å²	26	52.3 Å²	52.3	17%	0.169	25%	0.248	C	C	.	.	H	α-helix	trans	-69.9	-32.3	-169.8	26.3	-34.8	0	0	0	113.6	L821 W822 L823 S852 L855	P819-L821 VanDerWaalsContact C-N 3.28Å; P819-L821 PolarHBondContact O-N 3.39Å; P819-W822 WeakPolarHBondContact O-CB 3.5Å; P819-W822 PolarHBondContact O-N 3.1Å; P819-W822 VanDerWaalsContact O-N 3.15Å; P819-L823 VanDerWaalsContact O-CB 3.31Å; P819-L823 WeakPolarHBondContact O-CB 3.17Å; P819-L823 PolarHBondContact O-N 3.39Å; P819-S852 WeakPolarHBondContact CB-OG 3.36Å; P819-S852 WeakPolarHBondContact CG-OG 3.38Å; P819-L855 HydrophobicContact CB-CD1 3.79Å; P819-L855 HydrophobicContact CB-CG 3.91Å
820	E	90.4	Very high	89.4	Confident	77 Å²	77	50.9 Å²	50.9	36%	0.36	24%	0.242	S	C	.	.	H	α-helix	trans	-58.1	-37.8	176.6	-67.6	-178.8	-179.4	0	0	112.7	I785 L789 M818 A824	I785-E820 HydrophobicContact CG2-CB 3.81Å; I785-E820 WeakPolarHBondContact CG2-OE2 3.26Å; L789-E820 HydrophobicContact CD1-CB 4.34Å; M818-E820 PolarHBondContact O-N 3.23Å; E820-A824 WeakPolarHBondContact O-CB 3.34Å; E820-A824 PolarHBondContact O-N 3.05Å
821	L	91.4	Very high	89.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-71.8	-37.3	177	-68.3	175.7	0	0	0	111.9	I785 L788 L789 L808 R812 N815 M818 P819 A825	I785-L821 HydrophobicContact CG1-CD1 4.39Å; I785-L821 HydrophobicContact CG1-CG 4.43Å; I785-L821 HydrophobicContact CG2-CD2 3.79Å; I785-L821 HydrophobicContact CG2-CG 3.8Å; L788-L821 HydrophobicContact CB-CD2 3.97Å; L788-L821 HydrophobicContact CD1-CD1 4.29Å; L788-L821 HydrophobicContact CD1-CD2 4.15Å; L789-L821 HydrophobicContact CD2-CD2 4.04Å; L808-L821 HydrophobicContact CD2-CD2 4.38Å; R812-L821 HydrophobicContact CG-CB 3.95Å; N815-L821 HydrophobicContact CB-CD1 3.96Å; M818-L821 HydrophobicContact CB-CD1 4.27Å; M818-L821 PolarHBondContact O-N 2.92Å; P819-L821 VanDerWaalsContact C-N 3.28Å; P819-L821 PolarHBondContact O-N 3.39Å; L821-A825 WeakPolarHBondContact O-CB 3.41Å; L821-A825 PolarHBondContact O-N 3.23Å; L821-A825 VanDerWaalsContact O-N 3.11Å
822	W	93.1	Very high	89.3	Confident	25 Å²	25	51.9 Å²	51.9	10%	0.095	25%	0.254	C	S	.	.	H	α-helix	trans	-64	-48.4	172.4	-79.8	112.8	0	0	0	111.6	M818 P819 A824 A825 I826 L841 R844 A845 D848 L855	M818-W822 PolarHBondContact O-N 2.95Å; P819-W822 WeakPolarHBondContact O-CB 3.5Å; P819-W822 PolarHBondContact O-N 3.1Å; P819-W822 VanDerWaalsContact O-N 3.15Å; W822-A824 VanDerWaalsContact C-N 3.34Å; W822-A824 PolarHBondContact O-N 2.72Å; W822-A825 WeakPolarHBondContact O-CB 3.46Å; W822-A825 PolarHBondContact O-N 3.44Å; W822-A825 VanDerWaalsContact O-N 3.17Å; W822-I826 VanDerWaalsContact O-CD1 3.28Å; W822-I826 WeakPolarHBondContact O-CD1 3.26Å; W822-I826 WeakPolarHBondContact O-CG1 3.49Å; W822-I826 PolarHBondContact O-N 2.7Å; W822-L841 HydrophobicContact CZ3-CD2 4.14Å; W822-R844 HydrophobicContact CH2-CB 4.15Å; W822-R844 HydrophobicContact CZ3-CB 4.23Å; W822-A845 HydrophobicContact CB-CB 3.68Å; W822-A845 HydrophobicContact CD2-CB 3.62Å; W822-A845 HydrophobicContact CE3-CB 3.65Å; W822-A845 HydrophobicContact CG-CB 3.63Å; W822-A845 HydrophobicContact CZ3-CB 4.45Å; W822-D848 VanDerWaalsContact CZ2-OD2 3.25Å; W822-D848 WeakPolarHBondContact CZ2-OD2 3.44Å; W822-L855 HydrophobicContact CB-CD1 4.41Å; W822-L855 HydrophobicContact CB-CD2 3.86Å
823	L	92.4	Very high	89.2	Confident	12 Å²	12	53.4 Å²	53.4	6%	0.063	28%	0.279	C	S	.	.	H	α-helix	trans	-54	-49.1	177.3	-168	91.5	0	0	0	111.6	P819 I826 R827 I854 L855 E858	P819-L823 VanDerWaalsContact O-CB 3.31Å; P819-L823 WeakPolarHBondContact O-CB 3.17Å; P819-L823 PolarHBondContact O-N 3.39Å; L823-I826 PolarHBondContact O-N 2.88Å; L823-R827 WeakPolarHBondContact O-CB 3.25Å; L823-R827 WeakPolarHBondContact O-CG 3.39Å; L823-R827 PolarHBondContact O-N 3.4Å; L823-I854 HydrophobicContact CD1-CB 4.12Å; L823-I854 HydrophobicContact CD1-CG2 3.6Å; L823-I854 WeakPolarHBondContact CD1-O 3.42Å; L823-I854 HydrophobicContact CD2-CG2 3.72Å; L823-I854 HydrophobicContact CG-CG2 4.31Å; L823-L855 HydrophobicContact CB-CD2 4.16Å; L823-L855 HydrophobicContact CD1-CD2 4.2Å; L823-E858 HydrophobicContact CD1-CB 4.26Å; L823-E858 HydrophobicContact CD1-CG 3.39Å; L823-E858 HydrophobicContact CG-CG 4.28Å
824	A	89.9	Confident	89.2	Confident	18 Å²	18	50.5 Å²	50.5	15%	0.149	26%	0.262	C	S	.	.	H	α-helix	trans	-62.9	-43.4	177.8	0	0	0	0	0	112	L789 L808 E820 W822 R827 T828	L789-A824 HydrophobicContact CD2-CB 3.28Å; L808-A824 HydrophobicContact CD1-CB 4.32Å; L808-A824 HydrophobicContact CD2-CB 4.01Å; E820-A824 WeakPolarHBondContact O-CB 3.34Å; E820-A824 PolarHBondContact O-N 3.05Å; W822-A824 VanDerWaalsContact C-N 3.34Å; W822-A824 PolarHBondContact O-N 2.72Å; A824-R827 PolarHBondContact O-N 3.48Å; A824-T828 WeakPolarHBondContact O-CG2 3.19Å; A824-T828 PolarHBondContact O-N 3.44Å; A824-T828 PolarHBondContact O-OG1 3.2Å
825	A	91.8	Very high	89.3	Confident	4 Å²	4	52.2 Å²	52.2	3%	0.033	27%	0.267	C	S	.	.	H	α-helix	trans	-60.8	-46.9	176.1	0	0	0	0	0	111.8	L808 L821 W822 R827 T828 E829 L841	L808-A825 HydrophobicContact CB-CB 4.43Å; L808-A825 HydrophobicContact CD1-CB 4.3Å; L821-A825 WeakPolarHBondContact O-CB 3.41Å; L821-A825 PolarHBondContact O-N 3.23Å; L821-A825 VanDerWaalsContact O-N 3.11Å; W822-A825 WeakPolarHBondContact O-CB 3.46Å; W822-A825 PolarHBondContact O-N 3.44Å; W822-A825 VanDerWaalsContact O-N 3.17Å; A825-R827 VanDerWaalsContact C-N 3.32Å; A825-R827 PolarHBondContact O-N 2.96Å; A825-T828 WeakPolarHBondContact CA-OG1 3.45Å; A825-T828 PolarHBondContact O-N 3.04Å; A825-T828 PolarHBondContact O-OG1 2.97Å; A825-E829 WeakPolarHBondContact O-CG 3.34Å; A825-E829 PolarHBondContact O-N 2.77Å; A825-L841 HydrophobicContact CB-CD1 4.42Å
826	I	91.8	Very high	89.5	Confident	7 Å²	7	59 Å²	59	4%	0.036	30%	0.297	C	S	.	.	H	α-helix	trans	-59.1	-44.4	177.1	-65.1	155.1	0	0	0	110.3	W822 L823 E829 M830 A838 L841 L842 A845 L855	W822-I826 VanDerWaalsContact O-CD1 3.28Å; W822-I826 WeakPolarHBondContact O-CD1 3.26Å; W822-I826 WeakPolarHBondContact O-CG1 3.49Å; W822-I826 PolarHBondContact O-N 2.7Å; L823-I826 PolarHBondContact O-N 2.88Å; I826-E829 PolarHBondContact O-N 3.22Å; I826-M830 VanDerWaalsContact O-CG 3.3Å; I826-M830 WeakPolarHBondContact O-CG 3.41Å; I826-M830 PolarHBondContact O-N 2.75Å; I826-A838 HydrophobicContact CG2-CB 4.3Å; I826-L841 HydrophobicContact CG1-CB 3.96Å; I826-L842 HydrophobicContact CD1-CB 3.89Å; I826-L842 HydrophobicContact CD1-CD1 3.84Å; I826-L842 HydrophobicContact CD1-CG 4.5Å; I826-L842 HydrophobicContact CG1-CB 4.2Å; I826-L842 HydrophobicContact CG2-CB 4.36Å; I826-A845 HydrophobicContact CD1-CB 4.06Å; I826-L855 HydrophobicContact CD1-CD2 4Å
827	R	91.1	Very high	89.8	Confident	48 Å²	48	57.4 Å²	57.4	18%	0.181	29%	0.286	C	S	.	.	H	α-helix	trans	-71.3	-30.1	178.2	-72.3	172	174.3	176.4	-7	114.1	L823 A824 A825 R831 E858 E952	L823-R827 WeakPolarHBondContact O-CB 3.25Å; L823-R827 WeakPolarHBondContact O-CG 3.39Å; L823-R827 PolarHBondContact O-N 3.4Å; A824-R827 PolarHBondContact O-N 3.48Å; A825-R827 VanDerWaalsContact C-N 3.32Å; A825-R827 PolarHBondContact O-N 2.96Å; R827-R831 WeakPolarHBondContact O-CB 3.41Å; R827-R831 WeakPolarHBondContact O-CG 3.18Å; R827-R831 PolarHBondContact O-N 3.39Å; R827-R831 PolarHBondContact O-NE 2.73Å; R827-R831 VanDerWaalsContact O-NE 3.08Å; R827-E858 IonicContact CZ-OE1 3.7Å; R827-E858 IonicContact NE-OE1 2.75Å; R827-E858 PolarHBondContact NE-OE1 3.37Å; R827-E858 IonicContact NH2-OE1 3.66Å; R827-E858 PolarHBondContact NH2-OE1 2.76Å; R827-E952 IonicContact CZ-OE1 3.47Å; R827-E952 IonicContact CZ-OE2 3.46Å; R827-E952 IonicContact NH1-OE1 2.73Å; R827-E952 PolarHBondContact NH1-OE1 3.46Å; R827-E952 IonicContact NH1-OE2 3.66Å; R827-E952 PolarHBondContact NH1-OE2 3.19Å; R827-E952 IonicContact NH2-OE2 3.41Å; R827-E952 PolarHBondContact NH2-OE2 3.1Å
828	T	90.3	Very high	90.1	Very high	4 Å²	4	50.8 Å²	50.8	3%	0.025	26%	0.257	C	S	.	.	H	α-helix	trans	-69.4	-36.9	170.4	49	0	0	0	0	111.5	L808 A824 A825 G832	L808-T828 HydrophobicContact CD1-CG2 3.96Å; A824-T828 WeakPolarHBondContact O-CG2 3.19Å; A824-T828 PolarHBondContact O-N 3.44Å; A824-T828 PolarHBondContact O-OG1 3.2Å; A825-T828 WeakPolarHBondContact CA-OG1 3.45Å; A825-T828 PolarHBondContact O-N 3.04Å; A825-T828 PolarHBondContact O-OG1 2.97Å; T828-G832 PolarHBondContact O-N 2.84Å
829	E	90.1	Very high	90.2	Very high	13 Å²	13	49.5 Å²	49.5	6%	0.061	25%	0.251	C	S	.	.	H	α-helix	trans	-65.8	-46.2	172.9	-68.5	-47.1	120.1	0	0	111.9	R805 A825 I826 R831 G832 G833 F834 T837 A838 L841	R805-E829 WeakPolarHBondContact CG-OE1 3.41Å; R805-E829 IonicContact CZ-OE1 2.97Å; R805-E829 IonicContact CZ-OE2 2.71Å; R805-E829 IonicContact NE-OE1 3.28Å; R805-E829 PolarHBondContact NE-OE1 2.9Å; R805-E829 IonicContact NE-OE2 3.33Å; R805-E829 PolarHBondContact NE-OE2 3.13Å; R805-E829 IonicContact NH2-OE1 3.85Å; R805-E829 PolarHBondContact NH2-OE1 3.21Å; R805-E829 IonicContact NH2-OE2 3.45Å; R805-E829 PolarHBondContact NH2-OE2 2.7Å; A825-E829 WeakPolarHBondContact O-CG 3.34Å; A825-E829 PolarHBondContact O-N 2.77Å; I826-E829 PolarHBondContact O-N 3.22Å; E829-R831 PolarHBondContact O-N 3.1Å; E829-G832 CarbonylContact O-C 3.53Å; E829-G832 PolarHBondContact O-N 3.21Å; E829-G833 PolarHBondContact O-N 3.2Å; E829-F834 PolarHBondContact O-N 3.19Å; E829-T837 PolarHBondContact OE2-OG1 3.35Å; E829-A838 HydrophobicContact CB-CB 3.74Å; E829-L841 HydrophobicContact CG-CD1 3.56Å
830	M	88.5	Confident	90.3	Very high	73 Å²	73	53 Å²	53	36%	0.36	27%	0.269	S	S	.	.	H	α-helix	trans	-60.4	-43.5	177.1	-72	-66.1	-73	0	0	112	I826 G832 G833 R835 A838 M839	I826-M830 VanDerWaalsContact O-CG 3.3Å; I826-M830 WeakPolarHBondContact O-CG 3.41Å; I826-M830 PolarHBondContact O-N 2.75Å; M830-G832 VanDerWaalsContact C-N 3.35Å; M830-G833 PolarHBondContact O-N 3.26Å; M830-G833 VanDerWaalsContact O-N 3.15Å; M830-R835 HydrophobicContact CE-CG 4.45Å; M830-R835 HydrophobicContact SD-CB 4.43Å; M830-R835 HydrophobicContact SD-CG 4.04Å; M830-A838 HydrophobicContact CG-CB 3.56Å; M830-A838 HydrophobicContact SD-CB 3.5Å; M830-A838 WeakPolarHBondContact SD-CB 3.42Å; M830-M839 HydrophobicContact SD-CE 4.43Å
831	R	87.8	Confident	90.4	Very high	150 Å²	150	50.6 Å²	50.6	57%	0.566	26%	0.258	S	S	*	.	H	α-helix	trans	-70.2	-29.6	175.8	-75.5	179.3	-74.3	154	9.4	112.9	E796 R827 E829 G833	E796-R831 VanDerWaalsContact CD-NH2 3.32Å; E796-R831 IonicContact OE1-CZ 3.62Å; E796-R831 IonicContact OE1-NE 2.7Å; E796-R831 PolarHBondContact OE1-NE 3.02Å; E796-R831 IonicContact OE1-NH1 3.58Å; E796-R831 PolarHBondContact OE1-NH1 3.02Å; E796-R831 IonicContact OE1-NH2 3.68Å; E796-R831 PolarHBondContact OE1-NH2 3.39Å; E796-R831 VanDerWaalsContact OE1-NH2 3.12Å; E796-R831 IonicContact OE2-CZ 2.71Å; E796-R831 IonicContact OE2-NH1 3.94Å; E796-R831 PolarHBondContact OE2-NH1 3.2Å; E796-R831 IonicContact OE2-NH2 3.45Å; E796-R831 PolarHBondContact OE2-NH2 2.71Å; R827-R831 WeakPolarHBondContact O-CB 3.41Å; R827-R831 WeakPolarHBondContact O-CG 3.18Å; R827-R831 PolarHBondContact O-N 3.39Å; R827-R831 PolarHBondContact O-NE 2.73Å; R827-R831 VanDerWaalsContact O-NE 3.08Å; E829-R831 PolarHBondContact O-N 3.1Å; R831-G833 PolarHBondContact O-N 3.35Å
832	G	86.2	Confident	90.4	Very high	27 Å²	27	50.9 Å²	50.9	28%	0.278	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-3.3	169.4	0	0	0	0	0	114.9	T828 E829 M830 F834	T828-G832 PolarHBondContact O-N 2.84Å; E829-G832 CarbonylContact O-C 3.53Å; E829-G832 PolarHBondContact O-N 3.21Å; M830-G832 VanDerWaalsContact C-N 3.35Å; G832-F834 VanDerWaalsContact C-N 3.32Å; G832-F834 WeakPolarHBondContact O-CD2 3.31Å; G832-F834 VanDerWaalsContact O-CE2 3.22Å; G832-F834 WeakPolarHBondContact O-CE2 3.25Å; G832-F834 PolarHBondContact O-N 2.87Å
833	G	87	Confident	90.4	Very high	62 Å²	62	52.1 Å²	52.1	64%	0.639	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	-2.7	-179	0	0	0	0	0	115.1	E829 M830 R831 R835	E829-G833 PolarHBondContact O-N 3.2Å; M830-G833 PolarHBondContact O-N 3.26Å; M830-G833 VanDerWaalsContact O-N 3.15Å; R831-G833 PolarHBondContact O-N 3.35Å; G833-R835 VanDerWaalsContact C-N 3.32Å; G833-R835 PolarHBondContact O-N 3.4Å
834	F	89.8	Confident	90.4	Very high	104 Å²	104	58.8 Å²	58.8	46%	0.456	30%	0.3	S	S	.	.			trans	-86.5	69	-176.6	-56.7	-83.9	0	0	0	111.1	R805 E829 G832 E836 T837 A838	R805-F834 VanDerWaalsContact NH2-CE2 3.28Å; E829-F834 PolarHBondContact O-N 3.19Å; G832-F834 VanDerWaalsContact C-N 3.32Å; G832-F834 WeakPolarHBondContact O-CD2 3.31Å; G832-F834 VanDerWaalsContact O-CE2 3.22Å; G832-F834 WeakPolarHBondContact O-CE2 3.25Å; G832-F834 PolarHBondContact O-N 2.87Å; F834-E836 VanDerWaalsContact C-N 3.3Å; F834-E836 PolarHBondContact O-N 2.77Å; F834-T837 HydrophobicContact CB-CG2 4.29Å; F834-T837 WeakPolarHBondContact CB-OG1 3.39Å; F834-T837 PolarHBondContact O-N 3.4Å; F834-T837 PolarHBondContact O-OG1 3.47Å; F834-A838 PolarHBondContact O-N 2.98Å
835	R	88.8	Confident	90.5	Very high	123 Å²	123	58 Å²	58	46%	0.464	29%	0.292	S	S	.	.	H	α-helix	trans	-57.4	-40.6	-176.2	-170.8	-179.9	-174.8	124	3.4	112.9	M830 G833 A838 M839 A862	M830-R835 HydrophobicContact CE-CG 4.45Å; M830-R835 HydrophobicContact SD-CB 4.43Å; M830-R835 HydrophobicContact SD-CG 4.04Å; G833-R835 VanDerWaalsContact C-N 3.32Å; G833-R835 PolarHBondContact O-N 3.4Å; R835-A838 WeakPolarHBondContact O-CB 3.49Å; R835-A838 PolarHBondContact O-N 2.94Å; R835-M839 HydrophobicContact CG-CE 3.67Å; R835-M839 WeakPolarHBondContact O-CG 3.49Å; R835-M839 PolarHBondContact O-N 3.01Å; R835-A862 PolarHBondContact NH2-O 3.02Å
836	E	90.4	Very high	90.5	Very high	159 Å²	159	58.9 Å²	58.9	74%	0.743	30%	0.297	S	S	*	.	H	α-helix	trans	-68.6	-40.7	-177.8	-63.8	179.8	178.5	0	0	112.6	F834 A838 M839 N840	F834-E836 VanDerWaalsContact C-N 3.3Å; F834-E836 PolarHBondContact O-N 2.77Å; E836-A838 VanDerWaalsContact C-N 3.34Å; E836-M839 PolarHBondContact O-N 2.99Å; E836-N840 WeakPolarHBondContact O-CB 3.21Å; E836-N840 VanDerWaalsContact O-CG 3.31Å; E836-N840 PolarHBondContact O-N 3.06Å; E836-N840 PolarHBondContact O-ND2 3.04Å; E836-N840 VanDerWaalsContact O-ND2 3.15Å
837	T	90.8	Very high	90.4	Very high	58 Å²	58	65.9 Å²	65.9	36%	0.356	33%	0.329	S	S	.	.	H	α-helix	trans	-65.6	-40.4	174.5	63.9	0	0	0	0	110.4	E829 F834 N840 L841	E829-T837 PolarHBondContact OE2-OG1 3.35Å; F834-T837 HydrophobicContact CB-CG2 4.29Å; F834-T837 WeakPolarHBondContact CB-OG1 3.39Å; F834-T837 PolarHBondContact O-N 3.4Å; F834-T837 PolarHBondContact O-OG1 3.47Å; T837-N840 PolarHBondContact O-N 3.38Å; T837-L841 WeakPolarHBondContact O-CB 3.24Å; T837-L841 WeakPolarHBondContact O-CG 3.41Å; T837-L841 PolarHBondContact O-N 3.28Å
838	A	91.5	Very high	90.3	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-57.3	-47.1	172.6	0	0	0	0	0	112.9	I826 E829 M830 F834 R835 E836 N840 L841 L842	I826-A838 HydrophobicContact CG2-CB 4.3Å; E829-A838 HydrophobicContact CB-CB 3.74Å; M830-A838 HydrophobicContact CG-CB 3.56Å; M830-A838 HydrophobicContact SD-CB 3.5Å; M830-A838 WeakPolarHBondContact SD-CB 3.42Å; F834-A838 PolarHBondContact O-N 2.98Å; R835-A838 WeakPolarHBondContact O-CB 3.49Å; R835-A838 PolarHBondContact O-N 2.94Å; E836-A838 VanDerWaalsContact C-N 3.34Å; A838-N840 PolarHBondContact O-N 3.44Å; A838-L841 PolarHBondContact O-N 2.88Å; A838-L842 VanDerWaalsContact O-CB 3.25Å; A838-L842 WeakPolarHBondContact O-CB 3.48Å; A838-L842 PolarHBondContact O-N 3.32Å
839	M	91.1	Very high	90.2	Very high	49 Å²	49	67.6 Å²	67.6	24%	0.241	34%	0.343	C	S	.	.	H	α-helix	trans	-63.2	-41.1	176.8	-63.4	-51.9	162.6	0	0	112.1	M830 R835 E836 L842 A843 A862	M830-M839 HydrophobicContact SD-CE 4.43Å; R835-M839 HydrophobicContact CG-CE 3.67Å; R835-M839 WeakPolarHBondContact O-CG 3.49Å; R835-M839 PolarHBondContact O-N 3.01Å; E836-M839 PolarHBondContact O-N 2.99Å; M839-L842 PolarHBondContact O-N 3.39Å; M839-L842 HydrophobicContact SD-CD2 4.34Å; M839-A843 WeakPolarHBondContact O-CB 3.31Å; M839-A843 PolarHBondContact O-N 3.39Å; M839-A862 HydrophobicContact CE-CB 3.77Å; M839-A862 WeakPolarHBondContact CE-O 3.45Å; M839-A862 HydrophobicContact SD-CB 3.82Å
840	N	92.7	Very high	90.1	Very high	101 Å²	101	69.2 Å²	69.2	54%	0.54	35%	0.354	S	S	.	.	H	α-helix	trans	-66.9	-38.4	177.5	-71.9	-32.5	0	0	0	112.1	E836 T837 A838 R844	E836-N840 WeakPolarHBondContact O-CB 3.21Å; E836-N840 VanDerWaalsContact O-CG 3.31Å; E836-N840 PolarHBondContact O-N 3.06Å; E836-N840 PolarHBondContact O-ND2 3.04Å; E836-N840 VanDerWaalsContact O-ND2 3.15Å; T837-N840 PolarHBondContact O-N 3.38Å; A838-N840 PolarHBondContact O-N 3.44Å; N840-R844 WeakPolarHBondContact O-CG 3.35Å; N840-R844 PolarHBondContact O-N 2.97Å; N840-R844 VanDerWaalsContact O-N 3.16Å
841	L	91.8	Very high	90	Very high	25 Å²	25	71.2 Å²	71.2	13%	0.131	37%	0.366	C	S	.	.	H	α-helix	trans	-66.8	-39.5	172.2	-72.2	-176.1	0	0	0	111.9	W822 A825 I826 E829 T837 A838 R844 A845	W822-L841 HydrophobicContact CZ3-CD2 4.14Å; A825-L841 HydrophobicContact CB-CD1 4.42Å; I826-L841 HydrophobicContact CG1-CB 3.96Å; E829-L841 HydrophobicContact CG-CD1 3.56Å; T837-L841 WeakPolarHBondContact O-CB 3.24Å; T837-L841 WeakPolarHBondContact O-CG 3.41Å; T837-L841 PolarHBondContact O-N 3.28Å; A838-L841 PolarHBondContact O-N 2.88Å; L841-R844 PolarHBondContact O-N 3.46Å; L841-A845 VanDerWaalsContact O-CB 3.31Å; L841-A845 WeakPolarHBondContact O-CB 3.47Å; L841-A845 PolarHBondContact O-N 3.47Å
842	L	91.9	Very high	90.1	Very high	7 Å²	7	64.9 Å²	64.9	4%	0.037	35%	0.345	C	S	.	.	H	α-helix	trans	-64.8	-42.5	176.6	174.6	67.2	0	0	0	111.7	I826 A838 M839 R844 A845 L846 A862	I826-L842 HydrophobicContact CD1-CB 3.89Å; I826-L842 HydrophobicContact CD1-CD1 3.84Å; I826-L842 HydrophobicContact CD1-CG 4.5Å; I826-L842 HydrophobicContact CG1-CB 4.2Å; I826-L842 HydrophobicContact CG2-CB 4.36Å; A838-L842 VanDerWaalsContact O-CB 3.25Å; A838-L842 WeakPolarHBondContact O-CB 3.48Å; A838-L842 PolarHBondContact O-N 3.32Å; M839-L842 PolarHBondContact O-N 3.39Å; M839-L842 HydrophobicContact SD-CD2 4.34Å; L842-R844 PolarHBondContact O-N 3.15Å; L842-A845 PolarHBondContact O-N 3.4Å; L842-L846 HydrophobicContact CD1-CD1 4.32Å; L842-L846 HydrophobicContact CD1-CG 4.38Å; L842-L846 HydrophobicContact CG-CD1 4.38Å; L842-L846 WeakPolarHBondContact O-CG 3.47Å; L842-L846 PolarHBondContact O-N 3.12Å; L842-A862 HydrophobicContact CD2-CB 3.9Å
843	A	91.9	Very high	90.3	Very high	51 Å²	51	63.6 Å²	63.6	42%	0.421	33%	0.332	S	S	.	.	H	α-helix	trans	-60.9	-42.8	174.4	0	0	0	0	0	111.9	M839 Q847	M839-A843 WeakPolarHBondContact O-CB 3.31Å; M839-A843 PolarHBondContact O-N 3.39Å; A843-Q847 WeakPolarHBondContact O-CG 3.5Å; A843-Q847 PolarHBondContact O-N 3.27Å
844	R	92.5	Very high	90.6	Very high	152 Å²	152	62.4 Å²	62.4	57%	0.574	31%	0.31	S	S	*	.	H	α-helix	trans	-65.3	-42.4	173.4	-70.2	174.8	-176.8	-177.2	1.4	112.3	W822 N840 L841 L842 L846 Q847 D848	W822-R844 HydrophobicContact CH2-CB 4.15Å; W822-R844 HydrophobicContact CZ3-CB 4.23Å; N840-R844 WeakPolarHBondContact O-CG 3.35Å; N840-R844 PolarHBondContact O-N 2.97Å; N840-R844 VanDerWaalsContact O-N 3.16Å; L841-R844 PolarHBondContact O-N 3.46Å; L842-R844 PolarHBondContact O-N 3.15Å; R844-L846 VanDerWaalsContact C-N 3.31Å; R844-L846 PolarHBondContact O-N 3.04Å; R844-Q847 WeakPolarHBondContact O-CB 3.45Å; R844-Q847 PolarHBondContact O-N 2.85Å; R844-Q847 VanDerWaalsContact O-N 3.07Å; R844-D848 PolarHBondContact O-N 3.34Å
845	A	92.4	Very high	90.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.4	-40.3	177.8	0	0	0	0	0	112.2	W822 I826 L841 L842 Q847 D848 C849 L855	W822-A845 HydrophobicContact CB-CB 3.68Å; W822-A845 HydrophobicContact CD2-CB 3.62Å; W822-A845 HydrophobicContact CE3-CB 3.65Å; W822-A845 HydrophobicContact CG-CB 3.63Å; W822-A845 HydrophobicContact CZ3-CB 4.45Å; I826-A845 HydrophobicContact CD1-CB 4.06Å; L841-A845 VanDerWaalsContact O-CB 3.31Å; L841-A845 WeakPolarHBondContact O-CB 3.47Å; L841-A845 PolarHBondContact O-N 3.47Å; L842-A845 PolarHBondContact O-N 3.4Å; A845-Q847 VanDerWaalsContact C-N 3.32Å; A845-D848 PolarHBondContact O-N 3.2Å; A845-C849 WeakPolarHBondContact O-CA 3.29Å; A845-C849 WeakPolarHBondContact O-CB 3.49Å; A845-C849 PolarHBondContact O-N 3.41Å; A845-L855 HydrophobicContact CB-CD1 3.81Å; A845-L855 HydrophobicContact CB-CD2 4.11Å
846	L	91.3	Very high	91	Very high	24 Å²	24	52.8 Å²	52.8	13%	0.126	27%	0.271	C	S	.	.	H	α-helix	trans	-73.9	-18.8	175.8	-67.8	174.9	0	0	0	113.6	L842 R844 P850 L855 W856	L842-L846 HydrophobicContact CD1-CD1 4.32Å; L842-L846 HydrophobicContact CD1-CG 4.38Å; L842-L846 HydrophobicContact CG-CD1 4.38Å; L842-L846 WeakPolarHBondContact O-CG 3.47Å; L842-L846 PolarHBondContact O-N 3.12Å; R844-L846 VanDerWaalsContact C-N 3.31Å; R844-L846 PolarHBondContact O-N 3.04Å; L846-P850 WeakPolarHBondContact O-CA 3.48Å; L846-L855 HydrophobicContact CD2-CB 3.76Å; L846-W856 HydrophobicContact CD1-CE3 4.41Å; L846-W856 HydrophobicContact CD1-CH2 4.45Å; L846-W856 HydrophobicContact CD1-CZ3 4.39Å; L846-W856 HydrophobicContact CD2-CD2 3.92Å; L846-W856 HydrophobicContact CD2-CG 4.06Å; L846-W856 HydrophobicContact CD2-CZ2 4.28Å
847	Q	90.7	Very high	91.1	Very high	153 Å²	153	45.9 Å²	45.9	72%	0.715	24%	0.242	S	C	*	.	H	α-helix	trans	-76.9	-42.7	169.5	-73.4	172.6	-19.4	0	0	111.5	A843 R844 A845	A843-Q847 WeakPolarHBondContact O-CG 3.5Å; A843-Q847 PolarHBondContact O-N 3.27Å; R844-Q847 WeakPolarHBondContact O-CB 3.45Å; R844-Q847 PolarHBondContact O-N 2.85Å; R844-Q847 VanDerWaalsContact O-N 3.07Å; A845-Q847 VanDerWaalsContact C-N 3.32Å
848	D	89.1	Confident	91.1	Very high	76 Å²	76	45.8 Å²	45.8	41%	0.406	24%	0.237	S	C	.	.	H	α-helix	trans	-73.5	-36.4	178.2	-81.3	-6.2	0	0	0	113.2	W822 R844 A845	W822-D848 VanDerWaalsContact CZ2-OD2 3.25Å; W822-D848 WeakPolarHBondContact CZ2-OD2 3.44Å; R844-D848 PolarHBondContact O-N 3.34Å; A845-D848 PolarHBondContact O-N 3.2Å
849	C	87.8	Confident	91.1	Very high	12 Å²	12	45.9 Å²	45.9	8%	0.081	24%	0.238	C	C	.	.			trans	-132.1	64	-171.2	-56.2	0	0	0	0	111.3	K817 A845 D851 S852 L855	K817-C849 VanDerWaalsContact CA-SG 3.54Å; K817-C849 PolarHBondContact O-SG 3.34Å; A845-C849 WeakPolarHBondContact O-CA 3.29Å; A845-C849 WeakPolarHBondContact O-CB 3.49Å; A845-C849 PolarHBondContact O-N 3.41Å; C849-D851 PolarHBondContact O-N 3.06Å; C849-S852 PolarHBondContact O-N 3.37Å; C849-L855 HydrophobicContact CB-CD1 3.8Å
850	P	88.2	Confident	91.2	Very high	47 Å²	47	43.5 Å²	43.5	31%	0.305	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-21.7	-173.3	27.1	-36.2	0	0	0	114.4	L846 W856	L846-P850 WeakPolarHBondContact O-CA 3.48Å; P850-W856 PolarHBondContact O-NE1 2.95Å
851	D	87.2	Confident	91.1	Very high	115 Å²	115	41.2 Å²	41.2	62%	0.615	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.6	3.9	-173.3	-47.8	-37.2	0	0	0	112.8	C849 G853	C849-D851 PolarHBondContact O-N 3.06Å; D851-G853 PolarHBondContact O-N 2.85Å
852	S	89	Confident	91	Very high	17 Å²	17	40.6 Å²	40.6	12%	0.119	21%	0.21	C	C	.	.			trans	-85.1	108.5	-177.8	-176.6	0	0	0	0	112.5	P819 C849 I854 L855 W856	P819-S852 WeakPolarHBondContact CB-OG 3.36Å; P819-S852 WeakPolarHBondContact CG-OG 3.38Å; C849-S852 PolarHBondContact O-N 3.37Å; S852-I854 VanDerWaalsContact C-N 3.27Å; S852-I854 PolarHBondContact O-N 2.89Å; S852-L855 PolarHBondContact O-N 2.86Å; S852-W856 VanDerWaalsContact O-CD1 3.31Å; S852-W856 PolarHBondContact O-N 3.22Å
853	G	90.7	Very high	90.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.7	-24.8	179.5	0	0	0	0	0	115.2	D851 W856 A857 D882 V885	D851-G853 PolarHBondContact O-N 2.85Å; G853-W856 PolarHBondContact O-N 3.36Å; G853-A857 VanDerWaalsContact O-CB 3.26Å; G853-A857 WeakPolarHBondContact O-CB 3.29Å; G853-A857 PolarHBondContact O-N 3.06Å; G853-D882 VanDerWaalsContact CA-CG 3.46Å; G853-D882 WeakPolarHBondContact CA-OD2 3.31Å; G853-D882 PolarHBondContact N-OD2 3.13Å; G853-V885 VanDerWaalsContact CA-CG2 3.42Å
854	I	92.4	Very high	90.6	Very high	37 Å²	37	46.7 Å²	46.7	19%	0.19	23%	0.233	C	C	.	.	H	α-helix	trans	-66.7	-40.7	175.7	-30	-180	0	0	0	111	L823 S852 A857 E858	L823-I854 HydrophobicContact CD1-CB 4.12Å; L823-I854 HydrophobicContact CD1-CG2 3.6Å; L823-I854 WeakPolarHBondContact CD1-O 3.42Å; L823-I854 HydrophobicContact CD2-CG2 3.72Å; L823-I854 HydrophobicContact CG-CG2 4.31Å; S852-I854 VanDerWaalsContact C-N 3.27Å; S852-I854 PolarHBondContact O-N 2.89Å; I854-A857 PolarHBondContact O-N 3.06Å; I854-E858 PolarHBondContact O-N 3.19Å
855	L	93.8	Very high	90.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-68.1	-40.5	175.1	-66.9	176.7	0	0	0	111.5	P819 W822 L823 I826 A845 L846 C849 S852 S859	P819-L855 HydrophobicContact CB-CD1 3.79Å; P819-L855 HydrophobicContact CB-CG 3.91Å; W822-L855 HydrophobicContact CB-CD1 4.41Å; W822-L855 HydrophobicContact CB-CD2 3.86Å; L823-L855 HydrophobicContact CB-CD2 4.16Å; L823-L855 HydrophobicContact CD1-CD2 4.2Å; I826-L855 HydrophobicContact CD1-CD2 4Å; A845-L855 HydrophobicContact CB-CD1 3.81Å; A845-L855 HydrophobicContact CB-CD2 4.11Å; L846-L855 HydrophobicContact CD2-CB 3.76Å; C849-L855 HydrophobicContact CB-CD1 3.8Å; S852-L855 PolarHBondContact O-N 2.86Å; L855-S859 WeakPolarHBondContact O-CB 3.48Å; L855-S859 PolarHBondContact O-N 3.09Å
856	W	94.3	Very high	90.3	Very high	25 Å²	25	52 Å²	52	10%	0.095	27%	0.268	C	S	.	.	H	α-helix	trans	-64.6	-38.3	173.9	-79.7	109	0	0	0	113	L846 P850 S852 G853 S859 I860 K871 D874 A875 K878 V885	L846-W856 HydrophobicContact CD1-CE3 4.41Å; L846-W856 HydrophobicContact CD1-CH2 4.45Å; L846-W856 HydrophobicContact CD1-CZ3 4.39Å; L846-W856 HydrophobicContact CD2-CD2 3.92Å; L846-W856 HydrophobicContact CD2-CG 4.06Å; L846-W856 HydrophobicContact CD2-CZ2 4.28Å; P850-W856 PolarHBondContact O-NE1 2.95Å; S852-W856 VanDerWaalsContact O-CD1 3.31Å; S852-W856 PolarHBondContact O-N 3.22Å; G853-W856 PolarHBondContact O-N 3.36Å; W856-S859 WeakPolarHBondContact O-CA 3.36Å; W856-S859 WeakPolarHBondContact O-CB 3.46Å; W856-S859 PolarHBondContact O-N 3.06Å; W856-S859 VanDerWaalsContact O-N 3.14Å; W856-I860 WeakPolarHBondContact O-CG1 3.21Å; W856-I860 PolarHBondContact O-N 2.83Å; W856-K871 HydrophobicContact CZ3-CD 4.19Å; W856-K871 HydrophobicContact CZ3-CG 4.49Å; W856-D874 HydrophobicContact CH2-CB 4.42Å; W856-D874 HydrophobicContact CZ3-CB 4.31Å; W856-A875 HydrophobicContact CB-CB 3.81Å; W856-A875 HydrophobicContact CD2-CB 3.86Å; W856-A875 HydrophobicContact CE3-CB 3.65Å; W856-A875 HydrophobicContact CG-CB 3.95Å; W856-A875 HydrophobicContact CZ3-CB 4.46Å; W856-K878 HydrophobicContact CZ2-CB 4.34Å; W856-K878 HydrophobicContact CZ2-CG 3.84Å; W856-V885 HydrophobicContact CB-CG2 4.09Å
857	A	92.8	Very high	90.4	Very high	15 Å²	15	52.6 Å²	52.6	12%	0.124	28%	0.277	C	S	.	.	H	α-helix	trans	-61.1	-48.3	176.7	0	0	0	0	0	111.6	G853 I854 S859 I860 F861 H884 A888	G853-A857 VanDerWaalsContact O-CB 3.26Å; G853-A857 WeakPolarHBondContact O-CB 3.29Å; G853-A857 PolarHBondContact O-N 3.06Å; I854-A857 PolarHBondContact O-N 3.06Å; A857-S859 VanDerWaalsContact C-N 3.31Å; A857-S859 PolarHBondContact O-N 3.44Å; A857-I860 PolarHBondContact O-N 2.93Å; A857-F861 WeakPolarHBondContact O-CD2 3.46Å; A857-H884 HydrophobicContact CB-CB 4.17Å; A857-A888 HydrophobicContact CB-CB 3.92Å
858	E	90.6	Very high	90.5	Very high	56 Å²	56	47 Å²	47	26%	0.262	25%	0.249	S	C	.	.	H	α-helix	trans	-61.5	-41.1	171	-72.4	-62.3	156.3	0	0	111.4	L823 R827 I854 I860 F861 A862	L823-E858 HydrophobicContact CD1-CB 4.26Å; L823-E858 HydrophobicContact CD1-CG 3.39Å; L823-E858 HydrophobicContact CG-CG 4.28Å; R827-E858 IonicContact CZ-OE1 3.7Å; R827-E858 IonicContact NE-OE1 2.75Å; R827-E858 PolarHBondContact NE-OE1 3.37Å; R827-E858 IonicContact NH2-OE1 3.66Å; R827-E858 PolarHBondContact NH2-OE1 2.76Å; I854-E858 PolarHBondContact O-N 3.19Å; E858-I860 VanDerWaalsContact C-N 3.26Å; E858-I860 PolarHBondContact O-N 3.43Å; E858-F861 PolarHBondContact O-N 3.17Å; E858-A862 VanDerWaalsContact O-CB 3.22Å; E858-A862 WeakPolarHBondContact O-CB 3.31Å; E858-A862 PolarHBondContact O-N 3.31Å
859	S	92	Very high	90.6	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-59.8	-34.8	179	-165	0	0	0	0	113.5	L855 W856 A857 E863 K871	L855-S859 WeakPolarHBondContact O-CB 3.48Å; L855-S859 PolarHBondContact O-N 3.09Å; W856-S859 WeakPolarHBondContact O-CA 3.36Å; W856-S859 WeakPolarHBondContact O-CB 3.46Å; W856-S859 PolarHBondContact O-N 3.06Å; W856-S859 VanDerWaalsContact O-N 3.14Å; A857-S859 VanDerWaalsContact C-N 3.31Å; A857-S859 PolarHBondContact O-N 3.44Å; S859-E863 VanDerWaalsContact O-CG 3.27Å; S859-E863 WeakPolarHBondContact O-CG 3.32Å; S859-E863 PolarHBondContact O-N 3.49Å; S859-K871 WeakPolarHBondContact OG-CE 3.48Å
860	I	92.2	Very high	90.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.9	-38.2	176.2	-68.4	160.4	0	0	0	111	W856 A857 E858 R868 K871 A875 A888 L892	W856-I860 WeakPolarHBondContact O-CG1 3.21Å; W856-I860 PolarHBondContact O-N 2.83Å; A857-I860 PolarHBondContact O-N 2.93Å; E858-I860 VanDerWaalsContact C-N 3.26Å; E858-I860 PolarHBondContact O-N 3.43Å; I860-R868 HydrophobicContact CG2-CB 4.21Å; I860-R868 WeakPolarHBondContact O-CD 3.5Å; I860-R868 WeakPolarHBondContact O-CG 3.45Å; I860-R868 PolarHBondContact O-NE 3.3Å; I860-K871 HydrophobicContact CG1-CG 4.44Å; I860-A875 HydrophobicContact CD1-CB 3.96Å; I860-A888 HydrophobicContact CD1-CB 3.83Å; I860-L892 HydrophobicContact CG2-CD1 3.98Å
861	F	90.4	Very high	91.1	Very high	52 Å²	52	52.1 Å²	52.1	23%	0.228	27%	0.27	C	S	.	.	H	α-helix	trans	-84.4	-26.9	-179.9	-75.5	-76.5	0	0	0	114	A857 E858 E863 R868 A888 K891 P982	A857-F861 WeakPolarHBondContact O-CD2 3.46Å; E858-F861 PolarHBondContact O-N 3.17Å; F861-E863 VanDerWaalsContact C-N 3.31Å; F861-R868 PolarHBondContact O-NH2 3.5Å; F861-A888 HydrophobicContact CE2-CB 3.97Å; F861-K891 HydrophobicContact CE1-CB 4.47Å; F861-K891 HydrophobicContact CE2-CB 4.22Å; F861-K891 HydrophobicContact CE2-CD 4.08Å; F861-K891 HydrophobicContact CZ-CB 3.54Å; F861-K891 HydrophobicContact CZ-CD 4.04Å; F861-K891 HydrophobicContact CZ-CG 4.48Å; F861-P982 HydrophobicContact CE1-CB 4.32Å
862	A	89	Confident	91.4	Very high	12 Å²	12	47 Å²	47	10%	0.099	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-33.5	172.8	0	0	0	0	0	112.6	R835 M839 L842 E858	R835-A862 PolarHBondContact NH2-O 3.02Å; M839-A862 HydrophobicContact CE-CB 3.77Å; M839-A862 WeakPolarHBondContact CE-O 3.45Å; M839-A862 HydrophobicContact SD-CB 3.82Å; L842-A862 HydrophobicContact CD2-CB 3.9Å; E858-A862 VanDerWaalsContact O-CB 3.22Å; E858-A862 WeakPolarHBondContact O-CB 3.31Å; E858-A862 PolarHBondContact O-N 3.31Å
863	E	87.3	Confident	91.6	Very high	62 Å²	62	49.2 Å²	49.2	29%	0.29	26%	0.256	S	S	.	.	S	Bend	trans	-71.8	154.9	175.8	-67.7	-73.1	-174.3	0	0	113.2	S859 F861 A867 R868 K871	S859-E863 VanDerWaalsContact O-CG 3.27Å; S859-E863 WeakPolarHBondContact O-CG 3.32Å; S859-E863 PolarHBondContact O-N 3.49Å; F861-E863 VanDerWaalsContact C-N 3.31Å; E863-A867 HydrophobicContact CB-CB 4.39Å; E863-R868 HydrophobicContact CB-CG 4.32Å; E863-R868 PolarHBondContact O-NE 2.74Å; E863-R868 VanDerWaalsContact O-NE 3.08Å; E863-K871 HydrophobicContact CG-CB 4.29Å; E863-K871 HydrophobicContact CG-CD 4.18Å; E863-K871 HydrophobicContact CG-CG 3.99Å; E863-K871 IonicContact OE1-NZ 2.7Å; E863-K871 PolarHBondContact OE1-NZ 3.37Å; E863-K871 VanDerWaalsContact OE1-NZ 3.07Å
864	L	88.5	Confident	91.6	Very high	125 Å²	125	52.4 Å²	52.4	65%	0.654	27%	0.273	S	S	*	.			trans	-63.7	143.9	173	-65.7	174.6	0	0	0	111	P866 A867 R868	L864-P866 VanDerWaalsContact C-CD 3.42Å; L864-P866 VanDerWaalsContact C-N 3.33Å; L864-A867 PolarHBondContact O-N 3.35Å; L864-R868 WeakPolarHBondContact O-CG 3.39Å; L864-R868 PolarHBondContact O-N 3.28Å
865	R	88.9	Confident	91.7	Very high	145 Å²	145	50.7 Å²	50.7	55%	0.547	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.1	-42.4	-171.5	-166.4	174	179.8	-154.8	2.6	115.3	A895 T983	R865-A895 PolarHBondContact NH2-O 3.34Å; R865-T983 PolarHBondContact NE-OXT 3.35Å
866	P	90.9	Very high	91.6	Very high	119 Å²	119	52.3 Å²	52.3	77%	0.773	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-34.3	177	-19.5	33.9	0	0	0	114.4	L864	L864-P866 VanDerWaalsContact C-CD 3.42Å; L864-P866 VanDerWaalsContact C-N 3.33Å
867	A	92.6	Very high	91.4	Very high	36 Å²	36	59.4 Å²	59.4	30%	0.298	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-18.7	-177.7	0	0	0	0	0	113.1	E863 L864 K869 S870 K871	E863-A867 HydrophobicContact CB-CB 4.39Å; L864-A867 PolarHBondContact O-N 3.35Å; A867-K869 PolarHBondContact O-N 2.75Å; A867-K869 VanDerWaalsContact O-N 3.16Å; A867-S870 PolarHBondContact O-N 2.99Å; A867-S870 PolarHBondContact O-OG 3.08Å; A867-K871 PolarHBondContact O-N 3.11Å; A867-K871 VanDerWaalsContact O-N 3.11Å
868	R	93	Very high	91.3	Very high	36 Å²	36	64.5 Å²	64.5	14%	0.136	32%	0.319	C	S	.	.	H	α-helix	trans	-55.9	-34.7	-179.9	-56	-165.2	177.2	155.1	-9.6	113.2	I860 F861 E863 L864 K871 S872 L892 T983	I860-R868 HydrophobicContact CG2-CB 4.21Å; I860-R868 WeakPolarHBondContact O-CD 3.5Å; I860-R868 WeakPolarHBondContact O-CG 3.45Å; I860-R868 PolarHBondContact O-NE 3.3Å; F861-R868 PolarHBondContact O-NH2 3.5Å; E863-R868 HydrophobicContact CB-CG 4.32Å; E863-R868 PolarHBondContact O-NE 2.74Å; E863-R868 VanDerWaalsContact O-NE 3.08Å; L864-R868 WeakPolarHBondContact O-CG 3.39Å; L864-R868 PolarHBondContact O-N 3.28Å; R868-K871 PolarHBondContact O-N 3.29Å; R868-S872 VanDerWaalsContact O-CB 3.31Å; R868-S872 WeakPolarHBondContact O-CB 3.48Å; R868-S872 PolarHBondContact O-N 2.62Å; R868-S872 PolarHBondContact O-OG 2.81Å; R868-L892 HydrophobicContact CB-CD1 3.72Å; R868-T983 PolarHBondContact NH1-O 3.14Å
869	K	91.7	Very high	91	Very high	122 Å²	122	62.5 Å²	62.5	53%	0.53	31%	0.311	S	S	.	.	H	α-helix	trans	-71	-36	-177.4	-174.7	-175.7	172.9	-163	0	113.4	A867 S872 V873	A867-K869 PolarHBondContact O-N 2.75Å; A867-K869 VanDerWaalsContact O-N 3.16Å; K869-S872 PolarHBondContact O-OG 3.3Å; K869-S872 VanDerWaalsContact O-OG 3.06Å; K869-V873 WeakPolarHBondContact O-CG2 3.33Å; K869-V873 PolarHBondContact O-N 3.15Å
870	S	93.8	Very high	90.5	Very high	72 Å²	72	68.5 Å²	68.5	50%	0.503	34%	0.339	S	S	.	.	H	α-helix	trans	-72	-45.5	171.2	45	0	0	0	0	110	A867 S872 V873 D874	A867-S870 PolarHBondContact O-N 2.99Å; A867-S870 PolarHBondContact O-OG 3.08Å; S870-S872 VanDerWaalsContact C-N 3.26Å; S870-S872 PolarHBondContact O-N 3.44Å; S870-V873 WeakPolarHBondContact O-CB 3.35Å; S870-V873 PolarHBondContact O-N 2.69Å; S870-D874 PolarHBondContact O-N 3.39Å
871	K	92.4	Very high	90	Very high	47 Å²	47	75.3 Å²	75.3	20%	0.204	37%	0.37	C	S	.	.	H	α-helix	trans	-57.5	-37.5	178.2	-158.6	71.9	165.6	-154.3	0	113.2	W856 S859 I860 E863 A867 R868 D874 A875	W856-K871 HydrophobicContact CZ3-CD 4.19Å; W856-K871 HydrophobicContact CZ3-CG 4.49Å; S859-K871 WeakPolarHBondContact OG-CE 3.48Å; I860-K871 HydrophobicContact CG1-CG 4.44Å; E863-K871 HydrophobicContact CG-CB 4.29Å; E863-K871 HydrophobicContact CG-CD 4.18Å; E863-K871 HydrophobicContact CG-CG 3.99Å; E863-K871 IonicContact OE1-NZ 2.7Å; E863-K871 PolarHBondContact OE1-NZ 3.37Å; E863-K871 VanDerWaalsContact OE1-NZ 3.07Å; A867-K871 PolarHBondContact O-N 3.11Å; A867-K871 VanDerWaalsContact O-N 3.11Å; R868-K871 PolarHBondContact O-N 3.29Å; K871-D874 PolarHBondContact O-N 3.21Å; K871-A875 WeakPolarHBondContact O-CB 3.49Å; K871-A875 PolarHBondContact O-N 2.96Å
872	S	92.7	Very high	90	Very high	8 Å²	8	74.5 Å²	74.5	6%	0.056	37%	0.369	C	S	.	.	H	α-helix	trans	-71.9	-30.4	177	67.6	0	0	0	0	113.2	R868 K869 S870 L876	R868-S872 VanDerWaalsContact O-CB 3.31Å; R868-S872 WeakPolarHBondContact O-CB 3.48Å; R868-S872 PolarHBondContact O-N 2.62Å; R868-S872 PolarHBondContact O-OG 2.81Å; K869-S872 PolarHBondContact O-OG 3.3Å; K869-S872 VanDerWaalsContact O-OG 3.06Å; S870-S872 VanDerWaalsContact C-N 3.26Å; S870-S872 PolarHBondContact O-N 3.44Å; S872-L876 WeakPolarHBondContact O-CB 3.36Å; S872-L876 VanDerWaalsContact O-CG 3.27Å; S872-L876 WeakPolarHBondContact O-CG 3.32Å; S872-L876 PolarHBondContact O-N 3.21Å
873	V	93.4	Very high	90.2	Very high	63 Å²	63	74.4 Å²	74.4	38%	0.382	37%	0.367	S	S	.	.	H	α-helix	trans	-70.2	-38.5	171.8	170.6	0	0	0	0	110.6	K869 S870 L876 R877	K869-V873 WeakPolarHBondContact O-CG2 3.33Å; K869-V873 PolarHBondContact O-N 3.15Å; S870-V873 WeakPolarHBondContact O-CB 3.35Å; S870-V873 PolarHBondContact O-N 2.69Å; V873-L876 PolarHBondContact O-N 3.34Å; V873-R877 VanDerWaalsContact O-CG 3.29Å; V873-R877 WeakPolarHBondContact O-CG 3.25Å; V873-R877 PolarHBondContact O-N 3.41Å
874	D	91.9	Very high	90.4	Very high	68 Å²	68	73.7 Å²	73.7	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-67.8	-40.4	174.9	-63.9	-30.7	0	0	0	111.9	W856 S870 K871 R877 K878	W856-D874 HydrophobicContact CH2-CB 4.42Å; W856-D874 HydrophobicContact CZ3-CB 4.31Å; S870-D874 PolarHBondContact O-N 3.39Å; K871-D874 PolarHBondContact O-N 3.21Å; D874-R877 PolarHBondContact O-N 2.95Å; D874-R877 IonicContact OD1-NH1 2.99Å; D874-R877 PolarHBondContact OD1-NH1 3.18Å; D874-K878 WeakPolarHBondContact O-CG 3.24Å; D874-K878 PolarHBondContact O-N 2.97Å
875	A	92.8	Very high	90.7	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-59	-46.7	172.3	0	0	0	0	0	112.3	W856 I860 K871 K878 C879 V885	W856-A875 HydrophobicContact CB-CB 3.81Å; W856-A875 HydrophobicContact CD2-CB 3.86Å; W856-A875 HydrophobicContact CE3-CB 3.65Å; W856-A875 HydrophobicContact CG-CB 3.95Å; W856-A875 HydrophobicContact CZ3-CB 4.46Å; I860-A875 HydrophobicContact CD1-CB 3.96Å; K871-A875 WeakPolarHBondContact O-CB 3.49Å; K871-A875 PolarHBondContact O-N 2.96Å; A875-K878 PolarHBondContact O-N 2.99Å; A875-C879 PolarHBondContact O-N 2.88Å; A875-C879 PolarHBondContact O-SG 3.3Å; A875-V885 HydrophobicContact CB-CG1 3.8Å
876	L	92.4	Very high	90.9	Very high	34 Å²	34	61.3 Å²	61.3	18%	0.178	31%	0.309	C	S	.	.	H	α-helix	trans	-60.5	-47.8	175.8	-73.7	169.2	0	0	0	110.9	S872 V873 K878 C879 E880 V885 L886 V889 W905	S872-L876 WeakPolarHBondContact O-CB 3.36Å; S872-L876 VanDerWaalsContact O-CG 3.27Å; S872-L876 WeakPolarHBondContact O-CG 3.32Å; S872-L876 PolarHBondContact O-N 3.21Å; V873-L876 PolarHBondContact O-N 3.34Å; L876-K878 PolarHBondContact O-N 2.89Å; L876-C879 CarbonylContact O-C 3.6Å; L876-C879 VanDerWaalsContact O-C 3.28Å; L876-C879 PolarHBondContact O-N 3.48Å; L876-C879 VanDerWaalsContact O-N 3.16Å; L876-E880 VanDerWaalsContact O-CA 3.25Å; L876-E880 WeakPolarHBondContact O-CA 3.26Å; L876-E880 WeakPolarHBondContact O-CG 3.44Å; L876-E880 PolarHBondContact O-N 3.06Å; L876-V885 HydrophobicContact CD2-CG1 3.88Å; L876-V885 HydrophobicContact CG-CG1 4.17Å; L876-L886 HydrophobicContact CD2-CD2 3.86Å; L876-V889 HydrophobicContact CD1-CG2 4.08Å; L876-V889 HydrophobicContact CD2-CG2 4.35Å; L876-V889 HydrophobicContact CG-CG2 4.2Å; L876-W905 HydrophobicContact CD1-CH2 3.78Å; L876-W905 HydrophobicContact CD1-CZ3 4.11Å; L876-W905 HydrophobicContact CD2-CH2 4.44Å; L876-W905 HydrophobicContact CD2-CZ3 4.13Å
877	R	90.5	Very high	91.1	Very high	175 Å²	175	55.9 Å²	55.9	66%	0.66	27%	0.273	S	S	*	.	H	α-helix	trans	-59	-20	177.4	-74.8	167.6	170.9	173.2	-6.6	114.9	V873 D874	V873-R877 VanDerWaalsContact O-CG 3.29Å; V873-R877 WeakPolarHBondContact O-CG 3.25Å; V873-R877 PolarHBondContact O-N 3.41Å; D874-R877 PolarHBondContact O-N 2.95Å; D874-R877 IonicContact OD1-NH1 2.99Å; D874-R877 PolarHBondContact OD1-NH1 3.18Å
878	K	89.8	Confident	91.1	Very high	122 Å²	122	54.3 Å²	54.3	53%	0.53	26%	0.26	S	S	.	.	H	α-helix	trans	-94.2	-37.7	175.9	-69.9	-64.3	-173	177.4	0	112.6	W856 D874 A875 L876	W856-K878 HydrophobicContact CZ2-CB 4.34Å; W856-K878 HydrophobicContact CZ2-CG 3.84Å; D874-K878 WeakPolarHBondContact O-CG 3.24Å; D874-K878 PolarHBondContact O-N 2.97Å; A875-K878 PolarHBondContact O-N 2.99Å; L876-K878 PolarHBondContact O-N 2.89Å
879	C	85.9	Confident	91.2	Very high	13 Å²	13	52.8 Å²	52.8	9%	0.088	26%	0.255	C	S	.	.			trans	-142.2	74.4	-175.1	22.8	0	0	0	0	110	A875 L876 H881 D882 V885	A875-C879 PolarHBondContact O-N 2.88Å; A875-C879 PolarHBondContact O-SG 3.3Å; L876-C879 CarbonylContact O-C 3.6Å; L876-C879 VanDerWaalsContact O-C 3.28Å; L876-C879 PolarHBondContact O-N 3.48Å; L876-C879 VanDerWaalsContact O-N 3.16Å; C879-H881 PolarHBondContact O-N 3.37Å; C879-D882 HydrophobicContact CB-CB 3.89Å; C879-V885 HydrophobicContact CB-CG2 4.37Å
880	E	80	Confident	91.3	Very high	127 Å²	127	47 Å²	47	59%	0.593	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-24.7	-173.6	-71.1	-168.3	168.7	0	0	114.1	L876	L876-E880 VanDerWaalsContact O-CA 3.25Å; L876-E880 WeakPolarHBondContact O-CA 3.26Å; L876-E880 WeakPolarHBondContact O-CG 3.44Å; L876-E880 PolarHBondContact O-N 3.06Å
881	H	82.9	Confident	91.3	Very high	143 Å²	143	45 Å²	45	66%	0.662	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.3	13.3	-173.5	-56	-21.4	0	0	0	113.1	C879 V912	C879-H881 PolarHBondContact O-N 3.37Å; H881-V912 WeakPolarHBondContact O-CG1 3.33Å
882	D	90.4	Very high	91.4	Very high	36 Å²	36	43.2 Å²	43.2	19%	0.193	20%	0.204	C	C	.	.			trans	-81.2	127.5	175.7	-178.9	-71.7	0	0	0	110.9	G853 C879 H884 V885 L886	G853-D882 VanDerWaalsContact CA-CG 3.46Å; G853-D882 WeakPolarHBondContact CA-OD2 3.31Å; G853-D882 PolarHBondContact N-OD2 3.13Å; C879-D882 HydrophobicContact CB-CB 3.89Å; D882-H884 VanDerWaalsContact C-N 3.32Å; D882-H884 PolarHBondContact O-N 3.16Å; D882-H884 WeakPolarHBondContact OD1-CA 2.77Å; D882-H884 VanDerWaalsContact OD1-CB 3.27Å; D882-H884 WeakPolarHBondContact OD1-CB 3.38Å; D882-H884 IonicContact OD1-CD2 2.68Å; D882-H884 IonicContact OD1-CG 3.85Å; D882-H884 PolarHBondContact OD1-N 3.49Å; D882-V885 HydrophobicContact CB-CB 4.43Å; D882-V885 HydrophobicContact CB-CG2 4.05Å; D882-V885 PolarHBondContact O-N 2.62Å; D882-V885 PolarHBondContact OD1-N 2.7Å; D882-V885 VanDerWaalsContact OD1-N 3.17Å; D882-L886 WeakPolarHBondContact O-CG 3.42Å; D882-L886 PolarHBondContact O-N 3.07Å; D882-L886 VanDerWaalsContact O-N 3.12Å
883	P	91.8	Very high	91.5	Very high	10 Å²	10	44.4 Å²	44.4	7%	0.065	21%	0.209	C	C	.	.	H	α-helix	trans	-70.4	-25.9	-174	33.3	-40.6	0	0	0	113	L887 E913 L916	P883-L887 WeakPolarHBondContact O-CB 3.38Å; P883-L887 PolarHBondContact O-N 3.29Å; P883-E913 HydrophobicContact CB-CB 4.07Å; P883-E913 HydrophobicContact CG-CB 4.23Å; P883-E913 WeakPolarHBondContact CG-OE2 3.5Å; P883-L916 HydrophobicContact CB-CD2 3.74Å; P883-L916 HydrophobicContact CG-CD2 4Å
884	H	92.6	Very high	91.5	Very high	46 Å²	46	42.1 Å²	42.1	21%	0.213	19%	0.193	C	C	.	.	H	α-helix	trans	-71.9	-36.3	176.2	-63.2	-85	0	0	0	111.3	A857 D882 A888	A857-H884 HydrophobicContact CB-CB 4.17Å; D882-H884 VanDerWaalsContact C-N 3.32Å; D882-H884 PolarHBondContact O-N 3.16Å; D882-H884 WeakPolarHBondContact OD1-CA 2.77Å; D882-H884 VanDerWaalsContact OD1-CB 3.27Å; D882-H884 WeakPolarHBondContact OD1-CB 3.38Å; D882-H884 IonicContact OD1-CD2 2.68Å; D882-H884 IonicContact OD1-CG 3.85Å; D882-H884 PolarHBondContact OD1-N 3.49Å; H884-A888 WeakPolarHBondContact O-CB 3.3Å; H884-A888 PolarHBondContact O-N 2.84Å
885	V	93.9	Very high	91.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.6	-48.3	172.9	-178.1	0	0	0	0	110.6	G853 W856 A875 L876 C879 D882 L887 A888 V889	G853-V885 VanDerWaalsContact CA-CG2 3.42Å; W856-V885 HydrophobicContact CB-CG2 4.09Å; A875-V885 HydrophobicContact CB-CG1 3.8Å; L876-V885 HydrophobicContact CD2-CG1 3.88Å; L876-V885 HydrophobicContact CG-CG1 4.17Å; C879-V885 HydrophobicContact CB-CG2 4.37Å; D882-V885 HydrophobicContact CB-CB 4.43Å; D882-V885 HydrophobicContact CB-CG2 4.05Å; D882-V885 PolarHBondContact O-N 2.62Å; D882-V885 PolarHBondContact OD1-N 2.7Å; D882-V885 VanDerWaalsContact OD1-N 3.17Å; V885-L887 VanDerWaalsContact C-N 3.3Å; V885-L887 PolarHBondContact O-N 3.41Å; V885-A888 WeakPolarHBondContact O-CB 3.33Å; V885-A888 PolarHBondContact O-N 2.82Å; V885-A888 VanDerWaalsContact O-N 3.11Å; V885-V889 WeakPolarHBondContact O-CG2 3.44Å; V885-V889 PolarHBondContact O-N 2.97Å
886	L	94.4	Very high	91.5	Very high	11 Å²	11	42.3 Å²	42.3	6%	0.058	19%	0.194	C	C	.	.	H	α-helix	trans	-60.5	-40	177.2	-63.6	176.5	0	0	0	111.8	L876 D882 V889 S890 W905 T909 V912	L876-L886 HydrophobicContact CD2-CD2 3.86Å; D882-L886 WeakPolarHBondContact O-CG 3.42Å; D882-L886 PolarHBondContact O-N 3.07Å; D882-L886 VanDerWaalsContact O-N 3.12Å; L886-V889 PolarHBondContact O-N 3.18Å; L886-S890 WeakPolarHBondContact O-CB 3.43Å; L886-S890 PolarHBondContact O-N 3.31Å; L886-S890 PolarHBondContact O-OG 3.02Å; L886-W905 HydrophobicContact CD2-CE3 4.12Å; L886-W905 HydrophobicContact CD2-CZ3 3.66Å; L886-T909 HydrophobicContact CB-CG2 4.14Å; L886-T909 WeakPolarHBondContact CB-OG1 3.33Å; L886-T909 PolarHBondContact O-OG1 3.44Å; L886-V912 HydrophobicContact CD1-CB 4.09Å; L886-V912 HydrophobicContact CD1-CG1 4.3Å; L886-V912 HydrophobicContact CD1-CG2 3.74Å
887	L	94.4	Very high	91.4	Very high	5 Å²	5	50.4 Å²	50.4	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-63.6	-41.3	173.2	179.6	54.4	0	0	0	112.1	P883 V885 S890 K891 F906 T909 L916 D918 Y922	P883-L887 WeakPolarHBondContact O-CB 3.38Å; P883-L887 PolarHBondContact O-N 3.29Å; V885-L887 VanDerWaalsContact C-N 3.3Å; V885-L887 PolarHBondContact O-N 3.41Å; L887-S890 PolarHBondContact O-N 3.17Å; L887-K891 WeakPolarHBondContact O-CG 3.5Å; L887-K891 PolarHBondContact O-N 3.44Å; L887-F906 HydrophobicContact CD1-CD1 4.48Å; L887-F906 HydrophobicContact CD1-CE1 3.98Å; L887-T909 HydrophobicContact CB-CG2 3.96Å; L887-L916 HydrophobicContact CD2-CD2 4.35Å; L887-D918 HydrophobicContact CD2-CB 4.1Å; L887-Y922 HydrophobicContact CD1-CD2 4.23Å; L887-Y922 HydrophobicContact CD1-CG 4.27Å; L887-Y922 HydrophobicContact CD2-CD2 4.35Å
888	A	93.4	Very high	91.5	Very high	3 Å²	3	46.3 Å²	46.3	3%	0.025	21%	0.209	C	C	.	.	H	α-helix	trans	-64.9	-39.8	175.7	0	0	0	0	0	112.4	A857 I860 F861 H884 V885 K891 L892	A857-A888 HydrophobicContact CB-CB 3.92Å; I860-A888 HydrophobicContact CD1-CB 3.83Å; F861-A888 HydrophobicContact CE2-CB 3.97Å; H884-A888 WeakPolarHBondContact O-CB 3.3Å; H884-A888 PolarHBondContact O-N 2.84Å; V885-A888 WeakPolarHBondContact O-CB 3.33Å; V885-A888 PolarHBondContact O-N 2.82Å; V885-A888 VanDerWaalsContact O-N 3.11Å; A888-K891 PolarHBondContact O-N 2.94Å; A888-L892 WeakPolarHBondContact O-CB 3.37Å; A888-L892 PolarHBondContact O-N 3.09Å
889	V	94.3	Very high	91.6	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.018	19%	0.194	C	C	.	.	H	α-helix	trans	-65.5	-39.9	173.8	176.6	0	0	0	0	111.4	L876 V885 L886 L892 F893 W905	L876-V889 HydrophobicContact CD1-CG2 4.08Å; L876-V889 HydrophobicContact CD2-CG2 4.35Å; L876-V889 HydrophobicContact CG-CG2 4.2Å; V885-V889 WeakPolarHBondContact O-CG2 3.44Å; V885-V889 PolarHBondContact O-N 2.97Å; L886-V889 PolarHBondContact O-N 3.18Å; V889-L892 WeakPolarHBondContact O-CB 3.44Å; V889-L892 PolarHBondContact O-N 3.07Å; V889-F893 HydrophobicContact CG1-CD2 3.8Å; V889-F893 HydrophobicContact CG1-CE2 3.46Å; V889-F893 VanDerWaalsContact CG1-CE2 3.46Å; V889-F893 HydrophobicContact CG1-CZ 4.4Å; V889-F893 WeakPolarHBondContact O-CD2 3.44Å; V889-F893 PolarHBondContact O-N 3.28Å; V889-W905 HydrophobicContact CB-CE3 3.95Å; V889-W905 HydrophobicContact CB-CZ3 4.13Å; V889-W905 HydrophobicContact CG1-CD2 3.76Å; V889-W905 HydrophobicContact CG1-CE3 3.44Å; V889-W905 VanDerWaalsContact CG1-CE3 3.44Å; V889-W905 HydrophobicContact CG1-CG 4.46Å; V889-W905 HydrophobicContact CG1-CH2 4.13Å; V889-W905 HydrophobicContact CG1-CZ2 4.41Å; V889-W905 HydrophobicContact CG1-CZ3 3.65Å; V889-W905 HydrophobicContact CG2-CZ3 4.48Å
890	S	94.1	Very high	91.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.5	-47.3	176	-55.6	0	0	0	0	111.4	L886 L887 L892 F893 W894 W905 F906 T909	L886-S890 WeakPolarHBondContact O-CB 3.43Å; L886-S890 PolarHBondContact O-N 3.31Å; L886-S890 PolarHBondContact O-OG 3.02Å; L887-S890 PolarHBondContact O-N 3.17Å; S890-L892 VanDerWaalsContact C-N 3.31Å; S890-L892 PolarHBondContact O-N 3.29Å; S890-F893 PolarHBondContact O-N 3.39Å; S890-W894 PolarHBondContact O-N 2.9Å; S890-W905 WeakPolarHBondContact OG-CB 3.26Å; S890-W905 PolarHBondContact OG-O 3.01Å; S890-F906 PolarHBondContact OG-N 3.36Å; S890-T909 PolarHBondContact OG-OG1 3.33Å
891	K	94.2	Very high	92.6	Very high	32 Å²	32	46.6 Å²	46.6	14%	0.139	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-36.4	172.3	-69.6	173.3	-169.3	-179.3	0	112.7	F861 L887 A888 W894 A895 Y922 P982	F861-K891 HydrophobicContact CE1-CB 4.47Å; F861-K891 HydrophobicContact CE2-CB 4.22Å; F861-K891 HydrophobicContact CE2-CD 4.08Å; F861-K891 HydrophobicContact CZ-CB 3.54Å; F861-K891 HydrophobicContact CZ-CD 4.04Å; F861-K891 HydrophobicContact CZ-CG 4.48Å; L887-K891 WeakPolarHBondContact O-CG 3.5Å; L887-K891 PolarHBondContact O-N 3.44Å; A888-K891 PolarHBondContact O-N 2.94Å; K891-W894 PolarHBondContact O-N 3.44Å; K891-A895 WeakPolarHBondContact O-CB 3.41Å; K891-A895 PolarHBondContact O-N 2.89Å; K891-Y922 HydrophobicContact CD-CD1 4.28Å; K891-Y922 HydrophobicContact CD-CE1 4.08Å; K891-Y922 VanDerWaalsContact CE-CE1 3.45Å; K891-Y922 HydrophobicContact CG-CD1 4.18Å; K891-Y922 HydrophobicContact CG-CE1 4.4Å; K891-Y922 PolarHBondContact NZ-OH 3.12Å; K891-P982 HydrophobicContact CB-CB 4.19Å; K891-P982 HydrophobicContact CB-CG 4.13Å; K891-P982 HydrophobicContact CG-CG 4.4Å
892	L	93.8	Very high	93.1	Very high	8 Å²	8	39.8 Å²	39.8	4%	0.042	19%	0.186	C	C	.	.	H	α-helix	trans	-64.3	-48.2	175.9	-175.5	161.3	0	0	0	111.2	I860 R868 A888 V889 S890 W894 A895 E896	I860-L892 HydrophobicContact CG2-CD1 3.98Å; R868-L892 HydrophobicContact CB-CD1 3.72Å; A888-L892 WeakPolarHBondContact O-CB 3.37Å; A888-L892 PolarHBondContact O-N 3.09Å; V889-L892 WeakPolarHBondContact O-CB 3.44Å; V889-L892 PolarHBondContact O-N 3.07Å; S890-L892 VanDerWaalsContact C-N 3.31Å; S890-L892 PolarHBondContact O-N 3.29Å; L892-W894 VanDerWaalsContact C-N 3.27Å; L892-W894 PolarHBondContact O-N 3.23Å; L892-A895 CarbonylContact O-C 3.51Å; L892-A895 PolarHBondContact O-N 3.36Å; L892-E896 HydrophobicContact CD2-CG 4.02Å; L892-E896 PolarHBondContact O-N 2.86Å
893	F	94.2	Very high	93.3	Very high	34 Å²	34	41.2 Å²	41.2	15%	0.149	19%	0.189	C	C	.	.	H	α-helix	trans	-63.9	-32.9	176.5	-75.3	-53.4	0	0	0	112.9	V889 S890 E896 R897 K898 K901 A902 W905	V889-F893 HydrophobicContact CG1-CD2 3.8Å; V889-F893 HydrophobicContact CG1-CE2 3.46Å; V889-F893 VanDerWaalsContact CG1-CE2 3.46Å; V889-F893 HydrophobicContact CG1-CZ 4.4Å; V889-F893 WeakPolarHBondContact O-CD2 3.44Å; V889-F893 PolarHBondContact O-N 3.28Å; S890-F893 PolarHBondContact O-N 3.39Å; F893-E896 CarbonylContact O-C 3.56Å; F893-E896 PolarHBondContact O-N 3.16Å; F893-R897 PolarHBondContact O-N 2.79Å; F893-K898 HydrophobicContact CD1-CD 4.26Å; F893-K898 PolarHBondContact O-N 2.9Å; F893-K901 HydrophobicContact CD1-CB 4.4Å; F893-K901 HydrophobicContact CG-CB 4.28Å; F893-A902 HydrophobicContact CB-CB 4.06Å; F893-W905 HydrophobicContact CD2-CB 4.38Å; F893-W905 AromaticContact CD2-CD1 3.78Å; F893-W905 HydrophobicContact CD2-CD2 4.31Å; F893-W905 AromaticContact CD2-CG 3.88Å; F893-W905 HydrophobicContact CD2-CG 3.88Å; F893-W905 AromaticContact CE2-CD1 3.66Å; F893-W905 AromaticContact CE2-CD2 3.94Å; F893-W905 HydrophobicContact CE2-CD2 3.94Å; F893-W905 AromaticContact CE2-CE2 3.69Å; F893-W905 AromaticContact CE2-CG 3.92Å; F893-W905 HydrophobicContact CE2-CG 3.92Å; F893-W905 HydrophobicContact CE2-CZ2 4.33Å; F893-W905 AromaticContact CE2-NE1 3.5Å
894	W	94.7	Very high	93.4	Very high	14 Å²	14	45.2 Å²	45.2	5%	0.053	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-46.3	171.8	-176.3	19.9	0	0	0	111.7	S890 K891 L892 E896 R897 A902 F906 Y922 K925 F926 L929 H930 I981 P982	S890-W894 PolarHBondContact O-N 2.9Å; K891-W894 PolarHBondContact O-N 3.44Å; L892-W894 VanDerWaalsContact C-N 3.27Å; L892-W894 PolarHBondContact O-N 3.23Å; W894-E896 VanDerWaalsContact C-N 3.27Å; W894-E896 PolarHBondContact O-N 3.44Å; W894-R897 WeakPolarHBondContact O-CA 3.34Å; W894-R897 PolarHBondContact O-N 3.43Å; W894-A902 HydrophobicContact CB-CB 4.24Å; W894-F906 HydrophobicContact CE3-CZ 4.2Å; W894-Y922 HydrophobicContact CZ3-CD1 4.24Å; W894-K925 HydrophobicContact CH2-CB 4.44Å; W894-K925 HydrophobicContact CH2-CD 4.16Å; W894-K925 HydrophobicContact CH2-CG 4.19Å; W894-F926 HydrophobicContact CB-CD2 4.43Å; W894-F926 AromaticContact CD1-CD2 3.77Å; W894-F926 HydrophobicContact CD2-CB 4.45Å; W894-F926 HydrophobicContact CD2-CD2 4.01Å; W894-F926 HydrophobicContact CE3-CB 4.4Å; W894-F926 AromaticContact CG-CD2 3.84Å; W894-F926 HydrophobicContact CG-CD2 3.84Å; W894-F926 HydrophobicContact CG-CE2 4.42Å; W894-F926 HydrophobicContact CZ3-CB 4.5Å; W894-F926 AromaticContact NE1-CD2 3.94Å; W894-L929 HydrophobicContact CH2-CD1 4.28Å; W894-L929 HydrophobicContact CZ2-CD1 3.66Å; W894-H930 AromaticContact NE1-CD2 3.47Å; W894-H930 PolarHBondContact NE1-CD2 3.3Å; W894-I981 HydrophobicContact CH2-CG1 4.41Å; W894-I981 HydrophobicContact CH2-CG2 4.23Å; W894-I981 HydrophobicContact CZ2-CG1 4.46Å; W894-I981 HydrophobicContact CZ2-CG2 3.86Å; W894-P982 HydrophobicContact CD2-CG 3.88Å; W894-P982 VanDerWaalsContact CE3-CD 3.46Å; W894-P982 HydrophobicContact CE3-CG 3.4Å; W894-P982 VanDerWaalsContact CE3-CG 3.4Å; W894-P982 HydrophobicContact CG-CG 4.44Å; W894-P982 HydrophobicContact CZ3-CG 3.81Å
895	A	92.1	Very high	93.4	Very high	11 Å²	11	45 Å²	45	9%	0.091	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-26.7	173.7	0	0	0	0	0	113.4	R865 K891 L892 R897	R865-A895 PolarHBondContact NH2-O 3.34Å; K891-A895 WeakPolarHBondContact O-CB 3.41Å; K891-A895 PolarHBondContact O-N 2.89Å; L892-A895 CarbonylContact O-C 3.51Å; L892-A895 PolarHBondContact O-N 3.36Å; A895-R897 VanDerWaalsContact C-N 3.28Å
896	E	91.1	Very high	93.5	Very high	62 Å²	62	45 Å²	45	29%	0.29	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-1	168.7	-72.3	-168	157.1	0	0	113.9	L892 F893 W894 K898	L892-E896 HydrophobicContact CD2-CG 4.02Å; L892-E896 PolarHBondContact O-N 2.86Å; F893-E896 CarbonylContact O-C 3.56Å; F893-E896 PolarHBondContact O-N 3.16Å; W894-E896 VanDerWaalsContact C-N 3.27Å; W894-E896 PolarHBondContact O-N 3.44Å; E896-K898 VanDerWaalsContact C-N 3.28Å; E896-K898 HydrophobicContact CB-CD 4.22Å; E896-K898 HydrophobicContact CB-CG 4.37Å; E896-K898 PolarHBondContact O-N 3.5Å; E896-K898 IonicContact OE1-NZ 2.77Å; E896-K898 WeakPolarHBondContact OE2-CD 3.4Å; E896-K898 WeakPolarHBondContact OE2-CE 3.22Å; E896-K898 IonicContact OE2-NZ 3.02Å; E896-K898 PolarHBondContact OE2-NZ 3.16Å
897	R	90.3	Very high	93.5	Very high	203 Å²	203	45.7 Å²	45.7	77%	0.766	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	24.3	-176.6	-59.8	-176	174.3	-173.7	-2.6	115.5	F893 W894 A895 M899	F893-R897 PolarHBondContact O-N 2.79Å; W894-R897 WeakPolarHBondContact O-CA 3.34Å; W894-R897 PolarHBondContact O-N 3.43Å; A895-R897 VanDerWaalsContact C-N 3.28Å; R897-M899 HydrophobicContact CB-CE 3.86Å; R897-M899 HydrophobicContact CG-CE 4.21Å; R897-M899 PolarHBondContact O-N 3Å
898	K	92.2	Very high	93.3	Very high	90 Å²	90	50.9 Å²	50.9	39%	0.391	23%	0.233	S	C	.	.			trans	-91.3	69.9	179.9	-69.3	171.6	-172.3	160.3	0	110.9	F893 E896 T900 K901 A902	F893-K898 HydrophobicContact CD1-CD 4.26Å; F893-K898 PolarHBondContact O-N 2.9Å; E896-K898 VanDerWaalsContact C-N 3.28Å; E896-K898 HydrophobicContact CB-CD 4.22Å; E896-K898 HydrophobicContact CB-CG 4.37Å; E896-K898 PolarHBondContact O-N 3.5Å; E896-K898 IonicContact OE1-NZ 2.77Å; E896-K898 WeakPolarHBondContact OE2-CD 3.4Å; E896-K898 WeakPolarHBondContact OE2-CE 3.22Å; E896-K898 IonicContact OE2-NZ 3.02Å; E896-K898 PolarHBondContact OE2-NZ 3.16Å; K898-T900 PolarHBondContact O-N 2.95Å; K898-K901 HydrophobicContact CB-CB 4.35Å; K898-K901 PolarHBondContact O-N 2.88Å; K898-A902 PolarHBondContact O-N 2.91Å
899	M	92.6	Very high	93.3	Very high	45 Å²	45	50.8 Å²	50.8	22%	0.222	23%	0.232	C	C	.	.	H	α-helix	trans	-57.4	-41.3	-165.2	-48.1	-44.9	-178.1	0	0	114.5	R897 K901 A902 R903 F926	R897-M899 HydrophobicContact CB-CE 3.86Å; R897-M899 HydrophobicContact CG-CE 4.21Å; R897-M899 PolarHBondContact O-N 3Å; M899-K901 VanDerWaalsContact C-N 3.34Å; M899-K901 PolarHBondContact O-N 3.37Å; M899-A902 PolarHBondContact O-N 2.83Å; M899-R903 WeakPolarHBondContact O-CB 3.36Å; M899-R903 PolarHBondContact O-N 2.9Å; M899-F926 HydrophobicContact CB-CE2 4.44Å; M899-F926 HydrophobicContact CB-CZ 4.27Å; M899-F926 WeakPolarHBondContact O-CZ 2.98Å; M899-F926 HydrophobicContact SD-CE2 4.09Å
900	T	93	Very high	93.3	Very high	115 Å²	115	50.9 Å²	50.9	71%	0.706	23%	0.233	S	C	*	.	H	α-helix	trans	-60.8	-42.6	177.3	50	0	0	0	0	112.2	K898 E904	K898-T900 PolarHBondContact O-N 2.95Å; T900-E904 PolarHBondContact O-N 3.3Å
901	K	93.1	Very high	93.1	Very high	108 Å²	108	57.5 Å²	57.5	47%	0.47	26%	0.262	S	S	.	.	H	α-helix	trans	-71.8	-41.2	175.1	-63.2	-167.4	176.4	-168.5	0	111.9	F893 K898 M899 R903 E904 W905	F893-K901 HydrophobicContact CD1-CB 4.4Å; F893-K901 HydrophobicContact CG-CB 4.28Å; K898-K901 HydrophobicContact CB-CB 4.35Å; K898-K901 PolarHBondContact O-N 2.88Å; M899-K901 VanDerWaalsContact C-N 3.34Å; M899-K901 PolarHBondContact O-N 3.37Å; K901-R903 VanDerWaalsContact C-N 3.33Å; K901-R903 PolarHBondContact O-N 3.45Å; K901-E904 PolarHBondContact O-N 3.12Å; K901-W905 PolarHBondContact O-N 3.43Å
902	A	94.4	Very high	92.9	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-57.2	-47.6	176.6	0	0	0	0	0	111.2	F893 W894 K898 M899 E904 W905 F906 F926	F893-A902 HydrophobicContact CB-CB 4.06Å; W894-A902 HydrophobicContact CB-CB 4.24Å; K898-A902 PolarHBondContact O-N 2.91Å; M899-A902 PolarHBondContact O-N 2.83Å; A902-E904 PolarHBondContact O-N 3.21Å; A902-W905 PolarHBondContact O-N 3.4Å; A902-F906 HydrophobicContact CB-CE2 4.44Å; A902-F906 WeakPolarHBondContact O-CD2 3.38Å; A902-F906 PolarHBondContact O-N 3.23Å; A902-F926 HydrophobicContact CB-CD2 4.39Å; A902-F926 HydrophobicContact CB-CE2 3.72Å; A902-F926 HydrophobicContact CB-CZ 3.96Å
903	R	94.2	Very high	92.7	Very high	66 Å²	66	62.4 Å²	62.4	25%	0.249	29%	0.29	C	S	.	.	H	α-helix	trans	-58.1	-46.2	175.2	-174	169.7	-69.6	124.3	1	112.8	M899 K901 W905 F906 G907 F926 E927 H930	M899-R903 WeakPolarHBondContact O-CB 3.36Å; M899-R903 PolarHBondContact O-N 2.9Å; K901-R903 VanDerWaalsContact C-N 3.33Å; K901-R903 PolarHBondContact O-N 3.45Å; R903-W905 PolarHBondContact O-N 3.08Å; R903-F906 PolarHBondContact O-N 2.93Å; R903-G907 PolarHBondContact O-N 3.4Å; R903-F926 HydrophobicContact CB-CE1 3.8Å; R903-F926 HydrophobicContact CB-CZ 4.13Å; R903-F926 HydrophobicContact CG-CE1 4.37Å; R903-E927 WeakPolarHBondContact CD-OE1 3.25Å; R903-E927 WeakPolarHBondContact CG-OE1 3.34Å; R903-E927 IonicContact CZ-OE1 3.22Å; R903-E927 IonicContact CZ-OE2 2.67Å; R903-E927 IonicContact NE-OE1 3.02Å; R903-E927 PolarHBondContact NE-OE1 2.9Å; R903-E927 IonicContact NE-OE2 3.93Å; R903-E927 PolarHBondContact NE-OE2 3.22Å; R903-E927 IonicContact NH2-OE1 3.33Å; R903-E927 IonicContact NH2-OE2 3.94Å; R903-E927 PolarHBondContact NH2-OE2 3.18Å; R903-H930 PolarHBondContact NH2-O 3.14Å
904	E	93.7	Very high	92.5	Very high	94 Å²	94	63.6 Å²	63.6	44%	0.439	30%	0.301	S	S	.	.	H	α-helix	trans	-59.8	-45.6	176.3	-169.2	-166.4	175.1	0	0	111.8	T900 K901 A902 G907 R908	T900-E904 PolarHBondContact O-N 3.3Å; K901-E904 PolarHBondContact O-N 3.12Å; A902-E904 PolarHBondContact O-N 3.21Å; E904-G907 PolarHBondContact O-N 3.39Å; E904-R908 WeakPolarHBondContact O-CG 3.35Å; E904-R908 PolarHBondContact O-N 2.96Å; E904-R908 IonicContact OE1-CZ 3.13Å; E904-R908 IonicContact OE1-NE 2.85Å; E904-R908 PolarHBondContact OE1-NE 2.66Å; E904-R908 IonicContact OE1-NH2 2.7Å; E904-R908 PolarHBondContact OE1-NH2 3.27Å
905	W	94.2	Very high	92.3	Very high	40 Å²	40	65 Å²	65	15%	0.152	31%	0.31	C	S	.	.	H	α-helix	trans	-71.6	-35.2	-179.2	-80.3	76.4	0	0	0	113.1	L876 L886 V889 S890 F893 K901 A902 R903 R908 T909	L876-W905 HydrophobicContact CD1-CH2 3.78Å; L876-W905 HydrophobicContact CD1-CZ3 4.11Å; L876-W905 HydrophobicContact CD2-CH2 4.44Å; L876-W905 HydrophobicContact CD2-CZ3 4.13Å; L886-W905 HydrophobicContact CD2-CE3 4.12Å; L886-W905 HydrophobicContact CD2-CZ3 3.66Å; V889-W905 HydrophobicContact CB-CE3 3.95Å; V889-W905 HydrophobicContact CB-CZ3 4.13Å; V889-W905 HydrophobicContact CG1-CD2 3.76Å; V889-W905 HydrophobicContact CG1-CE3 3.44Å; V889-W905 VanDerWaalsContact CG1-CE3 3.44Å; V889-W905 HydrophobicContact CG1-CG 4.46Å; V889-W905 HydrophobicContact CG1-CH2 4.13Å; V889-W905 HydrophobicContact CG1-CZ2 4.41Å; V889-W905 HydrophobicContact CG1-CZ3 3.65Å; V889-W905 HydrophobicContact CG2-CZ3 4.48Å; S890-W905 WeakPolarHBondContact OG-CB 3.26Å; S890-W905 PolarHBondContact OG-O 3.01Å; F893-W905 HydrophobicContact CD2-CB 4.38Å; F893-W905 AromaticContact CD2-CD1 3.78Å; F893-W905 HydrophobicContact CD2-CD2 4.31Å; F893-W905 AromaticContact CD2-CG 3.88Å; F893-W905 HydrophobicContact CD2-CG 3.88Å; F893-W905 AromaticContact CE2-CD1 3.66Å; F893-W905 AromaticContact CE2-CD2 3.94Å; F893-W905 HydrophobicContact CE2-CD2 3.94Å; F893-W905 AromaticContact CE2-CE2 3.69Å; F893-W905 AromaticContact CE2-CG 3.92Å; F893-W905 HydrophobicContact CE2-CG 3.92Å; F893-W905 HydrophobicContact CE2-CZ2 4.33Å; F893-W905 AromaticContact CE2-NE1 3.5Å; K901-W905 PolarHBondContact O-N 3.43Å; A902-W905 PolarHBondContact O-N 3.4Å; R903-W905 PolarHBondContact O-N 3.08Å; W905-R908 PolarHBondContact O-N 3.48Å; W905-T909 WeakPolarHBondContact O-CB 3.25Å; W905-T909 PolarHBondContact O-N 3.17Å; W905-T909 PolarHBondContact O-OG1 3.36Å
906	F	95.3	Very high	92.3	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.8	-45.3	168.1	-78	-60.3	0	0	0	111.2	L887 S890 W894 A902 R903 R908 T909 V910 F923 F926	L887-F906 HydrophobicContact CD1-CD1 4.48Å; L887-F906 HydrophobicContact CD1-CE1 3.98Å; S890-F906 PolarHBondContact OG-N 3.36Å; W894-F906 HydrophobicContact CE3-CZ 4.2Å; A902-F906 HydrophobicContact CB-CE2 4.44Å; A902-F906 WeakPolarHBondContact O-CD2 3.38Å; A902-F906 PolarHBondContact O-N 3.23Å; R903-F906 PolarHBondContact O-N 2.93Å; F906-R908 VanDerWaalsContact C-N 3.32Å; F906-R908 PolarHBondContact O-N 3.29Å; F906-T909 WeakPolarHBondContact O-CB 3.37Å; F906-T909 PolarHBondContact O-N 3.11Å; F906-T909 VanDerWaalsContact O-N 3.13Å; F906-V910 PolarHBondContact O-N 2.88Å; F906-F923 HydrophobicContact CB-CB 4.15Å; F906-F923 HydrophobicContact CB-CD1 4.22Å; F906-F923 HydrophobicContact CB-CD2 3.38Å; F906-F923 HydrophobicContact CB-CE1 4.45Å; F906-F923 HydrophobicContact CB-CE2 3.68Å; F906-F923 HydrophobicContact CB-CG 3.68Å; F906-F923 HydrophobicContact CB-CZ 4.21Å; F906-F923 HydrophobicContact CD1-CB 3.92Å; F906-F923 HydrophobicContact CD1-CD2 4.45Å; F906-F923 HydrophobicContact CD1-CG 4.39Å; F906-F923 HydrophobicContact CD2-CD2 4.06Å; F906-F923 HydrophobicContact CG-CB 4.1Å; F906-F923 AromaticContact CG-CD2 3.75Å; F906-F923 HydrophobicContact CG-CD2 3.75Å; F906-F923 HydrophobicContact CG-CE2 4.43Å; F906-F923 HydrophobicContact CG-CG 4.08Å; F906-F926 HydrophobicContact CD2-CB 4.2Å; F906-F926 AromaticContact CD2-CD1 3.89Å; F906-F926 HydrophobicContact CD2-CD1 3.89Å; F906-F926 HydrophobicContact CD2-CD2 4.48Å; F906-F926 HydrophobicContact CD2-CE1 4.43Å; F906-F926 AromaticContact CD2-CG 3.92Å; F906-F926 HydrophobicContact CD2-CG 3.92Å; F906-F926 HydrophobicContact CE2-CB 3.64Å; F906-F926 HydrophobicContact CE2-CD1 4.06Å; F906-F926 AromaticContact CE2-CD2 3.93Å; F906-F926 HydrophobicContact CE2-CD2 3.93Å; F906-F926 AromaticContact CE2-CG 3.59Å; F906-F926 HydrophobicContact CE2-CG 3.59Å; F906-F926 HydrophobicContact CZ-CB 4.2Å
907	G	93.6	Very high	92.3	Very high	26 Å²	26	61.7 Å²	61.7	27%	0.268	29%	0.292	S	S	.	.	H	α-helix	trans	-57.9	-39.7	174.9	0	0	0	0	0	113.5	R903 E904 K911	R903-G907 PolarHBondContact O-N 3.4Å; E904-G907 PolarHBondContact O-N 3.39Å; G907-K911 WeakPolarHBondContact O-CB 2.81Å; G907-K911 PolarHBondContact O-N 2.7Å
908	R	91.2	Very high	92.3	Very high	114 Å²	114	52.7 Å²	52.7	43%	0.43	26%	0.259	S	S	.	.	H	α-helix	trans	-65.2	-47.1	171.7	-68.3	169.1	-176.6	-147.3	-4.7	111.7	E904 W905 F906 V910 K911 V912	E904-R908 WeakPolarHBondContact O-CG 3.35Å; E904-R908 PolarHBondContact O-N 2.96Å; E904-R908 IonicContact OE1-CZ 3.13Å; E904-R908 IonicContact OE1-NE 2.85Å; E904-R908 PolarHBondContact OE1-NE 2.66Å; E904-R908 IonicContact OE1-NH2 2.7Å; E904-R908 PolarHBondContact OE1-NH2 3.27Å; W905-R908 PolarHBondContact O-N 3.48Å; F906-R908 VanDerWaalsContact C-N 3.32Å; F906-R908 PolarHBondContact O-N 3.29Å; R908-V910 PolarHBondContact O-N 3.48Å; R908-K911 PolarHBondContact O-N 2.91Å; R908-K911 VanDerWaalsContact O-N 3.12Å; R908-V912 WeakPolarHBondContact O-CG2 3.2Å; R908-V912 PolarHBondContact O-N 2.8Å; R908-V912 VanDerWaalsContact O-N 3.08Å
909	T	93.1	Very high	92.4	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-56	-51.5	-178.5	-55.5	0	0	0	0	111.2	L886 L887 S890 W905 F906 K911 V912 E913	L886-T909 HydrophobicContact CB-CG2 4.14Å; L886-T909 WeakPolarHBondContact CB-OG1 3.33Å; L886-T909 PolarHBondContact O-OG1 3.44Å; L887-T909 HydrophobicContact CB-CG2 3.96Å; S890-T909 PolarHBondContact OG-OG1 3.33Å; W905-T909 WeakPolarHBondContact O-CB 3.25Å; W905-T909 PolarHBondContact O-N 3.17Å; W905-T909 PolarHBondContact O-OG1 3.36Å; F906-T909 WeakPolarHBondContact O-CB 3.37Å; F906-T909 PolarHBondContact O-N 3.11Å; F906-T909 VanDerWaalsContact O-N 3.13Å; T909-K911 VanDerWaalsContact C-N 3.26Å; T909-K911 PolarHBondContact O-N 3Å; T909-V912 PolarHBondContact O-N 3.34Å; T909-E913 PolarHBondContact O-N 3.3Å
910	V	93.4	Very high	92.5	Very high	6 Å²	6	46.6 Å²	46.6	4%	0.036	23%	0.232	C	C	.	.	H	α-helix	trans	-71.6	-17.3	-179.6	-57.4	0	0	0	0	113.9	F906 R908 P914 W920 F923	F906-V910 PolarHBondContact O-N 2.88Å; R908-V910 PolarHBondContact O-N 3.48Å; V910-P914 WeakPolarHBondContact O-CG 3.12Å; V910-W920 HydrophobicContact CB-CD2 4.42Å; V910-W920 HydrophobicContact CB-CE3 4.44Å; V910-W920 HydrophobicContact CB-CH2 3.67Å; V910-W920 HydrophobicContact CB-CZ2 3.68Å; V910-W920 HydrophobicContact CB-CZ3 4.08Å; V910-W920 HydrophobicContact CG1-CD2 3.95Å; V910-W920 HydrophobicContact CG1-CE3 3.96Å; V910-W920 HydrophobicContact CG1-CH2 4.11Å; V910-W920 HydrophobicContact CG1-CZ2 4.14Å; V910-W920 HydrophobicContact CG1-CZ3 4.04Å; V910-W920 HydrophobicContact CG2-CH2 3.8Å; V910-W920 HydrophobicContact CG2-CZ2 4.3Å; V910-W920 HydrophobicContact CG2-CZ3 4.11Å; V910-F923 HydrophobicContact CG1-CD1 3.97Å; V910-F923 HydrophobicContact CG2-CD1 4.39Å; V910-F923 HydrophobicContact CG2-CE1 4.22Å
911	K	91.2	Very high	92.5	Very high	138 Å²	138	41.1 Å²	41.1	60%	0.6	20%	0.198	S	C	*	.	H	α-helix	trans	-81.2	-32.4	174.2	-174.5	175.5	179.9	-180	0	112.1	G907 R908 T909	G907-K911 WeakPolarHBondContact O-CB 2.81Å; G907-K911 PolarHBondContact O-N 2.7Å; R908-K911 PolarHBondContact O-N 2.91Å; R908-K911 VanDerWaalsContact O-N 3.12Å; T909-K911 VanDerWaalsContact C-N 3.26Å; T909-K911 PolarHBondContact O-N 3Å
912	V	90.5	Very high	92.6	Very high	71 Å²	71	37.3 Å²	37.3	43%	0.43	18%	0.181	S	C	.	.	H	α-helix	trans	-71.1	-50.7	178.3	170.5	0	0	0	0	110.8	H881 L886 R908 T909	H881-V912 WeakPolarHBondContact O-CG1 3.33Å; L886-V912 HydrophobicContact CD1-CB 4.09Å; L886-V912 HydrophobicContact CD1-CG1 4.3Å; L886-V912 HydrophobicContact CD1-CG2 3.74Å; R908-V912 WeakPolarHBondContact O-CG2 3.2Å; R908-V912 PolarHBondContact O-N 2.8Å; R908-V912 VanDerWaalsContact O-N 3.08Å; T909-V912 PolarHBondContact O-N 3.34Å
913	E	87.8	Confident	92.6	Very high	72 Å²	72	37.5 Å²	37.5	34%	0.336	18%	0.182	S	C	.	.			trans	-137.4	96.9	174.2	-169.4	167.7	174.3	0	0	112	P883 T909 D915 L916	P883-E913 HydrophobicContact CB-CB 4.07Å; P883-E913 HydrophobicContact CG-CB 4.23Å; P883-E913 WeakPolarHBondContact CG-OE2 3.5Å; T909-E913 PolarHBondContact O-N 3.3Å; E913-D915 HydrophobicContact CG-CB 4.26Å; E913-D915 PolarHBondContact O-N 3.12Å; E913-L916 PolarHBondContact O-N 2.98Å
914	P	90	Very high	92.6	Very high	59 Å²	59	35 Å²	35	38%	0.383	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.7	176.1	-21.9	32.2	0	0	0	114.7	V910 W920 A946	V910-P914 WeakPolarHBondContact O-CG 3.12Å; P914-W920 HydrophobicContact CB-CZ2 4.42Å; P914-W920 PolarHBondContact O-NE1 3.28Å; P914-A946 HydrophobicContact CB-CB 3.77Å
915	D	91.1	Very high	92.6	Very high	44 Å²	44	32 Å²	32	24%	0.235	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-13.1	-176	-164.6	19	0	0	0	113.5	E913 G917 P948 R949 H950	E913-D915 HydrophobicContact CG-CB 4.26Å; E913-D915 PolarHBondContact O-N 3.12Å; D915-G917 PolarHBondContact O-N 3.31Å; D915-G917 VanDerWaalsContact O-N 3.13Å; D915-P948 VanDerWaalsContact O-CB 3.31Å; D915-P948 WeakPolarHBondContact O-CB 3.37Å; D915-P948 WeakPolarHBondContact OD1-CA 3.3Å; D915-R949 PolarHBondContact O-N 2.83Å; D915-R949 VanDerWaalsContact O-N 3.13Å; D915-R949 WeakPolarHBondContact OD1-CB 3.41Å; D915-R949 PolarHBondContact OD1-N 2.69Å; D915-H950 PolarHBondContact O-N 3.49Å; D915-H950 IonicContact OD1-ND1 2.7Å; D915-H950 IonicContact OD2-CE1 3.13Å; D915-H950 PolarHBondContact OD2-CE1 3.38Å; D915-H950 VanDerWaalsContact OD2-CE1 3.31Å; D915-H950 IonicContact OD2-CG 2.68Å; D915-H950 IonicContact OD2-ND1 3.18Å; D915-H950 PolarHBondContact OD2-ND1 3.03Å
916	L	92	Very high	92.6	Very high	3 Å²	3	30 Å²	30	2%	0.016	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-79.8	93.5	178.2	-175.9	66.4	0	0	0	111	P883 L887 E913 D918 S919 G951	P883-L916 HydrophobicContact CB-CD2 3.74Å; P883-L916 HydrophobicContact CG-CD2 4Å; L887-L916 HydrophobicContact CD2-CD2 4.35Å; E913-L916 PolarHBondContact O-N 2.98Å; L916-D918 VanDerWaalsContact C-N 3.26Å; L916-D918 HydrophobicContact CD1-CB 4.48Å; L916-D918 HydrophobicContact CG-CB 4.43Å; L916-D918 PolarHBondContact O-N 2.84Å; L916-S919 WeakPolarHBondContact O-CB 3.1Å; L916-S919 PolarHBondContact O-N 3.18Å; L916-S919 PolarHBondContact O-OG 3.19Å; L916-G951 VanDerWaalsContact CD1-CA 3.48Å
917	G	91.2	Very high	92.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.6	-29.4	-178.2	0	0	0	0	0	114.9	D915 S919 W920 A921 H950	D915-G917 PolarHBondContact O-N 3.31Å; D915-G917 VanDerWaalsContact O-N 3.13Å; G917-S919 PolarHBondContact O-N 2.85Å; G917-W920 PolarHBondContact O-N 2.85Å; G917-A921 PolarHBondContact O-N 3.26Å; G917-H950 PolarHBondContact N-O 3.09Å
918	D	91.7	Very high	92.5	Very high	14 Å²	14	32.8 Å²	32.8	8%	0.075	16%	0.159	C	C	.	.	H	α-helix	trans	-60.8	-35.9	173.7	-68.1	-5.5	0	0	0	111.5	L887 L916 A921 Y922 G951 E952 A953 W954	L887-D918 HydrophobicContact CD2-CB 4.1Å; L916-D918 VanDerWaalsContact C-N 3.26Å; L916-D918 HydrophobicContact CD1-CB 4.48Å; L916-D918 HydrophobicContact CG-CB 4.43Å; L916-D918 PolarHBondContact O-N 2.84Å; D918-A921 PolarHBondContact O-N 3.43Å; D918-Y922 VanDerWaalsContact O-CD2 3.29Å; D918-Y922 WeakPolarHBondContact O-CD2 3.25Å; D918-Y922 PolarHBondContact O-N 3.18Å; D918-G951 VanDerWaalsContact CG-CA 3.44Å; D918-G951 WeakPolarHBondContact OD1-CA 3.44Å; D918-G951 WeakPolarHBondContact OD2-CA 3.47Å; D918-E952 VanDerWaalsContact CG-N 3.35Å; D918-E952 PolarHBondContact OD1-N 3.04Å; D918-E952 PolarHBondContact OD2-N 2.91Å; D918-A953 WeakPolarHBondContact OD1-CB 3.09Å; D918-A953 PolarHBondContact OD1-N 3.28Å; D918-W954 PolarHBondContact OD1-N 3.2Å
919	S	93	Very high	92.5	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.007	16%	0.159	C	C	.	.	H	α-helix	trans	-66	-43.3	179.5	73.3	0	0	0	0	111.7	L916 G917 F923	L916-S919 WeakPolarHBondContact O-CB 3.1Å; L916-S919 PolarHBondContact O-N 3.18Å; L916-S919 PolarHBondContact O-OG 3.19Å; G917-S919 PolarHBondContact O-N 2.85Å; S919-F923 VanDerWaalsContact O-CB 3.25Å; S919-F923 WeakPolarHBondContact O-CB 3.29Å; S919-F923 PolarHBondContact O-N 3.06Å
920	W	94.8	Very high	92.5	Very high	7 Å²	7	36.2 Å²	36.2	3%	0.027	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-44	173.8	-66.8	107.3	0	0	0	112.3	V910 P914 G917 F923 Y924 V939 R942 C943 A946 L972	V910-W920 HydrophobicContact CB-CD2 4.42Å; V910-W920 HydrophobicContact CB-CE3 4.44Å; V910-W920 HydrophobicContact CB-CH2 3.67Å; V910-W920 HydrophobicContact CB-CZ2 3.68Å; V910-W920 HydrophobicContact CB-CZ3 4.08Å; V910-W920 HydrophobicContact CG1-CD2 3.95Å; V910-W920 HydrophobicContact CG1-CE3 3.96Å; V910-W920 HydrophobicContact CG1-CH2 4.11Å; V910-W920 HydrophobicContact CG1-CZ2 4.14Å; V910-W920 HydrophobicContact CG1-CZ3 4.04Å; V910-W920 HydrophobicContact CG2-CH2 3.8Å; V910-W920 HydrophobicContact CG2-CZ2 4.3Å; V910-W920 HydrophobicContact CG2-CZ3 4.11Å; P914-W920 HydrophobicContact CB-CZ2 4.42Å; P914-W920 PolarHBondContact O-NE1 3.28Å; G917-W920 PolarHBondContact O-N 2.85Å; W920-F923 HydrophobicContact CE3-CD1 4.45Å; W920-F923 HydrophobicContact CZ3-CD1 4.44Å; W920-F923 PolarHBondContact O-N 3.18Å; W920-Y924 WeakPolarHBondContact O-CB 3.44Å; W920-Y924 PolarHBondContact O-N 3.35Å; W920-V939 HydrophobicContact CE3-CG1 4.07Å; W920-V939 HydrophobicContact CZ3-CG1 4.44Å; W920-R942 HydrophobicContact CH2-CB 3.5Å; W920-R942 HydrophobicContact CZ3-CB 3.64Å; W920-C943 HydrophobicContact CB-CB 4.31Å; W920-C943 HydrophobicContact CD2-CB 3.84Å; W920-C943 HydrophobicContact CE3-CB 3.84Å; W920-C943 HydrophobicContact CG-CB 4.05Å; W920-A946 HydrophobicContact CZ2-CB 4.13Å; W920-L972 HydrophobicContact CB-CD1 3.86Å
921	A	93.5	Very high	92.3	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.8	-40.8	-178.2	0	0	0	0	0	112.9	G917 D918 K925 L972 V975 L979	G917-A921 PolarHBondContact O-N 3.26Å; D918-A921 PolarHBondContact O-N 3.43Å; A921-K925 WeakPolarHBondContact O-CB 3.39Å; A921-K925 PolarHBondContact O-N 2.98Å; A921-L972 HydrophobicContact CB-CD1 4.18Å; A921-V975 HydrophobicContact CB-CB 3.81Å; A921-V975 HydrophobicContact CB-CG1 3.34Å; A921-L979 HydrophobicContact CB-CD1 3.65Å
922	Y	94.5	Very high	92.4	Very high	27 Å²	27	33.2 Å²	33.2	11%	0.106	18%	0.179	C	C	.	.	H	α-helix	trans	-68.3	-36.6	172.6	-84.6	-76	0	0	0	112.5	L887 K891 W894 D918 F926 L979	L887-Y922 HydrophobicContact CD1-CD2 4.23Å; L887-Y922 HydrophobicContact CD1-CG 4.27Å; L887-Y922 HydrophobicContact CD2-CD2 4.35Å; K891-Y922 HydrophobicContact CD-CD1 4.28Å; K891-Y922 HydrophobicContact CD-CE1 4.08Å; K891-Y922 VanDerWaalsContact CE-CE1 3.45Å; K891-Y922 HydrophobicContact CG-CD1 4.18Å; K891-Y922 HydrophobicContact CG-CE1 4.4Å; K891-Y922 PolarHBondContact NZ-OH 3.12Å; W894-Y922 HydrophobicContact CZ3-CD1 4.24Å; D918-Y922 VanDerWaalsContact O-CD2 3.29Å; D918-Y922 WeakPolarHBondContact O-CD2 3.25Å; D918-Y922 PolarHBondContact O-N 3.18Å; Y922-F926 WeakPolarHBondContact O-CB 3.41Å; Y922-F926 PolarHBondContact O-N 3.22Å; Y922-L979 HydrophobicContact CD1-CD1 4.1Å; Y922-L979 HydrophobicContact CD2-CD1 3.59Å; Y922-L979 HydrophobicContact CD2-CD2 4.42Å; Y922-L979 HydrophobicContact CE1-CB 4.29Å; Y922-L979 HydrophobicContact CE1-CD1 4.15Å; Y922-L979 HydrophobicContact CE1-CD2 4.41Å; Y922-L979 HydrophobicContact CE2-CD1 3.59Å; Y922-L979 HydrophobicContact CE2-CD2 3.57Å; Y922-L979 HydrophobicContact CE2-CG 4.13Å; Y922-L979 HydrophobicContact CG-CD1 3.84Å
923	F	94.6	Very high	92.5	Very high	5 Å²	5	34.1 Å²	34.1	2%	0.022	19%	0.186	C	C	.	.	H	α-helix	trans	-67.7	-44.1	177.3	-173.9	-163	0	0	0	111.8	F906 V910 S919 W920 F926 E927 V939	F906-F923 HydrophobicContact CB-CB 4.15Å; F906-F923 HydrophobicContact CB-CD1 4.22Å; F906-F923 HydrophobicContact CB-CD2 3.38Å; F906-F923 HydrophobicContact CB-CE1 4.45Å; F906-F923 HydrophobicContact CB-CE2 3.68Å; F906-F923 HydrophobicContact CB-CG 3.68Å; F906-F923 HydrophobicContact CB-CZ 4.21Å; F906-F923 HydrophobicContact CD1-CB 3.92Å; F906-F923 HydrophobicContact CD1-CD2 4.45Å; F906-F923 HydrophobicContact CD1-CG 4.39Å; F906-F923 HydrophobicContact CD2-CD2 4.06Å; F906-F923 HydrophobicContact CG-CB 4.1Å; F906-F923 AromaticContact CG-CD2 3.75Å; F906-F923 HydrophobicContact CG-CD2 3.75Å; F906-F923 HydrophobicContact CG-CE2 4.43Å; F906-F923 HydrophobicContact CG-CG 4.08Å; V910-F923 HydrophobicContact CG1-CD1 3.97Å; V910-F923 HydrophobicContact CG2-CD1 4.39Å; V910-F923 HydrophobicContact CG2-CE1 4.22Å; S919-F923 VanDerWaalsContact O-CB 3.25Å; S919-F923 WeakPolarHBondContact O-CB 3.29Å; S919-F923 PolarHBondContact O-N 3.06Å; W920-F923 HydrophobicContact CE3-CD1 4.45Å; W920-F923 HydrophobicContact CZ3-CD1 4.44Å; W920-F923 PolarHBondContact O-N 3.18Å; F923-F926 HydrophobicContact CD2-CD1 4.26Å; F923-F926 HydrophobicContact CE2-CD1 4.49Å; F923-F926 WeakPolarHBondContact O-CB 3.46Å; F923-F926 PolarHBondContact O-N 2.81Å; F923-E927 HydrophobicContact CD2-CG 4.02Å; F923-E927 HydrophobicContact CE2-CG 3.85Å; F923-E927 VanDerWaalsContact CE2-OE1 3.3Å; F923-E927 WeakPolarHBondContact CE2-OE1 3.15Å; F923-E927 PolarHBondContact O-N 2.84Å; F923-V939 HydrophobicContact CB-CG1 4.49Å; F923-V939 HydrophobicContact CD1-CG1 3.93Å; F923-V939 HydrophobicContact CD1-CG2 3.73Å; F923-V939 HydrophobicContact CD2-CG2 4.24Å; F923-V939 HydrophobicContact CE1-CG1 4.47Å; F923-V939 HydrophobicContact CE1-CG2 3.5Å; F923-V939 VanDerWaalsContact CE1-CG2 3.5Å; F923-V939 HydrophobicContact CE2-CG2 4.03Å; F923-V939 HydrophobicContact CG-CG1 4.21Å; F923-V939 HydrophobicContact CG-CG2 4.11Å; F923-V939 HydrophobicContact CZ-CG2 3.65Å
924	Y	94.4	Very high	92.7	Very high	14 Å²	14	38.1 Å²	38.1	6%	0.055	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-44.1	174.7	-174.2	-117.6	0	0	0	111.3	W920 F926 E927 L928 Q936 V939 R940 L972 E973 A976	W920-Y924 WeakPolarHBondContact O-CB 3.44Å; W920-Y924 PolarHBondContact O-N 3.35Å; Y924-F926 VanDerWaalsContact C-N 3.26Å; Y924-F926 PolarHBondContact O-N 3.46Å; Y924-E927 PolarHBondContact O-N 3.24Å; Y924-L928 HydrophobicContact CD1-CD1 3.87Å; Y924-L928 HydrophobicContact CD1-CG 4.37Å; Y924-L928 HydrophobicContact CE1-CD1 3.62Å; Y924-L928 HydrophobicContact CE1-CD2 4.41Å; Y924-L928 HydrophobicContact CE1-CG 4.12Å; Y924-L928 HydrophobicContact CE2-CD2 4.42Å; Y924-L928 HydrophobicContact CE2-CG 4.37Å; Y924-L928 WeakPolarHBondContact O-CB 3.5Å; Y924-L928 WeakPolarHBondContact O-CG 3.43Å; Y924-L928 PolarHBondContact O-N 3.26Å; Y924-Q936 HydrophobicContact CE2-CB 4.2Å; Y924-V939 HydrophobicContact CD2-CG1 4.31Å; Y924-R940 PolarHBondContact OH-NH2 3.09Å; Y924-L972 HydrophobicContact CD1-CD2 4.26Å; Y924-L972 HydrophobicContact CD1-CG 4.03Å; Y924-L972 HydrophobicContact CD2-CD2 4.4Å; Y924-L972 HydrophobicContact CG-CD2 4.06Å; Y924-L972 HydrophobicContact CG-CG 4.2Å; Y924-E973 HydrophobicContact CE1-CG 3.95Å; Y924-A976 HydrophobicContact CD1-CB 3.76Å; Y924-A976 HydrophobicContact CE1-CB 4.49Å
925	K	93.7	Very high	92.8	Very high	29 Å²	29	38.3 Å²	38.3	13%	0.126	20%	0.201	C	C	.	.	H	α-helix	trans	-60.4	-34	173.7	-161.6	-174.7	-174.3	92.5	0	112.8	W894 A921 L929 A976 E977 L979	W894-K925 HydrophobicContact CH2-CB 4.44Å; W894-K925 HydrophobicContact CH2-CD 4.16Å; W894-K925 HydrophobicContact CH2-CG 4.19Å; A921-K925 WeakPolarHBondContact O-CB 3.39Å; A921-K925 PolarHBondContact O-N 2.98Å; K925-L929 WeakPolarHBondContact O-CD1 3.4Å; K925-A976 HydrophobicContact CB-CB 4.25Å; K925-A976 VanDerWaalsContact CD-O 3.31Å; K925-A976 WeakPolarHBondContact CD-O 3.47Å; K925-A976 PolarHBondContact NZ-O 3.09Å; K925-E977 PolarHBondContact NZ-O 3.21Å; K925-L979 HydrophobicContact CD-CB 4.18Å; K925-L979 WeakPolarHBondContact CE-O 3.44Å; K925-L979 PolarHBondContact NZ-O 2.91Å
926	F	94.6	Very high	92.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.6	-46.7	174.2	166	-95.1	0	0	0	112.1	W894 M899 A902 R903 F906 Y922 F923 Y924 L929 H930	W894-F926 HydrophobicContact CB-CD2 4.43Å; W894-F926 AromaticContact CD1-CD2 3.77Å; W894-F926 HydrophobicContact CD2-CB 4.45Å; W894-F926 HydrophobicContact CD2-CD2 4.01Å; W894-F926 HydrophobicContact CE3-CB 4.4Å; W894-F926 AromaticContact CG-CD2 3.84Å; W894-F926 HydrophobicContact CG-CD2 3.84Å; W894-F926 HydrophobicContact CG-CE2 4.42Å; W894-F926 HydrophobicContact CZ3-CB 4.5Å; W894-F926 AromaticContact NE1-CD2 3.94Å; M899-F926 HydrophobicContact CB-CE2 4.44Å; M899-F926 HydrophobicContact CB-CZ 4.27Å; M899-F926 WeakPolarHBondContact O-CZ 2.98Å; M899-F926 HydrophobicContact SD-CE2 4.09Å; A902-F926 HydrophobicContact CB-CD2 4.39Å; A902-F926 HydrophobicContact CB-CE2 3.72Å; A902-F926 HydrophobicContact CB-CZ 3.96Å; R903-F926 HydrophobicContact CB-CE1 3.8Å; R903-F926 HydrophobicContact CB-CZ 4.13Å; R903-F926 HydrophobicContact CG-CE1 4.37Å; F906-F926 HydrophobicContact CD2-CB 4.2Å; F906-F926 AromaticContact CD2-CD1 3.89Å; F906-F926 HydrophobicContact CD2-CD1 3.89Å; F906-F926 HydrophobicContact CD2-CD2 4.48Å; F906-F926 HydrophobicContact CD2-CE1 4.43Å; F906-F926 AromaticContact CD2-CG 3.92Å; F906-F926 HydrophobicContact CD2-CG 3.92Å; F906-F926 HydrophobicContact CE2-CB 3.64Å; F906-F926 HydrophobicContact CE2-CD1 4.06Å; F906-F926 AromaticContact CE2-CD2 3.93Å; F906-F926 HydrophobicContact CE2-CD2 3.93Å; F906-F926 AromaticContact CE2-CG 3.59Å; F906-F926 HydrophobicContact CE2-CG 3.59Å; F906-F926 HydrophobicContact CZ-CB 4.2Å; Y922-F926 WeakPolarHBondContact O-CB 3.41Å; Y922-F926 PolarHBondContact O-N 3.22Å; F923-F926 HydrophobicContact CD2-CD1 4.26Å; F923-F926 HydrophobicContact CE2-CD1 4.49Å; F923-F926 WeakPolarHBondContact O-CB 3.46Å; F923-F926 PolarHBondContact O-N 2.81Å; Y924-F926 VanDerWaalsContact C-N 3.26Å; Y924-F926 PolarHBondContact O-N 3.46Å; F926-L929 PolarHBondContact O-N 3.31Å; F926-L929 VanDerWaalsContact O-N 3.13Å; F926-H930 AromaticContact CD2-CD2 3.75Å; F926-H930 HydrophobicContact CE2-CB 4.19Å; F926-H930 AromaticContact CE2-CD2 3.75Å; F926-H930 HydrophobicContact CZ-CB 4.28Å; F926-H930 PolarHBondContact O-N 2.87Å
927	E	94.4	Very high	92.9	Very high	3 Å²	3	41.7 Å²	41.7	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-71.9	-27.1	179.1	-61.3	-60.9	179	0	0	113.3	R903 F923 Y924 L929 G931 Q935 Q936 V939	R903-E927 WeakPolarHBondContact CD-OE1 3.25Å; R903-E927 WeakPolarHBondContact CG-OE1 3.34Å; R903-E927 IonicContact CZ-OE1 3.22Å; R903-E927 IonicContact CZ-OE2 2.67Å; R903-E927 IonicContact NE-OE1 3.02Å; R903-E927 PolarHBondContact NE-OE1 2.9Å; R903-E927 IonicContact NE-OE2 3.93Å; R903-E927 PolarHBondContact NE-OE2 3.22Å; R903-E927 IonicContact NH2-OE1 3.33Å; R903-E927 IonicContact NH2-OE2 3.94Å; R903-E927 PolarHBondContact NH2-OE2 3.18Å; F923-E927 HydrophobicContact CD2-CG 4.02Å; F923-E927 HydrophobicContact CE2-CG 3.85Å; F923-E927 VanDerWaalsContact CE2-OE1 3.3Å; F923-E927 WeakPolarHBondContact CE2-OE1 3.15Å; F923-E927 PolarHBondContact O-N 2.84Å; Y924-E927 PolarHBondContact O-N 3.24Å; E927-L929 PolarHBondContact O-N 3.44Å; E927-G931 VanDerWaalsContact O-CA 3.23Å; E927-G931 WeakPolarHBondContact O-CA 3.42Å; E927-G931 PolarHBondContact O-N 2.87Å; E927-G931 WeakPolarHBondContact OE2-CA 3.17Å; E927-Q935 PolarHBondContact OE2-OE1 3.03Å; E927-Q936 HydrophobicContact CB-CG 3.98Å; E927-Q936 PolarHBondContact O-NE2 3.39Å; E927-V939 HydrophobicContact CG-CG2 4.08Å
928	L	92.7	Very high	92.9	Very high	81 Å²	81	44.1 Å²	44.1	42%	0.424	23%	0.231	S	C	.	.	H	α-helix	trans	-60.8	-25.1	168.5	-77.7	174.6	0	0	0	113.1	Y924 Q936	Y924-L928 HydrophobicContact CD1-CD1 3.87Å; Y924-L928 HydrophobicContact CD1-CG 4.37Å; Y924-L928 HydrophobicContact CE1-CD1 3.62Å; Y924-L928 HydrophobicContact CE1-CD2 4.41Å; Y924-L928 HydrophobicContact CE1-CG 4.12Å; Y924-L928 HydrophobicContact CE2-CD2 4.42Å; Y924-L928 HydrophobicContact CE2-CG 4.37Å; Y924-L928 WeakPolarHBondContact O-CB 3.5Å; Y924-L928 WeakPolarHBondContact O-CG 3.43Å; Y924-L928 PolarHBondContact O-N 3.26Å; L928-Q936 HydrophobicContact CD2-CG 4.49Å
929	L	91.2	Very high	93	Very high	84 Å²	84	43.5 Å²	43.5	44%	0.44	23%	0.227	S	C	.	.	H	α-helix	trans	-105.4	-24.7	-176.5	-70	167.5	0	0	0	113.9	W894 K925 F926 E927 I981	W894-L929 HydrophobicContact CH2-CD1 4.28Å; W894-L929 HydrophobicContact CZ2-CD1 3.66Å; K925-L929 WeakPolarHBondContact O-CD1 3.4Å; F926-L929 PolarHBondContact O-N 3.31Å; F926-L929 VanDerWaalsContact O-N 3.13Å; E927-L929 PolarHBondContact O-N 3.44Å; L929-I981 HydrophobicContact CD1-CD1 3.96Å; L929-I981 HydrophobicContact CD1-CG1 4.32Å
930	H	92.1	Very high	93	Very high	102 Å²	102	46.3 Å²	46.3	47%	0.472	24%	0.238	S	C	.	.	H	α-helix	trans	-137.4	2.9	-172.1	-57	-55.9	0	0	0	115	W894 R903 F926	W894-H930 AromaticContact NE1-CD2 3.47Å; W894-H930 PolarHBondContact NE1-CD2 3.3Å; R903-H930 PolarHBondContact NH2-O 3.14Å; F926-H930 AromaticContact CD2-CD2 3.75Å; F926-H930 HydrophobicContact CE2-CB 4.19Å; F926-H930 AromaticContact CE2-CD2 3.75Å; F926-H930 HydrophobicContact CZ-CB 4.28Å; F926-H930 PolarHBondContact O-N 2.87Å
931	G	89.4	Confident	92.9	Very high	22 Å²	22	52.6 Å²	52.6	23%	0.227	26%	0.261	C	S	.	.	S	Bend	trans	-108.4	165.3	-175.3	0	0	0	0	0	114.1	E927 Q935	E927-G931 VanDerWaalsContact O-CA 3.23Å; E927-G931 WeakPolarHBondContact O-CA 3.42Å; E927-G931 PolarHBondContact O-N 2.87Å; E927-G931 WeakPolarHBondContact OE2-CA 3.17Å; G931-Q935 VanDerWaalsContact CA-OE1 3.23Å
932	T	93.4	Very high	92.8	Very high	60 Å²	60	56 Å²	56	37%	0.368	27%	0.274	S	S	.	.			trans	-77.8	158.4	166.2	59.4	0	0	0	0	110.4	E934 Q935 Q936	T932-E934 PolarHBondContact O-N 2.98Å; T932-Q935 VanDerWaalsContact N-OE1 3.1Å; T932-Q935 WeakPolarHBondContact O-CB 3.47Å; T932-Q935 PolarHBondContact O-N 3.2Å; T932-Q935 WeakPolarHBondContact OG1-CG 3.48Å; T932-Q935 PolarHBondContact OG1-N 3.42Å; T932-Q936 PolarHBondContact O-N 3.22Å; T932-Q936 VanDerWaalsContact O-N 3.14Å
933	P	92.4	Very high	92.6	Very high	89 Å²	89	54.7 Å²	54.7	58%	0.578	27%	0.269	S	S	*	.	H	α-helix	trans	-55.8	-36.4	174.6	21.2	-33.5	0	0	0	112.5	Q935 Q936 D937	P933-Q935 VanDerWaalsContact C-N 3.31Å; P933-Q935 PolarHBondContact O-N 2.81Å; P933-Q936 WeakPolarHBondContact O-CB 3.48Å; P933-Q936 PolarHBondContact O-N 3.19Å; P933-Q936 VanDerWaalsContact O-N 3.15Å; P933-D937 PolarHBondContact O-N 3.2Å
934	E	93	Very high	92.4	Very high	156 Å²	156	57.1 Å²	57.1	73%	0.729	28%	0.284	S	S	*	.	H	α-helix	trans	-59.8	-37.8	174.8	-59.6	178.7	157.3	0	0	113.1	T932 D938	T932-E934 PolarHBondContact O-N 2.98Å; E934-D938 WeakPolarHBondContact O-CB 3.42Å; E934-D938 PolarHBondContact O-N 3.29Å
935	Q	92.1	Very high	92	Very high	64 Å²	64	63.5 Å²	63.5	30%	0.299	32%	0.315	S	S	.	.	H	α-helix	trans	-70.5	-37.5	176.4	-71.8	165.1	-3.1	0	0	111.3	E927 G931 T932 P933 D938 V939	E927-Q935 PolarHBondContact OE2-OE1 3.03Å; G931-Q935 VanDerWaalsContact CA-OE1 3.23Å; T932-Q935 VanDerWaalsContact N-OE1 3.1Å; T932-Q935 WeakPolarHBondContact O-CB 3.47Å; T932-Q935 PolarHBondContact O-N 3.2Å; T932-Q935 WeakPolarHBondContact OG1-CG 3.48Å; T932-Q935 PolarHBondContact OG1-N 3.42Å; P933-Q935 VanDerWaalsContact C-N 3.31Å; P933-Q935 PolarHBondContact O-N 2.81Å; Q935-D938 PolarHBondContact O-N 3.2Å; Q935-V939 WeakPolarHBondContact O-CG2 3.35Å; Q935-V939 PolarHBondContact O-N 3.24Å
936	Q	92.3	Very high	91.6	Very high	42 Å²	42	63.7 Å²	63.7	20%	0.196	32%	0.322	C	S	.	.	H	α-helix	trans	-64.1	-46.2	175.8	-63.5	165.2	11.6	0	0	111	Y924 E927 L928 T932 P933 V939 R940	Y924-Q936 HydrophobicContact CE2-CB 4.2Å; E927-Q936 HydrophobicContact CB-CG 3.98Å; E927-Q936 PolarHBondContact O-NE2 3.39Å; L928-Q936 HydrophobicContact CD2-CG 4.49Å; T932-Q936 PolarHBondContact O-N 3.22Å; T932-Q936 VanDerWaalsContact O-N 3.14Å; P933-Q936 WeakPolarHBondContact O-CB 3.48Å; P933-Q936 PolarHBondContact O-N 3.19Å; P933-Q936 VanDerWaalsContact O-N 3.15Å; Q936-V939 PolarHBondContact O-N 3.24Å; Q936-R940 PolarHBondContact O-N 2.99Å
937	D	92.6	Very high	91.3	Very high	75 Å²	75	67.4 Å²	67.4	40%	0.401	34%	0.339	S	S	.	.	H	α-helix	trans	-67.7	-34.9	176.9	-80.1	-28.3	0	0	0	113	P933 R940 R941	P933-D937 PolarHBondContact O-N 3.2Å; D937-R940 PolarHBondContact O-N 3.48Å; D937-R940 IonicContact OD1-NH1 3.58Å; D937-R940 PolarHBondContact OD1-NH1 2.75Å; D937-R941 WeakPolarHBondContact O-CB 3.45Å; D937-R941 PolarHBondContact O-N 2.82Å
938	D	91.8	Very high	91.1	Very high	52 Å²	52	67.6 Å²	67.6	28%	0.278	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-43.1	172.6	176.8	59.5	0	0	0	112.2	E934 Q935 R941 R942	E934-D938 WeakPolarHBondContact O-CB 3.42Å; E934-D938 PolarHBondContact O-N 3.29Å; Q935-D938 PolarHBondContact O-N 3.2Å; D938-R941 PolarHBondContact O-N 3.2Å; D938-R941 IonicContact OD1-NH1 3.76Å; D938-R942 WeakPolarHBondContact O-CB 3.49Å; D938-R942 WeakPolarHBondContact O-CG 3.43Å; D938-R942 PolarHBondContact O-N 3.13Å; D938-R942 IonicContact OD1-NE 3.12Å; D938-R942 PolarHBondContact OD1-NE 3.44Å; D938-R942 IonicContact OD2-CZ 2.97Å; D938-R942 IonicContact OD2-NE 3.23Å; D938-R942 PolarHBondContact OD2-NE 3.47Å; D938-R942 IonicContact OD2-NH2 2.66Å; D938-R942 PolarHBondContact OD2-NH2 3.44Å
939	V	92.8	Very high	90.7	Very high	1 Å²	1	71.7 Å²	71.7	1%	0.006	35%	0.35	C	S	.	.	H	α-helix	trans	-62.8	-43.5	174.2	174.3	0	0	0	0	111.3	W920 F923 Y924 E927 Q935 Q936 R942 C943	W920-V939 HydrophobicContact CE3-CG1 4.07Å; W920-V939 HydrophobicContact CZ3-CG1 4.44Å; F923-V939 HydrophobicContact CB-CG1 4.49Å; F923-V939 HydrophobicContact CD1-CG1 3.93Å; F923-V939 HydrophobicContact CD1-CG2 3.73Å; F923-V939 HydrophobicContact CD2-CG2 4.24Å; F923-V939 HydrophobicContact CE1-CG1 4.47Å; F923-V939 HydrophobicContact CE1-CG2 3.5Å; F923-V939 VanDerWaalsContact CE1-CG2 3.5Å; F923-V939 HydrophobicContact CE2-CG2 4.03Å; F923-V939 HydrophobicContact CG-CG1 4.21Å; F923-V939 HydrophobicContact CG-CG2 4.11Å; F923-V939 HydrophobicContact CZ-CG2 3.65Å; Y924-V939 HydrophobicContact CD2-CG1 4.31Å; E927-V939 HydrophobicContact CG-CG2 4.08Å; Q935-V939 WeakPolarHBondContact O-CG2 3.35Å; Q935-V939 PolarHBondContact O-N 3.24Å; Q936-V939 PolarHBondContact O-N 3.24Å; V939-R942 PolarHBondContact O-N 2.87Å; V939-C943 WeakPolarHBondContact O-CB 3.4Å; V939-C943 PolarHBondContact O-N 3.04Å
940	R	93.1	Very high	90.5	Very high	60 Å²	60	72.7 Å²	72.7	23%	0.226	35%	0.353	C	S	.	.	H	α-helix	trans	-59	-51.1	174.6	-175.3	-171.8	-80.7	139.3	-14.7	110.9	Y924 Q936 D937 R942 C943 V944 E969 E973	Y924-R940 PolarHBondContact OH-NH2 3.09Å; Q936-R940 PolarHBondContact O-N 2.99Å; D937-R940 PolarHBondContact O-N 3.48Å; D937-R940 IonicContact OD1-NH1 3.58Å; D937-R940 PolarHBondContact OD1-NH1 2.75Å; R940-R942 PolarHBondContact O-N 2.99Å; R940-C943 WeakPolarHBondContact O-CB 3.48Å; R940-C943 PolarHBondContact O-N 3.38Å; R940-V944 WeakPolarHBondContact O-CG2 3.31Å; R940-V944 PolarHBondContact O-N 3.44Å; R940-E969 HydrophobicContact CG-CG 4.05Å; R940-E973 IonicContact CZ-OE1 3.72Å; R940-E973 IonicContact NE-OE1 2.73Å; R940-E973 IonicContact NH2-OE1 3.46Å; R940-E973 PolarHBondContact NH2-OE1 3.2Å
941	R	91.5	Very high	90.3	Very high	138 Å²	138	68.4 Å²	68.4	52%	0.521	34%	0.336	S	S	.	.	H	α-helix	trans	-57.9	-45.9	179.5	-171.7	-170.6	-57.2	129.8	1.9	112.2	D937 D938 V944 Q945	D937-R941 WeakPolarHBondContact O-CB 3.45Å; D937-R941 PolarHBondContact O-N 2.82Å; D938-R941 PolarHBondContact O-N 3.2Å; D938-R941 IonicContact OD1-NH1 3.76Å; R941-V944 PolarHBondContact O-N 3.07Å; R941-Q945 WeakPolarHBondContact O-CG 3.29Å; R941-Q945 PolarHBondContact O-N 3.12Å
942	R	91.5	Very high	90.1	Very high	71 Å²	71	72.3 Å²	72.3	27%	0.268	35%	0.348	S	S	.	.	H	α-helix	trans	-67.6	-38.1	178.5	-71.5	-171.6	-78.7	133.6	-5	112.4	W920 D938 V939 R940 Q945 A946	W920-R942 HydrophobicContact CH2-CB 3.5Å; W920-R942 HydrophobicContact CZ3-CB 3.64Å; D938-R942 WeakPolarHBondContact O-CB 3.49Å; D938-R942 WeakPolarHBondContact O-CG 3.43Å; D938-R942 PolarHBondContact O-N 3.13Å; D938-R942 IonicContact OD1-NE 3.12Å; D938-R942 PolarHBondContact OD1-NE 3.44Å; D938-R942 IonicContact OD2-CZ 2.97Å; D938-R942 IonicContact OD2-NE 3.23Å; D938-R942 PolarHBondContact OD2-NE 3.47Å; D938-R942 IonicContact OD2-NH2 2.66Å; D938-R942 PolarHBondContact OD2-NH2 3.44Å; V939-R942 PolarHBondContact O-N 2.87Å; R940-R942 PolarHBondContact O-N 2.99Å; R942-Q945 PolarHBondContact O-N 3.32Å; R942-A946 WeakPolarHBondContact O-CB 3.31Å; R942-A946 PolarHBondContact O-N 3.14Å
943	C	91.7	Very high	89.9	Confident	1 Å²	1	70.4 Å²	70.4	1%	0.007	34%	0.338	C	S	.	.	H	α-helix	trans	-61.3	-43.8	173.3	-176.4	0	0	0	0	112	W920 V939 R940 Q945 A946 E947 P948 L972	W920-C943 HydrophobicContact CB-CB 4.31Å; W920-C943 HydrophobicContact CD2-CB 3.84Å; W920-C943 HydrophobicContact CE3-CB 3.84Å; W920-C943 HydrophobicContact CG-CB 4.05Å; V939-C943 WeakPolarHBondContact O-CB 3.4Å; V939-C943 PolarHBondContact O-N 3.04Å; R940-C943 WeakPolarHBondContact O-CB 3.48Å; R940-C943 PolarHBondContact O-N 3.38Å; C943-Q945 PolarHBondContact O-N 2.93Å; C943-A946 PolarHBondContact O-N 3.49Å; C943-E947 PolarHBondContact O-N 3.48Å; C943-E947 VanDerWaalsContact O-N 3.09Å; C943-P948 VanDerWaalsContact O-CD 3.26Å; C943-P948 WeakPolarHBondContact O-CD 3.47Å; C943-L972 HydrophobicContact CB-CD2 4.04Å
944	V	89.6	Confident	89.9	Confident	55 Å²	55	66.4 Å²	66.4	33%	0.333	31%	0.312	S	S	.	.	H	α-helix	trans	-63.8	-39.3	176.3	173.4	0	0	0	0	112	R940 R941 A946 E947 E969	R940-V944 WeakPolarHBondContact O-CG2 3.31Å; R940-V944 PolarHBondContact O-N 3.44Å; R941-V944 PolarHBondContact O-N 3.07Å; V944-A946 VanDerWaalsContact C-N 3.3Å; V944-A946 PolarHBondContact O-N 3.36Å; V944-E947 WeakPolarHBondContact O-CG 3.36Å; V944-E969 HydrophobicContact CG2-CG 3.32Å
945	Q	86.6	Confident	89.8	Confident	149 Å²	149	60 Å²	60	70%	0.696	28%	0.284	S	S	*	.	H	α-helix	trans	-66.6	-30.5	175.2	-72	174.5	0.5	0	0	113.2	R941 R942 C943	R941-Q945 WeakPolarHBondContact O-CG 3.29Å; R941-Q945 PolarHBondContact O-N 3.12Å; R942-Q945 PolarHBondContact O-N 3.32Å; C943-Q945 PolarHBondContact O-N 2.93Å
946	A	85.8	Confident	89.6	Confident	33 Å²	33	64 Å²	64	27%	0.273	30%	0.303	S	S	.	.	H	α-helix	trans	-80.1	-29.3	179.5	0	0	0	0	0	113.9	P914 W920 R942 C943 V944	P914-A946 HydrophobicContact CB-CB 3.77Å; W920-A946 HydrophobicContact CZ2-CB 4.13Å; R942-A946 WeakPolarHBondContact O-CB 3.31Å; R942-A946 PolarHBondContact O-N 3.14Å; C943-A946 PolarHBondContact O-N 3.49Å; V944-A946 VanDerWaalsContact C-N 3.3Å; V944-A946 PolarHBondContact O-N 3.36Å
947	E	87	Confident	89.5	Confident	77 Å²	77	63.2 Å²	63.2	36%	0.36	30%	0.301	S	S	.	.			trans	49.7	55.3	-173.7	-61.2	-169.9	168.6	0	0	114.2	K658 C943 V944 R949	K658-E947 IonicContact NZ-OE1 3.76Å; K658-E947 PolarHBondContact NZ-OE1 3.27Å; K658-E947 IonicContact NZ-OE2 2.74Å; K658-E947 PolarHBondContact NZ-OE2 3.19Å; C943-E947 PolarHBondContact O-N 3.48Å; C943-E947 VanDerWaalsContact O-N 3.09Å; V944-E947 WeakPolarHBondContact O-CG 3.36Å; E947-R949 WeakPolarHBondContact O-CG 3.34Å
948	P	90.2	Very high	89.2	Confident	7 Å²	7	61.3 Å²	61.3	5%	0.045	29%	0.293	C	S	.	.			trans	-62.1	145.7	-171.6	24.8	-34.4	0	0	0	114.1	D915 C943 W954	D915-P948 VanDerWaalsContact O-CB 3.31Å; D915-P948 WeakPolarHBondContact O-CB 3.37Å; D915-P948 WeakPolarHBondContact OD1-CA 3.3Å; C943-P948 VanDerWaalsContact O-CD 3.26Å; C943-P948 WeakPolarHBondContact O-CD 3.47Å; P948-W954 HydrophobicContact CG-CH2 3.99Å; P948-W954 HydrophobicContact CG-CZ2 3.75Å; P948-W954 PolarHBondContact O-NE1 3.27Å
949	R	84.8	Confident	88.9	Confident	168 Å²	168	64.8 Å²	64.8	63%	0.634	31%	0.306	S	S	*	.			trans	-128.6	-26.9	-173	-55.4	-178.6	-179	-179.8	0.9	113.5	D915 E947	D915-R949 PolarHBondContact O-N 2.83Å; D915-R949 VanDerWaalsContact O-N 3.13Å; D915-R949 WeakPolarHBondContact OD1-CB 3.41Å; D915-R949 PolarHBondContact OD1-N 2.69Å; E947-R949 WeakPolarHBondContact O-CG 3.34Å
950	H	87.8	Confident	88.5	Confident	105 Å²	105	67.9 Å²	67.9	49%	0.486	32%	0.323	S	S	.	.	B	Isolated β-bridge	trans	-97.9	173.2	-178.2	-64.2	106.3	0	0	0	111.3	D915 G917	D915-H950 PolarHBondContact O-N 3.49Å; D915-H950 IonicContact OD1-ND1 2.7Å; D915-H950 IonicContact OD2-CE1 3.13Å; D915-H950 PolarHBondContact OD2-CE1 3.38Å; D915-H950 VanDerWaalsContact OD2-CE1 3.31Å; D915-H950 IonicContact OD2-CG 2.68Å; D915-H950 IonicContact OD2-ND1 3.18Å; D915-H950 PolarHBondContact OD2-ND1 3.03Å; G917-H950 PolarHBondContact N-O 3.09Å
951	G	86.6	Confident	88	Confident	12 Å²	12	65.7 Å²	65.7	12%	0.124	32%	0.315	C	S	.	.			trans	102.8	143.1	-169.8	0	0	0	0	0	111.7	L916 D918 C955	L916-G951 VanDerWaalsContact CD1-CA 3.48Å; D918-G951 VanDerWaalsContact CG-CA 3.44Å; D918-G951 WeakPolarHBondContact OD1-CA 3.44Å; D918-G951 WeakPolarHBondContact OD2-CA 3.47Å; G951-C955 WeakPolarHBondContact O-CB 3.45Å; G951-C955 PolarHBondContact O-N 2.64Å; G951-C955 PolarHBondContact O-SG 3.03Å
952	E	86.2	Confident	87.7	Confident	103 Å²	103	67.8 Å²	67.8	48%	0.481	33%	0.328	S	S	.	.	H	α-helix	trans	-78.3	-49.2	-171.8	-179	178.3	-163.9	0	0	111.8	R827 D918 C955 Q956	R827-E952 IonicContact CZ-OE1 3.47Å; R827-E952 IonicContact CZ-OE2 3.46Å; R827-E952 IonicContact NH1-OE1 2.73Å; R827-E952 PolarHBondContact NH1-OE1 3.46Å; R827-E952 IonicContact NH1-OE2 3.66Å; R827-E952 PolarHBondContact NH1-OE2 3.19Å; R827-E952 IonicContact NH2-OE2 3.41Å; R827-E952 PolarHBondContact NH2-OE2 3.1Å; D918-E952 VanDerWaalsContact CG-N 3.35Å; D918-E952 PolarHBondContact OD1-N 3.04Å; D918-E952 PolarHBondContact OD2-N 2.91Å; E952-C955 PolarHBondContact O-N 3.4Å; E952-Q956 WeakPolarHBondContact O-CB 3.19Å; E952-Q956 PolarHBondContact O-N 3.09Å
953	A	88.5	Confident	87.4	Confident	20 Å²	20	65 Å²	65	17%	0.165	32%	0.319	C	S	.	.	H	α-helix	trans	-68.6	-39.6	177.6	0	0	0	0	0	110.4	D918 Q956 V957 V975 L979	D918-A953 WeakPolarHBondContact OD1-CB 3.09Å; D918-A953 PolarHBondContact OD1-N 3.28Å; A953-Q956 PolarHBondContact O-N 2.9Å; A953-V957 PolarHBondContact O-N 3.25Å; A953-V975 HydrophobicContact CB-CG1 3.95Å; A953-L979 HydrophobicContact CB-CD2 3.79Å
954	W	92.8	Very high	86.8	Confident	6 Å²	6	67.8 Å²	67.8	2%	0.023	33%	0.329	C	S	.	.	H	α-helix	trans	-58.8	-47.7	171	-169.1	-95.4	0	0	0	112.1	D918 P948 Q956 S958 V968 I971 L972 V975	D918-W954 PolarHBondContact OD1-N 3.2Å; P948-W954 HydrophobicContact CG-CH2 3.99Å; P948-W954 HydrophobicContact CG-CZ2 3.75Å; P948-W954 PolarHBondContact O-NE1 3.27Å; W954-Q956 VanDerWaalsContact C-N 3.34Å; W954-Q956 PolarHBondContact O-N 3.28Å; W954-S958 VanDerWaalsContact O-CB 3.27Å; W954-S958 WeakPolarHBondContact O-CB 3.49Å; W954-S958 PolarHBondContact O-N 3.09Å; W954-S958 PolarHBondContact O-OG 3.37Å; W954-V968 HydrophobicContact CH2-CG1 3.96Å; W954-V968 HydrophobicContact CZ2-CG1 4.05Å; W954-I971 HydrophobicContact CD2-CG2 4.03Å; W954-I971 HydrophobicContact CE3-CG2 4.1Å; W954-I971 HydrophobicContact CH2-CB 4.15Å; W954-I971 HydrophobicContact CH2-CG2 3.79Å; W954-I971 HydrophobicContact CZ2-CB 4.24Å; W954-I971 HydrophobicContact CZ2-CG2 3.71Å; W954-I971 HydrophobicContact CZ3-CG2 4Å; W954-L972 HydrophobicContact CH2-CB 4.13Å; W954-L972 HydrophobicContact CZ3-CB 3.94Å; W954-L972 HydrophobicContact CZ3-CD1 3.97Å; W954-V975 HydrophobicContact CE3-CG2 4.06Å
955	C	90.3	Very high	86.2	Confident	22 Å²	22	71 Å²	71	15%	0.149	34%	0.339	C	S	.	.	H	α-helix	trans	-61.9	-38.6	173.7	-85.9	0	0	0	0	112.7	G951 E952 S958 K959	G951-C955 WeakPolarHBondContact O-CB 3.45Å; G951-C955 PolarHBondContact O-N 2.64Å; G951-C955 PolarHBondContact O-SG 3.03Å; E952-C955 PolarHBondContact O-N 3.4Å; C955-S958 WeakPolarHBondContact CA-OG 3.38Å; C955-S958 PolarHBondContact O-OG 3.48Å; C955-K959 HydrophobicContact CB-CD 4.09Å; C955-K959 WeakPolarHBondContact O-CB 3.38Å; C955-K959 WeakPolarHBondContact O-CD 3.26Å; C955-K959 WeakPolarHBondContact O-CG 3.38Å; C955-K959 PolarHBondContact O-N 2.82Å; C955-K959 VanDerWaalsContact SG-CE 3.51Å; C955-K959 PolarHBondContact SG-NZ 2.98Å
956	Q	87.6	Confident	86.1	Confident	146 Å²	146	66 Å²	66	68%	0.682	32%	0.316	S	S	*	.	H	α-helix	trans	-63.4	-49.2	-179.5	-174.1	176.8	1	0	0	110.7	E952 A953 W954 D960	E952-Q956 WeakPolarHBondContact O-CB 3.19Å; E952-Q956 PolarHBondContact O-N 3.09Å; A953-Q956 PolarHBondContact O-N 2.9Å; W954-Q956 VanDerWaalsContact C-N 3.34Å; W954-Q956 PolarHBondContact O-N 3.28Å; Q956-D960 WeakPolarHBondContact O-CB 3.4Å; Q956-D960 PolarHBondContact O-N 2.93Å; Q956-D960 VanDerWaalsContact O-N 3.11Å
957	V	90.2	Very high	86.1	Confident	26 Å²	26	68.9 Å²	68.9	16%	0.158	33%	0.327	C	S	.	.	H	α-helix	trans	-68.9	-41.3	179.4	176.7	0	0	0	0	112	A953 N963 I971 K974 V975	A953-V957 PolarHBondContact O-N 3.25Å; V957-N963 VanDerWaalsContact O-CB 3.29Å; V957-N963 WeakPolarHBondContact O-CB 3.42Å; V957-N963 PolarHBondContact O-ND2 3.43Å; V957-I971 HydrophobicContact CG1-CG2 4.27Å; V957-K974 HydrophobicContact CG1-CB 3.96Å; V957-V975 HydrophobicContact CB-CG2 3.62Å; V957-V975 HydrophobicContact CG1-CG2 4Å; V957-V975 HydrophobicContact CG2-CB 4.44Å; V957-V975 HydrophobicContact CG2-CG2 3.59Å
958	S	86.2	Confident	86.1	Confident	35 Å²	35	67.2 Å²	67.2	25%	0.245	32%	0.322	C	S	.	.	H	α-helix	trans	-78.9	-23.1	-178	61.8	0	0	0	0	114.9	W954 C955	W954-S958 VanDerWaalsContact O-CB 3.27Å; W954-S958 WeakPolarHBondContact O-CB 3.49Å; W954-S958 PolarHBondContact O-N 3.09Å; W954-S958 PolarHBondContact O-OG 3.37Å; C955-S958 WeakPolarHBondContact CA-OG 3.38Å; C955-S958 PolarHBondContact O-OG 3.48Å
959	K	85.4	Confident	86	Confident	125 Å²	125	70.8 Å²	70.8	54%	0.543	34%	0.338	S	S	.	.	H	α-helix	trans	-86	-23.3	172	-65	168.2	-170.8	169	0	112.1	C955 I961	C955-K959 HydrophobicContact CB-CD 4.09Å; C955-K959 WeakPolarHBondContact O-CB 3.38Å; C955-K959 WeakPolarHBondContact O-CD 3.26Å; C955-K959 WeakPolarHBondContact O-CG 3.38Å; C955-K959 PolarHBondContact O-N 2.82Å; C955-K959 VanDerWaalsContact SG-CE 3.51Å; C955-K959 PolarHBondContact SG-NZ 2.98Å; K959-I961 PolarHBondContact O-N 3.24Å
960	D	85.7	Confident	86.3	Confident	67 Å²	67	66.7 Å²	66.7	36%	0.358	33%	0.326	S	S	.	.	S	Bend	trans	-61.7	123.3	171.4	-173	14	0	0	0	110.2	Q956 K962 N963	Q956-D960 WeakPolarHBondContact O-CB 3.4Å; Q956-D960 PolarHBondContact O-N 2.93Å; Q956-D960 VanDerWaalsContact O-N 3.11Å; D960-K962 PolarHBondContact O-N 3.4Å; D960-N963 PolarHBondContact O-N 3.32Å
961	I	82.8	Confident	86.4	Confident	14 Å²	14	62.5 Å²	62.5	7%	0.072	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-64.8	-35	-167.1	-51.3	156.5	0	0	0	110.1	W728 C729 Q763 K959 N963 W964	W728-I961 HydrophobicContact CD2-CD1 3.64Å; W728-I961 HydrophobicContact CD2-CG1 4.16Å; W728-I961 HydrophobicContact CE3-CD1 4.32Å; W728-I961 HydrophobicContact CE3-CG1 4.39Å; W728-I961 HydrophobicContact CG-CD1 3.96Å; W728-I961 HydrophobicContact CH2-CD1 4.24Å; W728-I961 HydrophobicContact CH2-CG1 4.43Å; W728-I961 HydrophobicContact CZ2-CD1 3.57Å; W728-I961 HydrophobicContact CZ2-CG1 4.24Å; C729-I961 HydrophobicContact CB-CG2 4.34Å; Q763-I961 VanDerWaalsContact NE2-CD1 3.26Å; K959-I961 PolarHBondContact O-N 3.24Å; I961-N963 PolarHBondContact O-N 3.33Å; I961-W964 VanDerWaalsContact O-CB 3.27Å; I961-W964 WeakPolarHBondContact O-CB 3.49Å; I961-W964 PolarHBondContact O-N 3.11Å
962	K	83.8	Confident	86.7	Confident	182 Å²	182	62 Å²	62	79%	0.791	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-56.2	-24.3	178.8	-63.4	178.2	-178.5	177.3	0	112.7	D960	D960-K962 PolarHBondContact O-N 3.4Å
963	N	85.4	Confident	86.9	Confident	13 Å²	13	60.1 Å²	60.1	7%	0.07	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-99.7	5.3	-179.6	-59.1	-38.6	0	0	0	113.4	V957 D960 I961 K965 L966 K974	V957-N963 VanDerWaalsContact O-CB 3.29Å; V957-N963 WeakPolarHBondContact O-CB 3.42Å; V957-N963 PolarHBondContact O-ND2 3.43Å; D960-N963 PolarHBondContact O-N 3.32Å; I961-N963 PolarHBondContact O-N 3.33Å; N963-K965 PolarHBondContact O-N 3.3Å; N963-K965 VanDerWaalsContact O-N 3.09Å; N963-L966 HydrophobicContact CB-CD1 3.69Å; N963-L966 HydrophobicContact CB-CG 4.21Å; N963-L966 WeakPolarHBondContact O-CB 3.44Å; N963-L966 WeakPolarHBondContact O-CG 3.49Å; N963-L966 PolarHBondContact O-N 2.84Å; N963-L966 WeakPolarHBondContact OD1-CD1 3.38Å; N963-K974 PolarHBondContact OD1-NZ 3.1Å
964	W	79.3	Confident	87	Confident	58 Å²	58	63.3 Å²	63.3	22%	0.22	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-26.9	-170.1	84.7	-102.6	0	0	0	114.3	S695 F700 C729 I961	S695-W964 WeakPolarHBondContact O-CH2 3.35Å; F700-W964 AromaticContact CE1-CH2 3.85Å; F700-W964 HydrophobicContact CE1-CH2 3.85Å; F700-W964 AromaticContact CE1-CZ2 3.84Å; F700-W964 HydrophobicContact CE1-CZ2 3.84Å; F700-W964 HydrophobicContact CZ-CZ2 4.24Å; C729-W964 HydrophobicContact CB-CD2 4.23Å; C729-W964 HydrophobicContact CB-CG 4.24Å; C729-W964 HydrophobicContact CB-CZ2 4.32Å; C729-W964 VanDerWaalsContact SG-CD1 3.55Å; C729-W964 VanDerWaalsContact SG-CG 3.51Å; I961-W964 VanDerWaalsContact O-CB 3.27Å; I961-W964 WeakPolarHBondContact O-CB 3.49Å; I961-W964 PolarHBondContact O-N 3.11Å
965	K	78.4	Confident	87	Confident	124 Å²	124	63.2 Å²	63.2	54%	0.539	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-3.7	178.7	-60.2	-171.5	178.1	-173.9	0	114.3	N963	N963-K965 PolarHBondContact O-N 3.3Å; N963-K965 VanDerWaalsContact O-N 3.09Å
966	L	83.6	Confident	87	Confident	43 Å²	43	62.3 Å²	62.3	23%	0.225	30%	0.297	C	S	.	.			trans	-79.9	141.3	-172.5	-61.5	-176.7	0	0	0	111.7	N963 Q970 I971 K974	N963-L966 HydrophobicContact CB-CD1 3.69Å; N963-L966 HydrophobicContact CB-CG 4.21Å; N963-L966 WeakPolarHBondContact O-CB 3.44Å; N963-L966 WeakPolarHBondContact O-CG 3.49Å; N963-L966 PolarHBondContact O-N 2.84Å; N963-L966 WeakPolarHBondContact OD1-CD1 3.38Å; L966-Q970 HydrophobicContact CB-CB 3.97Å; L966-Q970 HydrophobicContact CD1-CB 4.44Å; L966-Q970 HydrophobicContact CD2-CB 4.27Å; L966-Q970 HydrophobicContact CG-CB 4.45Å; L966-I971 HydrophobicContact CB-CG1 3.95Å; L966-K974 HydrophobicContact CD1-CD 3.62Å; L966-K974 VanDerWaalsContact CD1-CE 3.46Å
967	N	84.9	Confident	87	Confident	94 Å²	94	62.5 Å²	62.5	50%	0.503	30%	0.298	S	S	.	.			trans	-71	161.8	172	-71	-20.7	0	0	0	111.1	E969 Q970 I971	N967-E969 PolarHBondContact O-N 2.98Å; N967-E969 VanDerWaalsContact O-N 3.15Å; N967-Q970 VanDerWaalsContact N-OE1 3.12Å; N967-Q970 PolarHBondContact O-N 2.79Å; N967-I971 WeakPolarHBondContact O-CG1 3.31Å; N967-I971 PolarHBondContact O-N 2.91Å
968	V	87.6	Confident	86.8	Confident	42 Å²	42	64.7 Å²	64.7	26%	0.255	33%	0.326	S	S	.	.	H	α-helix	trans	-52.5	-38	178.7	176.3	0	0	0	0	112.2	W954 I971 L972	W954-V968 HydrophobicContact CH2-CG1 3.96Å; W954-V968 HydrophobicContact CZ2-CG1 4.05Å; V968-I971 PolarHBondContact O-N 3.48Å; V968-L972 WeakPolarHBondContact O-CB 3.32Å; V968-L972 PolarHBondContact O-N 3.09Å
969	E	89	Confident	86.8	Confident	81 Å²	81	63.9 Å²	63.9	38%	0.379	32%	0.318	S	S	.	.	H	α-helix	trans	-64	-45.8	176.5	-59.9	178.3	145.2	0	0	112.6	R940 V944 N967 I971 L972 E973	R940-E969 HydrophobicContact CG-CG 4.05Å; V944-E969 HydrophobicContact CG2-CG 3.32Å; N967-E969 PolarHBondContact O-N 2.98Å; N967-E969 VanDerWaalsContact O-N 3.15Å; E969-I971 VanDerWaalsContact C-N 3.32Å; E969-I971 PolarHBondContact O-N 3.48Å; E969-L972 WeakPolarHBondContact O-CB 3.29Å; E969-L972 PolarHBondContact O-N 2.8Å; E969-E973 WeakPolarHBondContact O-CG 3.34Å; E969-E973 PolarHBondContact O-N 2.64Å
970	Q	89.7	Confident	86.6	Confident	82 Å²	82	62 Å²	62	38%	0.383	32%	0.321	S	S	.	.	H	α-helix	trans	-70.2	-31.1	178.9	-67.5	169.3	-20.6	0	0	111.8	L966 N967 K974	L966-Q970 HydrophobicContact CB-CB 3.97Å; L966-Q970 HydrophobicContact CD1-CB 4.44Å; L966-Q970 HydrophobicContact CD2-CB 4.27Å; L966-Q970 HydrophobicContact CG-CB 4.45Å; N967-Q970 VanDerWaalsContact N-OE1 3.12Å; N967-Q970 PolarHBondContact O-N 2.79Å; Q970-K974 WeakPolarHBondContact O-CG 3.28Å; Q970-K974 PolarHBondContact O-N 3.35Å; Q970-K974 VanDerWaalsContact O-N 3.1Å
971	I	91.3	Very high	86.4	Confident	18 Å²	18	63.1 Å²	63.1	9%	0.092	33%	0.326	C	S	.	.	H	α-helix	trans	-66.6	-46.3	170.2	-64.9	169.5	0	0	0	109.4	W954 V957 L966 N967 V968 E969 E973 K974 V975	W954-I971 HydrophobicContact CD2-CG2 4.03Å; W954-I971 HydrophobicContact CE3-CG2 4.1Å; W954-I971 HydrophobicContact CH2-CB 4.15Å; W954-I971 HydrophobicContact CH2-CG2 3.79Å; W954-I971 HydrophobicContact CZ2-CB 4.24Å; W954-I971 HydrophobicContact CZ2-CG2 3.71Å; W954-I971 HydrophobicContact CZ3-CG2 4Å; V957-I971 HydrophobicContact CG1-CG2 4.27Å; L966-I971 HydrophobicContact CB-CG1 3.95Å; N967-I971 WeakPolarHBondContact O-CG1 3.31Å; N967-I971 PolarHBondContact O-N 2.91Å; V968-I971 PolarHBondContact O-N 3.48Å; E969-I971 VanDerWaalsContact C-N 3.32Å; E969-I971 PolarHBondContact O-N 3.48Å; I971-E973 VanDerWaalsContact C-N 3.34Å; I971-E973 PolarHBondContact O-N 3.31Å; I971-K974 PolarHBondContact O-N 2.93Å; I971-V975 HydrophobicContact CG2-CG2 4.11Å; I971-V975 WeakPolarHBondContact O-CG2 3.2Å; I971-V975 PolarHBondContact O-N 3.22Å
972	L	91.7	Very high	86.2	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-56.9	-45.7	177.2	179	68.3	0	0	0	112	W920 A921 Y924 C943 W954 V968 E969 V975 A976	W920-L972 HydrophobicContact CB-CD1 3.86Å; A921-L972 HydrophobicContact CB-CD1 4.18Å; Y924-L972 HydrophobicContact CD1-CD2 4.26Å; Y924-L972 HydrophobicContact CD1-CG 4.03Å; Y924-L972 HydrophobicContact CD2-CD2 4.4Å; Y924-L972 HydrophobicContact CG-CD2 4.06Å; Y924-L972 HydrophobicContact CG-CG 4.2Å; C943-L972 HydrophobicContact CB-CD2 4.04Å; W954-L972 HydrophobicContact CH2-CB 4.13Å; W954-L972 HydrophobicContact CZ3-CB 3.94Å; W954-L972 HydrophobicContact CZ3-CD1 3.97Å; V968-L972 WeakPolarHBondContact O-CB 3.32Å; V968-L972 PolarHBondContact O-N 3.09Å; E969-L972 WeakPolarHBondContact O-CB 3.29Å; E969-L972 PolarHBondContact O-N 2.8Å; L972-V975 PolarHBondContact O-N 3.1Å; L972-A976 VanDerWaalsContact O-CB 3.22Å; L972-A976 WeakPolarHBondContact O-CB 3.41Å; L972-A976 PolarHBondContact O-N 3.26Å
973	E	91.1	Very high	85.4	Confident	63 Å²	63	60.5 Å²	60.5	29%	0.294	33%	0.327	S	S	.	.	H	α-helix	trans	-61.3	-51.8	176.6	-73.7	166.4	179.4	0	0	111.6	Y924 R940 E969 I971 V975 A976 E977	Y924-E973 HydrophobicContact CE1-CG 3.95Å; R940-E973 IonicContact CZ-OE1 3.72Å; R940-E973 IonicContact NE-OE1 2.73Å; R940-E973 IonicContact NH2-OE1 3.46Å; R940-E973 PolarHBondContact NH2-OE1 3.2Å; E969-E973 WeakPolarHBondContact O-CG 3.34Å; E969-E973 PolarHBondContact O-N 2.64Å; I971-E973 VanDerWaalsContact C-N 3.34Å; I971-E973 PolarHBondContact O-N 3.31Å; E973-V975 VanDerWaalsContact C-N 3.35Å; E973-V975 PolarHBondContact O-N 3.12Å; E973-A976 PolarHBondContact O-N 2.76Å; E973-A976 VanDerWaalsContact O-N 3.15Å; E973-E977 WeakPolarHBondContact O-CG 3.32Å; E973-E977 PolarHBondContact O-N 2.67Å
974	K	91.1	Very high	85.4	Confident	88 Å²	88	62.9 Å²	62.9	38%	0.383	34%	0.34	S	S	.	.	H	α-helix	trans	-62.1	-37.4	178.4	-74.9	-165.1	-178.4	-164.6	0	113.9	V957 N963 L966 Q970 I971 G978	V957-K974 HydrophobicContact CG1-CB 3.96Å; N963-K974 PolarHBondContact OD1-NZ 3.1Å; L966-K974 HydrophobicContact CD1-CD 3.62Å; L966-K974 VanDerWaalsContact CD1-CE 3.46Å; Q970-K974 WeakPolarHBondContact O-CG 3.28Å; Q970-K974 PolarHBondContact O-N 3.35Å; Q970-K974 VanDerWaalsContact O-N 3.1Å; I971-K974 PolarHBondContact O-N 2.93Å; K974-G978 PolarHBondContact O-N 3.03Å; K974-G978 VanDerWaalsContact O-N 3.11Å
975	V	91.2	Very high	85.7	Confident	3 Å²	3	63.2 Å²	63.2	2%	0.018	35%	0.346	C	S	.	.	H	α-helix	trans	-67.2	-47	174	-176.9	0	0	0	0	109.1	A921 A953 W954 V957 I971 L972 E973 E977 G978 L979	A921-V975 HydrophobicContact CB-CB 3.81Å; A921-V975 HydrophobicContact CB-CG1 3.34Å; A953-V975 HydrophobicContact CB-CG1 3.95Å; W954-V975 HydrophobicContact CE3-CG2 4.06Å; V957-V975 HydrophobicContact CB-CG2 3.62Å; V957-V975 HydrophobicContact CG1-CG2 4Å; V957-V975 HydrophobicContact CG2-CB 4.44Å; V957-V975 HydrophobicContact CG2-CG2 3.59Å; I971-V975 HydrophobicContact CG2-CG2 4.11Å; I971-V975 WeakPolarHBondContact O-CG2 3.2Å; I971-V975 PolarHBondContact O-N 3.22Å; L972-V975 PolarHBondContact O-N 3.1Å; E973-V975 VanDerWaalsContact C-N 3.35Å; E973-V975 PolarHBondContact O-N 3.12Å; V975-E977 VanDerWaalsContact C-N 3.29Å; V975-E977 PolarHBondContact O-N 3.5Å; V975-G978 PolarHBondContact O-N 3.5Å; V975-G978 VanDerWaalsContact O-N 3.16Å; V975-L979 HydrophobicContact CG1-CD1 4Å; V975-L979 HydrophobicContact CG1-CG 4.08Å; V975-L979 VanDerWaalsContact O-CG 3.25Å; V975-L979 WeakPolarHBondContact O-CG 3.26Å; V975-L979 PolarHBondContact O-N 3.05Å
976	A	90.5	Very high	86.1	Confident	3 Å²	3	59.8 Å²	59.8	3%	0.025	34%	0.335	C	S	.	.	H	α-helix	trans	-61.8	-33.2	179.3	0	0	0	0	0	113.2	Y924 K925 L972 E973	Y924-A976 HydrophobicContact CD1-CB 3.76Å; Y924-A976 HydrophobicContact CE1-CB 4.49Å; K925-A976 HydrophobicContact CB-CB 4.25Å; K925-A976 VanDerWaalsContact CD-O 3.31Å; K925-A976 WeakPolarHBondContact CD-O 3.47Å; K925-A976 PolarHBondContact NZ-O 3.09Å; L972-A976 VanDerWaalsContact O-CB 3.22Å; L972-A976 WeakPolarHBondContact O-CB 3.41Å; L972-A976 PolarHBondContact O-N 3.26Å; E973-A976 PolarHBondContact O-N 2.76Å; E973-A976 VanDerWaalsContact O-N 3.15Å
977	E	89.1	Confident	86.3	Confident	151 Å²	151	60.8 Å²	60.8	71%	0.706	34%	0.342	S	S	*	.	H	α-helix	trans	-63.9	-54.1	169.4	-74	176.4	171.3	0	0	111.4	K925 E973 V975 L979	K925-E977 PolarHBondContact NZ-O 3.21Å; E973-E977 WeakPolarHBondContact O-CG 3.32Å; E973-E977 PolarHBondContact O-N 2.67Å; V975-E977 VanDerWaalsContact C-N 3.29Å; V975-E977 PolarHBondContact O-N 3.5Å; E977-L979 VanDerWaalsContact C-N 3.31Å; E977-L979 PolarHBondContact O-N 3.07Å
978	G	84.9	Confident	86.4	Confident	71 Å²	71	58.7 Å²	58.7	73%	0.732	33%	0.332	S	S	*	.	H	α-helix	trans	-69	-18.6	-174.6	0	0	0	0	0	115.9	K974 V975	K974-G978 PolarHBondContact O-N 3.03Å; K974-G978 VanDerWaalsContact O-N 3.11Å; V975-G978 PolarHBondContact O-N 3.5Å; V975-G978 VanDerWaalsContact O-N 3.16Å
979	L	86.7	Confident	86.3	Confident	18 Å²	18	59.8 Å²	59.8	9%	0.094	34%	0.337	C	S	.	.	S	Bend	trans	-73.3	137.6	176.9	-73.3	175.6	0	0	0	112.4	A921 Y922 K925 A953 V975 E977	A921-L979 HydrophobicContact CB-CD1 3.65Å; Y922-L979 HydrophobicContact CD1-CD1 4.1Å; Y922-L979 HydrophobicContact CD2-CD1 3.59Å; Y922-L979 HydrophobicContact CD2-CD2 4.42Å; Y922-L979 HydrophobicContact CE1-CB 4.29Å; Y922-L979 HydrophobicContact CE1-CD1 4.15Å; Y922-L979 HydrophobicContact CE1-CD2 4.41Å; Y922-L979 HydrophobicContact CE2-CD1 3.59Å; Y922-L979 HydrophobicContact CE2-CD2 3.57Å; Y922-L979 HydrophobicContact CE2-CG 4.13Å; Y922-L979 HydrophobicContact CG-CD1 3.84Å; K925-L979 HydrophobicContact CD-CB 4.18Å; K925-L979 WeakPolarHBondContact CE-O 3.44Å; K925-L979 PolarHBondContact NZ-O 2.91Å; A953-L979 HydrophobicContact CB-CD2 3.79Å; V975-L979 HydrophobicContact CG1-CD1 4Å; V975-L979 HydrophobicContact CG1-CG 4.08Å; V975-L979 VanDerWaalsContact O-CG 3.25Å; V975-L979 WeakPolarHBondContact O-CG 3.26Å; V975-L979 PolarHBondContact O-N 3.05Å; E977-L979 VanDerWaalsContact C-N 3.31Å; E977-L979 PolarHBondContact O-N 3.07Å
980	S	81.3	Confident	86.1	Confident	85 Å²	85	58.3 Å²	58.3	59%	0.594	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-72.1	145.2	170.8	55.5	0	0	0	0	112.2
981	I	80.9	Confident	85.8	Confident	91 Å²	91	56.5 Å²	56.5	47%	0.467	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-69.4	127.7	167.2	-60.5	173.7	0	0	0	108.2	W894 L929	W894-I981 HydrophobicContact CH2-CG1 4.41Å; W894-I981 HydrophobicContact CH2-CG2 4.23Å; W894-I981 HydrophobicContact CZ2-CG1 4.46Å; W894-I981 HydrophobicContact CZ2-CG2 3.86Å; L929-I981 HydrophobicContact CD1-CD1 3.96Å; L929-I981 HydrophobicContact CD1-CG1 4.32Å
982	P	77.8	Confident	85.4	Confident	18 Å²	18	59.7 Å²	59.7	12%	0.117	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-70	134.8	-179.6	28.7	-33.8	0	0	0	111.6	F861 K891 W894	F861-P982 HydrophobicContact CE1-CB 4.32Å; K891-P982 HydrophobicContact CB-CB 4.19Å; K891-P982 HydrophobicContact CB-CG 4.13Å; K891-P982 HydrophobicContact CG-CG 4.4Å; W894-P982 HydrophobicContact CD2-CG 3.88Å; W894-P982 VanDerWaalsContact CE3-CD 3.46Å; W894-P982 HydrophobicContact CE3-CG 3.4Å; W894-P982 VanDerWaalsContact CE3-CG 3.4Å; W894-P982 HydrophobicContact CG-CG 4.44Å; W894-P982 HydrophobicContact CZ3-CG 3.81Å
983	T	68.4	Low	84.8	Confident	124 Å²	124	65 Å²	65	76%	0.761	38%	0.381	S	S	*	.			trans	-114.5	0	-177.1	48.8	0	0	0	0	113.2	R865 R868	R865-T983 PolarHBondContact NE-OXT 3.35Å; R868-T983 PolarHBondContact NH1-O 3.14Å

Retrieved 983 of 983 residues in 475.2 ms (Link to these results)

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