A0A087XEQ6_POEFO Loading...

Transient receptor potential cation channel subfamily C member 7

AlphaFold DB , UniProt , Accession A0A087XEQ6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 866 aa.

						>A0A087XEQ6_POEFO|A0A087XEQ6
MHRRHTTLREKGRRQAVRGPAYMFNERGSALTAEEERFLDAAEYGNIPVVRKMLEESKTLNFNCVDYMGQNALQLAVGNEHLEVTEQLLKKDGLARIGDGLLLAISKGYVRIVEAILGHPAFGGGLRLALSPLEQEMRDDDFYAYDEDGTRFSHDITPIILAAHCQEYEIVHILLTKGARIERPHDYFCKCSECVEKQKKDSFSHSRSRMNAYKGLASAAYLSLSSEDPVLTALELSNELARLANIETEFKNDYRKLSMQCKDFVVGVLDLCRDTEEVEAILNGDVDQCPPSPYNRPCLSRVKLAIKYEVKKFVAHPNCQQQLLTIWYENLPDLRQQSIVVKCWTVLGVTVGLPFLAIAYWIMPCSKLGQILRSPFMKFVAHAVSFTLFLGLLVVNASDRFEGVKNLPNETITDHPRQVFRVKTTQFSWTEMLIMKWVLGMIWSECKEIWSDGPREYIMHLWNVLDFGMLSIFVASFTARLMAFLKASKAQQYVDMHVPDEDLSNASLPDEVAYFTYARNKWRPSDPQIISEGLYAIAVVLSFSRIAYILPANESFGPLQISLGRTVKDIFKFMVIFIMVFVAFMIGMFNLYSYYLGAKYNPAFTTVEESFKTLFWSIFGLSEVISVVLKYDHKFIENIGYVLYGVYNVTMVVVLLNMLIAMINSSYQEIEEDSDVEWKFARAKLWLSYFDEGRTLPAPFNLVPSPKSFYYLVLRIKSCLILLCKANGRRRNNEVEMGMLHTQAKEICQDLVDGYMPLSSLQLEKSQFDERFRSYARSGEEFIQRKARKHPTRYQKIMKRLIKRYVLKAQVDKESDEVNEGELKEIKQDISSLRYELLEEKSQAAGELALLIQQLGDKFGKNTMRH
					

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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	35.9	Very low	29.5	Very low	245 Å²	245	199.2 Å²	199.2	100%	1.207	92%	0.916	S	S	*	*				0	101.6	0	-83.9	178.8	165.1	0	0	108.6
2	H	28.7	Very low	29.5	Very low	192 Å²	192	187.8 Å²	187.8	89%	0.889	89%	0.893	S	S	*	*			trans	-113.7	123.1	-176.9	-98.5	7.2	0	0	0	110.2
3	R	30.3	Very low	29.7	Very low	250 Å²	250	192.3 Å²	192.3	94%	0.943	90%	0.896	S	S	*	*			trans	-77.7	115.6	174.7	-146.5	177.7	-167.4	-179.6	2.7	107.2
4	R	29.2	Very low	29.7	Very low	238 Å²	238	196.1 Å²	196.1	90%	0.898	90%	0.898	S	S	*	*			trans	-96.5	124.4	174.2	-89	-176.2	179.1	173.3	0.3	110.2
5	H	27.4	Very low	29.8	Very low	185 Å²	185	194.9 Å²	194.9	86%	0.856	89%	0.894	S	S	*	*			trans	-58.3	130.3	164.6	-80.7	-99.7	0	0	0	110.6
6	T	29.7	Very low	29.8	Very low	140 Å²	140	187.9 Å²	187.9	86%	0.859	88%	0.881	S	S	*	*			trans	-96.9	115.2	164.1	44.4	0	0	0	0	108.5
7	T	28.9	Very low	29.9	Very low	134 Å²	134	185 Å²	185	82%	0.822	88%	0.878	S	S	*	*			trans	-72.5	138.1	173.9	40.8	0	0	0	0	110.9	R9	T7-R9 PolarHBondContact O-N 3.28Å
8	L	28.3	Very low	30.6	Very low	179 Å²	179	185.5 Å²	185.5	94%	0.937	87%	0.87	S	S	*	*			trans	-62.9	124.1	169.7	-82.8	152.1	0	0	0	109.5
9	R	27.2	Very low	30.6	Very low	230 Å²	230	178.9 Å²	178.9	87%	0.868	86%	0.857	S	S	*	*			trans	-88.4	112.8	170.8	-177.9	176.3	174.3	-179.2	-0.3	108.3	T7 K11	T7-R9 PolarHBondContact O-N 3.28Å; R9-K11 PolarHBondContact O-N 3.13Å
10	E	28.5	Very low	30.9	Very low	188 Å²	188	175 Å²	175	88%	0.879	85%	0.847	S	S	*	*			trans	-56.3	119.3	166.6	-76.7	179.6	145.4	0	0	109.6	G12	E10-G12 PolarHBondContact O-N 3.02Å
11	K	30.5	Very low	31.2	Very low	210 Å²	210	170.6 Å²	170.6	91%	0.913	84%	0.839	S	S	*	*			trans	-80.8	95.2	167.2	-82.3	-177.9	177.3	176.9	0	107.7	R9	R9-K11 PolarHBondContact O-N 3.13Å
12	G	29.3	Very low	31.4	Very low	63 Å²	63	168.6 Å²	168.6	65%	0.649	82%	0.82	S	S	*	*			trans	-54.3	136.9	167.5	0	0	0	0	0	111.4	E10 R14	E10-G12 PolarHBondContact O-N 3.02Å; G12-R14 PolarHBondContact O-N 3.38Å
13	R	32.6	Very low	32.1	Very low	246 Å²	246	167.7 Å²	167.7	93%	0.928	82%	0.818	S	S	*	*			trans	-48.4	118.9	165.1	-83.1	174.9	168.7	167	-4.9	108.3	Q15	R13-Q15 VanDerWaalsContact C-N 3.34Å; R13-Q15 PolarHBondContact O-N 3.17Å
14	R	29.8	Very low	33.1	Very low	245 Å²	245	165.1 Å²	165.1	93%	0.925	81%	0.814	S	S	*	*			trans	-70.5	96.7	164.5	-74.1	-178.9	175.6	-179.4	-2.7	107.1	G12 A16	G12-R14 PolarHBondContact O-N 3.38Å; R14-A16 PolarHBondContact O-N 2.86Å
15	Q	31.3	Very low	34.1	Very low	178 Å²	178	158.8 Å²	158.8	83%	0.832	80%	0.798	S	S	*	*			trans	-62.4	109.8	152	-90.9	173.5	-24.3	0	0	106	R13 V17	R13-Q15 VanDerWaalsContact C-N 3.34Å; R13-Q15 PolarHBondContact O-N 3.17Å; Q15-V17 VanDerWaalsContact C-N 3.32Å; Q15-V17 PolarHBondContact O-N 3.43Å
16	A	29.3	Very low	34.9	Very low	83 Å²	83	159.5 Å²	159.5	69%	0.686	80%	0.802	S	S	*	*			trans	-68.6	97.9	167.3	0	0	0	0	0	106.8	R14 R18	R14-A16 PolarHBondContact O-N 2.86Å; A16-R18 VanDerWaalsContact C-N 3.29Å; A16-R18 PolarHBondContact O-N 3.11Å
17	V	32	Very low	35.8	Very low	139 Å²	139	164.3 Å²	164.3	84%	0.842	80%	0.804	S	S	*	*			trans	-64.2	96.9	165.1	179.9	0	0	0	0	106.2	Q15	Q15-V17 VanDerWaalsContact C-N 3.32Å; Q15-V17 PolarHBondContact O-N 3.43Å
18	R	41.5	Very low	36.9	Very low	194 Å²	194	160.8 Å²	160.8	73%	0.732	79%	0.794	S	S	*	*			trans	-75.8	119	169	-72.5	179.5	177.3	168.1	-1.1	107.5	A16	A16-R18 VanDerWaalsContact C-N 3.29Å; A16-R18 PolarHBondContact O-N 3.11Å
19	G	31.1	Very low	38.4	Very low	60 Å²	60	157.7 Å²	157.7	62%	0.619	79%	0.788	S	S	*	*			trans	-124.2	171.7	155.9	0	0	0	0	0	108.7
20	P	37.5	Very low	40.3	Very low	100 Å²	100	151.4 Å²	151.4	65%	0.649	79%	0.785	S	S	*	*			cis	-106.9	107.1	-24.6	28.1	-9.8	0	0	0	109.9	Y22	P20-Y22 HydrophobicContact CB-CD2 3.41Å; P20-Y22 VanDerWaalsContact CB-CD2 3.41Å; P20-Y22 HydrophobicContact CB-CE2 3.12Å; P20-Y22 HydrophobicContact CB-CG 4.47Å; P20-Y22 PolarHBondContact O-N 2.81Å; P20-Y22 VanDerWaalsContact O-N 3.12Å
21	A	35.6	Very low	42.6	Very low	84 Å²	84	145.5 Å²	145.5	69%	0.694	76%	0.759	S	S	*	*			trans	-85.5	46.4	-179.8	0	0	0	0	0	112.8
22	Y	41.6	Very low	45.3	Very low	203 Å²	203	138.9 Å²	138.9	80%	0.796	74%	0.737	S	S	*	*			trans	-103.5	0.8	-174.2	-36.7	-64.5	0	0	0	114.5	P20	P20-Y22 HydrophobicContact CB-CD2 3.41Å; P20-Y22 VanDerWaalsContact CB-CD2 3.41Å; P20-Y22 HydrophobicContact CB-CE2 3.12Å; P20-Y22 HydrophobicContact CB-CG 4.47Å; P20-Y22 PolarHBondContact O-N 2.81Å; P20-Y22 VanDerWaalsContact O-N 3.12Å
23	M	42.5	Very low	47.9	Very low	173 Å²	173	139.8 Å²	139.8	85%	0.852	74%	0.738	S	S	*	*	S	Bend	trans	-98.4	-7.8	-171.3	-97.4	-175.5	177	0	0	116
24	F	52.3	Low	50.4	Low	196 Å²	196	132.7 Å²	132.7	86%	0.86	72%	0.715	S	S	*	*	S	Bend	trans	-133.1	-7.6	-175.5	-64.8	-73.7	0	0	0	116.1	E26	F24-E26 PolarHBondContact O-N 2.77Å
25	N	49.8	Very low	53.2	Low	105 Å²	105	122.2 Å²	122.2	56%	0.561	68%	0.677	S	S	*	*			trans	-98.3	95.4	-177.5	-82.2	10.5	0	0	0	112.1	R27	N25-R27 PolarHBondContact O-N 3.45Å
26	E	44.4	Very low	55.8	Low	200 Å²	200	119.1 Å²	119.1	94%	0.935	66%	0.662	S	S	*	*	S	Bend	trans	-71.8	81.1	148.5	-75.3	-159	156.7	0	0	108.5	F24	F24-E26 PolarHBondContact O-N 2.77Å
27	R	46.9	Very low	58.7	Low	240 Å²	240	122.9 Å²	122.9	91%	0.906	66%	0.659	S	S	*	*			trans	39.5	80.9	161.8	-62.2	-176.3	-178	-176	1.6	117.9	N25	N25-R27 PolarHBondContact O-N 3.45Å
28	G	53.5	Low	61.5	Low	60 Å²	60	116.3 Å²	116.3	62%	0.619	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-67.7	149.3	140.8	0	0	0	0	0	110.6	A30	G28-A30 PolarHBondContact O-N 3.13Å
29	S	59.4	Low	63.8	Low	115 Å²	115	107.4 Å²	107.4	80%	0.804	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-56	131.4	171.5	49.9	0	0	0	0	110.2	L31	S29-L31 PolarHBondContact O-N 3.39Å; S29-L31 VanDerWaalsContact O-N 3.1Å
30	A	66.2	Low	66.5	Low	97 Å²	97	108.1 Å²	108.1	80%	0.802	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-57.2	119.4	176.9	0	0	0	0	0	109.7	G28 T32	G28-A30 PolarHBondContact O-N 3.13Å; A30-T32 PolarHBondContact O-N 2.82Å
31	L	78.4	Confident	69	Low	65 Å²	65	103.7 Å²	103.7	34%	0.34	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-51.8	132.9	176.5	-77.3	146.9	0	0	0	109.9	S29 E35 L39 C64 V65	S29-L31 PolarHBondContact O-N 3.39Å; S29-L31 VanDerWaalsContact O-N 3.1Å; L31-E35 HydrophobicContact CD2-CB 3.71Å; L31-L39 HydrophobicContact CD1-CD1 4.41Å; L31-L39 HydrophobicContact CD2-CD1 3.71Å; L31-C64 HydrophobicContact CD2-CB 4.07Å; L31-V65 WeakPolarHBondContact CD1-O 3.48Å; L31-V65 WeakPolarHBondContact CD2-O 3.46Å
32	T	85.4	Confident	71.6	Confident	71 Å²	71	99.7 Å²	99.7	44%	0.436	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-68.7	153.7	168.5	60.5	0	0	0	0	109.8	A30 E34 E35 E36	A30-T32 PolarHBondContact O-N 2.82Å; T32-E34 PolarHBondContact O-N 3.35Å; T32-E34 VanDerWaalsContact O-N 3.12Å; T32-E35 WeakPolarHBondContact CB-OE2 3.43Å; T32-E35 PolarHBondContact N-OE2 2.8Å; T32-E35 PolarHBondContact O-N 3.49Å; T32-E35 WeakPolarHBondContact OG1-CB 3.46Å; T32-E35 WeakPolarHBondContact OG1-CG 3.16Å; T32-E35 PolarHBondContact OG1-N 3.43Å; T32-E35 PolarHBondContact OG1-OE2 2.85Å; T32-E36 PolarHBondContact O-N 3.31Å
33	A	83.9	Confident	73.7	Confident	82 Å²	82	93.2 Å²	93.2	68%	0.678	49%	0.491	S	S	*	.	H	α-helix	trans	-60.8	-23	176.8	0	0	0	0	0	112.8	R37	A33-R37 VanDerWaalsContact O-CB 3.31Å; A33-R37 WeakPolarHBondContact O-CB 3.42Å; A33-R37 PolarHBondContact O-N 2.85Å
34	E	86.8	Confident	75.9	Confident	96 Å²	96	89.8 Å²	89.8	45%	0.449	47%	0.469	S	S	.	.	H	α-helix	trans	-72.2	-43.9	171.7	-66.3	-173.9	168.7	0	0	111.6	T32 R37 F38 M53 T59	T32-E34 PolarHBondContact O-N 3.35Å; T32-E34 VanDerWaalsContact O-N 3.12Å; E34-R37 PolarHBondContact O-N 3.39Å; E34-F38 WeakPolarHBondContact O-CB 3.37Å; E34-F38 PolarHBondContact O-N 2.8Å; E34-M53 VanDerWaalsContact O-CE 3.23Å; E34-M53 WeakPolarHBondContact O-CE 3.45Å; E34-T59 PolarHBondContact OE2-OG1 2.85Å; E34-T59 VanDerWaalsContact OE2-OG1 3.08Å
35	E	87.1	Confident	77.5	Confident	25 Å²	25	80.5 Å²	80.5	12%	0.117	43%	0.428	C	S	.	.	H	α-helix	trans	-68	-40.2	176.9	-70.6	160.5	155.6	0	0	112.5	L31 T32 R37 F38 L39 L60 N61 C64	L31-E35 HydrophobicContact CD2-CB 3.71Å; T32-E35 WeakPolarHBondContact CB-OE2 3.43Å; T32-E35 PolarHBondContact N-OE2 2.8Å; T32-E35 PolarHBondContact O-N 3.49Å; T32-E35 WeakPolarHBondContact OG1-CB 3.46Å; T32-E35 WeakPolarHBondContact OG1-CG 3.16Å; T32-E35 PolarHBondContact OG1-N 3.43Å; T32-E35 PolarHBondContact OG1-OE2 2.85Å; E35-R37 VanDerWaalsContact C-N 3.33Å; E35-R37 PolarHBondContact O-N 3.42Å; E35-F38 WeakPolarHBondContact O-CB 3.37Å; E35-F38 PolarHBondContact O-N 3.22Å; E35-F38 VanDerWaalsContact O-N 3.17Å; E35-L39 WeakPolarHBondContact O-CG 3.49Å; E35-L39 PolarHBondContact O-N 3.12Å; E35-L60 HydrophobicContact CG-CD1 3.92Å; E35-N61 WeakPolarHBondContact OE1-CB 3.41Å; E35-C64 HydrophobicContact CB-CB 4.14Å; E35-C64 HydrophobicContact CG-CB 4.01Å
36	E	87.8	Confident	79.3	Confident	113 Å²	113	76.6 Å²	76.6	53%	0.528	41%	0.408	S	S	.	.	H	α-helix	trans	-60.5	-45.1	174.6	-174	-180	-168.4	0	0	110.7	T32 F38 L39 D40	T32-E36 PolarHBondContact O-N 3.31Å; E36-F38 VanDerWaalsContact C-N 3.28Å; E36-F38 PolarHBondContact O-N 3.06Å; E36-L39 PolarHBondContact O-N 3.08Å; E36-D40 WeakPolarHBondContact O-CB 3.27Å; E36-D40 PolarHBondContact O-N 2.98Å
37	R	88.8	Confident	81.4	Confident	163 Å²	163	67.6 Å²	67.6	62%	0.615	37%	0.366	S	S	*	.	H	α-helix	trans	-64.5	-33.4	176.1	-172.9	177.8	-178.3	-170.7	-0.9	112.5	A33 E34 E35 A41	A33-R37 VanDerWaalsContact O-CB 3.31Å; A33-R37 WeakPolarHBondContact O-CB 3.42Å; A33-R37 PolarHBondContact O-N 2.85Å; E34-R37 PolarHBondContact O-N 3.39Å; E35-R37 VanDerWaalsContact C-N 3.33Å; E35-R37 PolarHBondContact O-N 3.42Å; R37-A41 VanDerWaalsContact O-CB 3.25Å; R37-A41 WeakPolarHBondContact O-CB 3.32Å; R37-A41 PolarHBondContact O-N 3.04Å
38	F	90.6	Very high	83.2	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-68.5	-46.9	176	175.9	-109.8	0	0	0	111.7	E34 E35 E36 A41 A42 V50 M53 L54 L60 A72 L88	E34-F38 WeakPolarHBondContact O-CB 3.37Å; E34-F38 PolarHBondContact O-N 2.8Å; E35-F38 WeakPolarHBondContact O-CB 3.37Å; E35-F38 PolarHBondContact O-N 3.22Å; E35-F38 VanDerWaalsContact O-N 3.17Å; E36-F38 VanDerWaalsContact C-N 3.28Å; E36-F38 PolarHBondContact O-N 3.06Å; F38-A41 PolarHBondContact O-N 3.45Å; F38-A42 PolarHBondContact O-N 3.27Å; F38-V50 HydrophobicContact CE2-CG1 4.03Å; F38-M53 HydrophobicContact CB-CE 3.74Å; F38-M53 HydrophobicContact CB-SD 4.4Å; F38-M53 HydrophobicContact CD2-CB 4.27Å; F38-L54 HydrophobicContact CE2-CD1 3.42Å; F38-L54 VanDerWaalsContact CE2-CD1 3.42Å; F38-L54 HydrophobicContact CZ-CD1 3.61Å; F38-L60 HydrophobicContact CB-CD1 4Å; F38-L60 HydrophobicContact CD1-CD1 4.32Å; F38-L60 HydrophobicContact CD1-CD2 4.46Å; F38-L60 HydrophobicContact CD2-CD2 3.83Å; F38-L60 HydrophobicContact CE2-CD2 4.09Å; F38-L60 HydrophobicContact CG-CD1 4.11Å; F38-L60 HydrophobicContact CG-CD2 4.02Å; F38-A72 HydrophobicContact CD1-CB 4.31Å; F38-A72 HydrophobicContact CE1-CB 3.52Å; F38-A72 HydrophobicContact CZ-CB 4.06Å; F38-L88 HydrophobicContact CZ-CD2 3.87Å
39	L	89.4	Confident	84.9	Confident	8 Å²	8	56.3 Å²	56.3	4%	0.042	31%	0.312	C	S	.	.	H	α-helix	trans	-63.4	-44.4	177.3	-69.1	174.2	0	0	0	111.5	L31 E35 E36 A41 A42 E43 D66 A72 L75	L31-L39 HydrophobicContact CD1-CD1 4.41Å; L31-L39 HydrophobicContact CD2-CD1 3.71Å; E35-L39 WeakPolarHBondContact O-CG 3.49Å; E35-L39 PolarHBondContact O-N 3.12Å; E36-L39 PolarHBondContact O-N 3.08Å; L39-A41 VanDerWaalsContact C-N 3.31Å; L39-A41 PolarHBondContact O-N 2.89Å; L39-A42 PolarHBondContact O-N 2.94Å; L39-E43 WeakPolarHBondContact O-CB 3.27Å; L39-E43 PolarHBondContact O-N 3.04Å; L39-D66 HydrophobicContact CD1-CB 4.22Å; L39-A72 HydrophobicContact CD2-CB 4.03Å; L39-L75 HydrophobicContact CB-CD1 4.33Å; L39-L75 HydrophobicContact CD2-CD1 3.93Å
40	D	89.3	Confident	86.3	Confident	74 Å²	74	50.9 Å²	50.9	40%	0.396	27%	0.274	S	S	.	.	H	α-helix	trans	-58.2	-44.6	173	-82.9	-6.4	0	0	0	111.1	E36 A42 E43 Y44	E36-D40 WeakPolarHBondContact O-CB 3.27Å; E36-D40 PolarHBondContact O-N 2.98Å; D40-A42 VanDerWaalsContact C-N 3.31Å; D40-A42 PolarHBondContact O-N 3.14Å; D40-E43 PolarHBondContact O-N 2.82Å; D40-Y44 WeakPolarHBondContact O-CD2 3.28Å; D40-Y44 PolarHBondContact O-N 2.89Å
41	A	89.3	Confident	87.3	Confident	7 Å²	7	51.1 Å²	51.1	6%	0.058	25%	0.254	C	S	.	.	H	α-helix	trans	-63.4	-37.6	178.8	0	0	0	0	0	112	R37 F38 L39 G45 N46 V49 V50	R37-A41 VanDerWaalsContact O-CB 3.25Å; R37-A41 WeakPolarHBondContact O-CB 3.32Å; R37-A41 PolarHBondContact O-N 3.04Å; F38-A41 PolarHBondContact O-N 3.45Å; L39-A41 VanDerWaalsContact C-N 3.31Å; L39-A41 PolarHBondContact O-N 2.89Å; A41-G45 PolarHBondContact O-N 3.33Å; A41-N46 HydrophobicContact CB-CB 4.19Å; A41-N46 PolarHBondContact O-N 2.94Å; A41-V49 HydrophobicContact CB-CB 4.22Å; A41-V49 HydrophobicContact CB-CG1 3.79Å; A41-V50 HydrophobicContact CB-CG2 3.8Å
42	A	89.3	Confident	87.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-70.3	-40.6	175	0	0	0	0	0	112.5	F38 L39 D40 G45 V50 A72 H81 V84	F38-A42 PolarHBondContact O-N 3.27Å; L39-A42 PolarHBondContact O-N 2.94Å; D40-A42 VanDerWaalsContact C-N 3.31Å; D40-A42 PolarHBondContact O-N 3.14Å; A42-G45 PolarHBondContact O-N 3.27Å; A42-V50 HydrophobicContact CB-CG2 4.45Å; A42-A72 HydrophobicContact CB-CB 4.13Å; A42-H81 PolarHBondContact O-CD2 3.43Å; A42-V84 HydrophobicContact CB-CG1 4.41Å
43	E	87.4	Confident	87.9	Confident	67 Å²	67	51.2 Å²	51.2	31%	0.313	25%	0.247	S	C	.	.	H	α-helix	trans	-64.2	-43	179.4	-171.2	-174.2	169.8	0	0	112	L39 D40 N79 H81	L39-E43 WeakPolarHBondContact O-CB 3.27Å; L39-E43 PolarHBondContact O-N 3.04Å; D40-E43 PolarHBondContact O-N 2.82Å; E43-N79 WeakPolarHBondContact CG-ND2 3.46Å; E43-N79 PolarHBondContact O-ND2 3.39Å; E43-H81 PolarHBondContact O-CD2 2.88Å; E43-H81 PolarHBondContact O-NE2 3.46Å
44	Y	86.8	Confident	88.1	Confident	102 Å²	102	48.4 Å²	48.4	40%	0.4	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	1.4	-178.9	-69.7	-70.5	0	0	0	114.5	D40	D40-Y44 WeakPolarHBondContact O-CD2 3.28Å; D40-Y44 PolarHBondContact O-N 2.89Å
45	G	86.2	Confident	88	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.9	27.5	177	0	0	0	0	0	114.5	A41 A42 I47 H81 S832	A41-G45 PolarHBondContact O-N 3.33Å; A42-G45 PolarHBondContact O-N 3.27Å; G45-I47 VanDerWaalsContact C-N 3.3Å; G45-I47 PolarHBondContact O-N 3.03Å; G45-H81 VanDerWaalsContact CA-CE1 3.45Å; G45-H81 WeakPolarHBondContact CA-CE1 3.17Å; G45-H81 WeakPolarHBondContact CA-ND1 3.28Å; G45-H81 PolarHBondContact N-NE2 3.34Å; G45-S832 PolarHBondContact O-OG 3.44Å
46	N	89.3	Confident	87.9	Confident	24 Å²	24	55.2 Å²	55.2	13%	0.128	25%	0.252	C	S	.	.			trans	-80.5	76.5	179.9	-168.9	-15	0	0	0	111.6	A41 P48 V49 V50 Y835	A41-N46 HydrophobicContact CB-CB 4.19Å; A41-N46 PolarHBondContact O-N 2.94Å; N46-P48 VanDerWaalsContact OD1-CD 3.3Å; N46-P48 WeakPolarHBondContact OD1-CD 3.22Å; N46-P48 WeakPolarHBondContact OD1-CG 3.34Å; N46-V49 HydrophobicContact CB-CB 4.39Å; N46-V49 VanDerWaalsContact ND2-CG2 3.29Å; N46-V49 WeakPolarHBondContact ND2-CG2 3.41Å; N46-V49 PolarHBondContact O-N 3.01Å; N46-V49 WeakPolarHBondContact OD1-CG2 3.39Å; N46-V50 WeakPolarHBondContact O-CG2 3.47Å; N46-V50 PolarHBondContact O-N 3.49Å; N46-Y835 HydrophobicContact CB-CD2 4.12Å; N46-Y835 HydrophobicContact CB-CE2 4.41Å; N46-Y835 HydrophobicContact CB-CG 4.19Å
47	I	87.2	Confident	87.5	Confident	10 Å²	10	51.9 Å²	51.9	5%	0.051	24%	0.241	C	C	.	.	H	α-helix	trans	-49.4	-49.1	-177.2	-58.2	142	0	0	0	114.1	G45 V49 V50 R51 E83 V84	G45-I47 VanDerWaalsContact C-N 3.3Å; G45-I47 PolarHBondContact O-N 3.03Å; I47-V49 PolarHBondContact O-N 3.22Å; I47-V50 PolarHBondContact O-N 3.4Å; I47-R51 WeakPolarHBondContact O-CB 3.38Å; I47-R51 PolarHBondContact O-N 2.98Å; I47-E83 HydrophobicContact CD1-CB 3.97Å; I47-E83 WeakPolarHBondContact CD1-OE2 3.42Å; I47-E83 HydrophobicContact CG1-CB 4.04Å; I47-V84 HydrophobicContact CG1-CG2 3.68Å
48	P	85.6	Confident	86.9	Confident	31 Å²	31	54.2 Å²	54.2	20%	0.201	26%	0.255	C	S	.	.	H	α-helix	trans	-67.7	-36.8	-175.8	25.5	-34.2	0	0	0	112.2	N46 K52 E839	N46-P48 VanDerWaalsContact OD1-CD 3.3Å; N46-P48 WeakPolarHBondContact OD1-CD 3.22Å; N46-P48 WeakPolarHBondContact OD1-CG 3.34Å; P48-K52 WeakPolarHBondContact O-CB 3.37Å; P48-K52 PolarHBondContact O-N 3.06Å; P48-E839 HydrophobicContact CB-CB 4.37Å; P48-E839 HydrophobicContact CB-CG 3.81Å; P48-E839 HydrophobicContact CG-CB 4.03Å; P48-E839 HydrophobicContact CG-CG 4.04Å
49	V	87.8	Confident	86.4	Confident	33 Å²	33	59.4 Å²	59.4	20%	0.2	29%	0.288	C	S	.	.	H	α-helix	trans	-67.1	-45.5	175.8	173.9	0	0	0	0	110.5	A41 N46 I47 R51 K52 M53	A41-V49 HydrophobicContact CB-CB 4.22Å; A41-V49 HydrophobicContact CB-CG1 3.79Å; N46-V49 HydrophobicContact CB-CB 4.39Å; N46-V49 VanDerWaalsContact ND2-CG2 3.29Å; N46-V49 WeakPolarHBondContact ND2-CG2 3.41Å; N46-V49 PolarHBondContact O-N 3.01Å; N46-V49 WeakPolarHBondContact OD1-CG2 3.39Å; I47-V49 PolarHBondContact O-N 3.22Å; V49-R51 PolarHBondContact O-N 2.78Å; V49-K52 PolarHBondContact O-N 3.04Å; V49-M53 HydrophobicContact CG1-CG 4.3Å; V49-M53 HydrophobicContact CG1-SD 3.61Å; V49-M53 WeakPolarHBondContact O-CB 3.48Å; V49-M53 WeakPolarHBondContact O-CG 3.18Å; V49-M53 PolarHBondContact O-N 2.88Å
50	V	88.9	Confident	86.2	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-59.3	-49.6	176.9	172.5	0	0	0	0	110.7	F38 A41 A42 N46 I47 K52 M53 L54 V84 L88	F38-V50 HydrophobicContact CE2-CG1 4.03Å; A41-V50 HydrophobicContact CB-CG2 3.8Å; A42-V50 HydrophobicContact CB-CG2 4.45Å; N46-V50 WeakPolarHBondContact O-CG2 3.47Å; N46-V50 PolarHBondContact O-N 3.49Å; I47-V50 PolarHBondContact O-N 3.4Å; V50-K52 PolarHBondContact O-N 3.15Å; V50-M53 PolarHBondContact O-N 3.15Å; V50-L54 HydrophobicContact CG1-CD1 4.28Å; V50-L54 WeakPolarHBondContact O-CB 3.36Å; V50-L54 PolarHBondContact O-N 3.42Å; V50-V84 HydrophobicContact CG1-CG1 4.28Å; V50-V84 HydrophobicContact CG2-CG1 4.39Å; V50-L88 HydrophobicContact CG1-CD2 4.36Å
51	R	88.8	Confident	85.9	Confident	101 Å²	101	60.3 Å²	60.3	38%	0.381	29%	0.292	S	S	.	.	H	α-helix	trans	-59.1	-49.2	179.2	-174.2	-170.6	-54.6	-126.6	7	111.5	I47 V49 M53 L54 E55 Q87	I47-R51 WeakPolarHBondContact O-CB 3.38Å; I47-R51 PolarHBondContact O-N 2.98Å; V49-R51 PolarHBondContact O-N 2.78Å; R51-M53 VanDerWaalsContact C-N 3.34Å; R51-M53 PolarHBondContact O-N 3.21Å; R51-L54 PolarHBondContact O-N 3.38Å; R51-E55 WeakPolarHBondContact CG-OE1 3.28Å; R51-E55 WeakPolarHBondContact O-CG 3.28Å; R51-E55 PolarHBondContact O-N 3.28Å; R51-Q87 VanDerWaalsContact NH2-NE2 3.16Å
52	K	87.8	Confident	85.6	Confident	117 Å²	117	63 Å²	63	51%	0.509	30%	0.303	S	S	.	.	H	α-helix	trans	-59.5	-45.2	179.5	-172.1	173.8	-175.9	169.7	0	111.5	P48 V49 V50 L54 E55 E56	P48-K52 WeakPolarHBondContact O-CB 3.37Å; P48-K52 PolarHBondContact O-N 3.06Å; V49-K52 PolarHBondContact O-N 3.04Å; V50-K52 PolarHBondContact O-N 3.15Å; K52-L54 VanDerWaalsContact C-N 3.35Å; K52-L54 PolarHBondContact O-N 3.23Å; K52-E55 PolarHBondContact O-N 3.33Å; K52-E56 VanDerWaalsContact CE-OE1 3.22Å; K52-E56 WeakPolarHBondContact CE-OE1 3.31Å; K52-E56 WeakPolarHBondContact CE-OE2 3.26Å; K52-E56 HydrophobicContact CG-CG 4.15Å; K52-E56 WeakPolarHBondContact CG-OE2 3.22Å; K52-E56 VanDerWaalsContact O-CB 3.28Å; K52-E56 WeakPolarHBondContact O-CB 3.36Å; K52-E56 WeakPolarHBondContact O-CG 3.45Å; K52-E56 PolarHBondContact O-N 2.99Å
53	M	87.8	Confident	85.3	Confident	22 Å²	22	65 Å²	65	11%	0.108	31%	0.314	C	S	.	.	H	α-helix	trans	-67.8	-33.5	178.1	-68.6	179	74.7	0	0	112.5	E34 F38 V49 V50 R51 S57 L60	E34-M53 VanDerWaalsContact O-CE 3.23Å; E34-M53 WeakPolarHBondContact O-CE 3.45Å; F38-M53 HydrophobicContact CB-CE 3.74Å; F38-M53 HydrophobicContact CB-SD 4.4Å; F38-M53 HydrophobicContact CD2-CB 4.27Å; V49-M53 HydrophobicContact CG1-CG 4.3Å; V49-M53 HydrophobicContact CG1-SD 3.61Å; V49-M53 WeakPolarHBondContact O-CB 3.48Å; V49-M53 WeakPolarHBondContact O-CG 3.18Å; V49-M53 PolarHBondContact O-N 2.88Å; V50-M53 PolarHBondContact O-N 3.15Å; R51-M53 VanDerWaalsContact C-N 3.34Å; R51-M53 PolarHBondContact O-N 3.21Å; M53-S57 WeakPolarHBondContact O-CB 3.44Å; M53-S57 PolarHBondContact O-N 3.07Å; M53-S57 PolarHBondContact O-OG 3.4Å; M53-L60 HydrophobicContact CB-CD2 4.18Å
54	L	87.5	Confident	85.2	Confident	22 Å²	22	62.1 Å²	62.1	12%	0.115	30%	0.301	C	S	.	.	H	α-helix	trans	-69.6	-30	174.9	-117.9	78.5	0	0	0	113.6	F38 V50 R51 K52 L88 K91	F38-L54 HydrophobicContact CE2-CD1 3.42Å; F38-L54 VanDerWaalsContact CE2-CD1 3.42Å; F38-L54 HydrophobicContact CZ-CD1 3.61Å; V50-L54 HydrophobicContact CG1-CD1 4.28Å; V50-L54 WeakPolarHBondContact O-CB 3.36Å; V50-L54 PolarHBondContact O-N 3.42Å; R51-L54 PolarHBondContact O-N 3.38Å; K52-L54 VanDerWaalsContact C-N 3.35Å; K52-L54 PolarHBondContact O-N 3.23Å; L54-L88 HydrophobicContact CD1-CD2 3.97Å; L54-K91 HydrophobicContact CD2-CD 4.11Å; L54-K91 HydrophobicContact CD2-CG 3.34Å; L54-K91 HydrophobicContact CG-CG 4.02Å; L54-K91 VanDerWaalsContact O-CE 3.26Å; L54-K91 WeakPolarHBondContact O-CE 3.39Å; L54-K91 PolarHBondContact O-NZ 3.12Å
55	E	86.2	Confident	85.1	Confident	134 Å²	134	59.8 Å²	59.8	63%	0.626	30%	0.297	S	S	*	.	H	α-helix	trans	-94.3	-39	-175.8	-70.8	174.4	-171.7	0	0	112.7	R51 K52	R51-E55 WeakPolarHBondContact CG-OE1 3.28Å; R51-E55 WeakPolarHBondContact O-CG 3.28Å; R51-E55 PolarHBondContact O-N 3.28Å; K52-E55 PolarHBondContact O-N 3.33Å
56	E	84.8	Confident	85	Confident	130 Å²	130	61 Å²	61	61%	0.607	30%	0.303	S	S	*	.	H	α-helix	trans	-96.2	-29.7	-171.2	-62.1	-178.9	178	0	0	114	K52	K52-E56 VanDerWaalsContact CE-OE1 3.22Å; K52-E56 WeakPolarHBondContact CE-OE1 3.31Å; K52-E56 WeakPolarHBondContact CE-OE2 3.26Å; K52-E56 HydrophobicContact CG-CG 4.15Å; K52-E56 WeakPolarHBondContact CG-OE2 3.22Å; K52-E56 VanDerWaalsContact O-CB 3.28Å; K52-E56 WeakPolarHBondContact O-CB 3.36Å; K52-E56 WeakPolarHBondContact O-CG 3.45Å; K52-E56 PolarHBondContact O-N 2.99Å
57	S	78.5	Confident	84.4	Confident	43 Å²	43	66.3 Å²	66.3	30%	0.301	32%	0.322	S	S	.	.			trans	-86	120.9	-173.2	-58.7	0	0	0	0	112.2	M53	M53-S57 WeakPolarHBondContact O-CB 3.44Å; M53-S57 PolarHBondContact O-N 3.07Å; M53-S57 PolarHBondContact O-OG 3.4Å
58	K	76	Confident	83.9	Confident	212 Å²	212	70.5 Å²	70.5	92%	0.922	34%	0.343	S	S	*	.	S	Bend	trans	-89.6	-17.5	174.8	-65.5	-177.4	-179.1	178.9	0	113.9
59	T	80.9	Confident	83.7	Confident	110 Å²	110	69.7 Å²	69.7	68%	0.675	34%	0.341	S	S	*	.	S	Bend	trans	-94.2	-12.4	-176.7	42.9	0	0	0	0	113.3	E34 N61	E34-T59 PolarHBondContact OE2-OG1 2.85Å; E34-T59 VanDerWaalsContact OE2-OG1 3.08Å; T59-N61 PolarHBondContact O-N 3.32Å
60	L	83.8	Confident	83.5	Confident	22 Å²	22	70 Å²	70	12%	0.115	34%	0.34	C	S	.	.			trans	-75.9	120.6	-173.8	-179.5	67.4	0	0	0	110.9	E35 F38 M53 F62	E35-L60 HydrophobicContact CG-CD1 3.92Å; F38-L60 HydrophobicContact CB-CD1 4Å; F38-L60 HydrophobicContact CD1-CD1 4.32Å; F38-L60 HydrophobicContact CD1-CD2 4.46Å; F38-L60 HydrophobicContact CD2-CD2 3.83Å; F38-L60 HydrophobicContact CE2-CD2 4.09Å; F38-L60 HydrophobicContact CG-CD1 4.11Å; F38-L60 HydrophobicContact CG-CD2 4.02Å; M53-L60 HydrophobicContact CB-CD2 4.18Å; L60-F62 PolarHBondContact O-N 3.38Å
61	N	84.1	Confident	83.5	Confident	78 Å²	78	70.1 Å²	70.1	42%	0.417	34%	0.34	S	S	.	.			trans	-80.3	111.3	161.8	-176.8	6.5	0	0	0	108.9	E35 T59 N63 C64	E35-N61 WeakPolarHBondContact OE1-CB 3.41Å; T59-N61 PolarHBondContact O-N 3.32Å; N61-N63 VanDerWaalsContact C-N 3.26Å; N61-N63 PolarHBondContact O-N 3.48Å; N61-N63 PolarHBondContact OD1-N 3.07Å; N61-C64 WeakPolarHBondContact O-CB 3.47Å; N61-C64 PolarHBondContact O-N 2.92Å; N61-C64 PolarHBondContact O-SG 3.01Å; N61-C64 VanDerWaalsContact O-SG 3.39Å
62	F	82.1	Confident	83.5	Confident	63 Å²	63	65.3 Å²	65.3	28%	0.276	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-12.7	178.7	57.5	-96.5	0	0	0	113.4	L60 C64 N71 G93 L94	L60-F62 PolarHBondContact O-N 3.38Å; F62-C64 VanDerWaalsContact C-N 3.3Å; F62-N71 PolarHBondContact O-OD1 3.48Å; F62-G93 WeakPolarHBondContact CE2-O 3.4Å; F62-L94 HydrophobicContact CD2-CD1 4.01Å; F62-L94 HydrophobicContact CE2-CD1 4.5Å
63	N	84.5	Confident	83.6	Confident	44 Å²	44	59.8 Å²	59.8	24%	0.235	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	25	172.2	-69.1	-38.4	0	0	0	111.7	N61 N71 G93 A95	N61-N63 VanDerWaalsContact C-N 3.26Å; N61-N63 PolarHBondContact O-N 3.48Å; N61-N63 PolarHBondContact OD1-N 3.07Å; N63-N71 PolarHBondContact OD1-ND2 2.86Å; N63-G93 PolarHBondContact ND2-O 3.43Å; N63-A95 PolarHBondContact OD1-N 3.39Å
64	C	85.7	Confident	83.7	Confident	6 Å²	6	58.9 Å²	58.9	4%	0.041	29%	0.294	C	S	.	.			trans	-64.6	149.5	173.9	61.1	0	0	0	0	110.8	L31 E35 N61 F62 N71	L31-C64 HydrophobicContact CD2-CB 4.07Å; E35-C64 HydrophobicContact CB-CB 4.14Å; E35-C64 HydrophobicContact CG-CB 4.01Å; N61-C64 WeakPolarHBondContact O-CB 3.47Å; N61-C64 PolarHBondContact O-N 2.92Å; N61-C64 PolarHBondContact O-SG 3.01Å; N61-C64 VanDerWaalsContact O-SG 3.39Å; F62-C64 VanDerWaalsContact C-N 3.3Å; C64-N71 PolarHBondContact O-OD1 2.89Å
65	V	83.1	Confident	83.8	Confident	53 Å²	53	58.5 Å²	58.5	32%	0.321	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-119.3	143.4	-176.4	-64.3	0	0	0	0	111	L31 Q70	L31-V65 WeakPolarHBondContact CD1-O 3.48Å; L31-V65 WeakPolarHBondContact CD2-O 3.46Å; V65-Q70 CarbonylContact C-O 3.45Å; V65-Q70 VanDerWaalsContact CA-O 3.3Å; V65-Q70 WeakPolarHBondContact CA-O 3.37Å
66	D	84.4	Confident	84	Confident	25 Å²	25	52.1 Å²	52.1	13%	0.134	26%	0.262	C	S	.	.			trans	-74.4	-174.5	175.2	84.2	-17.6	0	0	0	112.4	L39 M68 G69 Q70	L39-D66 HydrophobicContact CD1-CB 4.22Å; D66-M68 PolarHBondContact O-N 3.44Å; D66-M68 VanDerWaalsContact OD1-C 3.23Å; D66-M68 VanDerWaalsContact OD1-CA 3.27Å; D66-M68 WeakPolarHBondContact OD1-CA 3.44Å; D66-M68 WeakPolarHBondContact OD1-CB 3.44Å; D66-M68 PolarHBondContact OD1-N 3.26Å; D66-G69 PolarHBondContact O-N 3.38Å; D66-G69 PolarHBondContact OD1-N 2.89Å; D66-Q70 PolarHBondContact N-O 2.84Å; D66-Q70 WeakPolarHBondContact OD1-CB 3.32Å; D66-Q70 PolarHBondContact OD1-N 2.94Å
67	Y	76.7	Confident	84.3	Confident	135 Å²	135	46 Å²	46	53%	0.529	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.7	177.7	69.1	-88.1	0	0	0	114.2
68	M	77.7	Confident	84.8	Confident	98 Å²	98	44.9 Å²	44.9	48%	0.483	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	5	173.3	-55.8	-166.8	72	0	0	112.1	D66 Q70	D66-M68 PolarHBondContact O-N 3.44Å; D66-M68 VanDerWaalsContact OD1-C 3.23Å; D66-M68 VanDerWaalsContact OD1-CA 3.27Å; D66-M68 WeakPolarHBondContact OD1-CA 3.44Å; D66-M68 WeakPolarHBondContact OD1-CB 3.44Å; D66-M68 PolarHBondContact OD1-N 3.26Å; M68-Q70 HydrophobicContact CB-CG 4.25Å
69	G	80.3	Confident	85.3	Confident	15 Å²	15	36.8 Å²	36.8	16%	0.155	20%	0.196	C	C	.	.	S	Bend	trans	78.8	18.5	-177.7	0	0	0	0	0	114.4	D66 R96	D66-G69 PolarHBondContact O-N 3.38Å; D66-G69 PolarHBondContact OD1-N 2.89Å; G69-R96 PolarHBondContact O-NH1 3.27Å
70	Q	84.1	Confident	85.5	Confident	39 Å²	39	33.9 Å²	33.9	18%	0.182	18%	0.175	C	C	.	.			trans	-92	134.5	-176.7	-59.6	-178	-17.5	0	0	112.8	V65 D66 M68 Q74 L75 Y145	V65-Q70 CarbonylContact C-O 3.45Å; V65-Q70 VanDerWaalsContact CA-O 3.3Å; V65-Q70 WeakPolarHBondContact CA-O 3.37Å; D66-Q70 PolarHBondContact N-O 2.84Å; D66-Q70 WeakPolarHBondContact OD1-CB 3.32Å; D66-Q70 PolarHBondContact OD1-N 2.94Å; M68-Q70 HydrophobicContact CB-CG 4.25Å; Q70-Q74 VanDerWaalsContact CA-OE1 3.29Å; Q70-Q74 HydrophobicContact CB-CB 4.45Å; Q70-L75 HydrophobicContact CB-CD2 4.3Å; Q70-L75 HydrophobicContact CB-CG 4.25Å; Q70-Y145 HydrophobicContact CG-CE2 4.03Å; Q70-Y145 PolarHBondContact NE2-OH 3.25Å
71	N	87.9	Confident	85.8	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.016	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-79.7	159	174.1	-165.4	2.1	0	0	0	111.3	F62 N63 C64 L73 Q74 L75 A95	F62-N71 PolarHBondContact O-OD1 3.48Å; N63-N71 PolarHBondContact OD1-ND2 2.86Å; C64-N71 PolarHBondContact O-OD1 2.89Å; N71-L73 PolarHBondContact O-N 2.88Å; N71-L73 VanDerWaalsContact O-N 3.12Å; N71-Q74 PolarHBondContact O-N 3.09Å; N71-L75 PolarHBondContact O-N 2.76Å; N71-L75 VanDerWaalsContact O-N 3.09Å; N71-A95 PolarHBondContact ND2-O 3.33Å
72	A	89.7	Confident	86	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-52.2	-35.7	176.7	0	0	0	0	0	113.1	F38 L39 A42 A76 L88	F38-A72 HydrophobicContact CD1-CB 4.31Å; F38-A72 HydrophobicContact CE1-CB 3.52Å; F38-A72 HydrophobicContact CZ-CB 4.06Å; L39-A72 HydrophobicContact CD2-CB 4.03Å; A42-A72 HydrophobicContact CB-CB 4.13Å; A72-A76 WeakPolarHBondContact O-CB 3.32Å; A72-A76 PolarHBondContact O-N 2.88Å; A72-L88 HydrophobicContact CB-CD1 4.27Å
73	L	90.7	Very high	86.2	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-65.5	-46.1	174.7	-177.9	69.2	0	0	0	112.3	N71 L75 A76 V77 T85 L88 L94 I97	N71-L73 PolarHBondContact O-N 2.88Å; N71-L73 VanDerWaalsContact O-N 3.12Å; L73-L75 VanDerWaalsContact C-N 3.28Å; L73-L75 PolarHBondContact O-N 3.03Å; L73-A76 PolarHBondContact O-N 3.24Å; L73-V77 HydrophobicContact CD1-CG2 4.12Å; L73-V77 HydrophobicContact CG-CG2 4.29Å; L73-V77 WeakPolarHBondContact O-CB 3.32Å; L73-V77 VanDerWaalsContact O-CG2 3.22Å; L73-V77 WeakPolarHBondContact O-CG2 2.85Å; L73-V77 PolarHBondContact O-N 3.19Å; L73-T85 HydrophobicContact CD1-CG2 3.83Å; L73-L88 HydrophobicContact CB-CD1 4.5Å; L73-L94 HydrophobicContact CB-CD2 4.18Å; L73-L94 HydrophobicContact CD1-CD2 4.25Å; L73-L94 HydrophobicContact CD2-CD2 3.78Å; L73-L94 HydrophobicContact CG-CD2 4.28Å; L73-I97 HydrophobicContact CD2-CB 4.4Å; L73-I97 HydrophobicContact CD2-CG1 4.31Å; L73-I97 HydrophobicContact CD2-CG2 4.47Å
74	Q	90.1	Very high	86.5	Confident	3 Å²	3	30.2 Å²	30.2	1%	0.014	16%	0.155	C	C	.	.	H	α-helix	trans	-64.2	-36.7	-179.7	-71.5	163.1	-39	0	0	111	Q70 N71 G78 D99 L103 Y145	Q70-Q74 VanDerWaalsContact CA-OE1 3.29Å; Q70-Q74 HydrophobicContact CB-CB 4.45Å; N71-Q74 PolarHBondContact O-N 3.09Å; Q74-G78 PolarHBondContact O-N 2.97Å; Q74-D99 PolarHBondContact NE2-OD2 3.32Å; Q74-L103 WeakPolarHBondContact O-CD2 3.42Å; Q74-Y145 PolarHBondContact NE2-O 3.49Å
75	L	89	Confident	86.7	Confident	15 Å²	15	30 Å²	30	8%	0.079	15%	0.153	C	C	.	.	H	α-helix	trans	-66.6	-47.7	174.3	-69.1	171.6	0	0	0	112	L39 Q70 N71 L73 V77 G78 N79	L39-L75 HydrophobicContact CB-CD1 4.33Å; L39-L75 HydrophobicContact CD2-CD1 3.93Å; Q70-L75 HydrophobicContact CB-CD2 4.3Å; Q70-L75 HydrophobicContact CB-CG 4.25Å; N71-L75 PolarHBondContact O-N 2.76Å; N71-L75 VanDerWaalsContact O-N 3.09Å; L73-L75 VanDerWaalsContact C-N 3.28Å; L73-L75 PolarHBondContact O-N 3.03Å; L75-V77 PolarHBondContact O-N 2.94Å; L75-G78 PolarHBondContact O-N 3.29Å; L75-N79 PolarHBondContact O-N 3.25Å
76	A	90.6	Very high	87.1	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-45	178.1	0	0	0	0	0	111.6	A72 L73 N79 E80 H81 V84 L88	A72-A76 WeakPolarHBondContact O-CB 3.32Å; A72-A76 PolarHBondContact O-N 2.88Å; L73-A76 PolarHBondContact O-N 3.24Å; A76-N79 PolarHBondContact O-N 3.07Å; A76-E80 PolarHBondContact O-N 3.23Å; A76-H81 HydrophobicContact CB-CB 4.42Å; A76-H81 PolarHBondContact O-N 2.91Å; A76-V84 HydrophobicContact CB-CB 4.31Å; A76-V84 HydrophobicContact CB-CG1 3.82Å; A76-L88 HydrophobicContact CB-CD1 4.17Å
77	V	91.1	Very high	87.3	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-66.3	-41.1	176.4	172.6	0	0	0	0	111.1	L73 L75 N79 E80 T85 L103 A104 Y109 I112 I116	L73-V77 HydrophobicContact CD1-CG2 4.12Å; L73-V77 HydrophobicContact CG-CG2 4.29Å; L73-V77 WeakPolarHBondContact O-CB 3.32Å; L73-V77 VanDerWaalsContact O-CG2 3.22Å; L73-V77 WeakPolarHBondContact O-CG2 2.85Å; L73-V77 PolarHBondContact O-N 3.19Å; L75-V77 PolarHBondContact O-N 2.94Å; V77-N79 PolarHBondContact O-N 3.41Å; V77-E80 PolarHBondContact O-N 3.48Å; V77-T85 HydrophobicContact CG2-CG2 4.15Å; V77-L103 HydrophobicContact CB-CD2 4.32Å; V77-L103 HydrophobicContact CG1-CB 4.39Å; V77-L103 HydrophobicContact CG1-CD2 4.05Å; V77-L103 HydrophobicContact CG1-CG 3.99Å; V77-A104 HydrophobicContact CG1-CB 3.75Å; V77-Y109 WeakPolarHBondContact O-CD2 3.44Å; V77-Y109 WeakPolarHBondContact O-CE2 3.16Å; V77-I112 HydrophobicContact CG1-CG2 4.13Å; V77-I112 HydrophobicContact CG2-CG2 3.91Å; V77-I116 HydrophobicContact CG2-CD1 4.18Å
78	G	87.8	Confident	88	Confident	21 Å²	21	25.2 Å²	25.2	22%	0.216	13%	0.132	C	C	.	.	H	α-helix	trans	-59.8	-31.3	-179.6	0	0	0	0	0	113.8	Q74 L75	Q74-G78 PolarHBondContact O-N 2.97Å; L75-G78 PolarHBondContact O-N 3.29Å
79	N	86.1	Confident	88.5	Confident	41 Å²	41	21.4 Å²	21.4	22%	0.219	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	9.7	-179.9	-67	-26.6	0	0	0	114.1	E43 L75 A76 V77 H81 Q828	E43-N79 WeakPolarHBondContact CG-ND2 3.46Å; E43-N79 PolarHBondContact O-ND2 3.39Å; L75-N79 PolarHBondContact O-N 3.25Å; A76-N79 PolarHBondContact O-N 3.07Å; V77-N79 PolarHBondContact O-N 3.41Å; N79-H81 VanDerWaalsContact C-N 3.35Å; N79-H81 PolarHBondContact O-N 3.43Å; N79-Q828 HydrophobicContact CB-CG 4.45Å
80	E	87	Confident	88.9	Confident	49 Å²	49	26.9 Å²	26.9	23%	0.229	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	29.4	179.3	-151.9	174.6	174.9	0	0	116.2	A76 V77 L82 Y109 I112 E825	A76-E80 PolarHBondContact O-N 3.23Å; V77-E80 PolarHBondContact O-N 3.48Å; E80-L82 PolarHBondContact O-N 3.17Å; E80-Y109 HydrophobicContact CB-CD1 4.43Å; E80-Y109 HydrophobicContact CB-CD2 4.36Å; E80-Y109 HydrophobicContact CB-CE1 4.13Å; E80-Y109 HydrophobicContact CB-CE2 4.03Å; E80-Y109 HydrophobicContact CG-CD1 3.8Å; E80-Y109 HydrophobicContact CG-CD2 4.13Å; E80-Y109 HydrophobicContact CG-CE1 3.97Å; E80-Y109 HydrophobicContact CG-CE2 4.26Å; E80-Y109 HydrophobicContact CG-CG 3.9Å; E80-Y109 WeakPolarHBondContact OE2-CD1 3.38Å; E80-Y109 WeakPolarHBondContact OE2-CE1 3.43Å; E80-I112 HydrophobicContact CB-CD1 4.32Å; E80-I112 HydrophobicContact CG-CD1 3.75Å; E80-E825 HydrophobicContact CB-CG 4.46Å; E80-E825 VanDerWaalsContact OE2-CG 3.32Å; E80-E825 WeakPolarHBondContact OE2-CG 3.2Å
81	H	88.9	Confident	88.9	Confident	7 Å²	7	28.7 Å²	28.7	3%	0.032	14%	0.14	C	C	.	.			trans	-78.7	82.4	176.2	-63.7	-57.5	0	0	0	111.5	A42 E43 G45 A76 N79 E83 V84 T85	A42-H81 PolarHBondContact O-CD2 3.43Å; E43-H81 PolarHBondContact O-CD2 2.88Å; E43-H81 PolarHBondContact O-NE2 3.46Å; G45-H81 VanDerWaalsContact CA-CE1 3.45Å; G45-H81 WeakPolarHBondContact CA-CE1 3.17Å; G45-H81 WeakPolarHBondContact CA-ND1 3.28Å; G45-H81 PolarHBondContact N-NE2 3.34Å; A76-H81 HydrophobicContact CB-CB 4.42Å; A76-H81 PolarHBondContact O-N 2.91Å; N79-H81 VanDerWaalsContact C-N 3.35Å; N79-H81 PolarHBondContact O-N 3.43Å; H81-E83 PolarHBondContact O-N 3.42Å; H81-V84 HydrophobicContact CB-CB 3.88Å; H81-V84 HydrophobicContact CB-CG2 4.01Å; H81-V84 PolarHBondContact O-N 3.25Å; H81-T85 WeakPolarHBondContact O-CB 3.22Å; H81-T85 PolarHBondContact O-N 3.5Å; H81-T85 PolarHBondContact O-OG1 3.34Å
82	L	88.6	Confident	88.5	Confident	34 Å²	34	35.1 Å²	35.1	18%	0.178	17%	0.174	C	C	.	.	H	α-helix	trans	-55.7	-49.1	-178.8	177.1	63.5	0	0	0	112.3	E80 V84 T85 E86 R111 I112 A115	E80-L82 PolarHBondContact O-N 3.17Å; L82-V84 PolarHBondContact O-N 3.03Å; L82-T85 WeakPolarHBondContact O-CB 3.39Å; L82-T85 PolarHBondContact O-N 2.93Å; L82-E86 HydrophobicContact CD1-CG 4.43Å; L82-E86 PolarHBondContact O-N 3.08Å; L82-R111 HydrophobicContact CD1-CB 4.25Å; L82-R111 HydrophobicContact CD2-CB 4.11Å; L82-I112 HydrophobicContact CB-CG1 4.38Å; L82-I112 HydrophobicContact CD1-CG1 3.91Å; L82-A115 HydrophobicContact CD1-CB 4.26Å
83	E	87.1	Confident	87.9	Confident	89 Å²	89	37.9 Å²	37.9	42%	0.416	20%	0.203	S	C	.	.	H	α-helix	trans	-67.2	-40.6	-175	-61.9	-171.6	-172.3	0	0	112.5	I47 H81 T85 E86 Q87	I47-E83 HydrophobicContact CD1-CB 3.97Å; I47-E83 WeakPolarHBondContact CD1-OE2 3.42Å; I47-E83 HydrophobicContact CG1-CB 4.04Å; H81-E83 PolarHBondContact O-N 3.42Å; E83-T85 VanDerWaalsContact C-N 3.29Å; E83-T85 PolarHBondContact O-N 3.41Å; E83-E86 PolarHBondContact O-N 3.34Å; E83-Q87 WeakPolarHBondContact O-CG 3.47Å; E83-Q87 PolarHBondContact O-N 3.03Å
84	V	89.3	Confident	87.6	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-61.5	-43.6	173.3	176.5	0	0	0	0	109.7	A42 I47 V50 A76 H81 L82 E86 Q87 L88	A42-V84 HydrophobicContact CB-CG1 4.41Å; I47-V84 HydrophobicContact CG1-CG2 3.68Å; V50-V84 HydrophobicContact CG1-CG1 4.28Å; V50-V84 HydrophobicContact CG2-CG1 4.39Å; A76-V84 HydrophobicContact CB-CB 4.31Å; A76-V84 HydrophobicContact CB-CG1 3.82Å; H81-V84 HydrophobicContact CB-CB 3.88Å; H81-V84 HydrophobicContact CB-CG2 4.01Å; H81-V84 PolarHBondContact O-N 3.25Å; L82-V84 PolarHBondContact O-N 3.03Å; V84-E86 PolarHBondContact O-N 3.25Å; V84-Q87 PolarHBondContact O-N 3.33Å; V84-L88 HydrophobicContact CG1-CD1 3.99Å; V84-L88 HydrophobicContact CG1-CG 4.35Å; V84-L88 WeakPolarHBondContact O-CG 3.28Å; V84-L88 PolarHBondContact O-N 2.87Å
85	T	91.3	Very high	87.2	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.2	-45.8	176.8	-58	0	0	0	0	111.5	L73 V77 H81 L82 E83 Q87 L88 L89 I112 I116	L73-T85 HydrophobicContact CD1-CG2 3.83Å; V77-T85 HydrophobicContact CG2-CG2 4.15Å; H81-T85 WeakPolarHBondContact O-CB 3.22Å; H81-T85 PolarHBondContact O-N 3.5Å; H81-T85 PolarHBondContact O-OG1 3.34Å; L82-T85 WeakPolarHBondContact O-CB 3.39Å; L82-T85 PolarHBondContact O-N 2.93Å; E83-T85 VanDerWaalsContact C-N 3.29Å; E83-T85 PolarHBondContact O-N 3.41Å; T85-Q87 VanDerWaalsContact C-N 3.34Å; T85-Q87 PolarHBondContact O-N 2.8Å; T85-L88 PolarHBondContact O-N 3.48Å; T85-L89 HydrophobicContact CG2-CD1 3.86Å; T85-L89 HydrophobicContact CG2-CG 4.31Å; T85-L89 WeakPolarHBondContact O-CB 3.15Å; T85-L89 VanDerWaalsContact O-CG 3.25Å; T85-L89 WeakPolarHBondContact O-CG 3.41Å; T85-L89 PolarHBondContact O-N 3.1Å; T85-I112 HydrophobicContact CG2-CG2 4.26Å; T85-I116 HydrophobicContact CG2-CG1 4.47Å
86	E	90.9	Very high	87	Confident	88 Å²	88	40.4 Å²	40.4	41%	0.411	22%	0.219	S	C	.	.	H	α-helix	trans	-62.6	-36.7	175.7	-73.5	-174.4	177.2	0	0	113	L82 E83 V84 K90 A115	L82-E86 HydrophobicContact CD1-CG 4.43Å; L82-E86 PolarHBondContact O-N 3.08Å; E83-E86 PolarHBondContact O-N 3.34Å; V84-E86 PolarHBondContact O-N 3.25Å; E86-K90 WeakPolarHBondContact O-CG 3.13Å; E86-K90 PolarHBondContact O-N 3.37Å; E86-A115 HydrophobicContact CG-CB 4.36Å
87	Q	89.4	Confident	86.9	Confident	23 Å²	23	40.6 Å²	40.6	11%	0.107	22%	0.22	C	C	.	.	H	α-helix	trans	-68.9	-40.2	175.3	-63.1	-54.7	-21.6	0	0	112.2	R51 E83 V84 T85 K90	R51-Q87 VanDerWaalsContact NH2-NE2 3.16Å; E83-Q87 WeakPolarHBondContact O-CG 3.47Å; E83-Q87 PolarHBondContact O-N 3.03Å; V84-Q87 PolarHBondContact O-N 3.33Å; T85-Q87 VanDerWaalsContact C-N 3.34Å; T85-Q87 PolarHBondContact O-N 2.8Å; Q87-K90 PolarHBondContact O-N 3.19Å
88	L	89.8	Confident	86.6	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-65.7	-40.8	177.6	-68.4	173.5	0	0	0	111.4	F38 V50 L54 A72 L73 A76 V84 T85 K90 K91 L94	F38-L88 HydrophobicContact CZ-CD2 3.87Å; V50-L88 HydrophobicContact CG1-CD2 4.36Å; L54-L88 HydrophobicContact CD1-CD2 3.97Å; A72-L88 HydrophobicContact CB-CD1 4.27Å; L73-L88 HydrophobicContact CB-CD1 4.5Å; A76-L88 HydrophobicContact CB-CD1 4.17Å; V84-L88 HydrophobicContact CG1-CD1 3.99Å; V84-L88 HydrophobicContact CG1-CG 4.35Å; V84-L88 WeakPolarHBondContact O-CG 3.28Å; V84-L88 PolarHBondContact O-N 2.87Å; T85-L88 PolarHBondContact O-N 3.48Å; L88-K90 PolarHBondContact O-N 2.9Å; L88-K91 PolarHBondContact O-N 3.49Å; L88-L94 HydrophobicContact CB-CD2 4.4Å
89	L	89.6	Confident	86.6	Confident	17 Å²	17	39.6 Å²	39.6	9%	0.089	21%	0.21	C	C	.	.	H	α-helix	trans	-68.2	-14.9	178.9	-71.5	172.1	0	0	0	114.2	T85 K91 L94 I97 A115 I116 H119	T85-L89 HydrophobicContact CG2-CD1 3.86Å; T85-L89 HydrophobicContact CG2-CG 4.31Å; T85-L89 WeakPolarHBondContact O-CB 3.15Å; T85-L89 VanDerWaalsContact O-CG 3.25Å; T85-L89 WeakPolarHBondContact O-CG 3.41Å; T85-L89 PolarHBondContact O-N 3.1Å; L89-K91 VanDerWaalsContact C-N 3.29Å; L89-L94 HydrophobicContact CD2-CD2 4.41Å; L89-I97 HydrophobicContact CD2-CG2 4.35Å; L89-A115 HydrophobicContact CD1-CB 4.33Å; L89-I116 HydrophobicContact CD1-CG1 4.01Å; L89-H119 PolarHBondContact O-CD2 3.45Å
90	K	87.4	Confident	86.8	Confident	130 Å²	130	37.7 Å²	37.7	57%	0.565	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-16.5	174.4	-73.7	169.9	-166.4	170.3	0	113.4	E86 Q87 L88	E86-K90 WeakPolarHBondContact O-CG 3.13Å; E86-K90 PolarHBondContact O-N 3.37Å; Q87-K90 PolarHBondContact O-N 3.19Å; L88-K90 PolarHBondContact O-N 2.9Å
91	K	84.4	Confident	87	Confident	78 Å²	78	35.3 Å²	35.3	34%	0.339	19%	0.189	S	C	.	.	S	Bend	trans	-89.4	128.5	178.8	-67.9	-66	-170.5	168.6	0	110.1	L54 L88 L89	L54-K91 HydrophobicContact CD2-CD 4.11Å; L54-K91 HydrophobicContact CD2-CG 3.34Å; L54-K91 HydrophobicContact CG-CG 4.02Å; L54-K91 VanDerWaalsContact O-CE 3.26Å; L54-K91 WeakPolarHBondContact O-CE 3.39Å; L54-K91 PolarHBondContact O-NZ 3.12Å; L88-K91 PolarHBondContact O-N 3.49Å; L89-K91 VanDerWaalsContact C-N 3.29Å
92	D	79.1	Confident	87.1	Confident	137 Å²	137	35.2 Å²	35.2	73%	0.733	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	140.1	174.1	-62.3	-44	0	0	0	110.8
93	G	78.3	Confident	87.3	Confident	59 Å²	59	34.1 Å²	34.1	61%	0.608	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	94	13.9	176.1	0	0	0	0	0	116	F62 N63 A95	F62-G93 WeakPolarHBondContact CE2-O 3.4Å; N63-G93 PolarHBondContact ND2-O 3.43Å; G93-A95 PolarHBondContact O-N 3.34Å
94	L	83.1	Confident	87.5	Confident	14 Å²	14	29.9 Å²	29.9	7%	0.073	16%	0.163	C	C	.	.			trans	-66	126.1	174.2	-167.3	66.8	0	0	0	111.3	F62 L73 L88 L89 I97	F62-L94 HydrophobicContact CD2-CD1 4.01Å; F62-L94 HydrophobicContact CE2-CD1 4.5Å; L73-L94 HydrophobicContact CB-CD2 4.18Å; L73-L94 HydrophobicContact CD1-CD2 4.25Å; L73-L94 HydrophobicContact CD2-CD2 3.78Å; L73-L94 HydrophobicContact CG-CD2 4.28Å; L88-L94 HydrophobicContact CB-CD2 4.4Å; L89-L94 HydrophobicContact CD2-CD2 4.41Å; L94-I97 HydrophobicContact CB-CD1 4.19Å; L94-I97 HydrophobicContact CB-CG1 4.24Å; L94-I97 HydrophobicContact CD2-CG1 4.31Å; L94-I97 HydrophobicContact CG-CG1 4.3Å; L94-I97 WeakPolarHBondContact O-CD1 3.41Å; L94-I97 WeakPolarHBondContact O-CG1 3.45Å
95	A	81.7	Confident	87.7	Confident	32 Å²	32	29.9 Å²	29.9	26%	0.264	16%	0.162	S	C	.	.	S	Bend	trans	-85.2	160.8	176.2	0	0	0	0	0	111.6	N63 N71 G93 I97	N63-A95 PolarHBondContact OD1-N 3.39Å; N71-A95 PolarHBondContact ND2-O 3.33Å; G93-A95 PolarHBondContact O-N 3.34Å; A95-I97 VanDerWaalsContact C-N 3.3Å; A95-I97 PolarHBondContact O-N 3.34Å
96	R	85.3	Confident	87.8	Confident	25 Å²	25	32.2 Å²	32.2	9%	0.094	18%	0.179	C	C	.	.			trans	61.5	26.9	173.5	-52.3	-177.3	-178.1	167.3	1.1	116.3	G69 G98 D99 G100 D141 F142 A144 Y145	G69-R96 PolarHBondContact O-NH1 3.27Å; R96-G98 PolarHBondContact O-N 3.42Å; R96-D99 PolarHBondContact O-N 3.17Å; R96-G100 PolarHBondContact O-N 3.45Å; R96-G100 VanDerWaalsContact O-N 3.1Å; R96-D141 WeakPolarHBondContact CA-O 3.33Å; R96-D141 WeakPolarHBondContact CG-O 3.39Å; R96-D141 PolarHBondContact N-O 3.36Å; R96-F142 CarbonylContact C-O 3.59Å; R96-F142 WeakPolarHBondContact CA-O 3.32Å; R96-A144 VanDerWaalsContact CD-O 3.3Å; R96-A144 WeakPolarHBondContact CD-O 3.27Å; R96-A144 VanDerWaalsContact CG-O 3.31Å; R96-A144 WeakPolarHBondContact CG-O 3.35Å; R96-Y145 PolarHBondContact NH1-O 3.01Å
97	I	87.9	Confident	87.6	Confident	5 Å²	5	33.4 Å²	33.4	3%	0.026	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-34.7	175.6	-51.7	174.2	0	0	0	111.1	L73 L89 L94 A95 G100 L101 I116 F122 F142	L73-I97 HydrophobicContact CD2-CB 4.4Å; L73-I97 HydrophobicContact CD2-CG1 4.31Å; L73-I97 HydrophobicContact CD2-CG2 4.47Å; L89-I97 HydrophobicContact CD2-CG2 4.35Å; L94-I97 HydrophobicContact CB-CD1 4.19Å; L94-I97 HydrophobicContact CB-CG1 4.24Å; L94-I97 HydrophobicContact CD2-CG1 4.31Å; L94-I97 HydrophobicContact CG-CG1 4.3Å; L94-I97 WeakPolarHBondContact O-CD1 3.41Å; L94-I97 WeakPolarHBondContact O-CG1 3.45Å; A95-I97 VanDerWaalsContact C-N 3.3Å; A95-I97 PolarHBondContact O-N 3.34Å; I97-G100 PolarHBondContact O-N 3.12Å; I97-L101 PolarHBondContact O-N 3.26Å; I97-I116 HydrophobicContact CG2-CG2 3.85Å; I97-F122 HydrophobicContact CG2-CE2 3.73Å; I97-F122 HydrophobicContact CG2-CZ 4.23Å; I97-F142 HydrophobicContact CB-CE2 3.95Å; I97-F142 HydrophobicContact CB-CZ 4.33Å
98	G	86.1	Confident	87.6	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.3	-42.2	178	0	0	0	0	0	113.4	R96 L101 L102 F142 Y143	R96-G98 PolarHBondContact O-N 3.42Å; G98-L101 WeakPolarHBondContact O-CB 3.38Å; G98-L101 PolarHBondContact O-N 3.46Å; G98-L102 PolarHBondContact O-N 3.38Å; G98-F142 WeakPolarHBondContact CA-O 3.28Å; G98-F142 PolarHBondContact N-O 2.9Å; G98-Y143 VanDerWaalsContact CA-CE1 3.48Å; G98-Y143 WeakPolarHBondContact O-CD1 3.29Å; G98-Y143 WeakPolarHBondContact O-CE1 3.2Å
99	D	88	Confident	87.7	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-67.2	-39.3	173.2	-175.6	70.5	0	0	0	111.3	Q74 R96 L101 L102 L103 F142 R151	Q74-D99 PolarHBondContact NE2-OD2 3.32Å; R96-D99 PolarHBondContact O-N 3.17Å; D99-L101 VanDerWaalsContact C-N 3.26Å; D99-L101 PolarHBondContact O-N 3.12Å; D99-L102 PolarHBondContact O-N 3.46Å; D99-L102 VanDerWaalsContact O-N 3.15Å; D99-L103 WeakPolarHBondContact O-CB 3.45Å; D99-L103 PolarHBondContact O-N 3.33Å; D99-F142 PolarHBondContact N-O 3.08Å; D99-R151 VanDerWaalsContact OD1-CB 3.23Å; D99-R151 WeakPolarHBondContact OD1-CB 3.49Å; D99-R151 IonicContact OD1-NE 3.12Å; D99-R151 IonicContact OD2-CZ 3.25Å; D99-R151 IonicContact OD2-NE 3.72Å; D99-R151 IonicContact OD2-NH2 2.96Å; D99-R151 PolarHBondContact OD2-NH2 3.44Å; D99-R151 VanDerWaalsContact OD2-NH2 3.1Å
100	G	89.8	Confident	87.7	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-55	-41.6	171	0	0	0	0	0	112.5	R96 I97 L103 A104	R96-G100 PolarHBondContact O-N 3.45Å; R96-G100 VanDerWaalsContact O-N 3.1Å; I97-G100 PolarHBondContact O-N 3.12Å; G100-L103 PolarHBondContact O-N 3.45Å; G100-A104 WeakPolarHBondContact O-CB 3.45Å; G100-A104 PolarHBondContact O-N 2.89Å
101	L	91.1	Very high	87.9	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.7	-48.2	174	179.6	63.2	0	0	0	112	I97 G98 D99 L103 A104 I105 V113 I116 L117 F122 L128 P158	I97-L101 PolarHBondContact O-N 3.26Å; G98-L101 WeakPolarHBondContact O-CB 3.38Å; G98-L101 PolarHBondContact O-N 3.46Å; D99-L101 VanDerWaalsContact C-N 3.26Å; D99-L101 PolarHBondContact O-N 3.12Å; L101-L103 VanDerWaalsContact C-N 3.3Å; L101-L103 PolarHBondContact O-N 2.76Å; L101-A104 PolarHBondContact O-N 2.67Å; L101-I105 HydrophobicContact CD1-CD1 4.06Å; L101-I105 HydrophobicContact CD1-CG1 4.32Å; L101-I105 HydrophobicContact CG-CD1 3.92Å; L101-I105 VanDerWaalsContact O-CG1 3.26Å; L101-I105 WeakPolarHBondContact O-CG1 3.28Å; L101-I105 PolarHBondContact O-N 3.21Å; L101-V113 HydrophobicContact CD1-CG1 4.08Å; L101-V113 HydrophobicContact CD1-CG2 4.41Å; L101-I116 HydrophobicContact CB-CG2 4.04Å; L101-I116 HydrophobicContact CD1-CB 4.44Å; L101-I116 HydrophobicContact CD1-CG2 4.1Å; L101-L117 HydrophobicContact CD1-CD2 4.29Å; L101-L117 HydrophobicContact CD1-CG 4.27Å; L101-L117 HydrophobicContact CD2-CD2 4.12Å; L101-F122 HydrophobicContact CB-CZ 4.43Å; L101-F122 HydrophobicContact CD2-CE1 3.76Å; L101-F122 HydrophobicContact CD2-CZ 3.75Å; L101-L128 HydrophobicContact CD2-CD2 4.19Å; L101-P158 HydrophobicContact CD2-CB 4.31Å; L101-P158 HydrophobicContact CD2-CG 4.13Å
102	L	91.1	Very high	88.3	Confident	5 Å²	5	33.5 Å²	33.5	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-63.6	-36.7	179.6	-66.8	176.2	0	0	0	111.8	G98 D99 I105 S106 Y143 F152 P158 L161	G98-L102 PolarHBondContact O-N 3.38Å; D99-L102 PolarHBondContact O-N 3.46Å; D99-L102 VanDerWaalsContact O-N 3.15Å; L102-I105 PolarHBondContact O-N 3.08Å; L102-S106 WeakPolarHBondContact O-CB 3.32Å; L102-S106 PolarHBondContact O-N 2.89Å; L102-Y143 HydrophobicContact CD1-CD1 3.63Å; L102-Y143 HydrophobicContact CD1-CE1 3.96Å; L102-Y143 HydrophobicContact CG-CD1 4.12Å; L102-Y143 HydrophobicContact CG-CE1 4Å; L102-F152 HydrophobicContact CB-CD2 3.82Å; L102-F152 HydrophobicContact CB-CE2 3.77Å; L102-F152 HydrophobicContact CD1-CD2 4.02Å; L102-F152 HydrophobicContact CG-CD2 4.45Å; L102-P158 HydrophobicContact CD2-CB 4.32Å; L102-P158 HydrophobicContact CD2-CG 4.1Å; L102-L161 HydrophobicContact CB-CD2 3.94Å; L102-L161 HydrophobicContact CD2-CD2 3.8Å; L102-L161 HydrophobicContact CG-CD2 4.45Å; L102-L161 VanDerWaalsContact O-CD2 3.29Å; L102-L161 WeakPolarHBondContact O-CD2 3.29Å
103	L	91.6	Very high	88.9	Confident	11 Å²	11	27 Å²	27	6%	0.058	15%	0.149	C	C	.	.	H	α-helix	trans	-62.9	-48.2	172.8	172.6	54.1	0	0	0	111.6	Q74 V77 D99 G100 L101 I105 S106 K107 R151	Q74-L103 WeakPolarHBondContact O-CD2 3.42Å; V77-L103 HydrophobicContact CB-CD2 4.32Å; V77-L103 HydrophobicContact CG1-CB 4.39Å; V77-L103 HydrophobicContact CG1-CD2 4.05Å; V77-L103 HydrophobicContact CG1-CG 3.99Å; D99-L103 WeakPolarHBondContact O-CB 3.45Å; D99-L103 PolarHBondContact O-N 3.33Å; G100-L103 PolarHBondContact O-N 3.45Å; L101-L103 VanDerWaalsContact C-N 3.3Å; L101-L103 PolarHBondContact O-N 2.76Å; L103-I105 VanDerWaalsContact C-N 3.29Å; L103-I105 PolarHBondContact O-N 3Å; L103-S106 WeakPolarHBondContact O-CB 3.36Å; L103-S106 PolarHBondContact O-N 3.01Å; L103-K107 HydrophobicContact CD1-CG 3.89Å; L103-K107 WeakPolarHBondContact O-CG 3.48Å; L103-K107 PolarHBondContact O-N 3.38Å; L103-R151 VanDerWaalsContact CB-NH1 3.33Å; L103-R151 VanDerWaalsContact CG-NH1 3.34Å
104	A	92.6	Very high	89.6	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.1	-40.7	178.5	0	0	0	0	0	111.7	V77 G100 L101 K107 G108 Y109 I112 V113 I116	V77-A104 HydrophobicContact CG1-CB 3.75Å; G100-A104 WeakPolarHBondContact O-CB 3.45Å; G100-A104 PolarHBondContact O-N 2.89Å; L101-A104 PolarHBondContact O-N 2.67Å; A104-K107 PolarHBondContact O-N 3.47Å; A104-G108 PolarHBondContact O-N 2.88Å; A104-Y109 PolarHBondContact O-N 3.07Å; A104-Y109 VanDerWaalsContact O-N 3.11Å; A104-I112 HydrophobicContact CB-CG2 3.97Å; A104-V113 HydrophobicContact CB-CG2 3.63Å; A104-I116 HydrophobicContact CB-CD1 4.39Å
105	I	93.7	Very high	89.9	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.3	-43.3	175.8	-66.8	170.6	0	0	0	111.6	L101 L102 L103 K107 G108 V113 P158 L161 A162 I170 L174	L101-I105 HydrophobicContact CD1-CD1 4.06Å; L101-I105 HydrophobicContact CD1-CG1 4.32Å; L101-I105 HydrophobicContact CG-CD1 3.92Å; L101-I105 VanDerWaalsContact O-CG1 3.26Å; L101-I105 WeakPolarHBondContact O-CG1 3.28Å; L101-I105 PolarHBondContact O-N 3.21Å; L102-I105 PolarHBondContact O-N 3.08Å; L103-I105 VanDerWaalsContact C-N 3.29Å; L103-I105 PolarHBondContact O-N 3Å; I105-K107 PolarHBondContact O-N 3.08Å; I105-G108 PolarHBondContact O-N 3.49Å; I105-V113 HydrophobicContact CG1-CG2 3.95Å; I105-P158 HydrophobicContact CD1-CB 3.69Å; I105-L161 HydrophobicContact CB-CD2 4.37Å; I105-L161 HydrophobicContact CG2-CB 4.2Å; I105-L161 HydrophobicContact CG2-CD2 4.2Å; I105-L161 HydrophobicContact CG2-CG 4.01Å; I105-A162 VanDerWaalsContact CG2-CA 3.49Å; I105-A162 HydrophobicContact CG2-CB 3.69Å; I105-I170 HydrophobicContact CG1-CG2 3.95Å; I105-I170 HydrophobicContact CG2-CG2 4.29Å; I105-L174 HydrophobicContact CD1-CD1 4.27Å
106	S	92.3	Very high	90.4	Very high	49 Å²	49	28.1 Å²	28.1	34%	0.343	14%	0.137	S	C	.	.	H	α-helix	trans	-60.9	-34.1	178	-178.3	0	0	0	0	112.4	L102 L103	L102-S106 WeakPolarHBondContact O-CB 3.32Å; L102-S106 PolarHBondContact O-N 2.89Å; L103-S106 WeakPolarHBondContact O-CB 3.36Å; L103-S106 PolarHBondContact O-N 3.01Å
107	K	87.9	Confident	90.6	Very high	114 Å²	114	27.4 Å²	27.4	50%	0.496	14%	0.135	S	C	.	.	H	α-helix	trans	-86.3	-21.4	179.1	-67.5	-67.5	-174.7	173.8	0	114.7	L103 A104 I105 Y109	L103-K107 HydrophobicContact CD1-CG 3.89Å; L103-K107 WeakPolarHBondContact O-CG 3.48Å; L103-K107 PolarHBondContact O-N 3.38Å; A104-K107 PolarHBondContact O-N 3.47Å; I105-K107 PolarHBondContact O-N 3.08Å; K107-Y109 HydrophobicContact CB-CD1 4.11Å; K107-Y109 HydrophobicContact CB-CD2 3.7Å; K107-Y109 HydrophobicContact CB-CE1 3.87Å; K107-Y109 HydrophobicContact CB-CE2 3.45Å; K107-Y109 VanDerWaalsContact CB-CE2 3.45Å; K107-Y109 HydrophobicContact CB-CG 4.02Å; K107-Y109 HydrophobicContact CG-CD2 4.37Å; K107-Y109 HydrophobicContact CG-CE2 3.77Å
108	G	88.7	Confident	90.5	Very high	17 Å²	17	30 Å²	30	18%	0.175	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	15.9	-178.2	0	0	0	0	0	114.7	A104 I105 V110	A104-G108 PolarHBondContact O-N 2.88Å; I105-G108 PolarHBondContact O-N 3.49Å; G108-V110 PolarHBondContact O-N 3.19Å
109	Y	91.1	Very high	90.6	Very high	27 Å²	27	31.1 Å²	31.1	11%	0.106	17%	0.168	C	C	.	.			trans	-77	86.6	-176.6	-55.8	-33.5	0	0	0	112.2	V77 E80 A104 K107 R111 I112 V113	V77-Y109 WeakPolarHBondContact O-CD2 3.44Å; V77-Y109 WeakPolarHBondContact O-CE2 3.16Å; E80-Y109 HydrophobicContact CB-CD1 4.43Å; E80-Y109 HydrophobicContact CB-CD2 4.36Å; E80-Y109 HydrophobicContact CB-CE1 4.13Å; E80-Y109 HydrophobicContact CB-CE2 4.03Å; E80-Y109 HydrophobicContact CG-CD1 3.8Å; E80-Y109 HydrophobicContact CG-CD2 4.13Å; E80-Y109 HydrophobicContact CG-CE1 3.97Å; E80-Y109 HydrophobicContact CG-CE2 4.26Å; E80-Y109 HydrophobicContact CG-CG 3.9Å; E80-Y109 WeakPolarHBondContact OE2-CD1 3.38Å; E80-Y109 WeakPolarHBondContact OE2-CE1 3.43Å; A104-Y109 PolarHBondContact O-N 3.07Å; A104-Y109 VanDerWaalsContact O-N 3.11Å; K107-Y109 HydrophobicContact CB-CD1 4.11Å; K107-Y109 HydrophobicContact CB-CD2 3.7Å; K107-Y109 HydrophobicContact CB-CE1 3.87Å; K107-Y109 HydrophobicContact CB-CE2 3.45Å; K107-Y109 VanDerWaalsContact CB-CE2 3.45Å; K107-Y109 HydrophobicContact CB-CG 4.02Å; K107-Y109 HydrophobicContact CG-CD2 4.37Å; K107-Y109 HydrophobicContact CG-CE2 3.77Å; Y109-R111 PolarHBondContact O-N 3.28Å; Y109-I112 HydrophobicContact CD2-CD1 4.05Å; Y109-I112 HydrophobicContact CG-CD1 4.32Å; Y109-I112 PolarHBondContact O-N 2.91Å; Y109-V113 WeakPolarHBondContact O-CG2 3.37Å; Y109-V113 PolarHBondContact O-N 3.11Å
110	V	91.3	Very high	90.3	Very high	31 Å²	31	35.9 Å²	35.9	19%	0.188	20%	0.199	C	C	.	.	H	α-helix	trans	-57.9	-47.2	-173	-175.4	0	0	0	0	112.4	G108 I112 V113 E114 E169 I170 I173	G108-V110 PolarHBondContact O-N 3.19Å; V110-I112 PolarHBondContact O-N 3.32Å; V110-V113 PolarHBondContact O-N 3.09Å; V110-E114 PolarHBondContact O-N 3.14Å; V110-E169 HydrophobicContact CG1-CB 4.32Å; V110-E169 HydrophobicContact CG2-CB 4.19Å; V110-I170 HydrophobicContact CG2-CG1 4.19Å; V110-I173 HydrophobicContact CG1-CD1 3.83Å
111	R	90.7	Very high	89.7	Confident	176 Å²	176	37.1 Å²	37.1	66%	0.664	21%	0.209	S	C	*	.	H	α-helix	trans	-65.5	-39.5	-176.7	-59.4	-169	71.3	177.9	-2	112.6	L82 Y109 E114 A115	L82-R111 HydrophobicContact CD1-CB 4.25Å; L82-R111 HydrophobicContact CD2-CB 4.11Å; Y109-R111 PolarHBondContact O-N 3.28Å; R111-E114 PolarHBondContact O-N 3.06Å; R111-A115 PolarHBondContact O-N 2.97Å
112	I	92.3	Very high	89	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-67.4	-41.7	176.7	-66.5	179.3	0	0	0	110.3	V77 E80 L82 T85 A104 Y109 V110 E114 A115 I116	V77-I112 HydrophobicContact CG1-CG2 4.13Å; V77-I112 HydrophobicContact CG2-CG2 3.91Å; E80-I112 HydrophobicContact CB-CD1 4.32Å; E80-I112 HydrophobicContact CG-CD1 3.75Å; L82-I112 HydrophobicContact CB-CG1 4.38Å; L82-I112 HydrophobicContact CD1-CG1 3.91Å; T85-I112 HydrophobicContact CG2-CG2 4.26Å; A104-I112 HydrophobicContact CB-CG2 3.97Å; Y109-I112 HydrophobicContact CD2-CD1 4.05Å; Y109-I112 HydrophobicContact CG-CD1 4.32Å; Y109-I112 PolarHBondContact O-N 2.91Å; V110-I112 PolarHBondContact O-N 3.32Å; I112-E114 VanDerWaalsContact C-N 3.32Å; I112-E114 PolarHBondContact O-N 3.03Å; I112-A115 PolarHBondContact O-N 3.03Å; I112-I116 HydrophobicContact CG2-CD1 3.73Å; I112-I116 HydrophobicContact CG2-CG1 4.31Å; I112-I116 VanDerWaalsContact O-CG1 3.3Å; I112-I116 WeakPolarHBondContact O-CG1 3.43Å; I112-I116 PolarHBondContact O-N 3.35Å
113	V	93	Very high	87.9	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.4	-43.5	174.5	169.9	0	0	0	0	111	L101 A104 I105 Y109 V110 I116 L117 I170	L101-V113 HydrophobicContact CD1-CG1 4.08Å; L101-V113 HydrophobicContact CD1-CG2 4.41Å; A104-V113 HydrophobicContact CB-CG2 3.63Å; I105-V113 HydrophobicContact CG1-CG2 3.95Å; Y109-V113 WeakPolarHBondContact O-CG2 3.37Å; Y109-V113 PolarHBondContact O-N 3.11Å; V110-V113 PolarHBondContact O-N 3.09Å; V113-I116 PolarHBondContact O-N 3.35Å; V113-L117 HydrophobicContact CG1-CD1 3.67Å; V113-L117 HydrophobicContact CG1-CG 4.21Å; V113-L117 VanDerWaalsContact O-CB 3.32Å; V113-L117 WeakPolarHBondContact O-CB 3.34Å; V113-L117 VanDerWaalsContact O-CG 3.22Å; V113-L117 WeakPolarHBondContact O-CG 3.34Å; V113-L117 PolarHBondContact O-N 3.4Å; V113-I170 HydrophobicContact CG1-CG2 4.35Å; V113-I170 HydrophobicContact CG2-CD1 4.24Å
114	E	91.9	Very high	86.7	Confident	105 Å²	105	43.9 Å²	43.9	49%	0.491	28%	0.279	S	S	.	.	H	α-helix	trans	-62.4	-43.6	175.7	-71.8	-173.8	158.5	0	0	112.5	V110 R111 I112 L117 G118 I173	V110-E114 PolarHBondContact O-N 3.14Å; R111-E114 PolarHBondContact O-N 3.06Å; I112-E114 VanDerWaalsContact C-N 3.32Å; I112-E114 PolarHBondContact O-N 3.03Å; E114-L117 PolarHBondContact O-N 3.1Å; E114-G118 PolarHBondContact O-N 3.03Å; E114-I173 HydrophobicContact CG-CD1 3.71Å; E114-I173 WeakPolarHBondContact OE1-CD1 3.1Å
115	A	90.9	Very high	85.4	Confident	24 Å²	24	45.2 Å²	45.2	20%	0.198	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-45.7	176.7	0	0	0	0	0	111.7	L82 E86 L89 R111 I112 G118	L82-A115 HydrophobicContact CD1-CB 4.26Å; E86-A115 HydrophobicContact CG-CB 4.36Å; L89-A115 HydrophobicContact CD1-CB 4.33Å; R111-A115 PolarHBondContact O-N 2.97Å; I112-A115 PolarHBondContact O-N 3.03Å; A115-G118 PolarHBondContact O-N 3.01Å
116	I	90.8	Very high	84.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-65.5	-43.6	177.9	-65.9	170.3	0	0	0	111.1	V77 T85 L89 I97 L101 A104 I112 V113 G118 H119 F122	V77-I116 HydrophobicContact CG2-CD1 4.18Å; T85-I116 HydrophobicContact CG2-CG1 4.47Å; L89-I116 HydrophobicContact CD1-CG1 4.01Å; I97-I116 HydrophobicContact CG2-CG2 3.85Å; L101-I116 HydrophobicContact CB-CG2 4.04Å; L101-I116 HydrophobicContact CD1-CB 4.44Å; L101-I116 HydrophobicContact CD1-CG2 4.1Å; A104-I116 HydrophobicContact CB-CD1 4.39Å; I112-I116 HydrophobicContact CG2-CD1 3.73Å; I112-I116 HydrophobicContact CG2-CG1 4.31Å; I112-I116 VanDerWaalsContact O-CG1 3.3Å; I112-I116 WeakPolarHBondContact O-CG1 3.43Å; I112-I116 PolarHBondContact O-N 3.35Å; V113-I116 PolarHBondContact O-N 3.35Å; I116-G118 PolarHBondContact O-N 2.97Å; I116-H119 WeakPolarHBondContact O-CB 3.3Å; I116-H119 PolarHBondContact O-N 3.16Å; I116-H119 VanDerWaalsContact O-N 3.08Å; I116-F122 HydrophobicContact CG2-CD2 4.4Å; I116-F122 HydrophobicContact CG2-CE2 3.58Å; I116-F122 HydrophobicContact CG2-CZ 4.17Å; I116-F122 VanDerWaalsContact O-CD2 3.28Å; I116-F122 WeakPolarHBondContact O-CD2 3.4Å
117	L	89.3	Confident	83.2	Confident	10 Å²	10	51.1 Å²	51.1	5%	0.052	31%	0.314	C	S	.	.	H	α-helix	trans	-69.9	-15.4	177.6	-70.2	175.6	0	0	0	113.5	L101 V113 E114 H119 F122 L128 I173 L174	L101-L117 HydrophobicContact CD1-CD2 4.29Å; L101-L117 HydrophobicContact CD1-CG 4.27Å; L101-L117 HydrophobicContact CD2-CD2 4.12Å; V113-L117 HydrophobicContact CG1-CD1 3.67Å; V113-L117 HydrophobicContact CG1-CG 4.21Å; V113-L117 VanDerWaalsContact O-CB 3.32Å; V113-L117 WeakPolarHBondContact O-CB 3.34Å; V113-L117 VanDerWaalsContact O-CG 3.22Å; V113-L117 WeakPolarHBondContact O-CG 3.34Å; V113-L117 PolarHBondContact O-N 3.4Å; E114-L117 PolarHBondContact O-N 3.1Å; L117-H119 VanDerWaalsContact C-N 3.3Å; L117-F122 HydrophobicContact CD2-CG 4.44Å; L117-L128 HydrophobicContact CD2-CD1 4.31Å; L117-L128 HydrophobicContact CD2-CD2 3.84Å; L117-I173 HydrophobicContact CD1-CG2 3.62Å; L117-L174 HydrophobicContact CD1-CD2 3.97Å; L117-L174 HydrophobicContact CD2-CD2 4.33Å
118	G	86.8	Confident	82.6	Confident	60 Å²	60	45.8 Å²	45.8	62%	0.619	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-16.6	170.2	0	0	0	0	0	113.6	E114 A115 I116	E114-G118 PolarHBondContact O-N 3.03Å; A115-G118 PolarHBondContact O-N 3.01Å; I116-G118 PolarHBondContact O-N 2.97Å
119	H	86.7	Confident	81.6	Confident	23 Å²	23	47.4 Å²	47.4	11%	0.106	30%	0.303	C	S	.	.	S	Bend	trans	-68.3	139.2	-178.7	-171.8	-92.3	0	0	0	111.8	L89 I116 L117 A121 F122	L89-H119 PolarHBondContact O-CD2 3.45Å; I116-H119 WeakPolarHBondContact O-CB 3.3Å; I116-H119 PolarHBondContact O-N 3.16Å; I116-H119 VanDerWaalsContact O-N 3.08Å; L117-H119 VanDerWaalsContact C-N 3.3Å; H119-A121 WeakPolarHBondContact ND1-CB 3.41Å; H119-A121 PolarHBondContact ND1-N 3.38Å; H119-A121 VanDerWaalsContact ND1-N 3.15Å; H119-A121 PolarHBondContact O-N 3.43Å; H119-F122 HydrophobicContact CB-CD2 4.45Å; H119-F122 PolarHBondContact O-N 3.14Å
120	P	82.6	Confident	80.6	Confident	100 Å²	100	48.2 Å²	48.2	65%	0.649	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-57.4	-24.9	-177.3	20.8	-33.9	0	0	0	114	F122 G123	P120-F122 PolarHBondContact O-N 2.93Å; P120-F122 VanDerWaalsContact O-N 3.07Å; P120-G123 PolarHBondContact O-N 3.26Å
121	A	76.8	Confident	79.5	Confident	25 Å²	25	47.4 Å²	47.4	21%	0.207	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-57.9	-20.6	175	0	0	0	0	0	114.2	H119 R127 F142	H119-A121 WeakPolarHBondContact ND1-CB 3.41Å; H119-A121 PolarHBondContact ND1-N 3.38Å; H119-A121 VanDerWaalsContact ND1-N 3.15Å; H119-A121 PolarHBondContact O-N 3.43Å; A121-R127 WeakPolarHBondContact O-CD 3.5Å; A121-R127 PolarHBondContact O-NH1 2.98Å; A121-R127 VanDerWaalsContact O-NH1 3.12Å; A121-F142 HydrophobicContact CB-CE2 4.24Å
122	F	77.5	Confident	78.3	Confident	11 Å²	11	39.3 Å²	39.3	5%	0.048	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-105.3	0.2	178	-65.9	-77.4	0	0	0	114	I97 L101 I116 L117 H119 P120 G124 G125 L128 F142	I97-F122 HydrophobicContact CG2-CE2 3.73Å; I97-F122 HydrophobicContact CG2-CZ 4.23Å; L101-F122 HydrophobicContact CB-CZ 4.43Å; L101-F122 HydrophobicContact CD2-CE1 3.76Å; L101-F122 HydrophobicContact CD2-CZ 3.75Å; I116-F122 HydrophobicContact CG2-CD2 4.4Å; I116-F122 HydrophobicContact CG2-CE2 3.58Å; I116-F122 HydrophobicContact CG2-CZ 4.17Å; I116-F122 VanDerWaalsContact O-CD2 3.28Å; I116-F122 WeakPolarHBondContact O-CD2 3.4Å; L117-F122 HydrophobicContact CD2-CG 4.44Å; H119-F122 HydrophobicContact CB-CD2 4.45Å; H119-F122 PolarHBondContact O-N 3.14Å; P120-F122 PolarHBondContact O-N 2.93Å; P120-F122 VanDerWaalsContact O-N 3.07Å; F122-G124 PolarHBondContact O-N 3.45Å; F122-G125 PolarHBondContact O-N 3Å; F122-L128 HydrophobicContact CD1-CD2 3.91Å; F122-L128 HydrophobicContact CD1-CG 4.31Å; F122-L128 HydrophobicContact CE1-CD2 4.19Å; F122-F142 HydrophobicContact CD1-CZ 4.41Å; F122-F142 AromaticContact CE1-CE1 3.76Å; F122-F142 HydrophobicContact CE1-CE1 3.76Å; F122-F142 AromaticContact CE1-CZ 3.6Å; F122-F142 HydrophobicContact CE1-CZ 3.6Å; F122-F142 HydrophobicContact CE2-CZ 4Å; F122-F142 AromaticContact CZ-CE1 3.81Å; F122-F142 HydrophobicContact CZ-CE1 3.81Å; F122-F142 AromaticContact CZ-CZ 3.37Å; F122-F142 HydrophobicContact CZ-CZ 3.37Å
123	G	66.6	Low	76.9	Confident	74 Å²	74	42.5 Å²	42.5	76%	0.763	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.5	-171.7	0	0	0	0	0	115.9	P120	P120-G123 PolarHBondContact O-N 3.26Å
124	G	66.3	Low	75.5	Confident	73 Å²	73	46 Å²	46	75%	0.753	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-4.6	-179.9	0	0	0	0	0	116.1	F122 L126	F122-G124 PolarHBondContact O-N 3.45Å; G124-L126 PolarHBondContact O-N 3.35Å
125	G	66.1	Low	73.9	Confident	28 Å²	28	42 Å²	42	29%	0.289	29%	0.289	S	S	.	.	S	Bend	trans	66.8	-24.4	179.9	0	0	0	0	0	116.4	F122 R127 L128	F122-G125 PolarHBondContact O-N 3Å; G125-R127 VanDerWaalsContact C-N 3.29Å; G125-R127 PolarHBondContact O-N 3.37Å; G125-L128 WeakPolarHBondContact O-CB 3.19Å; G125-L128 PolarHBondContact O-N 3.42Å
126	L	67.4	Low	72.1	Confident	93 Å²	93	45.5 Å²	45.5	49%	0.487	30%	0.302	S	S	.	.	H	α-helix	trans	-58.4	-38	-176.9	-166.2	75.2	0	0	0	112.8	G124 L128 A129 L130	G124-L126 PolarHBondContact O-N 3.35Å; L126-L128 PolarHBondContact O-N 3.22Å; L126-A129 PolarHBondContact O-N 2.95Å; L126-L130 HydrophobicContact CD1-CD1 4.45Å; L126-L130 HydrophobicContact CD2-CD1 4.17Å; L126-L130 HydrophobicContact CG-CD1 3.82Å; L126-L130 HydrophobicContact CG-CG 4.42Å; L126-L130 WeakPolarHBondContact O-CG 3.49Å; L126-L130 PolarHBondContact O-N 2.9Å; L126-L130 VanDerWaalsContact O-N 3.17Å
127	R	73.1	Confident	70.3	Confident	80 Å²	80	53.8 Å²	53.8	30%	0.302	34%	0.343	S	S	.	.	H	α-helix	trans	-69.8	-17.6	178.2	-71	-178.1	170.9	167.6	-12.4	113.8	A121 G125 Q135 D140 Y143	A121-R127 WeakPolarHBondContact O-CD 3.5Å; A121-R127 PolarHBondContact O-NH1 2.98Å; A121-R127 VanDerWaalsContact O-NH1 3.12Å; G125-R127 VanDerWaalsContact C-N 3.29Å; G125-R127 PolarHBondContact O-N 3.37Å; R127-Q135 PolarHBondContact O-NE2 2.94Å; R127-D140 IonicContact NH2-OD2 3.08Å; R127-D140 PolarHBondContact NH2-OD2 3.1Å; R127-D140 VanDerWaalsContact NH2-OD2 3.08Å; R127-Y143 PolarHBondContact O-OH 3.45Å
128	L	73.9	Confident	68.7	Low	3 Å²	3	60.6 Å²	60.6	2%	0.016	37%	0.368	C	S	.	.	H	α-helix	trans	-86.3	-22.3	176.1	-62.7	170.1	0	0	0	112.5	L101 L117 F122 G125 L126 P158 L174 K177 A179	L101-L128 HydrophobicContact CD2-CD2 4.19Å; L117-L128 HydrophobicContact CD2-CD1 4.31Å; L117-L128 HydrophobicContact CD2-CD2 3.84Å; F122-L128 HydrophobicContact CD1-CD2 3.91Å; F122-L128 HydrophobicContact CD1-CG 4.31Å; F122-L128 HydrophobicContact CE1-CD2 4.19Å; G125-L128 WeakPolarHBondContact O-CB 3.19Å; G125-L128 PolarHBondContact O-N 3.42Å; L126-L128 PolarHBondContact O-N 3.22Å; L128-P158 HydrophobicContact CD2-CG 4.36Å; L128-L174 HydrophobicContact CD2-CD2 4.33Å; L128-K177 HydrophobicContact CD1-CB 4.12Å; L128-A179 HydrophobicContact CB-CB 4.21Å
129	A	67.6	Low	67.1	Low	51 Å²	51	65.5 Å²	65.5	42%	0.421	38%	0.379	S	S	.	.	H	α-helix	trans	-92.7	-37.3	-178.6	0	0	0	0	0	112.7	L126	L126-A129 PolarHBondContact O-N 2.95Å
130	L	71.2	Confident	66	Low	43 Å²	43	69 Å²	69	23%	0.225	40%	0.399	C	S	.	.	S	Bend	trans	-75.8	139.8	-178.5	-68.1	171.2	0	0	0	111.7	L126 Q135	L126-L130 HydrophobicContact CD1-CD1 4.45Å; L126-L130 HydrophobicContact CD2-CD1 4.17Å; L126-L130 HydrophobicContact CG-CD1 3.82Å; L126-L130 HydrophobicContact CG-CG 4.42Å; L126-L130 WeakPolarHBondContact O-CG 3.49Å; L126-L130 PolarHBondContact O-N 2.9Å; L126-L130 VanDerWaalsContact O-N 3.17Å; L130-Q135 HydrophobicContact CB-CG 3.69Å; L130-Q135 HydrophobicContact CD1-CG 4.28Å; L130-Q135 PolarHBondContact O-NE2 3.28Å
131	S	68.6	Low	65.6	Low	14 Å²	14	69.8 Å²	69.8	10%	0.098	40%	0.398	C	S	.	.			trans	-68.6	149.4	171.6	63.7	0	0	0	0	111.6	L133 E134 Q135	S131-L133 PolarHBondContact O-N 2.86Å; S131-E134 PolarHBondContact N-OE2 3.4Å; S131-E134 PolarHBondContact O-N 3.36Å; S131-E134 WeakPolarHBondContact OG-CB 3.33Å; S131-E134 VanDerWaalsContact OG-CG 3.31Å; S131-E134 WeakPolarHBondContact OG-CG 3.35Å; S131-E134 PolarHBondContact OG-N 3.44Å; S131-E134 PolarHBondContact OG-OE2 3.44Å; S131-Q135 WeakPolarHBondContact O-CG 3.25Å; S131-Q135 PolarHBondContact O-N 2.97Å; S131-Q135 VanDerWaalsContact O-N 3.07Å
132	P	64.6	Low	65.8	Low	7 Å²	7	69.4 Å²	69.4	5%	0.045	39%	0.392	C	S	.	.	H	α-helix	trans	-48.7	-40.1	171.3	-28.1	31.2	0	0	0	113.3	E134 Q135 E136 Y143 H154	P132-E134 VanDerWaalsContact C-N 3.35Å; P132-E134 PolarHBondContact O-N 3.27Å; P132-Q135 CarbonylContact O-C 3.5Å; P132-Q135 WeakPolarHBondContact O-CA 3.22Å; P132-Q135 PolarHBondContact O-N 2.89Å; P132-E136 WeakPolarHBondContact O-CG 3.14Å; P132-E136 PolarHBondContact O-N 3.17Å; P132-Y143 HydrophobicContact CB-CD2 4.4Å; P132-Y143 HydrophobicContact CB-CG 4.46Å; P132-Y143 HydrophobicContact CG-CD2 4.24Å; P132-Y143 HydrophobicContact CG-CG 4.21Å; P132-H154 HydrophobicContact CB-CB 4.49Å; P132-H154 WeakPolarHBondContact CB-O 3.38Å; P132-H154 WeakPolarHBondContact CD-O 3.41Å
133	L	62.5	Low	66.1	Low	69 Å²	69	69.5 Å²	69.5	36%	0.361	39%	0.392	S	S	.	.	H	α-helix	trans	-61.9	-36.4	177.1	-169.5	71.6	0	0	0	113.8	S131 Q135 H154	S131-L133 PolarHBondContact O-N 2.86Å; L133-Q135 VanDerWaalsContact C-N 3.31Å; L133-H154 HydrophobicContact CB-CB 3.94Å; L133-H154 HydrophobicContact CD1-CB 4.24Å; L133-H154 PolarHBondContact N-O 2.89Å
134	E	63.7	Low	66.7	Low	72 Å²	72	66.8 Å²	66.8	34%	0.336	36%	0.362	S	S	.	.	H	α-helix	trans	-80.8	-17.4	176.9	-72	157	172.4	0	0	112	S131 P132 K197	S131-E134 PolarHBondContact N-OE2 3.4Å; S131-E134 PolarHBondContact O-N 3.36Å; S131-E134 WeakPolarHBondContact OG-CB 3.33Å; S131-E134 VanDerWaalsContact OG-CG 3.31Å; S131-E134 WeakPolarHBondContact OG-CG 3.35Å; S131-E134 PolarHBondContact OG-N 3.44Å; S131-E134 PolarHBondContact OG-OE2 3.44Å; P132-E134 VanDerWaalsContact C-N 3.35Å; P132-E134 PolarHBondContact O-N 3.27Å; E134-K197 IonicContact OE1-NZ 3.35Å; E134-K197 PolarHBondContact OE1-NZ 2.85Å
135	Q	59.2	Low	67.3	Low	22 Å²	22	65.1 Å²	65.1	10%	0.103	33%	0.333	C	S	.	.	H	α-helix	trans	-90.2	-25	176.2	-66.8	-177.8	24.5	0	0	113.3	R127 L130 S131 P132 L133 M137 R138 Y143	R127-Q135 PolarHBondContact O-NE2 2.94Å; L130-Q135 HydrophobicContact CB-CG 3.69Å; L130-Q135 HydrophobicContact CD1-CG 4.28Å; L130-Q135 PolarHBondContact O-NE2 3.28Å; S131-Q135 WeakPolarHBondContact O-CG 3.25Å; S131-Q135 PolarHBondContact O-N 2.97Å; S131-Q135 VanDerWaalsContact O-N 3.07Å; P132-Q135 CarbonylContact O-C 3.5Å; P132-Q135 WeakPolarHBondContact O-CA 3.22Å; P132-Q135 PolarHBondContact O-N 2.89Å; L133-Q135 VanDerWaalsContact C-N 3.31Å; Q135-M137 PolarHBondContact O-N 2.77Å; Q135-M137 VanDerWaalsContact O-N 3.13Å; Q135-R138 WeakPolarHBondContact O-CA 3.3Å; Q135-R138 VanDerWaalsContact O-CB 3.28Å; Q135-R138 WeakPolarHBondContact O-CB 3.43Å; Q135-R138 PolarHBondContact O-N 2.93Å; Q135-Y143 VanDerWaalsContact OE1-CE2 3.23Å
136	E	53.5	Low	67.8	Low	97 Å²	97	65.8 Å²	65.8	45%	0.453	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-57	-25.6	175.3	-83.1	169.1	-161.9	0	0	112.9	P132 R138 D139 H154	P132-E136 WeakPolarHBondContact O-CG 3.14Å; P132-E136 PolarHBondContact O-N 3.17Å; E136-R138 PolarHBondContact O-N 3.48Å; E136-D139 PolarHBondContact O-N 3.44Å; E136-H154 IonicContact OE1-CE1 3.83Å; E136-H154 PolarHBondContact OE1-CE1 3.49Å; E136-H154 IonicContact OE1-CG 2.97Å; E136-H154 IonicContact OE1-ND1 3.33Å; E136-H154 PolarHBondContact OE1-ND1 2.96Å
137	M	52	Low	68	Low	175 Å²	175	70.4 Å²	70.4	86%	0.862	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-67	-4.4	171.5	-61.6	-129.2	77.8	0	0	113.8	Q135	Q135-M137 PolarHBondContact O-N 2.77Å; Q135-M137 VanDerWaalsContact O-N 3.13Å
138	R	55.9	Low	68	Low	153 Å²	153	74.1 Å²	74.1	58%	0.577	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-109.5	5.6	-179.7	-57.8	-174.1	178.9	-165.1	-0.3	114.2	Q135 E136 D140	Q135-R138 WeakPolarHBondContact O-CA 3.3Å; Q135-R138 VanDerWaalsContact O-CB 3.28Å; Q135-R138 WeakPolarHBondContact O-CB 3.43Å; Q135-R138 PolarHBondContact O-N 2.93Å; E136-R138 PolarHBondContact O-N 3.48Å; R138-D140 PolarHBondContact O-N 2.94Å
139	D	53.3	Low	68.2	Low	162 Å²	162	75.2 Å²	75.2	87%	0.866	39%	0.387	S	S	*	.			trans	57.3	36.6	165.3	-119.3	8.9	0	0	0	115.5	E136	E136-D139 PolarHBondContact O-N 3.44Å
140	D	64.5	Low	68.9	Low	98 Å²	98	74.3 Å²	74.3	52%	0.524	38%	0.376	S	S	.	.			trans	-112.6	125.7	173.3	-73	-26.7	0	0	0	109.4	R127 R138 F142	R127-D140 IonicContact NH2-OD2 3.08Å; R127-D140 PolarHBondContact NH2-OD2 3.1Å; R127-D140 VanDerWaalsContact NH2-OD2 3.08Å; R138-D140 PolarHBondContact O-N 2.94Å; D140-F142 HydrophobicContact CB-CB 4.15Å; D140-F142 PolarHBondContact O-N 3.01Å
141	D	73.1	Confident	69.6	Low	115 Å²	115	75.9 Å²	75.9	62%	0.615	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	38.5	171.4	-72	-25.9	0	0	0	113	R96 A144	R96-D141 WeakPolarHBondContact CA-O 3.33Å; R96-D141 WeakPolarHBondContact CG-O 3.39Å; R96-D141 PolarHBondContact N-O 3.36Å; D141-A144 HydrophobicContact CB-CB 4.33Å
142	F	81.9	Confident	70.5	Confident	18 Å²	18	77.4 Å²	77.4	8%	0.079	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-43	-167.5	-169.7	-100.1	0	0	0	112.3	R96 I97 G98 D99 A121 F122 D140	R96-F142 CarbonylContact C-O 3.59Å; R96-F142 WeakPolarHBondContact CA-O 3.32Å; I97-F142 HydrophobicContact CB-CE2 3.95Å; I97-F142 HydrophobicContact CB-CZ 4.33Å; G98-F142 WeakPolarHBondContact CA-O 3.28Å; G98-F142 PolarHBondContact N-O 2.9Å; D99-F142 PolarHBondContact N-O 3.08Å; A121-F142 HydrophobicContact CB-CE2 4.24Å; F122-F142 HydrophobicContact CD1-CZ 4.41Å; F122-F142 AromaticContact CE1-CE1 3.76Å; F122-F142 HydrophobicContact CE1-CE1 3.76Å; F122-F142 AromaticContact CE1-CZ 3.6Å; F122-F142 HydrophobicContact CE1-CZ 3.6Å; F122-F142 HydrophobicContact CE2-CZ 4Å; F122-F142 AromaticContact CZ-CE1 3.81Å; F122-F142 HydrophobicContact CZ-CE1 3.81Å; F122-F142 AromaticContact CZ-CZ 3.37Å; F122-F142 HydrophobicContact CZ-CZ 3.37Å; D140-F142 HydrophobicContact CB-CB 4.15Å; D140-F142 PolarHBondContact O-N 3.01Å
143	Y	82.2	Confident	71.5	Confident	13 Å²	13	79.2 Å²	79.2	5%	0.051	40%	0.397	C	S	.	.	S	Bend	trans	-104.3	-0.3	178	-77.2	-69.5	0	0	0	113.7	G98 L102 R127 P132 Q135 T150	G98-Y143 VanDerWaalsContact CA-CE1 3.48Å; G98-Y143 WeakPolarHBondContact O-CD1 3.29Å; G98-Y143 WeakPolarHBondContact O-CE1 3.2Å; L102-Y143 HydrophobicContact CD1-CD1 3.63Å; L102-Y143 HydrophobicContact CD1-CE1 3.96Å; L102-Y143 HydrophobicContact CG-CD1 4.12Å; L102-Y143 HydrophobicContact CG-CE1 4Å; R127-Y143 PolarHBondContact O-OH 3.45Å; P132-Y143 HydrophobicContact CB-CD2 4.4Å; P132-Y143 HydrophobicContact CB-CG 4.46Å; P132-Y143 HydrophobicContact CG-CD2 4.24Å; P132-Y143 HydrophobicContact CG-CG 4.21Å; Q135-Y143 VanDerWaalsContact OE1-CE2 3.23Å; Y143-T150 WeakPolarHBondContact O-CG2 3.38Å
144	A	80.4	Confident	72.4	Confident	16 Å²	16	79.4 Å²	79.4	13%	0.132	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-63.8	134.7	177	0	0	0	0	0	110.6	R96 D141	R96-A144 VanDerWaalsContact CD-O 3.3Å; R96-A144 WeakPolarHBondContact CD-O 3.27Å; R96-A144 VanDerWaalsContact CG-O 3.31Å; R96-A144 WeakPolarHBondContact CG-O 3.35Å; D141-A144 HydrophobicContact CB-CB 4.33Å
145	Y	78.4	Confident	73.3	Confident	39 Å²	39	76.7 Å²	76.7	15%	0.153	38%	0.384	C	S	.	.	S	Bend	trans	-85.7	-51.8	174.2	168.9	-105.4	0	0	0	109.9	Q70 Q74 R96 G149 R151	Q70-Y145 HydrophobicContact CG-CE2 4.03Å; Q70-Y145 PolarHBondContact NE2-OH 3.25Å; Q74-Y145 PolarHBondContact NE2-O 3.49Å; R96-Y145 PolarHBondContact NH1-O 3.01Å; Y145-G149 PolarHBondContact N-O 2.86Å; Y145-R151 HydrophobicContact CD2-CB 4.33Å; Y145-R151 VanDerWaalsContact CE2-NH2 3.25Å; Y145-R151 HydrophobicContact CG-CB 4.22Å
146	D	77.3	Confident	74.8	Confident	42 Å²	42	76.3 Å²	76.3	23%	0.225	38%	0.382	C	S	.	.	S	Bend	trans	-132.3	-167.7	175.4	55	16	0	0	0	109.9	D148 G149	D146-D148 PolarHBondContact OD1-N 2.92Å; D146-G149 PolarHBondContact N-O 3.45Å; D146-G149 PolarHBondContact OD1-N 3.18Å
147	E	71.7	Confident	76.5	Confident	190 Å²	190	72.2 Å²	72.2	89%	0.888	36%	0.364	S	S	*	.	S	Bend	trans	-74.8	-15.4	174.6	-62.3	-165.3	171.6	0	0	112.8
148	D	72.3	Confident	78.4	Confident	157 Å²	157	63.9 Å²	63.9	84%	0.84	32%	0.323	S	S	*	.	S	Bend	trans	-92.4	-21.6	-174.2	-69.2	-36	0	0	0	112.9	D146	D146-D148 PolarHBondContact OD1-N 2.92Å
149	G	77.6	Confident	80.2	Confident	26 Å²	26	56.7 Å²	56.7	27%	0.268	30%	0.296	S	S	.	.			trans	165.3	-160.1	171.8	0	0	0	0	0	116.7	Y145 D146	Y145-G149 PolarHBondContact N-O 2.86Å; D146-G149 PolarHBondContact N-O 3.45Å; D146-G149 PolarHBondContact OD1-N 3.18Å
150	T	83.8	Confident	82.1	Confident	32 Å²	32	49.6 Å²	49.6	20%	0.196	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-95.6	149.9	178.7	59.3	0	0	0	0	111.2	Y143 F152 H154	Y143-T150 WeakPolarHBondContact O-CG2 3.38Å; T150-F152 PolarHBondContact O-N 3.36Å; T150-F152 PolarHBondContact OG1-O 2.98Å; T150-H154 PolarHBondContact OG1-CE1 2.99Å; T150-H154 VanDerWaalsContact OG1-CE1 3.31Å; T150-H154 PolarHBondContact OG1-ND1 3.36Å
151	R	84.5	Confident	83.6	Confident	76 Å²	76	45.4 Å²	45.4	29%	0.287	24%	0.235	S	C	.	.	S	Bend	trans	-63.4	-40.7	-179.7	-179.8	179.9	-60.5	-164.7	5.8	113.6	D99 L103 Y145	D99-R151 VanDerWaalsContact OD1-CB 3.23Å; D99-R151 WeakPolarHBondContact OD1-CB 3.49Å; D99-R151 IonicContact OD1-NE 3.12Å; D99-R151 IonicContact OD2-CZ 3.25Å; D99-R151 IonicContact OD2-NE 3.72Å; D99-R151 IonicContact OD2-NH2 2.96Å; D99-R151 PolarHBondContact OD2-NH2 3.44Å; D99-R151 VanDerWaalsContact OD2-NH2 3.1Å; L103-R151 VanDerWaalsContact CB-NH1 3.33Å; L103-R151 VanDerWaalsContact CG-NH1 3.34Å; Y145-R151 HydrophobicContact CD2-CB 4.33Å; Y145-R151 VanDerWaalsContact CE2-NH2 3.25Å; Y145-R151 HydrophobicContact CG-CB 4.22Å
152	F	88	Confident	84.6	Confident	47 Å²	47	39.9 Å²	39.9	21%	0.206	21%	0.206	C	C	.	.	S	Bend	trans	-107	164.5	177.9	-61.7	-74.8	0	0	0	109.1	L102 T150 I156 L161	L102-F152 HydrophobicContact CB-CD2 3.82Å; L102-F152 HydrophobicContact CB-CE2 3.77Å; L102-F152 HydrophobicContact CD1-CD2 4.02Å; L102-F152 HydrophobicContact CG-CD2 4.45Å; T150-F152 PolarHBondContact O-N 3.36Å; T150-F152 PolarHBondContact OG1-O 2.98Å; F152-I156 HydrophobicContact CB-CB 4.44Å; F152-I156 HydrophobicContact CB-CD1 4.11Å; F152-L161 HydrophobicContact CD1-CD1 4.22Å; F152-L161 HydrophobicContact CD2-CD2 4.02Å; F152-L161 HydrophobicContact CE1-CD1 4Å; F152-L161 HydrophobicContact CE1-CD2 4.41Å; F152-L161 HydrophobicContact CE2-CD2 3.68Å; F152-L161 HydrophobicContact CZ-CD1 4.25Å; F152-L161 HydrophobicContact CZ-CD2 3.89Å
153	S	85.6	Confident	85.2	Confident	44 Å²	44	39 Å²	39	31%	0.308	20%	0.202	S	C	.	.			trans	-61.7	141.5	177.3	62.8	0	0	0	0	110.9	D155 I156 N211	S153-D155 WeakPolarHBondContact CB-OD1 3.23Å; S153-D155 PolarHBondContact O-N 3.38Å; S153-D155 PolarHBondContact OG-OD1 3.43Å; S153-I156 WeakPolarHBondContact O-CB 3.32Å; S153-I156 PolarHBondContact O-N 2.93Å; S153-I156 WeakPolarHBondContact OG-CD1 3.46Å; S153-I156 WeakPolarHBondContact OG-CG1 3.44Å; S153-N211 PolarHBondContact OG-ND2 2.81Å
154	H	81.6	Confident	85.8	Confident	73 Å²	73	40.1 Å²	40.1	34%	0.338	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-9.9	-170	-53.2	-95	0	0	0	114.8	P132 L133 E136 T150	P132-H154 HydrophobicContact CB-CB 4.49Å; P132-H154 WeakPolarHBondContact CB-O 3.38Å; P132-H154 WeakPolarHBondContact CD-O 3.41Å; L133-H154 HydrophobicContact CB-CB 3.94Å; L133-H154 HydrophobicContact CD1-CB 4.24Å; L133-H154 PolarHBondContact N-O 2.89Å; E136-H154 IonicContact OE1-CE1 3.83Å; E136-H154 PolarHBondContact OE1-CE1 3.49Å; E136-H154 IonicContact OE1-CG 2.97Å; E136-H154 IonicContact OE1-ND1 3.33Å; E136-H154 PolarHBondContact OE1-ND1 2.96Å; T150-H154 PolarHBondContact OG1-CE1 2.99Å; T150-H154 VanDerWaalsContact OG1-CE1 3.31Å; T150-H154 PolarHBondContact OG1-ND1 3.36Å
155	D	82.8	Confident	86.4	Confident	16 Å²	16	41.3 Å²	41.3	9%	0.086	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-12.1	176.7	60.1	-60.3	0	0	0	113.8	S153 T157 S208 N211	S153-D155 WeakPolarHBondContact CB-OD1 3.23Å; S153-D155 PolarHBondContact O-N 3.38Å; S153-D155 PolarHBondContact OG-OD1 3.43Å; D155-T157 PolarHBondContact O-N 3.25Å; D155-S208 WeakPolarHBondContact OD2-CA 2.97Å; D155-N211 WeakPolarHBondContact OD2-CB 3.49Å; D155-N211 PolarHBondContact OD2-ND2 3.14Å
156	I	89.7	Confident	87	Confident	13 Å²	13	43.9 Å²	43.9	7%	0.067	23%	0.227	C	C	.	.			trans	-82.7	113.6	-177.5	-66.3	172.3	0	0	0	109.9	F152 S153 I160 L161	F152-I156 HydrophobicContact CB-CB 4.44Å; F152-I156 HydrophobicContact CB-CD1 4.11Å; S153-I156 WeakPolarHBondContact O-CB 3.32Å; S153-I156 PolarHBondContact O-N 2.93Å; S153-I156 WeakPolarHBondContact OG-CD1 3.46Å; S153-I156 WeakPolarHBondContact OG-CG1 3.44Å; I156-I160 HydrophobicContact CG2-CB 4.49Å; I156-I160 HydrophobicContact CG2-CG2 4.43Å; I156-L161 HydrophobicContact CG2-CB 3.74Å; I156-L161 HydrophobicContact CG2-CD1 4.41Å
157	T	90.4	Very high	87.7	Confident	11 Å²	11	43.6 Å²	43.6	7%	0.067	23%	0.225	C	C	.	.			trans	-84.7	159.5	168.7	61.1	0	0	0	0	111.1	D155 I159 I160 L161	D155-T157 PolarHBondContact O-N 3.25Å; T157-I159 PolarHBondContact O-N 3.28Å; T157-I159 VanDerWaalsContact O-N 3.14Å; T157-I159 WeakPolarHBondContact OG1-CG2 3.13Å; T157-I160 PolarHBondContact O-N 3.5Å; T157-I160 WeakPolarHBondContact OG1-CD1 3.32Å; T157-I160 VanDerWaalsContact OG1-CG1 3.3Å; T157-I160 WeakPolarHBondContact OG1-CG1 3.43Å; T157-L161 PolarHBondContact O-N 3.09Å
158	P	92.1	Very high	88.7	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-52.8	-37.3	178.2	-29	36	0	0	0	113.9	L101 L102 I105 L128 A162 L174	L101-P158 HydrophobicContact CD2-CB 4.31Å; L101-P158 HydrophobicContact CD2-CG 4.13Å; L102-P158 HydrophobicContact CD2-CB 4.32Å; L102-P158 HydrophobicContact CD2-CG 4.1Å; I105-P158 HydrophobicContact CD1-CB 3.69Å; L128-P158 HydrophobicContact CD2-CG 4.36Å; P158-A162 WeakPolarHBondContact O-CB 3.5Å; P158-A162 PolarHBondContact O-N 3.5Å; P158-L174 HydrophobicContact CB-CD1 4.38Å; P158-L174 HydrophobicContact CB-CD2 4.49Å
159	I	92.9	Very high	89.7	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-71.7	-35.1	178.5	-174.3	63.7	0	0	0	112.8	T157 A163 V171 L174 L175 A179 I181 Y221	T157-I159 PolarHBondContact O-N 3.28Å; T157-I159 VanDerWaalsContact O-N 3.14Å; T157-I159 WeakPolarHBondContact OG1-CG2 3.13Å; I159-A163 VanDerWaalsContact O-CB 3.3Å; I159-A163 WeakPolarHBondContact O-CB 3.42Å; I159-A163 PolarHBondContact O-N 3.49Å; I159-V171 HydrophobicContact CD1-CG1 4.22Å; I159-L174 HydrophobicContact CB-CD1 4.38Å; I159-L174 HydrophobicContact CD1-CB 3.87Å; I159-L174 HydrophobicContact CD1-CD1 4.2Å; I159-L175 HydrophobicContact CD1-CD2 4.23Å; I159-L175 HydrophobicContact CD1-CG 4.35Å; I159-A179 HydrophobicContact CB-CB 4.31Å; I159-A179 HydrophobicContact CG2-CB 4.48Å; I159-I181 HydrophobicContact CB-CG1 4.48Å; I159-I181 HydrophobicContact CG1-CD1 4.4Å; I159-I181 HydrophobicContact CG1-CG1 3.9Å; I159-I181 HydrophobicContact CG2-CG1 3.88Å; I159-Y221 HydrophobicContact CD1-CD2 4.42Å; I159-Y221 HydrophobicContact CD1-CE2 4.37Å; I159-Y221 HydrophobicContact CG1-CD2 4.42Å; I159-Y221 HydrophobicContact CG1-CE2 4.09Å
160	I	94.2	Very high	90.5	Very high	13 Å²	13	31.7 Å²	31.7	7%	0.067	16%	0.156	C	C	.	.	H	α-helix	trans	-66.6	-44.6	175.1	-68.2	171.1	0	0	0	109.5	I156 T157 A163 H164 I181	I156-I160 HydrophobicContact CG2-CB 4.49Å; I156-I160 HydrophobicContact CG2-CG2 4.43Å; T157-I160 PolarHBondContact O-N 3.5Å; T157-I160 WeakPolarHBondContact OG1-CD1 3.32Å; T157-I160 VanDerWaalsContact OG1-CG1 3.3Å; T157-I160 WeakPolarHBondContact OG1-CG1 3.43Å; I160-A163 WeakPolarHBondContact O-CB 3.37Å; I160-A163 PolarHBondContact O-N 3.28Å; I160-H164 VanDerWaalsContact CG2-NE2 3.31Å; I160-H164 WeakPolarHBondContact CG2-NE2 3.47Å; I160-H164 PolarHBondContact O-CD2 2.84Å; I160-H164 PolarHBondContact O-N 2.96Å; I160-I181 HydrophobicContact CG1-CD1 4.21Å; I160-I181 HydrophobicContact CG1-CG1 4.03Å; I160-I181 HydrophobicContact CG1-CG2 4.18Å
161	L	94.4	Very high	91	Very high	9 Å²	9	30.1 Å²	30.1	5%	0.047	15%	0.147	C	C	.	.	H	α-helix	trans	-63.5	-46.1	178.2	-171.9	61.4	0	0	0	111.7	L102 I105 F152 I156 T157 A163 H164 C165	L102-L161 HydrophobicContact CB-CD2 3.94Å; L102-L161 HydrophobicContact CD2-CD2 3.8Å; L102-L161 HydrophobicContact CG-CD2 4.45Å; L102-L161 VanDerWaalsContact O-CD2 3.29Å; L102-L161 WeakPolarHBondContact O-CD2 3.29Å; I105-L161 HydrophobicContact CB-CD2 4.37Å; I105-L161 HydrophobicContact CG2-CB 4.2Å; I105-L161 HydrophobicContact CG2-CD2 4.2Å; I105-L161 HydrophobicContact CG2-CG 4.01Å; F152-L161 HydrophobicContact CD1-CD1 4.22Å; F152-L161 HydrophobicContact CD2-CD2 4.02Å; F152-L161 HydrophobicContact CE1-CD1 4Å; F152-L161 HydrophobicContact CE1-CD2 4.41Å; F152-L161 HydrophobicContact CE2-CD2 3.68Å; F152-L161 HydrophobicContact CZ-CD1 4.25Å; F152-L161 HydrophobicContact CZ-CD2 3.89Å; I156-L161 HydrophobicContact CG2-CB 3.74Å; I156-L161 HydrophobicContact CG2-CD1 4.41Å; T157-L161 PolarHBondContact O-N 3.09Å; L161-A163 VanDerWaalsContact C-N 3.25Å; L161-A163 PolarHBondContact O-N 3.38Å; L161-H164 WeakPolarHBondContact O-CB 3.4Å; L161-H164 PolarHBondContact O-N 3.35Å; L161-C165 PolarHBondContact O-N 3.28Å
162	A	94.8	Very high	91.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.9	-39	177	0	0	0	0	0	112	I105 P158 Q166 E167 I170 V171 L174	I105-A162 VanDerWaalsContact CG2-CA 3.49Å; I105-A162 HydrophobicContact CG2-CB 3.69Å; P158-A162 WeakPolarHBondContact O-CB 3.5Å; P158-A162 PolarHBondContact O-N 3.5Å; A162-Q166 PolarHBondContact O-N 3.34Å; A162-E167 PolarHBondContact O-N 3.08Å; A162-I170 HydrophobicContact CB-CG2 3.78Å; A162-V171 HydrophobicContact CB-CG2 3.77Å; A162-L174 HydrophobicContact CB-CD1 3.81Å
163	A	95.1	Very high	91.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67	-37.8	174.5	0	0	0	0	0	112.6	I159 I160 L161 Q166 I181 S218	I159-A163 VanDerWaalsContact O-CB 3.3Å; I159-A163 WeakPolarHBondContact O-CB 3.42Å; I159-A163 PolarHBondContact O-N 3.49Å; I160-A163 WeakPolarHBondContact O-CB 3.37Å; I160-A163 PolarHBondContact O-N 3.28Å; L161-A163 VanDerWaalsContact C-N 3.25Å; L161-A163 PolarHBondContact O-N 3.38Å; A163-Q166 PolarHBondContact O-N 3.38Å; A163-I181 HydrophobicContact CB-CD1 4.22Å; A163-S218 WeakPolarHBondContact CB-OG 3.43Å; A163-S218 WeakPolarHBondContact O-CB 3.22Å
164	H	94.9	Very high	92	Very high	36 Å²	36	28.4 Å²	28.4	17%	0.167	14%	0.138	C	C	.	.	H	α-helix	trans	-65.4	-39.1	176.5	-74.8	-162.4	0	0	0	112.3	I160 L161 Q166 N211 G215	I160-H164 VanDerWaalsContact CG2-NE2 3.31Å; I160-H164 WeakPolarHBondContact CG2-NE2 3.47Å; I160-H164 PolarHBondContact O-CD2 2.84Å; I160-H164 PolarHBondContact O-N 2.96Å; L161-H164 WeakPolarHBondContact O-CB 3.4Å; L161-H164 PolarHBondContact O-N 3.35Å; H164-Q166 VanDerWaalsContact C-N 3.25Å; H164-Q166 PolarHBondContact O-N 3.18Å; H164-N211 PolarHBondContact NE2-O 3.4Å; H164-G215 PolarHBondContact NE2-N 3.42Å
165	C	91.6	Very high	92.4	Very high	40 Å²	40	25.6 Å²	25.6	27%	0.27	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-6.6	177.5	-61.3	0	0	0	0	113.8	L161 E167	L161-C165 PolarHBondContact O-N 3.28Å; C165-E167 VanDerWaalsContact C-N 3.29Å; C165-E167 HydrophobicContact CB-CG 3.97Å; C165-E167 PolarHBondContact O-N 3.25Å
166	Q	92.4	Very high	92.8	Very high	93 Å²	93	29.7 Å²	29.7	44%	0.435	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	34.8	-178.7	-53	-177	-9.7	0	0	113.8	A162 A163 H164 Y168	A162-Q166 PolarHBondContact O-N 3.34Å; A163-Q166 PolarHBondContact O-N 3.38Å; H164-Q166 VanDerWaalsContact C-N 3.25Å; H164-Q166 PolarHBondContact O-N 3.18Å; Q166-Y168 WeakPolarHBondContact O-CD2 3.49Å; Q166-Y168 PolarHBondContact O-N 3.37Å
167	E	92.1	Very high	92.7	Very high	37 Å²	37	34.7 Å²	34.7	17%	0.173	17%	0.172	C	C	.	.			trans	-87.4	97.8	178.9	-63.2	-60.4	165.3	0	0	111.7	A162 C165 E169 I170 V171 K813	A162-E167 PolarHBondContact O-N 3.08Å; C165-E167 VanDerWaalsContact C-N 3.29Å; C165-E167 HydrophobicContact CB-CG 3.97Å; C165-E167 PolarHBondContact O-N 3.25Å; E167-E169 PolarHBondContact O-N 3.44Å; E167-I170 HydrophobicContact CB-CB 3.98Å; E167-I170 HydrophobicContact CB-CD1 3.97Å; E167-I170 HydrophobicContact CB-CG1 4.11Å; E167-I170 HydrophobicContact CG-CD1 4.11Å; E167-V171 WeakPolarHBondContact O-CB 3.43Å; E167-V171 WeakPolarHBondContact O-CG2 3.45Å; E167-V171 PolarHBondContact O-N 2.85Å; E167-K813 IonicContact OE1-NZ 2.79Å; E167-K813 PolarHBondContact OE1-NZ 2.95Å; E167-K813 IonicContact OE2-NZ 3.78Å; E167-K813 PolarHBondContact OE2-NZ 3.47Å
168	Y	93.3	Very high	92.5	Very high	22 Å²	22	36.9 Å²	36.9	9%	0.086	20%	0.198	C	C	.	.	H	α-helix	trans	-60.1	-40.9	-175	-69	-92.5	0	0	0	113.4	Q166 H172 A220 L224 V806 A809	Q166-Y168 WeakPolarHBondContact O-CD2 3.49Å; Q166-Y168 PolarHBondContact O-N 3.37Å; Y168-H172 WeakPolarHBondContact O-CB 3.49Å; Y168-H172 PolarHBondContact O-N 3.21Å; Y168-A220 HydrophobicContact CD1-CB 3.93Å; Y168-A220 VanDerWaalsContact CE1-CA 3.49Å; Y168-A220 HydrophobicContact CE1-CB 3.95Å; Y168-A220 HydrophobicContact CG-CB 4.24Å; Y168-L224 HydrophobicContact CD1-CD1 4.43Å; Y168-L224 VanDerWaalsContact O-CD1 3.28Å; Y168-L224 WeakPolarHBondContact O-CD1 3.37Å; Y168-V806 HydrophobicContact CD1-CB 4.34Å; Y168-V806 HydrophobicContact CD1-CG1 3.76Å; Y168-V806 HydrophobicContact CD1-CG2 3.84Å; Y168-V806 HydrophobicContact CE1-CB 4.45Å; Y168-V806 HydrophobicContact CE1-CG1 4.29Å; Y168-V806 HydrophobicContact CE1-CG2 3.85Å; Y168-V806 HydrophobicContact CG-CG1 3.98Å; Y168-A809 HydrophobicContact CE2-CB 3.97Å
169	E	92.2	Very high	92.3	Very high	100 Å²	100	37 Å²	37	47%	0.467	20%	0.199	S	C	.	.	H	α-helix	trans	-70.2	-47.2	-176.8	-61.5	-171.8	-177.5	0	0	111.7	V110 E167 V171 H172 I173	V110-E169 HydrophobicContact CG1-CB 4.32Å; V110-E169 HydrophobicContact CG2-CB 4.19Å; E167-E169 PolarHBondContact O-N 3.44Å; E169-V171 VanDerWaalsContact C-N 3.34Å; E169-V171 PolarHBondContact O-N 2.85Å; E169-H172 WeakPolarHBondContact O-CB 3.45Å; E169-H172 PolarHBondContact O-N 3.35Å; E169-H172 VanDerWaalsContact O-N 3.14Å; E169-I173 WeakPolarHBondContact O-CG1 3.36Å; E169-I173 PolarHBondContact O-N 2.86Å
170	I	94.1	Very high	92.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.6	-44.5	177	-61.4	-179.8	0	0	0	110.4	I105 V110 V113 A162 E167 H172 I173 L174	I105-I170 HydrophobicContact CG1-CG2 3.95Å; I105-I170 HydrophobicContact CG2-CG2 4.29Å; V110-I170 HydrophobicContact CG2-CG1 4.19Å; V113-I170 HydrophobicContact CG1-CG2 4.35Å; V113-I170 HydrophobicContact CG2-CD1 4.24Å; A162-I170 HydrophobicContact CB-CG2 3.78Å; E167-I170 HydrophobicContact CB-CB 3.98Å; E167-I170 HydrophobicContact CB-CD1 3.97Å; E167-I170 HydrophobicContact CB-CG1 4.11Å; E167-I170 HydrophobicContact CG-CD1 4.11Å; I170-H172 VanDerWaalsContact C-N 3.32Å; I170-H172 PolarHBondContact O-N 2.93Å; I170-I173 PolarHBondContact O-N 3.03Å; I170-L174 HydrophobicContact CG2-CD1 3.99Å; I170-L174 HydrophobicContact CG2-CG 4.42Å; I170-L174 WeakPolarHBondContact O-CG 3.31Å; I170-L174 PolarHBondContact O-N 2.72Å
171	V	94.7	Very high	92.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.6	-45.8	174.8	170.5	0	0	0	0	110.1	I159 A162 E167 E169 I173 L174 L175 A220 L224	I159-V171 HydrophobicContact CD1-CG1 4.22Å; A162-V171 HydrophobicContact CB-CG2 3.77Å; E167-V171 WeakPolarHBondContact O-CB 3.43Å; E167-V171 WeakPolarHBondContact O-CG2 3.45Å; E167-V171 PolarHBondContact O-N 2.85Å; E169-V171 VanDerWaalsContact C-N 3.34Å; E169-V171 PolarHBondContact O-N 2.85Å; V171-I173 PolarHBondContact O-N 3.2Å; V171-L174 PolarHBondContact O-N 3.25Å; V171-L175 HydrophobicContact CG1-CD1 3.67Å; V171-L175 HydrophobicContact CG1-CG 4.03Å; V171-L175 WeakPolarHBondContact O-CB 3.43Å; V171-L175 WeakPolarHBondContact O-CG 3.31Å; V171-L175 PolarHBondContact O-N 3Å; V171-A220 HydrophobicContact CG2-CB 4.34Å; V171-L224 HydrophobicContact CB-CD1 4.19Å; V171-L224 HydrophobicContact CG1-CD1 3.88Å
172	H	93.9	Very high	91.7	Very high	106 Å²	106	49.7 Å²	49.7	49%	0.491	25%	0.252	S	S	.	.	H	α-helix	trans	-59.8	-44.3	177.3	-178.9	-80.3	0	0	0	112.7	Y168 E169 I170 L175 T176 L224	Y168-H172 WeakPolarHBondContact O-CB 3.49Å; Y168-H172 PolarHBondContact O-N 3.21Å; E169-H172 WeakPolarHBondContact O-CB 3.45Å; E169-H172 PolarHBondContact O-N 3.35Å; E169-H172 VanDerWaalsContact O-N 3.14Å; I170-H172 VanDerWaalsContact C-N 3.32Å; I170-H172 PolarHBondContact O-N 2.93Å; H172-L175 PolarHBondContact O-N 3.01Å; H172-T176 PolarHBondContact CE1-OG1 2.88Å; H172-T176 WeakPolarHBondContact O-CB 3.49Å; H172-T176 PolarHBondContact O-N 3.37Å; H172-T176 PolarHBondContact O-OG1 2.83Å; H172-L224 HydrophobicContact CB-CD1 4.16Å
173	I	92.3	Very high	91.4	Very high	24 Å²	24	56.6 Å²	56.6	12%	0.123	28%	0.279	C	S	.	.	H	α-helix	trans	-60.2	-49.2	177.8	-67	160.7	0	0	0	110.4	V110 E114 L117 E169 I170 V171 L175 T176 K177	V110-I173 HydrophobicContact CG1-CD1 3.83Å; E114-I173 HydrophobicContact CG-CD1 3.71Å; E114-I173 WeakPolarHBondContact OE1-CD1 3.1Å; L117-I173 HydrophobicContact CD1-CG2 3.62Å; E169-I173 WeakPolarHBondContact O-CG1 3.36Å; E169-I173 PolarHBondContact O-N 2.86Å; I170-I173 PolarHBondContact O-N 3.03Å; V171-I173 PolarHBondContact O-N 3.2Å; I173-L175 PolarHBondContact O-N 3.07Å; I173-T176 WeakPolarHBondContact O-CB 3.48Å; I173-T176 PolarHBondContact O-N 3.43Å; I173-K177 WeakPolarHBondContact O-CG 3.5Å; I173-K177 PolarHBondContact O-N 3.13Å; I173-K177 VanDerWaalsContact O-N 3.07Å
174	L	91.9	Very high	91.3	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-63.9	-41	179	-69	174	0	0	0	112.2	I105 L117 L128 P158 I159 A162 I170 V171 T176 K177 G178 A179	I105-L174 HydrophobicContact CD1-CD1 4.27Å; L117-L174 HydrophobicContact CD1-CD2 3.97Å; L117-L174 HydrophobicContact CD2-CD2 4.33Å; L128-L174 HydrophobicContact CD2-CD2 4.33Å; P158-L174 HydrophobicContact CB-CD1 4.38Å; P158-L174 HydrophobicContact CB-CD2 4.49Å; I159-L174 HydrophobicContact CB-CD1 4.38Å; I159-L174 HydrophobicContact CD1-CB 3.87Å; I159-L174 HydrophobicContact CD1-CD1 4.2Å; A162-L174 HydrophobicContact CB-CD1 3.81Å; I170-L174 HydrophobicContact CG2-CD1 3.99Å; I170-L174 HydrophobicContact CG2-CG 4.42Å; I170-L174 WeakPolarHBondContact O-CG 3.31Å; I170-L174 PolarHBondContact O-N 2.72Å; V171-L174 PolarHBondContact O-N 3.25Å; L174-T176 VanDerWaalsContact C-N 3.28Å; L174-T176 PolarHBondContact O-N 3.07Å; L174-K177 PolarHBondContact O-N 2.83Å; L174-G178 PolarHBondContact O-N 3.07Å; L174-A179 HydrophobicContact CB-CB 4.44Å; L174-A179 WeakPolarHBondContact O-CB 3.41Å; L174-A179 PolarHBondContact O-N 3.28Å; L174-A179 VanDerWaalsContact O-N 3.1Å
175	L	91.9	Very high	91	Very high	15 Å²	15	60.8 Å²	60.8	8%	0.079	30%	0.301	C	S	.	.	H	α-helix	trans	-64.1	-34.2	175.8	-70.4	174.9	0	0	0	111.8	I159 V171 H172 I173 G178 A179 R180 Y221 L224	I159-L175 HydrophobicContact CD1-CD2 4.23Å; I159-L175 HydrophobicContact CD1-CG 4.35Å; V171-L175 HydrophobicContact CG1-CD1 3.67Å; V171-L175 HydrophobicContact CG1-CG 4.03Å; V171-L175 WeakPolarHBondContact O-CB 3.43Å; V171-L175 WeakPolarHBondContact O-CG 3.31Å; V171-L175 PolarHBondContact O-N 3Å; H172-L175 PolarHBondContact O-N 3.01Å; I173-L175 PolarHBondContact O-N 3.07Å; L175-G178 PolarHBondContact O-N 3.43Å; L175-A179 WeakPolarHBondContact CD2-O 3.3Å; L175-R180 VanDerWaalsContact CB-NH1 3.28Å; L175-R180 VanDerWaalsContact CD2-CZ 3.49Å; L175-R180 PolarHBondContact O-NH1 3.07Å; L175-Y221 HydrophobicContact CD2-CD2 4.4Å; L175-Y221 HydrophobicContact CD2-CE2 3.83Å; L175-L224 HydrophobicContact CD1-CB 3.61Å
176	T	90.4	Very high	90.9	Very high	101 Å²	101	63.1 Å²	63.1	62%	0.62	31%	0.311	S	S	*	.	H	α-helix	trans	-70.6	-32.9	176.9	-56.4	0	0	0	0	111.6	H172 I173 L174 G178	H172-T176 PolarHBondContact CE1-OG1 2.88Å; H172-T176 WeakPolarHBondContact O-CB 3.49Å; H172-T176 PolarHBondContact O-N 3.37Å; H172-T176 PolarHBondContact O-OG1 2.83Å; I173-T176 WeakPolarHBondContact O-CB 3.48Å; I173-T176 PolarHBondContact O-N 3.43Å; L174-T176 VanDerWaalsContact C-N 3.28Å; L174-T176 PolarHBondContact O-N 3.07Å; T176-G178 PolarHBondContact O-N 3.44Å
177	K	87.8	Confident	90.8	Very high	118 Å²	118	62.6 Å²	62.6	51%	0.513	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	0.6	172.7	-65.8	-76	-177.1	164.3	0	113.6	L128 I173 L174	L128-K177 HydrophobicContact CD1-CB 4.12Å; I173-K177 WeakPolarHBondContact O-CG 3.5Å; I173-K177 PolarHBondContact O-N 3.13Å; I173-K177 VanDerWaalsContact O-N 3.07Å; L174-K177 PolarHBondContact O-N 2.83Å
178	G	86	Confident	90.7	Very high	58 Å²	58	66.8 Å²	66.8	60%	0.598	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.6	4.5	175.3	0	0	0	0	0	115.2	L174 L175 T176	L174-G178 PolarHBondContact O-N 3.07Å; L175-G178 PolarHBondContact O-N 3.43Å; T176-G178 PolarHBondContact O-N 3.44Å
179	A	88.1	Confident	90.6	Very high	3 Å²	3	67.9 Å²	67.9	3%	0.025	33%	0.333	C	S	.	.			trans	-71.3	131.2	173.8	0	0	0	0	0	110	L128 I159 L174 L175	L128-A179 HydrophobicContact CB-CB 4.21Å; I159-A179 HydrophobicContact CB-CB 4.31Å; I159-A179 HydrophobicContact CG2-CB 4.48Å; L174-A179 HydrophobicContact CB-CB 4.44Å; L174-A179 WeakPolarHBondContact O-CB 3.41Å; L174-A179 PolarHBondContact O-N 3.28Å; L174-A179 VanDerWaalsContact O-N 3.1Å; L175-A179 WeakPolarHBondContact CD2-O 3.3Å
180	R	89.8	Confident	90.5	Very high	119 Å²	119	71.9 Å²	71.9	45%	0.449	35%	0.349	S	S	.	.			trans	-137.3	146.2	174.8	-72.7	-68.8	-173.2	-79.7	5.5	108.5	L175 E182	L175-R180 VanDerWaalsContact CB-NH1 3.28Å; L175-R180 VanDerWaalsContact CD2-CZ 3.49Å; L175-R180 PolarHBondContact O-NH1 3.07Å; R180-E182 PolarHBondContact O-N 3.33Å
181	I	91.8	Very high	90.5	Very high	15 Å²	15	73.8 Å²	73.8	8%	0.077	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-76.1	124.8	174.8	-58.1	172.9	0	0	0	108	I159 I160 A163 L216 Y221	I159-I181 HydrophobicContact CB-CG1 4.48Å; I159-I181 HydrophobicContact CG1-CD1 4.4Å; I159-I181 HydrophobicContact CG1-CG1 3.9Å; I159-I181 HydrophobicContact CG2-CG1 3.88Å; I160-I181 HydrophobicContact CG1-CD1 4.21Å; I160-I181 HydrophobicContact CG1-CG1 4.03Å; I160-I181 HydrophobicContact CG1-CG2 4.18Å; A163-I181 HydrophobicContact CB-CD1 4.22Å; I181-L216 HydrophobicContact CB-CD2 3.92Å; I181-L216 HydrophobicContact CB-CG 4.49Å; I181-L216 HydrophobicContact CG2-CD2 3.85Å; I181-L216 HydrophobicContact CG2-CG 3.92Å; I181-Y221 HydrophobicContact CB-CE1 4.44Å; I181-Y221 HydrophobicContact CB-CE2 4.21Å; I181-Y221 HydrophobicContact CD1-CD1 4.32Å; I181-Y221 HydrophobicContact CD1-CD2 3.67Å; I181-Y221 HydrophobicContact CD1-CE1 4.3Å; I181-Y221 HydrophobicContact CD1-CE2 3.64Å; I181-Y221 HydrophobicContact CD1-CG 4.02Å; I181-Y221 HydrophobicContact CG1-CD2 4.21Å; I181-Y221 HydrophobicContact CG1-CE2 3.66Å; I181-Y221 PolarHBondContact N-OH 3.41Å
182	E	87.2	Confident	90.4	Very high	156 Å²	156	78.6 Å²	78.6	73%	0.729	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-69.7	135.3	173.2	-61.5	-168.5	166.8	0	0	110.2	R180	R180-E182 PolarHBondContact O-N 3.33Å
183	R	88.8	Confident	90	Very high	146 Å²	146	78 Å²	78	55%	0.551	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-74.1	128.8	175.7	-77.9	-163	173.7	-167.5	0.8	109.3	L216	R183-L216 HydrophobicContact CG-CD1 4.14Å
184	P	91.3	Very high	89.9	Confident	31 Å²	31	77.7 Å²	77.7	20%	0.201	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-62.9	147.7	176.4	27.6	-34.6	0	0	0	110.4	R209 Y213	P184-R209 HydrophobicContact CB-CG 4.14Å; P184-R209 HydrophobicContact CG-CG 4.48Å; P184-Y213 HydrophobicContact CB-CE2 4.31Å; P184-Y213 HydrophobicContact CG-CD1 4.26Å; P184-Y213 HydrophobicContact CG-CD2 3.97Å; P184-Y213 HydrophobicContact CG-CE1 3.78Å; P184-Y213 HydrophobicContact CG-CE2 3.45Å; P184-Y213 VanDerWaalsContact CG-CE2 3.45Å; P184-Y213 HydrophobicContact CG-CG 4.34Å
185	H	90.6	Very high	89.9	Confident	92 Å²	92	80 Å²	80	43%	0.426	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-65	158.7	173.6	-67.4	172.5	0	0	0	111.6	C189 C191 C194	H185-C189 HydrophobicContact CB-CB 3.89Å; H185-C191 PolarHBondContact ND1-SG 2.85Å; H185-C194 PolarHBondContact ND1-SG 3.25Å
186	D	89.1	Confident	89.8	Confident	90 Å²	90	85.9 Å²	85.9	48%	0.481	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-54.1	144.8	172.2	-170.2	9.8	0	0	0	110.1	F188 C189	D186-F188 PolarHBondContact O-N 2.84Å; D186-F188 VanDerWaalsContact O-N 3.11Å; D186-C189 WeakPolarHBondContact O-CB 3.26Å; D186-C189 PolarHBondContact O-N 3.34Å
187	Y	89.1	Confident	89.6	Confident	82 Å²	82	84.5 Å²	84.5	32%	0.322	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-34.6	-175.4	177.2	-88.6	0	0	0	112.3	I246 E247	Y187-I246 HydrophobicContact CD1-CG2 3.71Å; Y187-I246 HydrophobicContact CD2-CG2 4.32Å; Y187-I246 HydrophobicContact CE1-CG2 3.82Å; Y187-I246 HydrophobicContact CE2-CG2 4.43Å; Y187-I246 HydrophobicContact CG-CG2 3.98Å; Y187-E247 HydrophobicContact CD2-CG 3.95Å; Y187-E247 VanDerWaalsContact CD2-OE1 3.24Å; Y187-E247 WeakPolarHBondContact CD2-OE1 3.3Å; Y187-E247 HydrophobicContact CE2-CG 3.58Å; Y187-E247 WeakPolarHBondContact CE2-OE1 3.36Å
188	F	89.8	Confident	89.6	Confident	124 Å²	124	83.5 Å²	83.5	54%	0.544	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	11.3	-179.9	-58.3	-70	0	0	0	114.1	D186 I246	D186-F188 PolarHBondContact O-N 2.84Å; D186-F188 VanDerWaalsContact O-N 3.11Å; F188-I246 HydrophobicContact CE2-CD1 4.19Å; F188-I246 HydrophobicContact CE2-CG2 4.43Å; F188-I246 HydrophobicContact CZ-CG2 4.04Å
189	C	92	Very high	89.8	Confident	45 Å²	45	88.9 Å²	88.9	30%	0.304	42%	0.424	S	S	.	.			trans	-62.4	136.4	176.5	-174.1	0	0	0	0	110.8	H185 D186	H185-C189 HydrophobicContact CB-CB 3.89Å; D186-C189 WeakPolarHBondContact O-CB 3.26Å; D186-C189 PolarHBondContact O-N 3.34Å
190	K	91	Very high	89.8	Confident	184 Å²	184	97.3 Å²	97.3	80%	0.8	46%	0.46	S	S	*	.			trans	-116.3	26.6	-178.8	-59.8	-176.8	-177.9	179	0	112.8
191	C	93.4	Very high	89.7	Confident	40 Å²	40	95.3 Å²	95.3	27%	0.27	46%	0.458	S	S	.	.			trans	-62.8	155.2	173.6	68.7	0	0	0	0	110.5	H185 E193 C194 V195	H185-C191 PolarHBondContact ND1-SG 2.85Å; C191-E193 PolarHBondContact O-N 3.05Å; C191-C194 PolarHBondContact O-N 2.85Å; C191-C194 VanDerWaalsContact SG-CB 3.59Å; C191-C194 PolarHBondContact SG-N 3.25Å; C191-C194 PolarHBondContact SG-SG 2.98Å; C191-V195 WeakPolarHBondContact O-CG2 3.46Å; C191-V195 PolarHBondContact O-N 2.82Å; C191-V195 VanDerWaalsContact O-N 3.08Å
192	S	91.6	Very high	89.6	Confident	102 Å²	102	97.6 Å²	97.6	71%	0.713	48%	0.475	S	S	*	.	H	α-helix	trans	-54.8	-42.7	-177.7	46.9	0	0	0	0	112	V195 E196	S192-V195 PolarHBondContact O-N 3.38Å; S192-E196 VanDerWaalsContact O-CB 3.28Å; S192-E196 WeakPolarHBondContact O-CB 3.32Å; S192-E196 PolarHBondContact O-N 3.15Å
193	E	86.8	Confident	89.7	Confident	94 Å²	94	96.1 Å²	96.1	44%	0.439	47%	0.467	S	S	.	.	H	α-helix	trans	-65.6	-45.9	-177.5	-158.9	-169.1	161.4	0	0	113.1	C191 E196 K197	C191-E193 PolarHBondContact O-N 3.05Å; E193-E196 PolarHBondContact O-N 2.91Å; E193-K197 HydrophobicContact CG-CD 4.32Å; E193-K197 WeakPolarHBondContact O-CB 3.32Å; E193-K197 WeakPolarHBondContact O-CG 2.97Å; E193-K197 PolarHBondContact O-N 3.3Å; E193-K197 WeakPolarHBondContact OE1-CE 3.4Å; E193-K197 IonicContact OE1-NZ 2.63Å; E193-K197 PolarHBondContact OE1-NZ 3.16Å
194	C	89.3	Confident	89.6	Confident	17 Å²	17	91.1 Å²	91.1	12%	0.115	45%	0.454	C	S	.	.	H	α-helix	trans	-65.1	-41.4	176.4	-72.5	0	0	0	0	111.4	H185 C191 E196 Q198	H185-C194 PolarHBondContact ND1-SG 3.25Å; C191-C194 PolarHBondContact O-N 2.85Å; C191-C194 VanDerWaalsContact SG-CB 3.59Å; C191-C194 PolarHBondContact SG-N 3.25Å; C191-C194 PolarHBondContact SG-SG 2.98Å; C194-E196 VanDerWaalsContact C-N 3.32Å; C194-E196 PolarHBondContact O-N 3.37Å; C194-Q198 WeakPolarHBondContact O-CB 3.37Å; C194-Q198 PolarHBondContact O-N 3.44Å
195	V	91.8	Very high	89.6	Confident	48 Å²	48	91.3 Å²	91.3	29%	0.291	45%	0.452	S	S	.	.	H	α-helix	trans	-65.7	-38.4	179.1	172.4	0	0	0	0	110.9	C191 S192 K199	C191-V195 WeakPolarHBondContact O-CG2 3.46Å; C191-V195 PolarHBondContact O-N 2.82Å; C191-V195 VanDerWaalsContact O-N 3.08Å; S192-V195 PolarHBondContact O-N 3.38Å; V195-K199 HydrophobicContact CG1-CD 4.11Å; V195-K199 WeakPolarHBondContact O-CB 3.39Å; V195-K199 WeakPolarHBondContact O-CG 3.35Å; V195-K199 PolarHBondContact O-N 2.92Å
196	E	90.3	Very high	89.6	Confident	138 Å²	138	87.7 Å²	87.7	65%	0.645	44%	0.437	S	S	*	.	H	α-helix	trans	-69.8	-48.6	177.2	-171.6	170.2	-171.9	0	0	111.9	S192 E193 C194 Q198 K199 K200	S192-E196 VanDerWaalsContact O-CB 3.28Å; S192-E196 WeakPolarHBondContact O-CB 3.32Å; S192-E196 PolarHBondContact O-N 3.15Å; E193-E196 PolarHBondContact O-N 2.91Å; C194-E196 VanDerWaalsContact C-N 3.32Å; C194-E196 PolarHBondContact O-N 3.37Å; E196-Q198 VanDerWaalsContact C-N 3.3Å; E196-Q198 PolarHBondContact O-N 3.12Å; E196-K199 PolarHBondContact O-N 3.04Å; E196-K200 WeakPolarHBondContact O-CB 3.3Å; E196-K200 PolarHBondContact O-N 3.42Å
197	K	85.6	Confident	89.7	Confident	73 Å²	73	87.6 Å²	87.6	32%	0.317	43%	0.43	S	S	.	.	H	α-helix	trans	-57.3	-42.4	174.8	-74.9	175.7	171.3	171.4	0	111.1	E134 E193 K200 D201	E134-K197 IonicContact OE1-NZ 3.35Å; E134-K197 PolarHBondContact OE1-NZ 2.85Å; E193-K197 HydrophobicContact CG-CD 4.32Å; E193-K197 WeakPolarHBondContact O-CB 3.32Å; E193-K197 WeakPolarHBondContact O-CG 2.97Å; E193-K197 PolarHBondContact O-N 3.3Å; E193-K197 WeakPolarHBondContact OE1-CE 3.4Å; E193-K197 IonicContact OE1-NZ 2.63Å; E193-K197 PolarHBondContact OE1-NZ 3.16Å; K197-K200 PolarHBondContact O-N 3.12Å; K197-D201 CarbonylContact O-C 3.54Å; K197-D201 PolarHBondContact O-N 3.19Å
198	Q	89.3	Confident	89.8	Confident	96 Å²	96	85.8 Å²	85.8	45%	0.449	43%	0.429	S	S	.	.	H	α-helix	trans	-68.8	-35.8	177.4	-171.7	175.7	17.2	0	0	113.5	C194 E196 S202	C194-Q198 WeakPolarHBondContact O-CB 3.37Å; C194-Q198 PolarHBondContact O-N 3.44Å; E196-Q198 VanDerWaalsContact C-N 3.3Å; E196-Q198 PolarHBondContact O-N 3.12Å; Q198-S202 PolarHBondContact O-N 3.43Å
199	K	90	Very high	89.9	Confident	172 Å²	172	81 Å²	81	75%	0.748	41%	0.408	S	S	*	.	H	α-helix	trans	-71.3	-36.9	175.7	-79.7	174.9	-179.1	180	0	112.6	V195 E196	V195-K199 HydrophobicContact CG1-CD 4.11Å; V195-K199 WeakPolarHBondContact O-CB 3.39Å; V195-K199 WeakPolarHBondContact O-CG 3.35Å; V195-K199 PolarHBondContact O-N 2.92Å; E196-K199 PolarHBondContact O-N 3.04Å
200	K	86.9	Confident	90	Very high	180 Å²	180	79.3 Å²	79.3	78%	0.783	40%	0.396	S	S	*	.	H	α-helix	trans	-69.7	-52.9	178.6	-171.9	178.7	-179.9	-176	0	110.5	E196 K197	E196-K200 WeakPolarHBondContact O-CB 3.3Å; E196-K200 PolarHBondContact O-N 3.42Å; K197-K200 PolarHBondContact O-N 3.12Å
201	D	87.7	Confident	90.1	Very high	76 Å²	76	71.4 Å²	71.4	41%	0.406	36%	0.362	S	S	.	.			trans	-155.6	105.8	174.8	-176.9	1.2	0	0	0	111.7	K197 F203 S204 H205	K197-D201 CarbonylContact O-C 3.54Å; K197-D201 PolarHBondContact O-N 3.19Å; D201-F203 VanDerWaalsContact C-N 3.35Å; D201-F203 PolarHBondContact O-N 3.11Å; D201-F203 PolarHBondContact OD1-N 3.48Å; D201-S204 PolarHBondContact OD1-N 3.4Å; D201-S204 WeakPolarHBondContact OD2-CB 3.47Å; D201-S204 PolarHBondContact OD2-N 2.68Å; D201-H205 WeakPolarHBondContact O-CB 3.48Å; D201-H205 PolarHBondContact O-N 2.98Å; D201-H205 VanDerWaalsContact O-N 3.12Å
202	S	89.6	Confident	90.1	Very high	64 Å²	64	70 Å²	70	45%	0.448	35%	0.353	S	S	.	.	H	α-helix	trans	-68.8	-31.1	178	-173.7	0	0	0	0	113.1	Q198 S206	Q198-S202 PolarHBondContact O-N 3.43Å; S202-S206 PolarHBondContact O-N 2.93Å; S202-S206 VanDerWaalsContact O-N 3.09Å; S202-S206 PolarHBondContact O-OG 3.45Å
203	F	89.7	Confident	90.3	Very high	125 Å²	125	65.3 Å²	65.3	55%	0.548	32%	0.32	S	S	.	.	H	α-helix	trans	-72.7	-50.7	-178.4	175.1	-102.9	0	0	0	110.1	D201 H205 S206 R207 F250	D201-F203 VanDerWaalsContact C-N 3.35Å; D201-F203 PolarHBondContact O-N 3.11Å; D201-F203 PolarHBondContact OD1-N 3.48Å; F203-H205 VanDerWaalsContact C-N 3.26Å; F203-H205 PolarHBondContact O-N 2.89Å; F203-S206 PolarHBondContact O-N 2.72Å; F203-S206 VanDerWaalsContact O-N 3.17Å; F203-S206 PolarHBondContact O-OG 3.04Å; F203-R207 PolarHBondContact O-N 2.95Å; F203-F250 HydrophobicContact CE2-CZ 4.45Å
204	S	87.5	Confident	90.7	Very high	40 Å²	40	65 Å²	65	28%	0.28	32%	0.317	S	S	.	.	H	α-helix	trans	-57.6	-40.1	174.1	177.8	0	0	0	0	111.9	D201 S206 R207 S208	D201-S204 PolarHBondContact OD1-N 3.4Å; D201-S204 WeakPolarHBondContact OD2-CB 3.47Å; D201-S204 PolarHBondContact OD2-N 2.68Å; S204-S206 PolarHBondContact O-N 2.7Å; S204-R207 PolarHBondContact O-N 2.9Å; S204-S208 WeakPolarHBondContact O-CB 3.48Å; S204-S208 PolarHBondContact O-N 3.3Å
205	H	89.9	Confident	91	Very high	35 Å²	35	64.2 Å²	64.2	16%	0.162	31%	0.312	C	S	.	.	H	α-helix	trans	-61	-44.8	175.8	-172.4	57.1	0	0	0	113.1	D201 F203 S208 R209	D201-H205 WeakPolarHBondContact O-CB 3.48Å; D201-H205 PolarHBondContact O-N 2.98Å; D201-H205 VanDerWaalsContact O-N 3.12Å; F203-H205 VanDerWaalsContact C-N 3.26Å; F203-H205 PolarHBondContact O-N 2.89Å; H205-S208 PolarHBondContact O-N 2.88Å; H205-R209 PolarHBondContact O-N 3.44Å; H205-R209 VanDerWaalsContact O-N 3.14Å
206	S	90.9	Very high	91.2	Very high	17 Å²	17	62.5 Å²	62.5	12%	0.119	30%	0.301	C	S	.	.	H	α-helix	trans	-66.5	-38.2	175.9	64.5	0	0	0	0	112.7	S202 F203 S204 R209 M210	S202-S206 PolarHBondContact O-N 2.93Å; S202-S206 VanDerWaalsContact O-N 3.09Å; S202-S206 PolarHBondContact O-OG 3.45Å; F203-S206 PolarHBondContact O-N 2.72Å; F203-S206 VanDerWaalsContact O-N 3.17Å; F203-S206 PolarHBondContact O-OG 3.04Å; S204-S206 PolarHBondContact O-N 2.7Å; S206-R209 PolarHBondContact O-N 2.91Å; S206-M210 PolarHBondContact O-N 3.22Å
207	R	91.1	Very high	91.5	Very high	87 Å²	87	56 Å²	56	33%	0.328	27%	0.271	S	S	.	.	H	α-helix	trans	-63.8	-42.9	175.6	-175.8	65.4	66.9	178.6	3.7	111.7	F203 S204 M210 N211	F203-R207 PolarHBondContact O-N 2.95Å; S204-R207 PolarHBondContact O-N 2.9Å; R207-M210 WeakPolarHBondContact O-CB 3.42Å; R207-M210 PolarHBondContact O-N 3.2Å; R207-N211 PolarHBondContact O-N 3.34Å
208	S	90.8	Very high	92	Very high	44 Å²	44	52.8 Å²	52.8	31%	0.308	26%	0.257	S	S	.	.	H	α-helix	trans	-59.8	-46.8	176.5	174.3	0	0	0	0	112.6	D155 S204 H205 M210 N211 A212	D155-S208 WeakPolarHBondContact OD2-CA 2.97Å; S204-S208 WeakPolarHBondContact O-CB 3.48Å; S204-S208 PolarHBondContact O-N 3.3Å; H205-S208 PolarHBondContact O-N 2.88Å; S208-M210 VanDerWaalsContact C-N 3.33Å; S208-M210 PolarHBondContact O-N 3.31Å; S208-N211 PolarHBondContact O-N 3.08Å; S208-A212 WeakPolarHBondContact O-CB 3Å; S208-A212 PolarHBondContact O-N 3.27Å
209	R	92.6	Very high	92.2	Very high	25 Å²	25	48.9 Å²	48.9	9%	0.094	24%	0.242	C	C	.	.	H	α-helix	trans	-58.9	-44.5	173.8	174.8	165.6	50.9	-146.4	-7.6	112	P184 H205 S206 A212 Y213 E247	P184-R209 HydrophobicContact CB-CG 4.14Å; P184-R209 HydrophobicContact CG-CG 4.48Å; H205-R209 PolarHBondContact O-N 3.44Å; H205-R209 VanDerWaalsContact O-N 3.14Å; S206-R209 PolarHBondContact O-N 2.91Å; R209-A212 PolarHBondContact O-N 3.44Å; R209-Y213 HydrophobicContact CG-CD2 3.68Å; R209-Y213 HydrophobicContact CG-CE2 3.54Å; R209-Y213 VanDerWaalsContact O-CD2 3.23Å; R209-Y213 WeakPolarHBondContact O-CD2 3.18Å; R209-Y213 PolarHBondContact O-N 3.42Å; R209-E247 IonicContact CZ-OE1 3.2Å; R209-E247 IonicContact NE-OE1 3.54Å; R209-E247 PolarHBondContact NE-OE1 3.15Å; R209-E247 VanDerWaalsContact NE-OE1 3.17Å; R209-E247 IonicContact NH2-OE1 3.08Å; R209-E247 PolarHBondContact NH2-OE1 3.27Å
210	M	93.6	Very high	92.4	Very high	9 Å²	9	40.7 Å²	40.7	4%	0.044	21%	0.206	C	C	.	.	H	α-helix	trans	-61.7	-44.9	176.8	178.5	57.2	73.1	0	0	112	S206 R207 S208 A212 Y213 K214 F250 D253 Y254 L257	S206-M210 PolarHBondContact O-N 3.22Å; R207-M210 WeakPolarHBondContact O-CB 3.42Å; R207-M210 PolarHBondContact O-N 3.2Å; S208-M210 VanDerWaalsContact C-N 3.33Å; S208-M210 PolarHBondContact O-N 3.31Å; M210-A212 PolarHBondContact O-N 2.99Å; M210-Y213 PolarHBondContact O-N 2.63Å; M210-K214 WeakPolarHBondContact O-CB 3.16Å; M210-K214 PolarHBondContact O-N 2.84Å; M210-F250 HydrophobicContact CE-CB 3.59Å; M210-F250 HydrophobicContact CE-CG 4.19Å; M210-D253 HydrophobicContact CE-CB 3.72Å; M210-D253 HydrophobicContact SD-CB 4.1Å; M210-Y254 HydrophobicContact CE-CD1 3.88Å; M210-Y254 HydrophobicContact CE-CD2 3.64Å; M210-Y254 HydrophobicContact CE-CE1 3.67Å; M210-Y254 HydrophobicContact CE-CE2 3.4Å; M210-Y254 VanDerWaalsContact CE-CE2 3.4Å; M210-Y254 HydrophobicContact CE-CG 3.86Å; M210-Y254 VanDerWaalsContact CE-CZ 3.43Å; M210-Y254 HydrophobicContact SD-CD1 4.45Å; M210-Y254 HydrophobicContact SD-CE1 4.25Å; M210-L257 HydrophobicContact SD-CD1 3.73Å
211	N	93.3	Very high	92.9	Very high	17 Å²	17	32.8 Å²	32.8	9%	0.091	17%	0.171	C	C	.	.	H	α-helix	trans	-63.5	-40.4	178.7	-77.5	-25	0	0	0	112.1	S153 D155 H164 R207 S208 K214 G215	S153-N211 PolarHBondContact OG-ND2 2.81Å; D155-N211 WeakPolarHBondContact OD2-CB 3.49Å; D155-N211 PolarHBondContact OD2-ND2 3.14Å; H164-N211 PolarHBondContact NE2-O 3.4Å; R207-N211 PolarHBondContact O-N 3.34Å; S208-N211 PolarHBondContact O-N 3.08Å; N211-K214 PolarHBondContact O-N 3.19Å; N211-G215 PolarHBondContact O-N 3Å
212	A	94.1	Very high	93.2	Very high	11 Å²	11	29.3 Å²	29.3	9%	0.091	15%	0.153	C	C	.	.	H	α-helix	trans	-61.6	-48.3	173.2	0	0	0	0	0	111.6	S208 R209 M210 K214 G215 L216	S208-A212 WeakPolarHBondContact O-CB 3Å; S208-A212 PolarHBondContact O-N 3.27Å; R209-A212 PolarHBondContact O-N 3.44Å; M210-A212 PolarHBondContact O-N 2.99Å; A212-K214 VanDerWaalsContact C-N 3.34Å; A212-K214 PolarHBondContact O-N 2.7Å; A212-G215 PolarHBondContact O-N 2.74Å; A212-G215 VanDerWaalsContact O-N 3.16Å; A212-L216 WeakPolarHBondContact O-CG 3.31Å; A212-L216 PolarHBondContact O-N 3.48Å
213	Y	95.9	Very high	93.4	Very high	4 Å²	4	26.7 Å²	26.7	2%	0.016	14%	0.135	C	C	.	.	H	α-helix	trans	-62.6	-38.6	176.5	-83.8	-57.5	0	0	0	113	P184 R209 M210 G215 L216 A217 L236 E239 L240 L243 Y254	P184-Y213 HydrophobicContact CB-CE2 4.31Å; P184-Y213 HydrophobicContact CG-CD1 4.26Å; P184-Y213 HydrophobicContact CG-CD2 3.97Å; P184-Y213 HydrophobicContact CG-CE1 3.78Å; P184-Y213 HydrophobicContact CG-CE2 3.45Å; P184-Y213 VanDerWaalsContact CG-CE2 3.45Å; P184-Y213 HydrophobicContact CG-CG 4.34Å; R209-Y213 HydrophobicContact CG-CD2 3.68Å; R209-Y213 HydrophobicContact CG-CE2 3.54Å; R209-Y213 VanDerWaalsContact O-CD2 3.23Å; R209-Y213 WeakPolarHBondContact O-CD2 3.18Å; R209-Y213 PolarHBondContact O-N 3.42Å; M210-Y213 PolarHBondContact O-N 2.63Å; Y213-G215 VanDerWaalsContact C-N 3.3Å; Y213-G215 PolarHBondContact O-N 3.35Å; Y213-L216 HydrophobicContact CD1-CD1 4.43Å; Y213-L216 PolarHBondContact O-N 3.42Å; Y213-A217 WeakPolarHBondContact O-CB 3.26Å; Y213-A217 PolarHBondContact O-N 3.3Å; Y213-L236 HydrophobicContact CD1-CD1 4.15Å; Y213-L236 HydrophobicContact CE1-CD1 4.24Å; Y213-E239 PolarHBondContact OH-OE1 2.83Å; Y213-L240 HydrophobicContact CD1-CD2 3.72Å; Y213-L240 HydrophobicContact CE1-CD2 4.41Å; Y213-L240 HydrophobicContact CG-CD2 3.81Å; Y213-L243 HydrophobicContact CD2-CD1 4.18Å; Y213-L243 HydrophobicContact CE1-CD1 4.16Å; Y213-L243 HydrophobicContact CE2-CD1 3.41Å; Y213-L243 VanDerWaalsContact CE2-CD1 3.41Å; Y213-L243 VanDerWaalsContact CZ-CD1 3.42Å; Y213-L243 WeakPolarHBondContact OH-CD1 3.43Å; Y213-Y254 AromaticContact CD2-CE1 3.95Å; Y213-Y254 HydrophobicContact CD2-CE1 3.95Å
214	K	95.8	Very high	93.6	Very high	88 Å²	88	23.4 Å²	23.4	38%	0.383	12%	0.122	S	C	.	.	H	α-helix	trans	-63	-36.9	174.7	-177.6	175.3	175.7	-157.5	0	111.9	M210 N211 A212 S218 L257	M210-K214 WeakPolarHBondContact O-CB 3.16Å; M210-K214 PolarHBondContact O-N 2.84Å; N211-K214 PolarHBondContact O-N 3.19Å; A212-K214 VanDerWaalsContact C-N 3.34Å; A212-K214 PolarHBondContact O-N 2.7Å; K214-S218 PolarHBondContact O-N 3.37Å; K214-L257 HydrophobicContact CB-CD1 4.05Å; K214-L257 HydrophobicContact CB-CD2 4.07Å; K214-L257 HydrophobicContact CG-CD2 3.93Å
215	G	95.1	Very high	93.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.4	-48.6	172.3	0	0	0	0	0	112.5	H164 N211 A212 Y213 A217 S218	H164-G215 PolarHBondContact NE2-N 3.42Å; N211-G215 PolarHBondContact O-N 3Å; A212-G215 PolarHBondContact O-N 2.74Å; A212-G215 VanDerWaalsContact O-N 3.16Å; Y213-G215 VanDerWaalsContact C-N 3.3Å; Y213-G215 PolarHBondContact O-N 3.35Å; G215-A217 VanDerWaalsContact C-N 3.32Å; G215-A217 PolarHBondContact O-N 3.41Å; G215-S218 WeakPolarHBondContact O-CB 3.28Å; G215-S218 PolarHBondContact O-N 3.35Å; G215-S218 PolarHBondContact O-OG 3Å
216	L	95.7	Very high	93.7	Very high	11 Å²	11	22.9 Å²	22.9	6%	0.058	12%	0.123	C	C	.	.	H	α-helix	trans	-63.6	-34.4	179.7	-69	171.4	0	0	0	113.4	I181 R183 A212 Y213 S218 Y221 L222 L236	I181-L216 HydrophobicContact CB-CD2 3.92Å; I181-L216 HydrophobicContact CB-CG 4.49Å; I181-L216 HydrophobicContact CG2-CD2 3.85Å; I181-L216 HydrophobicContact CG2-CG 3.92Å; R183-L216 HydrophobicContact CG-CD1 4.14Å; A212-L216 WeakPolarHBondContact O-CG 3.31Å; A212-L216 PolarHBondContact O-N 3.48Å; Y213-L216 HydrophobicContact CD1-CD1 4.43Å; Y213-L216 PolarHBondContact O-N 3.42Å; L216-S218 VanDerWaalsContact C-N 3.29Å; L216-Y221 HydrophobicContact CD2-CD1 4.15Å; L216-Y221 HydrophobicContact CD2-CE1 3.62Å; L216-L222 WeakPolarHBondContact O-CG 3.34Å; L216-L236 HydrophobicContact CB-CD2 4.14Å; L216-L236 WeakPolarHBondContact O-CD2 3.35Å
217	A	96.6	Very high	93.4	Very high	2 Å²	2	30.3 Å²	30.3	2%	0.017	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-8.5	-179.3	0	0	0	0	0	113.8	Y213 G215 L236 L240 L257 C261	Y213-A217 WeakPolarHBondContact O-CB 3.26Å; Y213-A217 PolarHBondContact O-N 3.3Å; G215-A217 VanDerWaalsContact C-N 3.32Å; G215-A217 PolarHBondContact O-N 3.41Å; A217-L236 HydrophobicContact CB-CD2 4.17Å; A217-L240 HydrophobicContact CB-CD1 4.17Å; A217-L257 HydrophobicContact CB-CB 4.18Å; A217-L257 HydrophobicContact CB-CD2 4.36Å; A217-C261 VanDerWaalsContact CB-SG 3.57Å
218	S	95.4	Very high	93.4	Very high	5 Å²	5	27.6 Å²	27.6	4%	0.035	15%	0.147	C	C	.	.			trans	-67.5	140.8	-180	70.9	0	0	0	0	112	A163 K214 G215 L216 A220 Y221 L222	A163-S218 WeakPolarHBondContact CB-OG 3.43Å; A163-S218 WeakPolarHBondContact O-CB 3.22Å; K214-S218 PolarHBondContact O-N 3.37Å; G215-S218 WeakPolarHBondContact O-CB 3.28Å; G215-S218 PolarHBondContact O-N 3.35Å; G215-S218 PolarHBondContact O-OG 3Å; L216-S218 VanDerWaalsContact C-N 3.29Å; S218-A220 VanDerWaalsContact C-N 3.27Å; S218-A220 PolarHBondContact O-N 2.96Å; S218-Y221 PolarHBondContact O-N 3.01Å; S218-Y221 WeakPolarHBondContact OG-CB 3.19Å; S218-Y221 PolarHBondContact OG-N 3.11Å; S218-L222 WeakPolarHBondContact O-CB 3.38Å; S218-L222 WeakPolarHBondContact O-CG 3.45Å; S218-L222 PolarHBondContact O-N 2.91Å
219	A	94.8	Very high	93.5	Very high	14 Å²	14	25.5 Å²	25.5	12%	0.116	13%	0.133	C	C	.	.	H	α-helix	trans	-61.2	-35.9	177.8	0	0	0	0	0	112.4	S223 F264 Y805	A219-S223 WeakPolarHBondContact O-CB 3.48Å; A219-S223 PolarHBondContact O-N 3.28Å; A219-S223 PolarHBondContact O-OG 2.98Å; A219-F264 HydrophobicContact CB-CD2 3.73Å; A219-F264 HydrophobicContact CB-CE2 4.27Å; A219-Y805 HydrophobicContact CB-CE1 4.15Å
220	A	94.4	Very high	93.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.9	-49	176.6	0	0	0	0	0	111.9	Y168 V171 S218 L224	Y168-A220 HydrophobicContact CD1-CB 3.93Å; Y168-A220 VanDerWaalsContact CE1-CA 3.49Å; Y168-A220 HydrophobicContact CE1-CB 3.95Å; Y168-A220 HydrophobicContact CG-CB 4.24Å; V171-A220 HydrophobicContact CG2-CB 4.34Å; S218-A220 VanDerWaalsContact C-N 3.27Å; S218-A220 PolarHBondContact O-N 2.96Å; A220-L224 WeakPolarHBondContact O-CG 3.32Å; A220-L224 PolarHBondContact O-N 2.91Å
221	Y	95.6	Very high	93.4	Very high	14 Å²	14	26.5 Å²	26.5	6%	0.055	14%	0.14	C	C	.	.	H	α-helix	trans	-68.7	-44.1	179.5	-167.2	-97	0	0	0	111.9	I159 L175 I181 L216 S218 S223 L224 S225	I159-Y221 HydrophobicContact CD1-CD2 4.42Å; I159-Y221 HydrophobicContact CD1-CE2 4.37Å; I159-Y221 HydrophobicContact CG1-CD2 4.42Å; I159-Y221 HydrophobicContact CG1-CE2 4.09Å; L175-Y221 HydrophobicContact CD2-CD2 4.4Å; L175-Y221 HydrophobicContact CD2-CE2 3.83Å; I181-Y221 HydrophobicContact CB-CE1 4.44Å; I181-Y221 HydrophobicContact CB-CE2 4.21Å; I181-Y221 HydrophobicContact CD1-CD1 4.32Å; I181-Y221 HydrophobicContact CD1-CD2 3.67Å; I181-Y221 HydrophobicContact CD1-CE1 4.3Å; I181-Y221 HydrophobicContact CD1-CE2 3.64Å; I181-Y221 HydrophobicContact CD1-CG 4.02Å; I181-Y221 HydrophobicContact CG1-CD2 4.21Å; I181-Y221 HydrophobicContact CG1-CE2 3.66Å; I181-Y221 PolarHBondContact N-OH 3.41Å; L216-Y221 HydrophobicContact CD2-CD1 4.15Å; L216-Y221 HydrophobicContact CD2-CE1 3.62Å; S218-Y221 PolarHBondContact O-N 3.01Å; S218-Y221 WeakPolarHBondContact OG-CB 3.19Å; S218-Y221 PolarHBondContact OG-N 3.11Å; Y221-S223 VanDerWaalsContact C-N 3.34Å; Y221-S223 PolarHBondContact O-N 3.44Å; Y221-L224 PolarHBondContact O-N 3.43Å; Y221-S225 WeakPolarHBondContact CD1-OG 3.15Å; Y221-S225 WeakPolarHBondContact CE1-OG 3.36Å; Y221-S225 WeakPolarHBondContact O-CB 3.44Å; Y221-S225 PolarHBondContact O-N 3.28Å; Y221-S225 PolarHBondContact O-OG 2.91Å
222	L	95.1	Very high	93.5	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-58.9	-45.1	178.5	-73.1	169.8	0	0	0	111.9	L216 S218 L224 S226 T232 A233 L236 F264	L216-L222 WeakPolarHBondContact O-CG 3.34Å; S218-L222 WeakPolarHBondContact O-CB 3.38Å; S218-L222 WeakPolarHBondContact O-CG 3.45Å; S218-L222 PolarHBondContact O-N 2.91Å; L222-L224 PolarHBondContact O-N 3.41Å; L222-S226 PolarHBondContact O-OG 2.9Å; L222-T232 HydrophobicContact CD2-CG2 4.05Å; L222-A233 HydrophobicContact CD1-CB 4.07Å; L222-L236 HydrophobicContact CD2-CD2 4.36Å; L222-F264 HydrophobicContact CB-CE1 4.08Å; L222-F264 HydrophobicContact CB-CZ 4.16Å; L222-F264 HydrophobicContact CD1-CD1 4.05Å; L222-F264 HydrophobicContact CD1-CE1 4.35Å; L222-F264 HydrophobicContact CD1-CG 4.44Å
223	S	94.3	Very high	93.5	Very high	9 Å²	9	26.6 Å²	26.6	6%	0.063	14%	0.14	C	C	.	.	H	α-helix	trans	-64.6	-38.1	-178.1	-62.5	0	0	0	0	113.6	A219 Y221 F264	A219-S223 WeakPolarHBondContact O-CB 3.48Å; A219-S223 PolarHBondContact O-N 3.28Å; A219-S223 PolarHBondContact O-OG 2.98Å; Y221-S223 VanDerWaalsContact C-N 3.34Å; Y221-S223 PolarHBondContact O-N 3.44Å; S223-F264 VanDerWaalsContact OG-CE2 3.31Å; S223-F264 WeakPolarHBondContact OG-CE2 3.3Å
224	L	93.1	Very high	93.5	Very high	56 Å²	56	26.4 Å²	26.4	29%	0.293	14%	0.139	S	C	.	.	H	α-helix	trans	-99.8	-26.2	-169.8	-62.5	173.8	0	0	0	113.8	Y168 V171 H172 L175 A220 Y221 L222	Y168-L224 HydrophobicContact CD1-CD1 4.43Å; Y168-L224 VanDerWaalsContact O-CD1 3.28Å; Y168-L224 WeakPolarHBondContact O-CD1 3.37Å; V171-L224 HydrophobicContact CB-CD1 4.19Å; V171-L224 HydrophobicContact CG1-CD1 3.88Å; H172-L224 HydrophobicContact CB-CD1 4.16Å; L175-L224 HydrophobicContact CD1-CB 3.61Å; A220-L224 WeakPolarHBondContact O-CG 3.32Å; A220-L224 PolarHBondContact O-N 2.91Å; Y221-L224 PolarHBondContact O-N 3.43Å; L222-L224 PolarHBondContact O-N 3.41Å
225	S	92.1	Very high	93.4	Very high	36 Å²	36	26.2 Å²	26.2	25%	0.252	14%	0.14	S	C	.	.	H	α-helix	trans	-90.9	-28.9	-174.2	69.4	0	0	0	0	114.4	Y221	Y221-S225 WeakPolarHBondContact CD1-OG 3.15Å; Y221-S225 WeakPolarHBondContact CE1-OG 3.36Å; Y221-S225 WeakPolarHBondContact O-CB 3.44Å; Y221-S225 PolarHBondContact O-N 3.28Å; Y221-S225 PolarHBondContact O-OG 2.91Å
226	S	87.6	Confident	93.4	Very high	28 Å²	28	26.5 Å²	26.5	20%	0.196	14%	0.141	C	C	.	.			trans	-105.4	144.2	-168.5	70.8	0	0	0	0	112.8	L222 P229	L222-S226 PolarHBondContact O-OG 2.9Å; S226-P229 WeakPolarHBondContact OG-CA 3.47Å; S226-P229 WeakPolarHBondContact OG-CB 3.13Å
227	E	85.3	Confident	93.4	Very high	172 Å²	172	26 Å²	26	80%	0.804	14%	0.139	S	C	*	.	S	Bend	trans	-72	-37	175.1	-65	-172.6	178.8	0	0	112
228	D	90	Very high	93.4	Very high	30 Å²	30	28.9 Å²	28.9	16%	0.16	15%	0.154	C	C	.	.	S	Bend	trans	-124.7	88.9	176	-170.1	17.7	0	0	0	110.6	V230 L231 T232 R301 Y794	D228-V230 VanDerWaalsContact C-N 3.32Å; D228-V230 PolarHBondContact O-N 3.25Å; D228-L231 HydrophobicContact CB-CB 4.43Å; D228-L231 VanDerWaalsContact OD2-CB 3.26Å; D228-L231 WeakPolarHBondContact OD2-CB 3.45Å; D228-T232 PolarHBondContact O-N 2.88Å; D228-T232 PolarHBondContact O-OG1 2.64Å; D228-R301 IonicContact OD1-CZ 3.96Å; D228-R301 IonicContact OD1-NH2 3.9Å; D228-R301 PolarHBondContact OD1-NH2 2.95Å; D228-R301 IonicContact OD2-CZ 3.44Å; D228-R301 IonicContact OD2-NE 3.77Å; D228-R301 IonicContact OD2-NH2 3.51Å; D228-R301 PolarHBondContact OD2-NH2 3.31Å; D228-Y794 PolarHBondContact OD1-OH 2.9Å
229	P	93.1	Very high	93.3	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	17%	0.167	C	C	.	.	H	α-helix	trans	-69.5	-30	-173.3	25.1	-33.1	0	0	0	112.9	S226 A233 F264 M798 I802	S226-P229 WeakPolarHBondContact OG-CA 3.47Å; S226-P229 WeakPolarHBondContact OG-CB 3.13Å; P229-A233 WeakPolarHBondContact O-CB 3.33Å; P229-A233 PolarHBondContact O-N 2.99Å; P229-F264 HydrophobicContact CB-CE1 3.98Å; P229-F264 HydrophobicContact CB-CZ 4Å; P229-M798 HydrophobicContact CG-CG 4.22Å; P229-M798 HydrophobicContact CG-SD 3.88Å; P229-I802 HydrophobicContact CB-CD1 4.18Å; P229-I802 HydrophobicContact CG-CD1 3.39Å; P229-I802 HydrophobicContact CG-CG1 3.74Å
230	V	93.1	Very high	93.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.2	-48.9	179.3	173.7	0	0	0	0	110.7	D228 A233 L234 V265 V268 I281 M798	D228-V230 VanDerWaalsContact C-N 3.32Å; D228-V230 PolarHBondContact O-N 3.25Å; V230-A233 PolarHBondContact O-N 3.3Å; V230-L234 HydrophobicContact CG1-CD1 4.22Å; V230-L234 WeakPolarHBondContact O-CB 3.25Å; V230-L234 VanDerWaalsContact O-CG 3.27Å; V230-L234 WeakPolarHBondContact O-CG 3.26Å; V230-L234 PolarHBondContact O-N 3.4Å; V230-V265 HydrophobicContact CG1-CG1 3.94Å; V230-V268 HydrophobicContact CG2-CG1 4.19Å; V230-I281 HydrophobicContact CG1-CG2 4.43Å; V230-M798 HydrophobicContact CG2-CE 3.89Å
231	L	92	Very high	93.4	Very high	54 Å²	54	32.9 Å²	32.9	28%	0.283	18%	0.175	S	C	.	.	H	α-helix	trans	-63.9	-46.1	178.2	179.2	63.4	0	0	0	111.2	D228 A233 L234 E235 L304	D228-L231 HydrophobicContact CB-CB 4.43Å; D228-L231 VanDerWaalsContact OD2-CB 3.26Å; D228-L231 WeakPolarHBondContact OD2-CB 3.45Å; L231-A233 VanDerWaalsContact C-N 3.32Å; L231-A233 PolarHBondContact O-N 3.49Å; L231-L234 PolarHBondContact O-N 3.18Å; L231-E235 HydrophobicContact CD1-CG 4.31Å; L231-E235 PolarHBondContact O-N 2.88Å; L231-L304 HydrophobicContact CD1-CD2 3.63Å
232	T	93.7	Very high	93.3	Very high	30 Å²	30	39.2 Å²	39.2	18%	0.184	20%	0.199	C	C	.	.	H	α-helix	trans	-59.4	-43.5	-179.9	-52.8	0	0	0	0	111.4	L222 D228 L236	L222-T232 HydrophobicContact CD2-CG2 4.05Å; D228-T232 PolarHBondContact O-N 2.88Å; D228-T232 PolarHBondContact O-OG1 2.64Å; T232-L236 VanDerWaalsContact O-CB 3.23Å; T232-L236 WeakPolarHBondContact O-CB 3.43Å; T232-L236 PolarHBondContact O-N 2.96Å
233	A	95.8	Very high	93.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.2	-38.4	177.4	0	0	0	0	0	112.7	L222 P229 V230 L231 S237 F264 V265	L222-A233 HydrophobicContact CD1-CB 4.07Å; P229-A233 WeakPolarHBondContact O-CB 3.33Å; P229-A233 PolarHBondContact O-N 2.99Å; V230-A233 PolarHBondContact O-N 3.3Å; L231-A233 VanDerWaalsContact C-N 3.32Å; L231-A233 PolarHBondContact O-N 3.49Å; A233-S237 VanDerWaalsContact O-CB 3.26Å; A233-S237 WeakPolarHBondContact O-CB 3.24Å; A233-S237 PolarHBondContact O-N 2.97Å; A233-S237 PolarHBondContact O-OG 3.37Å; A233-F264 HydrophobicContact CB-CD1 3.78Å; A233-F264 HydrophobicContact CB-CE1 4.16Å; A233-V265 HydrophobicContact CB-CG2 3.49Å; A233-V265 VanDerWaalsContact CB-CG2 3.49Å
234	L	94.5	Very high	93.4	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-48.1	175.1	-75	176.5	0	0	0	111.6	V230 L231 S237 N238 V265 L304 A305 Y308 V310	V230-L234 HydrophobicContact CG1-CD1 4.22Å; V230-L234 WeakPolarHBondContact O-CB 3.25Å; V230-L234 VanDerWaalsContact O-CG 3.27Å; V230-L234 WeakPolarHBondContact O-CG 3.26Å; V230-L234 PolarHBondContact O-N 3.4Å; L231-L234 PolarHBondContact O-N 3.18Å; L234-S237 PolarHBondContact O-N 3.24Å; L234-S237 PolarHBondContact O-OG 2.84Å; L234-N238 PolarHBondContact O-N 3.5Å; L234-V265 HydrophobicContact CD2-CG1 4.41Å; L234-V265 HydrophobicContact CD2-CG2 4.48Å; L234-V265 HydrophobicContact CG-CG2 4.4Å; L234-L304 HydrophobicContact CD1-CD2 4.49Å; L234-A305 HydrophobicContact CD2-CB 4.46Å; L234-Y308 HydrophobicContact CB-CD2 4.07Å; L234-Y308 HydrophobicContact CB-CE2 4.32Å; L234-Y308 WeakPolarHBondContact O-CD2 3.37Å; L234-V310 HydrophobicContact CD2-CB 4.28Å; L234-V310 HydrophobicContact CD2-CG1 4.39Å; L234-V310 HydrophobicContact CD2-CG2 3.63Å
235	E	94.3	Very high	93.4	Very high	85 Å²	85	41.5 Å²	41.5	40%	0.397	21%	0.211	S	C	.	.	H	α-helix	trans	-62.7	-47.3	177.8	-71.1	-179	171.2	0	0	111.9	L231 S237 N238 E239 Y308	L231-E235 HydrophobicContact CD1-CG 4.31Å; L231-E235 PolarHBondContact O-N 2.88Å; E235-S237 VanDerWaalsContact C-N 3.32Å; E235-S237 PolarHBondContact O-N 3.23Å; E235-N238 PolarHBondContact O-N 3.47Å; E235-E239 PolarHBondContact O-N 3.45Å; E235-Y308 HydrophobicContact CG-CE2 4.39Å
236	L	95.4	Very high	93.4	Very high	6 Å²	6	42.1 Å²	42.1	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-62.1	-39.2	178.3	-173.7	64.4	0	0	0	111.4	Y213 L216 A217 L222 T232 N238 E239 L240	Y213-L236 HydrophobicContact CD1-CD1 4.15Å; Y213-L236 HydrophobicContact CE1-CD1 4.24Å; L216-L236 HydrophobicContact CB-CD2 4.14Å; L216-L236 WeakPolarHBondContact O-CD2 3.35Å; A217-L236 HydrophobicContact CB-CD2 4.17Å; L222-L236 HydrophobicContact CD2-CD2 4.36Å; T232-L236 VanDerWaalsContact O-CB 3.23Å; T232-L236 WeakPolarHBondContact O-CB 3.43Å; T232-L236 PolarHBondContact O-N 2.96Å; L236-N238 VanDerWaalsContact C-N 3.27Å; L236-N238 PolarHBondContact O-N 3.43Å; L236-E239 PolarHBondContact O-N 2.86Å; L236-L240 HydrophobicContact CD1-CG 4.45Å; L236-L240 HydrophobicContact CG-CD1 4.02Å; L236-L240 HydrophobicContact CG-CG 4.39Å; L236-L240 WeakPolarHBondContact O-CB 3.22Å; L236-L240 VanDerWaalsContact O-CG 3.22Å; L236-L240 WeakPolarHBondContact O-CG 3.37Å; L236-L240 PolarHBondContact O-N 2.85Å
237	S	96.3	Very high	93.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.9	-37.4	177.6	77.8	0	0	0	0	112.5	A233 L234 E235 A241 S258	A233-S237 VanDerWaalsContact O-CB 3.26Å; A233-S237 WeakPolarHBondContact O-CB 3.24Å; A233-S237 PolarHBondContact O-N 2.97Å; A233-S237 PolarHBondContact O-OG 3.37Å; L234-S237 PolarHBondContact O-N 3.24Å; L234-S237 PolarHBondContact O-OG 2.84Å; E235-S237 VanDerWaalsContact C-N 3.32Å; E235-S237 PolarHBondContact O-N 3.23Å; S237-A241 WeakPolarHBondContact O-CB 3.3Å; S237-A241 PolarHBondContact O-N 3.42Å; S237-S258 PolarHBondContact O-OG 3.33Å
238	N	95	Very high	93.9	Very high	62 Å²	62	37.3 Å²	37.3	33%	0.332	19%	0.192	S	C	.	.	H	α-helix	trans	-75	-38.6	178.1	177.4	67	0	0	0	111.8	L234 E235 L236 A241 R242 Y308	L234-N238 PolarHBondContact O-N 3.5Å; E235-N238 PolarHBondContact O-N 3.47Å; L236-N238 VanDerWaalsContact C-N 3.27Å; L236-N238 PolarHBondContact O-N 3.43Å; N238-A241 PolarHBondContact O-N 2.81Å; N238-R242 WeakPolarHBondContact O-CB 3.26Å; N238-R242 PolarHBondContact O-N 3.24Å; N238-Y308 HydrophobicContact CB-CD1 3.47Å; N238-Y308 VanDerWaalsContact CB-CD1 3.47Å; N238-Y308 HydrophobicContact CB-CD2 4.09Å; N238-Y308 HydrophobicContact CB-CE1 3.69Å; N238-Y308 HydrophobicContact CB-CE2 4.28Å; N238-Y308 HydrophobicContact CB-CG 3.69Å; N238-Y308 WeakPolarHBondContact ND2-CE1 3.4Å; N238-Y308 WeakPolarHBondContact OD1-CD1 3.47Å
239	E	94.6	Very high	94	Very high	69 Å²	69	43.1 Å²	43.1	32%	0.322	22%	0.218	S	C	.	.	H	α-helix	trans	-59.6	-49.3	173	-177	170.5	-157.6	0	0	111.3	Y213 E235 L236 A241 R242 L243	Y213-E239 PolarHBondContact OH-OE1 2.83Å; E235-E239 PolarHBondContact O-N 3.45Å; L236-E239 PolarHBondContact O-N 2.86Å; E239-A241 VanDerWaalsContact C-N 3.33Å; E239-A241 PolarHBondContact O-N 3.21Å; E239-R242 WeakPolarHBondContact O-CB 3.45Å; E239-R242 PolarHBondContact O-N 3.46Å; E239-R242 VanDerWaalsContact O-N 3.15Å; E239-L243 HydrophobicContact CG-CD1 4.17Å; E239-L243 WeakPolarHBondContact O-CG 3.34Å; E239-L243 PolarHBondContact O-N 3.49Å
240	L	96	Very high	94	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.1	-40.2	175.8	-66	167.9	0	0	0	112.1	Y213 A217 L236 R242 L243 A244 Y254 L257	Y213-L240 HydrophobicContact CD1-CD2 3.72Å; Y213-L240 HydrophobicContact CE1-CD2 4.41Å; Y213-L240 HydrophobicContact CG-CD2 3.81Å; A217-L240 HydrophobicContact CB-CD1 4.17Å; L236-L240 HydrophobicContact CD1-CG 4.45Å; L236-L240 HydrophobicContact CG-CD1 4.02Å; L236-L240 HydrophobicContact CG-CG 4.39Å; L236-L240 WeakPolarHBondContact O-CB 3.22Å; L236-L240 VanDerWaalsContact O-CG 3.22Å; L236-L240 WeakPolarHBondContact O-CG 3.37Å; L236-L240 PolarHBondContact O-N 2.85Å; L240-R242 VanDerWaalsContact C-N 3.31Å; L240-R242 PolarHBondContact O-N 3.02Å; L240-L243 PolarHBondContact O-N 2.98Å; L240-A244 WeakPolarHBondContact O-CB 3.4Å; L240-A244 PolarHBondContact O-N 3.42Å; L240-Y254 HydrophobicContact CD2-CD1 3.77Å; L240-Y254 HydrophobicContact CD2-CE1 4.27Å; L240-L257 HydrophobicContact CD1-CB 3.84Å; L240-L257 HydrophobicContact CD2-CB 4.44Å; L240-L257 HydrophobicContact CD2-CD1 4.46Å
241	A	94.6	Very high	94	Very high	34 Å²	34	47.6 Å²	47.6	28%	0.281	24%	0.238	S	C	.	.	H	α-helix	trans	-65.3	-35.4	176.8	0	0	0	0	0	112.3	S237 N238 E239 N245	S237-A241 WeakPolarHBondContact O-CB 3.3Å; S237-A241 PolarHBondContact O-N 3.42Å; N238-A241 PolarHBondContact O-N 2.81Å; E239-A241 VanDerWaalsContact C-N 3.33Å; E239-A241 PolarHBondContact O-N 3.21Å; A241-N245 PolarHBondContact O-ND2 3.11Å
242	R	93.9	Very high	94.2	Very high	147 Å²	147	50.8 Å²	50.8	56%	0.555	26%	0.255	S	S	*	.	H	α-helix	trans	-69.4	-44.6	173.7	-173.8	-178	176.1	-160	-4.7	111.1	N238 E239 L240 A244 N245 I246	N238-R242 WeakPolarHBondContact O-CB 3.26Å; N238-R242 PolarHBondContact O-N 3.24Å; E239-R242 WeakPolarHBondContact O-CB 3.45Å; E239-R242 PolarHBondContact O-N 3.46Å; E239-R242 VanDerWaalsContact O-N 3.15Å; L240-R242 VanDerWaalsContact C-N 3.31Å; L240-R242 PolarHBondContact O-N 3.02Å; R242-A244 VanDerWaalsContact C-N 3.31Å; R242-A244 PolarHBondContact O-N 3.14Å; R242-N245 PolarHBondContact O-N 2.98Å; R242-N245 VanDerWaalsContact O-N 3.07Å; R242-I246 HydrophobicContact CG-CD1 4.13Å; R242-I246 WeakPolarHBondContact O-CG1 3.31Å; R242-I246 PolarHBondContact O-N 3.25Å
243	L	94.3	Very high	94.3	Very high	7 Å²	7	52.8 Å²	52.8	4%	0.037	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-36.9	177.4	-72.1	169.1	0	0	0	112.3	Y213 E239 L240 N245 I246 E247 Y254	Y213-L243 HydrophobicContact CD2-CD1 4.18Å; Y213-L243 HydrophobicContact CE1-CD1 4.16Å; Y213-L243 HydrophobicContact CE2-CD1 3.41Å; Y213-L243 VanDerWaalsContact CE2-CD1 3.41Å; Y213-L243 VanDerWaalsContact CZ-CD1 3.42Å; Y213-L243 WeakPolarHBondContact OH-CD1 3.43Å; E239-L243 HydrophobicContact CG-CD1 4.17Å; E239-L243 WeakPolarHBondContact O-CG 3.34Å; E239-L243 PolarHBondContact O-N 3.49Å; L240-L243 PolarHBondContact O-N 2.98Å; L243-N245 PolarHBondContact O-N 2.84Å; L243-N245 VanDerWaalsContact O-N 3.12Å; L243-I246 HydrophobicContact CD2-CD1 4.43Å; L243-I246 PolarHBondContact O-N 3.5Å; L243-E247 PolarHBondContact O-N 3.04Å; L243-Y254 HydrophobicContact CB-CD1 4.16Å; L243-Y254 HydrophobicContact CB-CE1 4.11Å; L243-Y254 HydrophobicContact CB-CG 4.43Å; L243-Y254 HydrophobicContact CD1-CE1 4.18Å
244	A	96	Very high	94.3	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-59.7	-23.3	173.8	0	0	0	0	0	113.8	L240 R242 K251 R255	L240-A244 WeakPolarHBondContact O-CB 3.4Å; L240-A244 PolarHBondContact O-N 3.42Å; R242-A244 VanDerWaalsContact C-N 3.31Å; R242-A244 PolarHBondContact O-N 3.14Å; A244-K251 HydrophobicContact CB-CG 4.34Å; A244-K251 VanDerWaalsContact O-CG 3.26Å; A244-K251 WeakPolarHBondContact O-CG 3.43Å; A244-R255 HydrophobicContact CB-CG 4.13Å
245	N	93.6	Very high	94.4	Very high	110 Å²	110	58.6 Å²	58.6	59%	0.588	29%	0.286	S	S	*	.	H	α-helix	trans	-91.6	-17.1	175.1	-67.1	-36.4	0	0	0	112.8	A241 R242 L243	A241-N245 PolarHBondContact O-ND2 3.11Å; R242-N245 PolarHBondContact O-N 2.98Å; R242-N245 VanDerWaalsContact O-N 3.07Å; L243-N245 PolarHBondContact O-N 2.84Å; L243-N245 VanDerWaalsContact O-N 3.12Å
246	I	93.3	Very high	94.5	Very high	49 Å²	49	61.1 Å²	61.1	25%	0.251	30%	0.296	S	S	.	.	H	α-helix	trans	-89.2	-52.5	177.8	-63.5	166.6	0	0	0	109.9	Y187 F188 R242 L243	Y187-I246 HydrophobicContact CD1-CG2 3.71Å; Y187-I246 HydrophobicContact CD2-CG2 4.32Å; Y187-I246 HydrophobicContact CE1-CG2 3.82Å; Y187-I246 HydrophobicContact CE2-CG2 4.43Å; Y187-I246 HydrophobicContact CG-CG2 3.98Å; F188-I246 HydrophobicContact CE2-CD1 4.19Å; F188-I246 HydrophobicContact CE2-CG2 4.43Å; F188-I246 HydrophobicContact CZ-CG2 4.04Å; R242-I246 HydrophobicContact CG-CD1 4.13Å; R242-I246 WeakPolarHBondContact O-CG1 3.31Å; R242-I246 PolarHBondContact O-N 3.25Å; L243-I246 HydrophobicContact CD2-CD1 4.43Å; L243-I246 PolarHBondContact O-N 3.5Å
247	E	92.4	Very high	94.6	Very high	7 Å²	7	61.3 Å²	61.3	3%	0.033	30%	0.297	C	S	.	.			trans	-93.6	101.4	176.1	-68.6	-171.9	173.4	0	0	109.7	Y187 R209 L243 Y254	Y187-E247 HydrophobicContact CD2-CG 3.95Å; Y187-E247 VanDerWaalsContact CD2-OE1 3.24Å; Y187-E247 WeakPolarHBondContact CD2-OE1 3.3Å; Y187-E247 HydrophobicContact CE2-CG 3.58Å; Y187-E247 WeakPolarHBondContact CE2-OE1 3.36Å; R209-E247 IonicContact CZ-OE1 3.2Å; R209-E247 IonicContact NE-OE1 3.54Å; R209-E247 PolarHBondContact NE-OE1 3.15Å; R209-E247 VanDerWaalsContact NE-OE1 3.17Å; R209-E247 IonicContact NH2-OE1 3.08Å; R209-E247 PolarHBondContact NH2-OE1 3.27Å; L243-E247 PolarHBondContact O-N 3.04Å; E247-Y254 HydrophobicContact CB-CE2 3.98Å; E247-Y254 WeakPolarHBondContact OE2-CE2 3.44Å; E247-Y254 VanDerWaalsContact OE2-CZ 3.29Å; E247-Y254 PolarHBondContact OE2-OH 2.96Å
248	T	90.5	Very high	94.6	Very high	92 Å²	92	61.6 Å²	61.6	56%	0.564	30%	0.299	S	S	*	.	S	Bend	trans	-76	-26	-175.6	56	0	0	0	0	113.3	K251	T248-K251 VanDerWaalsContact O-CB 3.31Å; T248-K251 WeakPolarHBondContact O-CB 3.45Å
249	E	91.4	Very high	94.6	Very high	152 Å²	152	62.3 Å²	62.3	71%	0.71	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-44.1	-175.9	-60.5	78.1	-175.6	0	0	111.2
250	F	93.4	Very high	94.6	Very high	32 Å²	32	62.3 Å²	62.3	14%	0.14	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	20.8	179.6	-60.9	-67.7	0	0	0	113.5	F203 M210 N252 D253 Y254	F203-F250 HydrophobicContact CE2-CZ 4.45Å; M210-F250 HydrophobicContact CE-CB 3.59Å; M210-F250 HydrophobicContact CE-CG 4.19Å; F250-N252 VanDerWaalsContact C-N 3.25Å; F250-N252 PolarHBondContact O-N 3.33Å; F250-D253 PolarHBondContact O-N 2.93Å; F250-D253 VanDerWaalsContact O-N 3.08Å; F250-Y254 HydrophobicContact CB-CD2 4.08Å; F250-Y254 HydrophobicContact CB-CE2 3.9Å; F250-Y254 VanDerWaalsContact O-CD2 3.29Å; F250-Y254 WeakPolarHBondContact O-CD2 3.41Å; F250-Y254 PolarHBondContact O-N 3.33Å; F250-Y254 VanDerWaalsContact O-N 3.12Å
251	K	94.2	Very high	94.6	Very high	63 Å²	63	62.3 Å²	62.3	27%	0.274	30%	0.301	S	S	.	.	H	α-helix	trans	-54.1	-39.8	-175	179.4	170	-158.7	-178.2	0	113.6	A244 T248 R255	A244-K251 HydrophobicContact CB-CG 4.34Å; A244-K251 VanDerWaalsContact O-CG 3.26Å; A244-K251 WeakPolarHBondContact O-CG 3.43Å; T248-K251 VanDerWaalsContact O-CB 3.31Å; T248-K251 WeakPolarHBondContact O-CB 3.45Å; K251-R255 VanDerWaalsContact CE-CZ 3.44Å; K251-R255 VanDerWaalsContact CE-NH2 3.26Å; K251-R255 WeakPolarHBondContact O-CB 3.47Å; K251-R255 VanDerWaalsContact O-CG 3.25Å; K251-R255 WeakPolarHBondContact O-CG 3.47Å; K251-R255 PolarHBondContact O-N 3.42Å; K251-R255 VanDerWaalsContact O-N 3.08Å
252	N	95.6	Very high	94.7	Very high	121 Å²	121	62.3 Å²	62.3	65%	0.647	30%	0.295	S	S	*	.	H	α-helix	trans	-69.3	-38.6	-179.4	-68.6	-18.6	0	0	0	111.9	F250 R255 K256	F250-N252 VanDerWaalsContact C-N 3.25Å; F250-N252 PolarHBondContact O-N 3.33Å; N252-R255 PolarHBondContact O-N 3.09Å; N252-K256 WeakPolarHBondContact O-CB 3.13Å; N252-K256 PolarHBondContact O-N 3.12Å
253	D	95.3	Very high	94.8	Very high	71 Å²	71	58.4 Å²	58.4	38%	0.38	29%	0.285	S	S	.	.	H	α-helix	trans	-67.2	-47.6	178.8	-65.6	-31.1	0	0	0	110.9	M210 F250 R255 K256 L257	M210-D253 HydrophobicContact CE-CB 3.72Å; M210-D253 HydrophobicContact SD-CB 4.1Å; F250-D253 PolarHBondContact O-N 2.93Å; F250-D253 VanDerWaalsContact O-N 3.08Å; D253-R255 VanDerWaalsContact C-N 3.3Å; D253-R255 PolarHBondContact O-N 2.96Å; D253-K256 WeakPolarHBondContact O-CB 3.44Å; D253-K256 PolarHBondContact O-N 3.18Å; D253-K256 VanDerWaalsContact O-N 3.1Å; D253-L257 WeakPolarHBondContact O-CG 3.3Å; D253-L257 PolarHBondContact O-N 2.93Å
254	Y	96.8	Very high	94.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-38.7	174.8	-74.2	-66.2	0	0	0	112.7	M210 Y213 L240 L243 E247 F250 L257 S258	M210-Y254 HydrophobicContact CE-CD1 3.88Å; M210-Y254 HydrophobicContact CE-CD2 3.64Å; M210-Y254 HydrophobicContact CE-CE1 3.67Å; M210-Y254 HydrophobicContact CE-CE2 3.4Å; M210-Y254 VanDerWaalsContact CE-CE2 3.4Å; M210-Y254 HydrophobicContact CE-CG 3.86Å; M210-Y254 VanDerWaalsContact CE-CZ 3.43Å; M210-Y254 HydrophobicContact SD-CD1 4.45Å; M210-Y254 HydrophobicContact SD-CE1 4.25Å; Y213-Y254 AromaticContact CD2-CE1 3.95Å; Y213-Y254 HydrophobicContact CD2-CE1 3.95Å; L240-Y254 HydrophobicContact CD2-CD1 3.77Å; L240-Y254 HydrophobicContact CD2-CE1 4.27Å; L243-Y254 HydrophobicContact CB-CD1 4.16Å; L243-Y254 HydrophobicContact CB-CE1 4.11Å; L243-Y254 HydrophobicContact CB-CG 4.43Å; L243-Y254 HydrophobicContact CD1-CE1 4.18Å; E247-Y254 HydrophobicContact CB-CE2 3.98Å; E247-Y254 WeakPolarHBondContact OE2-CE2 3.44Å; E247-Y254 VanDerWaalsContact OE2-CZ 3.29Å; E247-Y254 PolarHBondContact OE2-OH 2.96Å; F250-Y254 HydrophobicContact CB-CD2 4.08Å; F250-Y254 HydrophobicContact CB-CE2 3.9Å; F250-Y254 VanDerWaalsContact O-CD2 3.29Å; F250-Y254 WeakPolarHBondContact O-CD2 3.41Å; F250-Y254 PolarHBondContact O-N 3.33Å; F250-Y254 VanDerWaalsContact O-N 3.12Å; Y254-L257 PolarHBondContact O-N 3.4Å; Y254-S258 VanDerWaalsContact O-CB 3.3Å; Y254-S258 WeakPolarHBondContact O-CB 3.31Å; Y254-S258 PolarHBondContact O-N 2.91Å
255	R	95.7	Very high	94.8	Very high	123 Å²	123	58.3 Å²	58.3	46%	0.464	28%	0.284	S	S	.	.	H	α-helix	trans	-63.5	-41.8	174.4	-78.8	173.3	171.1	-175.4	-10.7	111.5	A244 K251 N252 D253 S258 M259	A244-R255 HydrophobicContact CB-CG 4.13Å; K251-R255 VanDerWaalsContact CE-CZ 3.44Å; K251-R255 VanDerWaalsContact CE-NH2 3.26Å; K251-R255 WeakPolarHBondContact O-CB 3.47Å; K251-R255 VanDerWaalsContact O-CG 3.25Å; K251-R255 WeakPolarHBondContact O-CG 3.47Å; K251-R255 PolarHBondContact O-N 3.42Å; K251-R255 VanDerWaalsContact O-N 3.08Å; N252-R255 PolarHBondContact O-N 3.09Å; D253-R255 VanDerWaalsContact C-N 3.3Å; D253-R255 PolarHBondContact O-N 2.96Å; R255-S258 PolarHBondContact O-N 3.35Å; R255-M259 WeakPolarHBondContact O-CB 3.49Å; R255-M259 WeakPolarHBondContact O-CG 3.17Å; R255-M259 PolarHBondContact O-N 3.38Å
256	K	96.6	Very high	94.9	Very high	138 Å²	138	54 Å²	54	60%	0.6	26%	0.262	S	S	*	.	H	α-helix	trans	-62.3	-46	176	-169.9	176.2	-178.2	177.4	0	111.3	N252 D253 M259 Q260	N252-K256 WeakPolarHBondContact O-CB 3.13Å; N252-K256 PolarHBondContact O-N 3.12Å; D253-K256 WeakPolarHBondContact O-CB 3.44Å; D253-K256 PolarHBondContact O-N 3.18Å; D253-K256 VanDerWaalsContact O-N 3.1Å; K256-M259 PolarHBondContact O-N 2.97Å; K256-Q260 WeakPolarHBondContact O-CG 3.39Å; K256-Q260 PolarHBondContact O-N 3.32Å
257	L	96.6	Very high	95	Very high	10 Å²	10	52.5 Å²	52.5	5%	0.052	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-41.2	175.9	-63	-179.3	0	0	0	112.3	M210 K214 A217 L240 D253 Y254 M259 Q260 C261	M210-L257 HydrophobicContact SD-CD1 3.73Å; K214-L257 HydrophobicContact CB-CD1 4.05Å; K214-L257 HydrophobicContact CB-CD2 4.07Å; K214-L257 HydrophobicContact CG-CD2 3.93Å; A217-L257 HydrophobicContact CB-CB 4.18Å; A217-L257 HydrophobicContact CB-CD2 4.36Å; L240-L257 HydrophobicContact CD1-CB 3.84Å; L240-L257 HydrophobicContact CD2-CB 4.44Å; L240-L257 HydrophobicContact CD2-CD1 4.46Å; D253-L257 WeakPolarHBondContact O-CG 3.3Å; D253-L257 PolarHBondContact O-N 2.93Å; Y254-L257 PolarHBondContact O-N 3.4Å; L257-M259 VanDerWaalsContact C-N 3.31Å; L257-M259 PolarHBondContact O-N 3.22Å; L257-Q260 WeakPolarHBondContact O-CB 3.48Å; L257-Q260 PolarHBondContact O-N 3.03Å; L257-C261 PolarHBondContact O-N 3.4Å; L257-C261 PolarHBondContact O-SG 3.36Å
258	S	96.9	Very high	95.2	Very high	5 Å²	5	52.1 Å²	52.1	4%	0.035	26%	0.257	C	S	.	.	H	α-helix	trans	-60.3	-43.1	174.8	-176.9	0	0	0	0	111	S237 Y254 R255 C261 K262	S237-S258 PolarHBondContact O-OG 3.33Å; Y254-S258 VanDerWaalsContact O-CB 3.3Å; Y254-S258 WeakPolarHBondContact O-CB 3.31Å; Y254-S258 PolarHBondContact O-N 2.91Å; R255-S258 PolarHBondContact O-N 3.35Å; S258-C261 PolarHBondContact O-N 3.1Å; S258-K262 VanDerWaalsContact O-CG 3.32Å; S258-K262 WeakPolarHBondContact O-CG 3.33Å; S258-K262 PolarHBondContact O-N 3.3Å
259	M	94.7	Very high	95.4	Very high	77 Å²	77	47.8 Å²	47.8	38%	0.379	23%	0.23	S	C	.	.	H	α-helix	trans	-64.4	-41	175.1	-73.3	-56.6	-60.1	0	0	112.4	R255 K256 L257 C261 K262 D263	R255-M259 WeakPolarHBondContact O-CB 3.49Å; R255-M259 WeakPolarHBondContact O-CG 3.17Å; R255-M259 PolarHBondContact O-N 3.38Å; K256-M259 PolarHBondContact O-N 2.97Å; L257-M259 VanDerWaalsContact C-N 3.31Å; L257-M259 PolarHBondContact O-N 3.22Å; M259-C261 VanDerWaalsContact C-N 3.35Å; M259-C261 PolarHBondContact O-N 3.17Å; M259-K262 WeakPolarHBondContact O-CB 3.49Å; M259-K262 PolarHBondContact O-N 2.81Å; M259-K262 VanDerWaalsContact O-N 3.09Å; M259-K262 HydrophobicContact SD-CD 4.09Å; M259-D263 WeakPolarHBondContact O-CB 3.38Å; M259-D263 PolarHBondContact O-N 2.69Å
260	Q	95.9	Very high	95.6	Very high	70 Å²	70	44.2 Å²	44.2	33%	0.327	22%	0.215	S	C	.	.	H	α-helix	trans	-58.1	-44.7	174.2	-73.9	175.6	-15	0	0	112.2	K256 L257 K262 D263 F264	K256-Q260 WeakPolarHBondContact O-CG 3.39Å; K256-Q260 PolarHBondContact O-N 3.32Å; L257-Q260 WeakPolarHBondContact O-CB 3.48Å; L257-Q260 PolarHBondContact O-N 3.03Å; Q260-K262 VanDerWaalsContact C-N 3.32Å; Q260-K262 PolarHBondContact O-N 3.39Å; Q260-D263 PolarHBondContact O-N 3.37Å; Q260-F264 WeakPolarHBondContact O-CB 3.4Å; Q260-F264 PolarHBondContact O-N 3.47Å
261	C	96.2	Very high	95.7	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.3	-39.7	174	-69.6	0	0	0	0	112.3	A217 L257 S258 M259 V265	A217-C261 VanDerWaalsContact CB-SG 3.57Å; L257-C261 PolarHBondContact O-N 3.4Å; L257-C261 PolarHBondContact O-SG 3.36Å; S258-C261 PolarHBondContact O-N 3.1Å; M259-C261 VanDerWaalsContact C-N 3.35Å; M259-C261 PolarHBondContact O-N 3.17Å; C261-V265 WeakPolarHBondContact O-CG2 3.28Å; C261-V265 PolarHBondContact O-N 3.45Å
262	K	95.3	Very high	95.7	Very high	33 Å²	33	41.5 Å²	41.5	14%	0.143	21%	0.206	C	C	.	.	H	α-helix	trans	-67.6	-44.8	177.7	-69.7	179.1	-175.4	-166.5	0	111.7	S258 M259 Q260 F264 V265 V266 E309 V310	S258-K262 VanDerWaalsContact O-CG 3.32Å; S258-K262 WeakPolarHBondContact O-CG 3.33Å; S258-K262 PolarHBondContact O-N 3.3Å; M259-K262 WeakPolarHBondContact O-CB 3.49Å; M259-K262 PolarHBondContact O-N 2.81Å; M259-K262 VanDerWaalsContact O-N 3.09Å; M259-K262 HydrophobicContact SD-CD 4.09Å; Q260-K262 VanDerWaalsContact C-N 3.32Å; Q260-K262 PolarHBondContact O-N 3.39Å; K262-F264 VanDerWaalsContact C-N 3.33Å; K262-V265 PolarHBondContact O-N 3.26Å; K262-V266 WeakPolarHBondContact O-CG2 3.3Å; K262-V266 PolarHBondContact O-N 2.92Å; K262-V266 VanDerWaalsContact O-N 3.13Å; K262-E309 PolarHBondContact NZ-O 3.45Å; K262-E309 VanDerWaalsContact NZ-O 3.12Å; K262-V310 HydrophobicContact CB-CG1 4.02Å; K262-V310 HydrophobicContact CD-CG1 4.32Å; K262-V310 HydrophobicContact CD-CG2 4.29Å; K262-V310 HydrophobicContact CG-CG1 3.9Å; K262-V310 HydrophobicContact CG-CG2 4.08Å
263	D	95.5	Very high	95.5	Very high	66 Å²	66	44.8 Å²	44.8	35%	0.353	21%	0.21	S	C	.	.	H	α-helix	trans	-67.8	-33.9	179.2	-69.6	-31.3	0	0	0	111.2	M259 Q260 V265 V266 G267 K312	M259-D263 WeakPolarHBondContact O-CB 3.38Å; M259-D263 PolarHBondContact O-N 2.69Å; Q260-D263 PolarHBondContact O-N 3.37Å; D263-V265 PolarHBondContact O-N 3.36Å; D263-V266 PolarHBondContact O-N 3Å; D263-G267 PolarHBondContact O-N 3.12Å; D263-K312 WeakPolarHBondContact OD1-CD 3.49Å; D263-K312 IonicContact OD1-NZ 2.69Å; D263-K312 PolarHBondContact OD1-NZ 3.39Å; D263-K312 IonicContact OD2-NZ 2.57Å
264	F	95.9	Very high	95.3	Very high	5 Å²	5	45.4 Å²	45.4	2%	0.022	21%	0.213	C	C	.	.	H	α-helix	trans	-57	-49.1	170	169.5	-102.9	0	0	0	111.9	A219 L222 S223 P229 A233 Q260 K262 V266 G267 V268 I802 Y805	A219-F264 HydrophobicContact CB-CD2 3.73Å; A219-F264 HydrophobicContact CB-CE2 4.27Å; L222-F264 HydrophobicContact CB-CE1 4.08Å; L222-F264 HydrophobicContact CB-CZ 4.16Å; L222-F264 HydrophobicContact CD1-CD1 4.05Å; L222-F264 HydrophobicContact CD1-CE1 4.35Å; L222-F264 HydrophobicContact CD1-CG 4.44Å; S223-F264 VanDerWaalsContact OG-CE2 3.31Å; S223-F264 WeakPolarHBondContact OG-CE2 3.3Å; P229-F264 HydrophobicContact CB-CE1 3.98Å; P229-F264 HydrophobicContact CB-CZ 4Å; A233-F264 HydrophobicContact CB-CD1 3.78Å; A233-F264 HydrophobicContact CB-CE1 4.16Å; Q260-F264 WeakPolarHBondContact O-CB 3.4Å; Q260-F264 PolarHBondContact O-N 3.47Å; K262-F264 VanDerWaalsContact C-N 3.33Å; F264-V266 VanDerWaalsContact C-N 3.3Å; F264-V266 PolarHBondContact O-N 3.24Å; F264-G267 PolarHBondContact O-N 3.06Å; F264-V268 HydrophobicContact CD2-CG2 4.48Å; F264-V268 HydrophobicContact CE1-CG2 4.32Å; F264-V268 HydrophobicContact CE2-CG2 4.02Å; F264-V268 HydrophobicContact CZ-CG2 3.93Å; F264-V268 WeakPolarHBondContact O-CG2 3.5Å; F264-V268 PolarHBondContact O-N 2.94Å; F264-I802 HydrophobicContact CZ-CD1 4.36Å; F264-Y805 AromaticContact CD2-CE1 3.72Å; F264-Y805 HydrophobicContact CD2-CE1 3.72Å; F264-Y805 HydrophobicContact CD2-CE2 4.23Å; F264-Y805 AromaticContact CD2-CZ 3.56Å; F264-Y805 WeakPolarHBondContact CD2-OH 3.36Å; F264-Y805 AromaticContact CE2-CD1 3.94Å; F264-Y805 HydrophobicContact CE2-CD1 3.94Å; F264-Y805 AromaticContact CE2-CE1 3.52Å; F264-Y805 HydrophobicContact CE2-CE1 3.52Å; F264-Y805 HydrophobicContact CE2-CE2 4.45Å; F264-Y805 AromaticContact CE2-CZ 3.82Å
265	V	95.9	Very high	94.9	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-37.3	179.3	174.8	0	0	0	0	111.7	V230 A233 L234 C261 K262 D263 L269 F313	V230-V265 HydrophobicContact CG1-CG1 3.94Å; A233-V265 HydrophobicContact CB-CG2 3.49Å; A233-V265 VanDerWaalsContact CB-CG2 3.49Å; L234-V265 HydrophobicContact CD2-CG1 4.41Å; L234-V265 HydrophobicContact CD2-CG2 4.48Å; L234-V265 HydrophobicContact CG-CG2 4.4Å; C261-V265 WeakPolarHBondContact O-CG2 3.28Å; C261-V265 PolarHBondContact O-N 3.45Å; K262-V265 PolarHBondContact O-N 3.26Å; D263-V265 PolarHBondContact O-N 3.36Å; V265-L269 PolarHBondContact O-N 2.8Å; V265-F313 HydrophobicContact CG1-CD2 3.53Å; V265-F313 HydrophobicContact CG1-CE2 3.73Å; V265-F313 HydrophobicContact CG1-CG 4.23Å
266	V	96.1	Very high	94.5	Very high	19 Å²	19	47.5 Å²	47.5	12%	0.115	24%	0.235	C	C	.	.	H	α-helix	trans	-64.2	-49.1	173.5	176.9	0	0	0	0	110.2	K262 D263 F264 V268 L269 D270 K312 F313	K262-V266 WeakPolarHBondContact O-CG2 3.3Å; K262-V266 PolarHBondContact O-N 2.92Å; K262-V266 VanDerWaalsContact O-N 3.13Å; D263-V266 PolarHBondContact O-N 3Å; F264-V266 VanDerWaalsContact C-N 3.3Å; F264-V266 PolarHBondContact O-N 3.24Å; V266-V268 VanDerWaalsContact C-N 3.25Å; V266-V268 PolarHBondContact O-N 2.6Å; V266-L269 WeakPolarHBondContact O-CA 3.31Å; V266-L269 WeakPolarHBondContact O-CB 3.29Å; V266-L269 PolarHBondContact O-N 2.82Å; V266-D270 PolarHBondContact O-N 3.4Å; V266-K312 HydrophobicContact CG2-CB 3.7Å; V266-F313 HydrophobicContact CG2-CB 4.1Å
267	G	95.3	Very high	94.3	Very high	17 Å²	17	41 Å²	41	18%	0.175	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-32.2	179.3	0	0	0	0	0	113.9	D263 F264 L271	D263-G267 PolarHBondContact O-N 3.12Å; F264-G267 PolarHBondContact O-N 3.06Å; G267-L271 WeakPolarHBondContact O-CD1 3.4Å; G267-L271 WeakPolarHBondContact O-CG 3.25Å
268	V	95.1	Very high	94	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-69.6	-38.6	172.2	175.7	0	0	0	0	111.6	V230 F264 V266 L271 I281 L801 I802 Y805	V230-V268 HydrophobicContact CG2-CG1 4.19Å; F264-V268 HydrophobicContact CD2-CG2 4.48Å; F264-V268 HydrophobicContact CE1-CG2 4.32Å; F264-V268 HydrophobicContact CE2-CG2 4.02Å; F264-V268 HydrophobicContact CZ-CG2 3.93Å; F264-V268 WeakPolarHBondContact O-CG2 3.5Å; F264-V268 PolarHBondContact O-N 2.94Å; V266-V268 VanDerWaalsContact C-N 3.25Å; V266-V268 PolarHBondContact O-N 2.6Å; V268-L271 PolarHBondContact O-N 3.39Å; V268-I281 HydrophobicContact CG1-CD1 4.14Å; V268-L801 HydrophobicContact CG1-CB 4.42Å; V268-I802 HydrophobicContact CG2-CD1 4.13Å; V268-Y805 HydrophobicContact CG2-CD2 3.97Å; V268-Y805 HydrophobicContact CG2-CE2 4.45Å; V268-Y805 HydrophobicContact CG2-CG 4.2Å
269	L	94.8	Very high	93.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.3	-35.1	177.7	-178.2	64.1	0	0	0	112.4	V265 V266 L271 C272 I281 F313 H316 C319	V265-L269 PolarHBondContact O-N 2.8Å; V266-L269 WeakPolarHBondContact O-CA 3.31Å; V266-L269 WeakPolarHBondContact O-CB 3.29Å; V266-L269 PolarHBondContact O-N 2.82Å; L269-L271 PolarHBondContact O-N 2.72Å; L269-C272 WeakPolarHBondContact O-CB 3.44Å; L269-C272 PolarHBondContact O-N 2.82Å; L269-C272 PolarHBondContact O-SG 3.31Å; L269-I281 HydrophobicContact CD1-CD1 4.15Å; L269-I281 HydrophobicContact CD1-CG2 4.3Å; L269-F313 HydrophobicContact CB-CD2 4.39Å; L269-F313 HydrophobicContact CB-CE2 4.23Å; L269-F313 HydrophobicContact CD2-CD2 3.75Å; L269-F313 HydrophobicContact CD2-CE2 3.73Å; L269-F313 HydrophobicContact CG-CE2 4.39Å; L269-H316 HydrophobicContact CD2-CB 3.69Å; L269-C319 HydrophobicContact CD2-CB 4.15Å
270	D	95.3	Very high	93.2	Very high	77 Å²	77	41.6 Å²	41.6	41%	0.412	21%	0.211	S	C	.	.	H	α-helix	trans	-61.1	-27.3	177.4	-67.1	6	0	0	0	112.3	V266 H316	V266-D270 PolarHBondContact O-N 3.4Å; D270-H316 IonicContact OD1-CD2 2.6Å; D270-H316 PolarHBondContact OD1-CD2 3.5Å; D270-H316 IonicContact OD1-CE1 2.62Å; D270-H316 IonicContact OD1-CG 3.53Å; D270-H316 IonicContact OD1-NE2 2.82Å; D270-H316 PolarHBondContact OD1-NE2 3.32Å
271	L	95.4	Very high	92.9	Very high	26 Å²	26	38.3 Å²	38.3	14%	0.136	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-1.5	-176.3	-66.6	170.8	0	0	0	114.6	G267 V268 L269 R804 Y805 K808	G267-L271 WeakPolarHBondContact O-CD1 3.4Å; G267-L271 WeakPolarHBondContact O-CG 3.25Å; V268-L271 PolarHBondContact O-N 3.39Å; L269-L271 PolarHBondContact O-N 2.72Å; L271-R804 HydrophobicContact CD1-CB 4.47Å; L271-R804 PolarHBondContact O-NH1 3.36Å; L271-R804 VanDerWaalsContact O-NH1 3.15Å; L271-Y805 HydrophobicContact CD1-CD2 3.76Å; L271-Y805 HydrophobicContact CD1-CG 4.16Å; L271-K808 HydrophobicContact CD2-CD 3.71Å
272	C	94.1	Very high	92.6	Very high	12 Å²	12	38.3 Å²	38.3	8%	0.081	20%	0.195	C	C	.	.			trans	-69.4	131.8	174	-65.1	0	0	0	0	110.3	L269 E277 V278 I281	L269-C272 WeakPolarHBondContact O-CB 3.44Å; L269-C272 PolarHBondContact O-N 2.82Å; L269-C272 PolarHBondContact O-SG 3.31Å; C272-E277 HydrophobicContact CB-CB 4.18Å; C272-V278 HydrophobicContact CB-CG2 3.59Å; C272-I281 WeakPolarHBondContact SG-CD1 3.3Å
273	R	92	Very high	92	Very high	191 Å²	191	37.7 Å²	37.7	72%	0.721	19%	0.193	S	C	*	.			trans	-109.6	-30.5	179.9	-64.8	179.9	-177	178.5	-1	112.8	E277	R273-E277 PolarHBondContact N-OE2 3.27Å
274	D	91.4	Very high	91.2	Very high	84 Å²	84	34.8 Å²	34.8	45%	0.449	18%	0.179	S	C	.	.	S	Bend	trans	-111.1	151.1	-176.9	-56	-42.3	0	0	0	111.2	E276 E277 V278	D274-E276 PolarHBondContact O-N 3.47Å; D274-E277 HydrophobicContact CB-CG 4.22Å; D274-E277 PolarHBondContact O-N 3.08Å; D274-V278 PolarHBondContact O-N 3.38Å; D274-V278 VanDerWaalsContact O-N 3.15Å
275	T	87.9	Confident	90	Very high	100 Å²	100	37.1 Å²	37.1	61%	0.613	19%	0.192	S	C	*	.	H	α-helix	trans	-59	-33	174.3	53.3	0	0	0	0	111.9	V278 E279	T275-V278 PolarHBondContact O-N 3.41Å; T275-E279 WeakPolarHBondContact O-CB 3.5Å; T275-E279 WeakPolarHBondContact O-CG 3.39Å; T275-E279 PolarHBondContact O-N 2.76Å
276	E	87.8	Confident	88.3	Confident	67 Å²	67	40.9 Å²	40.9	31%	0.313	22%	0.215	S	C	.	.	H	α-helix	trans	-62.8	-40.8	174.7	-176.5	-175.1	156.5	0	0	112.4	D274 A280 R793 I797	D274-E276 PolarHBondContact O-N 3.47Å; E276-A280 VanDerWaalsContact O-CB 3.3Å; E276-A280 WeakPolarHBondContact O-CB 3.45Å; E276-A280 PolarHBondContact O-N 2.96Å; E276-R793 IonicContact OE1-CZ 3.13Å; E276-R793 IonicContact OE1-NE 2.67Å; E276-R793 PolarHBondContact OE1-NE 3.5Å; E276-R793 IonicContact OE1-NH2 2.89Å; E276-R793 PolarHBondContact OE1-NH2 3.26Å; E276-R793 IonicContact OE2-CZ 3.76Å; E276-R793 IonicContact OE2-NH2 2.76Å; E276-R793 PolarHBondContact OE2-NH2 3.13Å; E276-I797 HydrophobicContact CG-CD1 4.06Å
277	E	91.4	Very high	86.2	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.1	-42.2	177.3	-63.2	-177.3	157.2	0	0	110.2	C272 R273 D274 A280 I281 I797 R800 L801 R804	C272-E277 HydrophobicContact CB-CB 4.18Å; R273-E277 PolarHBondContact N-OE2 3.27Å; D274-E277 HydrophobicContact CB-CG 4.22Å; D274-E277 PolarHBondContact O-N 3.08Å; E277-A280 PolarHBondContact O-N 3.15Å; E277-I281 WeakPolarHBondContact O-CG1 3.35Å; E277-I281 PolarHBondContact O-N 3.34Å; E277-I281 VanDerWaalsContact O-N 3.12Å; E277-I797 HydrophobicContact CB-CG2 4.22Å; E277-I797 HydrophobicContact CG-CG2 4.07Å; E277-R800 IonicContact OE1-CZ 3.84Å; E277-R800 IonicContact OE1-NH2 3.83Å; E277-L801 HydrophobicContact CB-CD2 4.43Å; E277-R804 IonicContact OE1-CZ 3.36Å; E277-R804 IonicContact OE1-NH1 3.25Å; E277-R804 PolarHBondContact OE1-NH1 3.47Å; E277-R804 IonicContact OE1-NH2 2.85Å; E277-R804 PolarHBondContact OE1-NH2 3.05Å; E277-R804 IonicContact OE2-CZ 2.65Å; E277-R804 IonicContact OE2-NH1 2.82Å; E277-R804 PolarHBondContact OE2-NH1 2.86Å; E277-R804 IonicContact OE2-NH2 3.81Å
278	V	91.4	Very high	84.1	Confident	12 Å²	12	51.2 Å²	51.2	7%	0.073	26%	0.26	C	S	.	.	H	α-helix	trans	-63.1	-49.5	176.3	177.6	0	0	0	0	111.1	C272 D274 T275 A280 I281 L282 N318	C272-V278 HydrophobicContact CB-CG2 3.59Å; D274-V278 PolarHBondContact O-N 3.38Å; D274-V278 VanDerWaalsContact O-N 3.15Å; T275-V278 PolarHBondContact O-N 3.41Å; V278-A280 VanDerWaalsContact C-N 3.29Å; V278-A280 PolarHBondContact O-N 3.22Å; V278-I281 PolarHBondContact O-N 3.39Å; V278-I281 VanDerWaalsContact O-N 3.14Å; V278-L282 HydrophobicContact CG1-CD1 3.64Å; V278-L282 HydrophobicContact CG1-CG 4.17Å; V278-L282 VanDerWaalsContact O-CG 3.29Å; V278-L282 WeakPolarHBondContact O-CG 3.44Å; V278-L282 PolarHBondContact O-N 2.9Å; V278-N318 HydrophobicContact CG2-CB 4.24Å
279	E	87.2	Confident	81.6	Confident	80 Å²	80	53.6 Å²	53.6	37%	0.374	28%	0.276	S	S	.	.	H	α-helix	trans	-61.9	-37.1	179.2	-76.2	-178.9	-179.8	0	0	112.4	T275 L282 N283 Q322	T275-E279 WeakPolarHBondContact O-CB 3.5Å; T275-E279 WeakPolarHBondContact O-CG 3.39Å; T275-E279 PolarHBondContact O-N 2.76Å; E279-L282 PolarHBondContact O-N 2.89Å; E279-N283 VanDerWaalsContact O-CB 3.31Å; E279-N283 WeakPolarHBondContact O-CB 3.44Å; E279-N283 PolarHBondContact O-N 2.93Å; E279-N283 PolarHBondContact O-ND2 2.79Å; E279-Q322 PolarHBondContact OE1-NE2 2.81Å
280	A	87.3	Confident	78.9	Confident	13 Å²	13	58.8 Å²	58.8	11%	0.107	31%	0.31	C	S	.	.	H	α-helix	trans	-62.1	-42.7	173.9	0	0	0	0	0	111.7	E276 E277 V278 G284 Y794 I797	E276-A280 VanDerWaalsContact O-CB 3.3Å; E276-A280 WeakPolarHBondContact O-CB 3.45Å; E276-A280 PolarHBondContact O-N 2.96Å; E277-A280 PolarHBondContact O-N 3.15Å; V278-A280 VanDerWaalsContact C-N 3.29Å; V278-A280 PolarHBondContact O-N 3.22Å; A280-G284 VanDerWaalsContact O-CA 3.32Å; A280-G284 WeakPolarHBondContact O-CA 3.5Å; A280-G284 PolarHBondContact O-N 2.96Å; A280-Y794 HydrophobicContact CB-CD2 4.05Å; A280-Y794 HydrophobicContact CB-CE2 4.31Å; A280-Y794 WeakPolarHBondContact O-CE2 3.4Å; A280-I797 HydrophobicContact CB-CD1 3.8Å; A280-I797 HydrophobicContact CB-CG2 4.01Å
281	I	90.2	Very high	76.2	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-64.8	-46.2	175.4	-66.3	-175.7	0	0	0	111.2	V230 V268 L269 C272 E277 V278 R301 F313 L801	V230-I281 HydrophobicContact CG1-CG2 4.43Å; V268-I281 HydrophobicContact CG1-CD1 4.14Å; L269-I281 HydrophobicContact CD1-CD1 4.15Å; L269-I281 HydrophobicContact CD1-CG2 4.3Å; C272-I281 WeakPolarHBondContact SG-CD1 3.3Å; E277-I281 WeakPolarHBondContact O-CG1 3.35Å; E277-I281 PolarHBondContact O-N 3.34Å; E277-I281 VanDerWaalsContact O-N 3.12Å; V278-I281 PolarHBondContact O-N 3.39Å; V278-I281 VanDerWaalsContact O-N 3.14Å; I281-R301 WeakPolarHBondContact O-CD 3.2Å; I281-R301 PolarHBondContact O-NH1 3.3Å; I281-F313 HydrophobicContact CG2-CE2 4Å; I281-F313 HydrophobicContact CG2-CZ 4.01Å; I281-L801 HydrophobicContact CD1-CD1 3.79Å; I281-L801 HydrophobicContact CG1-CD1 3.94Å
282	L	88.7	Confident	73.5	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-74.8	-33	-171.8	-62.6	176.5	0	0	0	113.8	V278 E279 L299 R301 V302 F313 C319 Q322	V278-L282 HydrophobicContact CG1-CD1 3.64Å; V278-L282 HydrophobicContact CG1-CG 4.17Å; V278-L282 VanDerWaalsContact O-CG 3.29Å; V278-L282 WeakPolarHBondContact O-CG 3.44Å; V278-L282 PolarHBondContact O-N 2.9Å; E279-L282 PolarHBondContact O-N 2.89Å; L282-L299 HydrophobicContact CB-CD2 4.42Å; L282-R301 VanDerWaalsContact O-CB 3.3Å; L282-R301 WeakPolarHBondContact O-CB 3.21Å; L282-R301 PolarHBondContact O-N 2.93Å; L282-V302 HydrophobicContact CB-CG2 4.03Å; L282-V302 HydrophobicContact CD2-CG2 3.67Å; L282-V302 HydrophobicContact CG-CG2 4.33Å; L282-F313 HydrophobicContact CD2-CE1 4.15Å; L282-F313 HydrophobicContact CD2-CZ 3.84Å; L282-C319 HydrophobicContact CD2-CB 4.3Å; L282-Q322 HydrophobicContact CD1-CB 3.84Å; L282-Q322 HydrophobicContact CD1-CG 3.84Å
283	N	83	Confident	70.9	Confident	20 Å²	20	67 Å²	67	11%	0.107	37%	0.37	C	S	.	.	H	α-helix	trans	-99.8	-24.2	-177.8	-61.1	-38.9	0	0	0	113.1	E279 V286 C298 S300	E279-N283 VanDerWaalsContact O-CB 3.31Å; E279-N283 WeakPolarHBondContact O-CB 3.44Å; E279-N283 PolarHBondContact O-N 2.93Å; E279-N283 PolarHBondContact O-ND2 2.79Å; N283-V286 HydrophobicContact CB-CG2 3.9Å; N283-C298 PolarHBondContact OD1-O 3.26Å; N283-S300 PolarHBondContact O-OG 3.04Å
284	G	79.3	Confident	68.6	Low	5 Å²	5	66.5 Å²	66.5	5%	0.052	37%	0.369	C	S	.	.			trans	79.7	-158.2	-174.8	0	0	0	0	0	113.8	A280 V286 R301	A280-G284 VanDerWaalsContact O-CA 3.32Å; A280-G284 WeakPolarHBondContact O-CA 3.5Å; A280-G284 PolarHBondContact O-N 2.96Å; G284-V286 WeakPolarHBondContact O-CG2 3.39Å; G284-V286 PolarHBondContact O-N 3.15Å; G284-R301 VanDerWaalsContact CA-CZ 3.48Å
285	D	69.6	Low	66.6	Low	54 Å²	54	67.4 Å²	67.4	29%	0.289	37%	0.374	S	S	.	.			trans	-76.1	93.1	179.9	-168	15.7	0	0	0	111	D287 Y794	D285-D287 PolarHBondContact O-N 3.12Å; D285-D287 WeakPolarHBondContact OD1-CB 3.36Å; D285-D287 PolarHBondContact OD1-N 2.62Å; D285-Y794 HydrophobicContact CB-CD1 4.02Å; D285-Y794 HydrophobicContact CB-CG 4.07Å
286	V	60.6	Low	65	Low	81 Å²	81	65.1 Å²	65.1	49%	0.491	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-75.2	-9.8	-179.4	-166.8	0	0	0	0	111.8	N283 G284 Q288 C289	N283-V286 HydrophobicContact CB-CG2 3.9Å; G284-V286 WeakPolarHBondContact O-CG2 3.39Å; G284-V286 PolarHBondContact O-N 3.15Å; V286-Q288 PolarHBondContact O-N 2.97Å; V286-C289 PolarHBondContact O-N 3.14Å
287	D	53.5	Low	63.5	Low	92 Å²	92	65 Å²	65	49%	0.492	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-67.6	-6.3	-176.5	-69.5	-21.6	0	0	0	113.7	D285	D285-D287 PolarHBondContact O-N 3.12Å; D285-D287 WeakPolarHBondContact OD1-CB 3.36Å; D285-D287 PolarHBondContact OD1-N 2.62Å
288	Q	51.2	Low	62.1	Low	161 Å²	161	67.9 Å²	67.9	75%	0.752	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-89.4	-12.9	173.6	-64.2	-174.3	25	0	0	114	V286	V286-Q288 PolarHBondContact O-N 2.97Å
289	C	41.7	Very low	61.4	Low	49 Å²	49	67.7 Å²	67.7	33%	0.331	38%	0.377	S	S	.	.	S	Bend	trans	-128.4	115.1	177.6	-82.2	0	0	0	0	110.1	V286	V286-C289 PolarHBondContact O-N 3.14Å
290	P	37.6	Very low	61.1	Low	110 Å²	110	66.1 Å²	66.1	71%	0.714	38%	0.375	S	S	*	.			trans	-60.2	137.4	-178.3	23.4	-31.3	0	0	0	110.6	S292	P290-S292 PolarHBondContact O-N 3.47Å
291	P	38.5	Very low	61.1	Low	126 Å²	126	66.1 Å²	66.1	82%	0.818	37%	0.372	S	S	*	.			trans	-66.1	107.3	178.7	25.6	-31.6	0	0	0	108.9
292	S	39.1	Very low	61.1	Low	40 Å²	40	66 Å²	66	28%	0.28	37%	0.372	S	S	.	.			trans	-80	139.6	165.5	94.2	0	0	0	0	108	P290 Y294 N295	P290-S292 PolarHBondContact O-N 3.47Å; S292-Y294 PolarHBondContact O-N 3.25Å; S292-Y294 PolarHBondContact OG-N 3.23Å; S292-N295 PolarHBondContact O-N 3.27Å; S292-N295 VanDerWaalsContact O-N 3.08Å; S292-N295 PolarHBondContact OG-N 3.4Å
293	P	39.8	Very low	61.1	Low	122 Å²	122	70 Å²	70	79%	0.792	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	2.2	179	25.1	-33.2	0	0	0	114
294	Y	43.3	Very low	61.4	Low	179 Å²	179	70.9 Å²	70.9	70%	0.702	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	-4.9	178.9	-60.2	-73.1	0	0	0	113.5	S292	S292-Y294 PolarHBondContact O-N 3.25Å; S292-Y294 PolarHBondContact OG-N 3.23Å
295	N	48.9	Very low	62	Low	104 Å²	104	70.7 Å²	70.7	56%	0.556	39%	0.391	S	S	*	.			trans	-92.2	112	177.2	-89.4	-4.9	0	0	0	110.2	S292	S292-N295 PolarHBondContact O-N 3.27Å; S292-N295 VanDerWaalsContact O-N 3.08Å; S292-N295 PolarHBondContact OG-N 3.4Å
296	R	55.2	Low	63	Low	52 Å²	52	69.3 Å²	69.3	20%	0.196	38%	0.384	C	S	.	.			trans	-52.6	149.3	161.9	-77.6	-179	171.3	158.4	1.3	109.8	C298 E329 R373 F690	R296-C298 PolarHBondContact O-N 3.4Å; R296-E329 IonicContact CZ-OE2 3.15Å; R296-E329 VanDerWaalsContact CZ-OE2 3.25Å; R296-E329 IonicContact NE-OE2 3.04Å; R296-E329 PolarHBondContact NE-OE2 3.34Å; R296-E329 IonicContact NH2-OE2 2.88Å; R296-E329 PolarHBondContact NH2-OE2 3.05Å; R296-R373 PolarHBondContact NH2-O 2.63Å; R296-R373 VanDerWaalsContact NH2-O 3.09Å; R296-F690 PolarHBondContact NH1-O 2.85Å
297	P	56.6	Low	64.4	Low	64 Å²	64	71.8 Å²	71.8	42%	0.416	39%	0.388	S	S	.	.			trans	-52.7	119.9	174.5	21.8	-32.1	0	0	0	109.1	L299 I326	P297-L299 VanDerWaalsContact C-N 3.34Å; P297-L299 PolarHBondContact O-N 2.94Å; P297-I326 HydrophobicContact CG-CD1 4.16Å
298	C	61.3	Low	66.2	Low	60 Å²	60	69.2 Å²	69.2	41%	0.405	37%	0.372	S	S	.	.			trans	-74.1	95.3	178	-170.3	0	0	0	0	106.9	N283 R296 S300	N283-C298 PolarHBondContact OD1-O 3.26Å; R296-C298 PolarHBondContact O-N 3.4Å; C298-S300 PolarHBondContact O-N 3.17Å
299	L	76.6	Confident	68.2	Low	8 Å²	8	67.4 Å²	67.4	4%	0.042	36%	0.363	C	S	.	.			trans	-64.9	54.2	176.2	-67.3	167.2	0	0	0	111.4	L282 P297 R301 V302 K303 L323 I326 L687 F690	L282-L299 HydrophobicContact CB-CD2 4.42Å; P297-L299 VanDerWaalsContact C-N 3.34Å; P297-L299 PolarHBondContact O-N 2.94Å; L299-R301 PolarHBondContact O-N 3.1Å; L299-V302 HydrophobicContact CB-CB 4.13Å; L299-V302 HydrophobicContact CB-CG2 4.27Å; L299-V302 HydrophobicContact CD2-CG2 4.08Å; L299-V302 PolarHBondContact O-N 3.49Å; L299-K303 WeakPolarHBondContact O-CG 3.32Å; L299-K303 PolarHBondContact O-N 3.25Å; L299-L323 HydrophobicContact CD1-CD2 3.84Å; L299-I326 HydrophobicContact CD1-CD1 3.88Å; L299-I326 HydrophobicContact CD2-CD1 4.16Å; L299-I326 HydrophobicContact CG-CD1 4.31Å; L299-L687 HydrophobicContact CD1-CD2 4.01Å; L299-F690 HydrophobicContact CD1-CD2 3.77Å; L299-F690 HydrophobicContact CD1-CE2 3.78Å
300	S	81.3	Confident	70.7	Confident	47 Å²	47	65.1 Å²	65.1	33%	0.329	35%	0.348	S	S	.	.	H	α-helix	trans	-62.2	-44.3	-170.9	63.9	0	0	0	0	110.8	N283 C298 K303 L304	N283-S300 PolarHBondContact O-OG 3.04Å; C298-S300 PolarHBondContact O-N 3.17Å; S300-K303 PolarHBondContact O-N 2.92Å; S300-L304 WeakPolarHBondContact O-CB 3.32Å; S300-L304 PolarHBondContact O-N 2.82Å
301	R	86.9	Confident	73.4	Confident	13 Å²	13	62.4 Å²	62.4	5%	0.049	33%	0.325	C	S	.	.	H	α-helix	trans	-72	-33.2	178.3	-57.1	-139.3	-178.5	120.3	-4.2	112.8	D228 I281 L282 G284 L299 L304 A305 Y794	D228-R301 IonicContact OD1-CZ 3.96Å; D228-R301 IonicContact OD1-NH2 3.9Å; D228-R301 PolarHBondContact OD1-NH2 2.95Å; D228-R301 IonicContact OD2-CZ 3.44Å; D228-R301 IonicContact OD2-NE 3.77Å; D228-R301 IonicContact OD2-NH2 3.51Å; D228-R301 PolarHBondContact OD2-NH2 3.31Å; I281-R301 WeakPolarHBondContact O-CD 3.2Å; I281-R301 PolarHBondContact O-NH1 3.3Å; L282-R301 VanDerWaalsContact O-CB 3.3Å; L282-R301 WeakPolarHBondContact O-CB 3.21Å; L282-R301 PolarHBondContact O-N 2.93Å; G284-R301 VanDerWaalsContact CA-CZ 3.48Å; L299-R301 PolarHBondContact O-N 3.1Å; R301-L304 PolarHBondContact O-N 3.35Å; R301-A305 VanDerWaalsContact O-CB 3.24Å; R301-A305 WeakPolarHBondContact O-CB 3.43Å; R301-A305 PolarHBondContact O-N 3.1Å; R301-Y794 VanDerWaalsContact CZ-OH 3.23Å; R301-Y794 PolarHBondContact NH1-OH 3.43Å; R301-Y794 VanDerWaalsContact NH2-CZ 3.25Å; R301-Y794 PolarHBondContact NH2-OH 3.06Å
302	V	90	Very high	76	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-68.4	-43.9	174.8	-173.7	0	0	0	0	110.4	L282 L299 L304 A305 I306 L323 L687	L282-V302 HydrophobicContact CB-CG2 4.03Å; L282-V302 HydrophobicContact CD2-CG2 3.67Å; L282-V302 HydrophobicContact CG-CG2 4.33Å; L299-V302 HydrophobicContact CB-CB 4.13Å; L299-V302 HydrophobicContact CB-CG2 4.27Å; L299-V302 HydrophobicContact CD2-CG2 4.08Å; L299-V302 PolarHBondContact O-N 3.49Å; V302-L304 VanDerWaalsContact C-N 3.27Å; V302-L304 PolarHBondContact O-N 3.21Å; V302-A305 PolarHBondContact O-N 3.01Å; V302-I306 HydrophobicContact CG1-CD1 4.28Å; V302-I306 WeakPolarHBondContact O-CG1 3.36Å; V302-I306 PolarHBondContact O-N 3.03Å; V302-L323 HydrophobicContact CG1-CD2 4.48Å; V302-L687 HydrophobicContact CG1-CD1 4.05Å
303	K	88.4	Confident	78.7	Confident	83 Å²	83	58.7 Å²	58.7	36%	0.361	29%	0.291	S	S	.	.	H	α-helix	trans	-58.8	-41.4	172.8	-71.7	-173.3	-179.2	-165.3	0	110.9	L299 S300 I306 K307 L687 D691	L299-K303 WeakPolarHBondContact O-CG 3.32Å; L299-K303 PolarHBondContact O-N 3.25Å; S300-K303 PolarHBondContact O-N 2.92Å; K303-I306 PolarHBondContact O-N 3.13Å; K303-K307 PolarHBondContact O-N 2.92Å; K303-K307 VanDerWaalsContact O-N 3.07Å; K303-L687 HydrophobicContact CG-CD2 4.24Å; K303-D691 IonicContact NZ-OD1 3.01Å; K303-D691 PolarHBondContact NZ-OD1 3.46Å; K303-D691 IonicContact NZ-OD2 2.76Å; K303-D691 PolarHBondContact NZ-OD2 3.23Å
304	L	89.4	Confident	81.3	Confident	39 Å²	39	52.9 Å²	52.9	20%	0.204	25%	0.253	C	S	.	.	H	α-helix	trans	-65.5	-44.4	175.3	-171.6	63.9	0	0	0	112.6	L231 L234 S300 R301 V302 I306 K307 Y308	L231-L304 HydrophobicContact CD1-CD2 3.63Å; L234-L304 HydrophobicContact CD1-CD2 4.49Å; S300-L304 WeakPolarHBondContact O-CB 3.32Å; S300-L304 PolarHBondContact O-N 2.82Å; R301-L304 PolarHBondContact O-N 3.35Å; V302-L304 VanDerWaalsContact C-N 3.27Å; V302-L304 PolarHBondContact O-N 3.21Å; L304-I306 VanDerWaalsContact C-N 3.28Å; L304-I306 PolarHBondContact O-N 2.87Å; L304-K307 WeakPolarHBondContact O-CB 3.37Å; L304-K307 PolarHBondContact O-N 2.87Å; L304-K307 VanDerWaalsContact O-N 3.12Å; L304-Y308 HydrophobicContact CD1-CD2 4.09Å; L304-Y308 HydrophobicContact CD1-CE1 4.16Å; L304-Y308 HydrophobicContact CD1-CE2 3.46Å; L304-Y308 VanDerWaalsContact CD1-CE2 3.46Å; L304-Y308 HydrophobicContact CD2-CE2 3.97Å; L304-Y308 HydrophobicContact CG-CD2 3.89Å; L304-Y308 HydrophobicContact CG-CE2 3.56Å; L304-Y308 PolarHBondContact O-N 3.05Å
305	A	92.8	Very high	83.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.2	-34.2	178.3	0	0	0	0	0	112.1	L234 R301 V302 Y308 E309 V310 F313 V314	L234-A305 HydrophobicContact CD2-CB 4.46Å; R301-A305 VanDerWaalsContact O-CB 3.24Å; R301-A305 WeakPolarHBondContact O-CB 3.43Å; R301-A305 PolarHBondContact O-N 3.1Å; V302-A305 PolarHBondContact O-N 3.01Å; A305-Y308 CarbonylContact O-C 3.6Å; A305-E309 PolarHBondContact O-N 2.93Å; A305-E309 VanDerWaalsContact O-N 3.1Å; A305-V310 HydrophobicContact CB-CB 4.34Å; A305-V310 PolarHBondContact O-N 3.06Å; A305-F313 HydrophobicContact CB-CD1 3.6Å; A305-F313 HydrophobicContact CB-CE1 3.91Å; A305-V314 HydrophobicContact CB-CG2 4.2Å
306	I	90.9	Very high	86	Confident	25 Å²	25	41 Å²	41	13%	0.128	20%	0.202	C	C	.	.	H	α-helix	trans	-69.3	-42.3	172.7	-70.3	170.3	0	0	0	111.1	V302 K303 L304 Y308 E309 V314 F680 K684 L687	V302-I306 HydrophobicContact CG1-CD1 4.28Å; V302-I306 WeakPolarHBondContact O-CG1 3.36Å; V302-I306 PolarHBondContact O-N 3.03Å; K303-I306 PolarHBondContact O-N 3.13Å; L304-I306 VanDerWaalsContact C-N 3.28Å; L304-I306 PolarHBondContact O-N 2.87Å; I306-Y308 VanDerWaalsContact C-N 3.26Å; I306-Y308 PolarHBondContact O-N 3.4Å; I306-E309 PolarHBondContact O-N 3.49Å; I306-V314 HydrophobicContact CG1-CG2 3.95Å; I306-F680 HydrophobicContact CB-CE2 4.27Å; I306-F680 HydrophobicContact CB-CZ 4.35Å; I306-F680 HydrophobicContact CG1-CE2 3.87Å; I306-F680 HydrophobicContact CG1-CZ 4.34Å; I306-F680 HydrophobicContact CG2-CE2 4.41Å; I306-F680 HydrophobicContact CG2-CZ 4.03Å; I306-K684 HydrophobicContact CG2-CD 4.46Å; I306-K684 HydrophobicContact CG2-CG 4.33Å; I306-L687 HydrophobicContact CD1-CD1 3.04Å; I306-L687 HydrophobicContact CD1-CG 4.48Å; I306-L687 HydrophobicContact CG1-CD1 4.48Å
307	K	88.9	Confident	87.8	Confident	133 Å²	133	42.6 Å²	42.6	58%	0.578	22%	0.219	S	C	*	.	H	α-helix	trans	-60	-36.9	175.5	-175.3	-179.5	179	-177.5	0	112.3	K303 L304 E309	K303-K307 PolarHBondContact O-N 2.92Å; K303-K307 VanDerWaalsContact O-N 3.07Å; L304-K307 WeakPolarHBondContact O-CB 3.37Å; L304-K307 PolarHBondContact O-N 2.87Å; L304-K307 VanDerWaalsContact O-N 3.12Å; K307-E309 VanDerWaalsContact C-N 3.32Å
308	Y	92.6	Very high	89.6	Confident	39 Å²	39	41.8 Å²	41.8	15%	0.153	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	7.8	176.9	-61.2	-25.2	0	0	0	114	L234 E235 N238 L304 A305 I306 V310	L234-Y308 HydrophobicContact CB-CD2 4.07Å; L234-Y308 HydrophobicContact CB-CE2 4.32Å; L234-Y308 WeakPolarHBondContact O-CD2 3.37Å; E235-Y308 HydrophobicContact CG-CE2 4.39Å; N238-Y308 HydrophobicContact CB-CD1 3.47Å; N238-Y308 VanDerWaalsContact CB-CD1 3.47Å; N238-Y308 HydrophobicContact CB-CD2 4.09Å; N238-Y308 HydrophobicContact CB-CE1 3.69Å; N238-Y308 HydrophobicContact CB-CE2 4.28Å; N238-Y308 HydrophobicContact CB-CG 3.69Å; N238-Y308 WeakPolarHBondContact ND2-CE1 3.4Å; N238-Y308 WeakPolarHBondContact OD1-CD1 3.47Å; L304-Y308 HydrophobicContact CD1-CD2 4.09Å; L304-Y308 HydrophobicContact CD1-CE1 4.16Å; L304-Y308 HydrophobicContact CD1-CE2 3.46Å; L304-Y308 VanDerWaalsContact CD1-CE2 3.46Å; L304-Y308 HydrophobicContact CD2-CE2 3.97Å; L304-Y308 HydrophobicContact CG-CD2 3.89Å; L304-Y308 HydrophobicContact CG-CE2 3.56Å; L304-Y308 PolarHBondContact O-N 3.05Å; A305-Y308 CarbonylContact O-C 3.6Å; I306-Y308 VanDerWaalsContact C-N 3.26Å; I306-Y308 PolarHBondContact O-N 3.4Å; Y308-V310 VanDerWaalsContact C-N 3.32Å; Y308-V310 PolarHBondContact O-N 3.05Å
309	E	91.9	Very high	91.1	Very high	122 Å²	122	38.9 Å²	38.9	57%	0.57	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	46.9	179.4	-56.5	-170	149.5	0	0	113.3	K262 A305 I306 K307 K311	K262-E309 PolarHBondContact NZ-O 3.45Å; K262-E309 VanDerWaalsContact NZ-O 3.12Å; A305-E309 PolarHBondContact O-N 2.93Å; A305-E309 VanDerWaalsContact O-N 3.1Å; I306-E309 PolarHBondContact O-N 3.49Å; K307-E309 VanDerWaalsContact C-N 3.32Å; E309-K311 PolarHBondContact O-N 2.85Å
310	V	94.8	Very high	91.9	Very high	1 Å²	1	39 Å²	39	1%	0.006	19%	0.191	C	C	.	.			trans	-88.2	77.9	174.9	-169.5	0	0	0	0	109.5	L234 K262 A305 Y308 F313 V314	L234-V310 HydrophobicContact CD2-CB 4.28Å; L234-V310 HydrophobicContact CD2-CG1 4.39Å; L234-V310 HydrophobicContact CD2-CG2 3.63Å; K262-V310 HydrophobicContact CB-CG1 4.02Å; K262-V310 HydrophobicContact CD-CG1 4.32Å; K262-V310 HydrophobicContact CD-CG2 4.29Å; K262-V310 HydrophobicContact CG-CG1 3.9Å; K262-V310 HydrophobicContact CG-CG2 4.08Å; A305-V310 HydrophobicContact CB-CB 4.34Å; A305-V310 PolarHBondContact O-N 3.06Å; Y308-V310 VanDerWaalsContact C-N 3.32Å; Y308-V310 PolarHBondContact O-N 3.05Å; V310-F313 HydrophobicContact CB-CB 4.33Å; V310-F313 HydrophobicContact CG1-CB 3.6Å; V310-F313 PolarHBondContact O-N 3.22Å; V310-V314 PolarHBondContact O-N 3.14Å
311	K	93.6	Very high	92.3	Very high	53 Å²	53	41.9 Å²	41.9	23%	0.23	20%	0.2	C	C	.	.	H	α-helix	trans	-63	-49.4	-167.7	-57.8	179.2	-178.6	171.8	0	113.7	E309 F313 V314 A315 V676 E677 F680	E309-K311 PolarHBondContact O-N 2.85Å; K311-F313 VanDerWaalsContact C-N 3.31Å; K311-F313 PolarHBondContact O-N 2.93Å; K311-V314 PolarHBondContact O-N 2.88Å; K311-A315 WeakPolarHBondContact O-CB 3.24Å; K311-A315 PolarHBondContact O-N 3.19Å; K311-V676 HydrophobicContact CB-CG1 3.98Å; K311-E677 WeakPolarHBondContact CD-OE1 3.27Å; K311-E677 IonicContact NZ-OE1 3.57Å; K311-E677 PolarHBondContact NZ-OE1 3.14Å; K311-E677 IonicContact NZ-OE2 3.68Å; K311-F680 HydrophobicContact CB-CB 4.32Å; K311-F680 HydrophobicContact CB-CD2 4.22Å; K311-F680 HydrophobicContact CB-CG 4.29Å; K311-F680 HydrophobicContact CG-CB 4.41Å; K311-F680 HydrophobicContact CG-CD1 4.26Å; K311-F680 HydrophobicContact CG-CD2 4.04Å; K311-F680 HydrophobicContact CG-CE2 4.34Å; K311-F680 HydrophobicContact CG-CG 3.98Å
312	K	94.3	Very high	92.5	Very high	88 Å²	88	42.3 Å²	42.3	38%	0.383	20%	0.202	S	C	.	.	H	α-helix	trans	-58.7	-39.1	-179.4	-67.6	-176.1	-173.5	173.9	0	112.8	D263 V266 V314 A315 H316 V676	D263-K312 WeakPolarHBondContact OD1-CD 3.49Å; D263-K312 IonicContact OD1-NZ 2.69Å; D263-K312 PolarHBondContact OD1-NZ 3.39Å; D263-K312 IonicContact OD2-NZ 2.57Å; V266-K312 HydrophobicContact CG2-CB 3.7Å; K312-V314 PolarHBondContact O-N 2.73Å; K312-A315 PolarHBondContact O-N 2.91Å; K312-H316 PolarHBondContact O-N 3.45Å; K312-V676 HydrophobicContact CG-CG1 4.15Å
313	F	95.3	Very high	92.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62	-43.5	178	176.1	-101.8	0	0	0	112.3	V265 V266 L269 I281 L282 A305 V310 K311 H316	V265-F313 HydrophobicContact CG1-CD2 3.53Å; V265-F313 HydrophobicContact CG1-CE2 3.73Å; V265-F313 HydrophobicContact CG1-CG 4.23Å; V266-F313 HydrophobicContact CG2-CB 4.1Å; L269-F313 HydrophobicContact CB-CD2 4.39Å; L269-F313 HydrophobicContact CB-CE2 4.23Å; L269-F313 HydrophobicContact CD2-CD2 3.75Å; L269-F313 HydrophobicContact CD2-CE2 3.73Å; L269-F313 HydrophobicContact CG-CE2 4.39Å; I281-F313 HydrophobicContact CG2-CE2 4Å; I281-F313 HydrophobicContact CG2-CZ 4.01Å; L282-F313 HydrophobicContact CD2-CE1 4.15Å; L282-F313 HydrophobicContact CD2-CZ 3.84Å; A305-F313 HydrophobicContact CB-CD1 3.6Å; A305-F313 HydrophobicContact CB-CE1 3.91Å; V310-F313 HydrophobicContact CB-CB 4.33Å; V310-F313 HydrophobicContact CG1-CB 3.6Å; V310-F313 PolarHBondContact O-N 3.22Å; K311-F313 VanDerWaalsContact C-N 3.31Å; K311-F313 PolarHBondContact O-N 2.93Å; F313-H316 WeakPolarHBondContact O-CB 3.44Å
314	V	95.1	Very high	92.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-74.4	-36.8	178.6	-178.2	0	0	0	0	110.9	A305 I306 V310 K311 K312 H316 Q320 L323 F680 A683	A305-V314 HydrophobicContact CB-CG2 4.2Å; I306-V314 HydrophobicContact CG1-CG2 3.95Å; V310-V314 PolarHBondContact O-N 3.14Å; K311-V314 PolarHBondContact O-N 2.88Å; K312-V314 PolarHBondContact O-N 2.73Å; V314-H316 PolarHBondContact O-N 2.91Å; V314-Q320 PolarHBondContact O-NE2 3.3Å; V314-L323 HydrophobicContact CG1-CD1 4.46Å; V314-F680 HydrophobicContact CB-CD2 4.01Å; V314-F680 HydrophobicContact CG1-CD2 4.35Å; V314-F680 HydrophobicContact CG2-CD2 4.12Å; V314-F680 HydrophobicContact CG2-CE2 4.26Å; V314-A683 HydrophobicContact CG1-CB 3.33Å
315	A	95.1	Very high	92.5	Very high	7 Å²	7	41.3 Å²	41.3	6%	0.058	20%	0.203	C	C	.	.	H	α-helix	trans	-72.9	-13.8	177.9	0	0	0	0	0	113.9	K311 K312 V676 K679	K311-A315 WeakPolarHBondContact O-CB 3.24Å; K311-A315 PolarHBondContact O-N 3.19Å; K312-A315 PolarHBondContact O-N 2.91Å; A315-V676 HydrophobicContact CB-CB 4.24Å; A315-V676 HydrophobicContact CB-CG1 3.79Å; A315-V676 HydrophobicContact CB-CG2 4.47Å; A315-K679 HydrophobicContact CB-CB 3.81Å; A315-K679 HydrophobicContact CB-CD 4.18Å
316	H	95.4	Very high	92.3	Very high	27 Å²	27	42.2 Å²	42.2	13%	0.125	21%	0.208	C	C	.	.	S	Bend	trans	-56	135.8	-178.3	-173	-98.8	0	0	0	111.8	L269 D270 K312 F313 V314 N318 C319 Q320	L269-H316 HydrophobicContact CD2-CB 3.69Å; D270-H316 IonicContact OD1-CD2 2.6Å; D270-H316 PolarHBondContact OD1-CD2 3.5Å; D270-H316 IonicContact OD1-CE1 2.62Å; D270-H316 IonicContact OD1-CG 3.53Å; D270-H316 IonicContact OD1-NE2 2.82Å; D270-H316 PolarHBondContact OD1-NE2 3.32Å; K312-H316 PolarHBondContact O-N 3.45Å; F313-H316 WeakPolarHBondContact O-CB 3.44Å; V314-H316 PolarHBondContact O-N 2.91Å; H316-N318 VanDerWaalsContact C-N 3.32Å; H316-N318 VanDerWaalsContact CE1-CG 3.48Å; H316-N318 PolarHBondContact CE1-ND2 3.04Å; H316-N318 WeakPolarHBondContact ND1-CB 3.17Å; H316-N318 PolarHBondContact ND1-N 3.36Å; H316-N318 PolarHBondContact O-N 2.76Å; H316-C319 HydrophobicContact CB-CB 4.38Å; H316-C319 WeakPolarHBondContact O-CB 3.45Å; H316-C319 PolarHBondContact O-N 3.49Å; H316-Q320 WeakPolarHBondContact O-CG 3.03Å; H316-Q320 PolarHBondContact O-N 2.93Å
317	P	93.8	Very high	92.2	Very high	85 Å²	85	41.4 Å²	41.4	55%	0.552	20%	0.203	S	C	*	.	H	α-helix	trans	-51.9	-43.2	-177.4	-30.9	36.6	0	0	0	114.7	C319 Q320 Q321	P317-C319 VanDerWaalsContact C-N 3.33Å; P317-C319 PolarHBondContact O-N 3.28Å; P317-Q320 PolarHBondContact O-N 3.46Å; P317-Q321 WeakPolarHBondContact O-CB 3.33Å; P317-Q321 PolarHBondContact O-N 2.83Å
318	N	93.3	Very high	92.2	Very high	47 Å²	47	36.8 Å²	36.8	25%	0.251	18%	0.182	S	C	.	.	H	α-helix	trans	-64	-38.8	179.5	-64.6	-13.3	0	0	0	112	V278 H316 Q322	V278-N318 HydrophobicContact CG2-CB 4.24Å; H316-N318 VanDerWaalsContact C-N 3.32Å; H316-N318 VanDerWaalsContact CE1-CG 3.48Å; H316-N318 PolarHBondContact CE1-ND2 3.04Å; H316-N318 WeakPolarHBondContact ND1-CB 3.17Å; H316-N318 PolarHBondContact ND1-N 3.36Å; H316-N318 PolarHBondContact O-N 2.76Å; N318-Q322 PolarHBondContact O-N 3.18Å
319	C	92.4	Very high	91.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-69	-46.7	176.8	-175.2	0	0	0	0	110.6	L269 L282 H316 P317 Q321 Q322 L323	L269-C319 HydrophobicContact CD2-CB 4.15Å; L282-C319 HydrophobicContact CD2-CB 4.3Å; H316-C319 HydrophobicContact CB-CB 4.38Å; H316-C319 WeakPolarHBondContact O-CB 3.45Å; H316-C319 PolarHBondContact O-N 3.49Å; P317-C319 VanDerWaalsContact C-N 3.33Å; P317-C319 PolarHBondContact O-N 3.28Å; C319-Q321 VanDerWaalsContact C-N 3.3Å; C319-Q321 PolarHBondContact O-N 2.6Å; C319-Q322 PolarHBondContact O-N 3.38Å; C319-Q322 VanDerWaalsContact O-N 3.14Å; C319-L323 WeakPolarHBondContact O-CG 3.31Å; C319-L323 PolarHBondContact O-N 2.89Å
320	Q	93.4	Very high	91.3	Very high	9 Å²	9	36.6 Å²	36.6	4%	0.042	19%	0.186	C	C	.	.	H	α-helix	trans	-61.1	-37.9	178.1	-70.7	-68.8	-36.6	0	0	112.4	V314 H316 P317 L323 L324 K679	V314-Q320 PolarHBondContact O-NE2 3.3Å; H316-Q320 WeakPolarHBondContact O-CG 3.03Å; H316-Q320 PolarHBondContact O-N 2.93Å; P317-Q320 PolarHBondContact O-N 3.46Å; Q320-L323 PolarHBondContact O-N 3.34Å; Q320-L324 VanDerWaalsContact O-CB 3.31Å; Q320-L324 WeakPolarHBondContact O-CB 3.24Å; Q320-L324 VanDerWaalsContact O-CG 3.25Å; Q320-L324 WeakPolarHBondContact O-CG 3.26Å; Q320-L324 PolarHBondContact O-N 3.5Å; Q320-K679 PolarHBondContact NE2-O 3.38Å
321	Q	90.8	Very high	90.7	Very high	108 Å²	108	38.3 Å²	38.3	51%	0.505	20%	0.195	S	C	.	.	H	α-helix	trans	-61.8	-43.5	174.9	-179.3	172.3	-13.2	0	0	111.7	P317 C319 L324 T325	P317-Q321 WeakPolarHBondContact O-CB 3.33Å; P317-Q321 PolarHBondContact O-N 2.83Å; C319-Q321 VanDerWaalsContact C-N 3.3Å; C319-Q321 PolarHBondContact O-N 2.6Å; Q321-L324 PolarHBondContact O-N 2.96Å; Q321-T325 WeakPolarHBondContact O-CG2 3.23Å; Q321-T325 PolarHBondContact O-N 2.96Å; Q321-T325 PolarHBondContact O-OG1 3.26Å
322	Q	89.8	Confident	90	Very high	22 Å²	22	40.2 Å²	40.2	10%	0.103	21%	0.213	C	C	.	.	H	α-helix	trans	-67.9	-37.5	176.5	-169.6	67.9	4	0	0	112.4	E279 L282 N318 C319 L324 T325 I326	E279-Q322 PolarHBondContact OE1-NE2 2.81Å; L282-Q322 HydrophobicContact CD1-CB 3.84Å; L282-Q322 HydrophobicContact CD1-CG 3.84Å; N318-Q322 PolarHBondContact O-N 3.18Å; C319-Q322 PolarHBondContact O-N 3.38Å; C319-Q322 VanDerWaalsContact O-N 3.14Å; Q322-L324 VanDerWaalsContact C-N 3.32Å; Q322-T325 WeakPolarHBondContact CA-OG1 3.44Å; Q322-T325 PolarHBondContact O-N 2.76Å; Q322-T325 PolarHBondContact O-OG1 3.5Å; Q322-I326 HydrophobicContact CG-CD1 4.47Å; Q322-I326 WeakPolarHBondContact O-CG1 3.3Å; Q322-I326 PolarHBondContact O-N 3.29Å
323	L	90.6	Very high	89.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.3	-37.6	174.2	-65.4	174.5	0	0	0	111.3	L299 V302 V314 C319 Q320 I326 W327 A683 W686 F690	L299-L323 HydrophobicContact CD1-CD2 3.84Å; V302-L323 HydrophobicContact CG1-CD2 4.48Å; V314-L323 HydrophobicContact CG1-CD1 4.46Å; C319-L323 WeakPolarHBondContact O-CG 3.31Å; C319-L323 PolarHBondContact O-N 2.89Å; Q320-L323 PolarHBondContact O-N 3.34Å; L323-I326 PolarHBondContact O-N 3.25Å; L323-W327 VanDerWaalsContact O-CB 3.29Å; L323-W327 WeakPolarHBondContact O-CB 3.35Å; L323-W327 PolarHBondContact O-N 3.46Å; L323-A683 HydrophobicContact CD1-CB 3.83Å; L323-W686 HydrophobicContact CB-CE3 3.98Å; L323-W686 HydrophobicContact CB-CZ3 4.04Å; L323-F690 HydrophobicContact CD2-CE2 3.82Å; L323-F690 HydrophobicContact CD2-CZ 4.46Å
324	L	89.9	Confident	88.7	Confident	42 Å²	42	42.9 Å²	42.9	22%	0.22	23%	0.231	C	C	.	.	H	α-helix	trans	-66.7	-37.7	176.7	-80.6	169.3	0	0	0	113	Q320 Q321 Q322 I326 W327 Y328 W686	Q320-L324 VanDerWaalsContact O-CB 3.31Å; Q320-L324 WeakPolarHBondContact O-CB 3.24Å; Q320-L324 VanDerWaalsContact O-CG 3.25Å; Q320-L324 WeakPolarHBondContact O-CG 3.26Å; Q320-L324 PolarHBondContact O-N 3.5Å; Q321-L324 PolarHBondContact O-N 2.96Å; Q322-L324 VanDerWaalsContact C-N 3.32Å; L324-I326 VanDerWaalsContact C-N 3.32Å; L324-W327 PolarHBondContact O-N 3.03Å; L324-Y328 HydrophobicContact CD2-CD2 4.45Å; L324-Y328 HydrophobicContact CD2-CE2 4.11Å; L324-Y328 PolarHBondContact O-N 3.05Å; L324-Y328 VanDerWaalsContact O-N 3.15Å; L324-W686 HydrophobicContact CD2-CH2 3.38Å; L324-W686 HydrophobicContact CD2-CZ2 4.04Å; L324-W686 HydrophobicContact CD2-CZ3 4.01Å; L324-W686 HydrophobicContact CG-CH2 3.81Å; L324-W686 HydrophobicContact CG-CZ3 4.02Å
325	T	88.6	Confident	88.2	Confident	59 Å²	59	47.5 Å²	47.5	36%	0.362	25%	0.248	S	C	.	.	H	α-helix	trans	-65.2	-38.7	176	51.7	0	0	0	0	111.2	Q321 Q322 E329	Q321-T325 WeakPolarHBondContact O-CG2 3.23Å; Q321-T325 PolarHBondContact O-N 2.96Å; Q321-T325 PolarHBondContact O-OG1 3.26Å; Q322-T325 WeakPolarHBondContact CA-OG1 3.44Å; Q322-T325 PolarHBondContact O-N 2.76Å; Q322-T325 PolarHBondContact O-OG1 3.5Å; T325-E329 PolarHBondContact O-N 3.31Å
326	I	87.6	Confident	87.7	Confident	19 Å²	19	55.9 Å²	55.9	10%	0.097	29%	0.286	C	S	.	.	H	α-helix	trans	-70.7	-37.1	174.3	-61.7	167.9	0	0	0	111.3	P297 L299 Q322 L323 L324 E329 F690	P297-I326 HydrophobicContact CG-CD1 4.16Å; L299-I326 HydrophobicContact CD1-CD1 3.88Å; L299-I326 HydrophobicContact CD2-CD1 4.16Å; L299-I326 HydrophobicContact CG-CD1 4.31Å; Q322-I326 HydrophobicContact CG-CD1 4.47Å; Q322-I326 WeakPolarHBondContact O-CG1 3.3Å; Q322-I326 PolarHBondContact O-N 3.29Å; L323-I326 PolarHBondContact O-N 3.25Å; L324-I326 VanDerWaalsContact C-N 3.32Å; I326-E329 VanDerWaalsContact O-CB 3.25Å; I326-E329 WeakPolarHBondContact O-CB 3.48Å; I326-E329 PolarHBondContact O-N 3.31Å; I326-F690 HydrophobicContact CB-CE1 4.42Å; I326-F690 HydrophobicContact CB-CE2 4.37Å; I326-F690 HydrophobicContact CB-CZ 4.02Å; I326-F690 HydrophobicContact CG2-CD1 4.12Å; I326-F690 HydrophobicContact CG2-CD2 4.2Å; I326-F690 HydrophobicContact CG2-CE1 3.79Å; I326-F690 HydrophobicContact CG2-CE2 3.94Å; I326-F690 HydrophobicContact CG2-CG 4.31Å; I326-F690 HydrophobicContact CG2-CZ 3.73Å
327	W	90.1	Very high	87.3	Confident	8 Å²	8	58.6 Å²	58.6	3%	0.03	30%	0.299	C	S	.	.	H	α-helix	trans	-64.6	-42.6	-178.6	-179.8	-102.5	0	0	0	113.5	L323 L324 E329 P375 F376 F379 W686 Y689 F690	L323-W327 VanDerWaalsContact O-CB 3.29Å; L323-W327 WeakPolarHBondContact O-CB 3.35Å; L323-W327 PolarHBondContact O-N 3.46Å; L324-W327 PolarHBondContact O-N 3.03Å; W327-E329 VanDerWaalsContact C-N 3.33Å; W327-P375 HydrophobicContact CD2-CB 4.32Å; W327-P375 HydrophobicContact CE3-CB 3.59Å; W327-P375 HydrophobicContact CZ3-CB 3.85Å; W327-F376 AromaticContact CE2-CD2 3.93Å; W327-F376 HydrophobicContact CZ2-CB 4.33Å; W327-F376 HydrophobicContact CZ2-CD2 4.06Å; W327-F376 AromaticContact NE1-CD2 3.41Å; W327-F376 WeakPolarHBondContact O-CB 3.45Å; W327-F376 PolarHBondContact O-N 3.3Å; W327-F379 HydrophobicContact CH2-CB 3.49Å; W327-F379 VanDerWaalsContact CH2-CB 3.49Å; W327-F379 HydrophobicContact CH2-CD1 4.35Å; W327-F379 HydrophobicContact CH2-CD2 4.44Å; W327-F379 AromaticContact CH2-CG 3.86Å; W327-F379 HydrophobicContact CH2-CG 3.86Å; W327-F379 HydrophobicContact CZ2-CB 3.88Å; W327-F379 HydrophobicContact CZ2-CD1 4.04Å; W327-F379 HydrophobicContact CZ2-CG 4.02Å; W327-W686 AromaticContact CD2-CD1 3.79Å; W327-W686 HydrophobicContact CD2-CD2 4.26Å; W327-W686 AromaticContact CD2-CG 3.97Å; W327-W686 HydrophobicContact CD2-CG 3.97Å; W327-W686 AromaticContact CD2-NE1 3.95Å; W327-W686 AromaticContact CE2-CD1 3.91Å; W327-W686 AromaticContact CE2-NE1 3.81Å; W327-W686 HydrophobicContact CE3-CB 3.68Å; W327-W686 AromaticContact CE3-CD1 3.51Å; W327-W686 HydrophobicContact CE3-CD2 4.26Å; W327-W686 AromaticContact CE3-CG 3.54Å; W327-W686 HydrophobicContact CE3-CG 3.54Å; W327-W686 HydrophobicContact CG-CD2 4.48Å; W327-W686 AromaticContact CH2-CD1 3.54Å; W327-W686 HydrophobicContact CH2-CG 4.35Å; W327-W686 AromaticContact CZ2-CD1 3.81Å; W327-W686 AromaticContact CZ2-NE1 3.91Å; W327-W686 HydrophobicContact CZ3-CB 3.84Å; W327-W686 AromaticContact CZ3-CD1 3.41Å; W327-W686 VanDerWaalsContact CZ3-CD1 3.41Å; W327-W686 AromaticContact CZ3-CG 3.79Å; W327-W686 HydrophobicContact CZ3-CG 3.79Å; W327-Y689 HydrophobicContact CH2-CD2 4.32Å; W327-Y689 HydrophobicContact CZ3-CD2 4.3Å; W327-Y689 HydrophobicContact CZ3-CG 4.49Å; W327-F690 HydrophobicContact CB-CE1 4.29Å; W327-F690 HydrophobicContact CB-CZ 4.5Å; W327-F690 HydrophobicContact CE3-CD1 4.49Å; W327-F690 AromaticContact CE3-CE1 3.8Å; W327-F690 HydrophobicContact CE3-CE1 3.8Å
328	Y	88.6	Confident	87.1	Confident	36 Å²	36	57.7 Å²	57.7	14%	0.141	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	23.5	176.7	-69.2	-75.3	0	0	0	113.2	L324 N330 L331 R335 F376	L324-Y328 HydrophobicContact CD2-CD2 4.45Å; L324-Y328 HydrophobicContact CD2-CE2 4.11Å; L324-Y328 PolarHBondContact O-N 3.05Å; L324-Y328 VanDerWaalsContact O-N 3.15Å; Y328-N330 PolarHBondContact O-N 3.21Å; Y328-L331 CarbonylContact O-C 3.52Å; Y328-L331 PolarHBondContact O-N 2.93Å; Y328-R335 HydrophobicContact CD2-CB 4.12Å; Y328-R335 HydrophobicContact CD2-CG 4.03Å; Y328-R335 HydrophobicContact CE2-CG 4.31Å; Y328-R335 HydrophobicContact CG-CB 4.15Å; Y328-F376 HydrophobicContact CD1-CB 4.46Å; Y328-F376 HydrophobicContact CD1-CG 4.33Å; Y328-F376 AromaticContact CE1-CD2 3.88Å; Y328-F376 HydrophobicContact CE1-CD2 3.88Å; Y328-F376 HydrophobicContact CE1-CE2 4.15Å; Y328-F376 HydrophobicContact CE1-CG 4.04Å
329	E	83.3	Confident	86.7	Confident	69 Å²	69	62.2 Å²	62.2	32%	0.322	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	130.6	175.3	-172.1	-173.3	-161.6	0	0	110.4	R296 T325 I326 W327 L331 S374	R296-E329 IonicContact CZ-OE2 3.15Å; R296-E329 VanDerWaalsContact CZ-OE2 3.25Å; R296-E329 IonicContact NE-OE2 3.04Å; R296-E329 PolarHBondContact NE-OE2 3.34Å; R296-E329 IonicContact NH2-OE2 2.88Å; R296-E329 PolarHBondContact NH2-OE2 3.05Å; T325-E329 PolarHBondContact O-N 3.31Å; I326-E329 VanDerWaalsContact O-CB 3.25Å; I326-E329 WeakPolarHBondContact O-CB 3.48Å; I326-E329 PolarHBondContact O-N 3.31Å; W327-E329 VanDerWaalsContact C-N 3.33Å; E329-L331 PolarHBondContact O-N 3.23Å; E329-S374 VanDerWaalsContact O-CB 3.22Å; E329-S374 WeakPolarHBondContact O-CB 3.3Å
330	N	81.6	Confident	86.5	Confident	89 Å²	89	66.7 Å²	66.7	48%	0.476	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	2.1	-175	-50.7	-54.5	0	0	0	116.8	Y328	Y328-N330 PolarHBondContact O-N 3.21Å
331	L	83.3	Confident	86.3	Confident	37 Å²	37	68.9 Å²	68.9	19%	0.194	36%	0.358	C	S	.	.			trans	-133.7	59.9	176.8	-66.6	172.7	0	0	0	111.6	Y328 E329 D333 L334 I371 F376 M377	Y328-L331 CarbonylContact O-C 3.52Å; Y328-L331 PolarHBondContact O-N 2.93Å; E329-L331 PolarHBondContact O-N 3.23Å; L331-D333 VanDerWaalsContact C-N 3.28Å; L331-D333 PolarHBondContact O-N 2.86Å; L331-L334 HydrophobicContact CB-CB 4.35Å; L331-L334 HydrophobicContact CD1-CD2 4.47Å; L331-L334 PolarHBondContact O-N 3.42Å; L331-I371 HydrophobicContact CD1-CG2 4.47Å; L331-I371 HydrophobicContact CD2-CG2 4.35Å; L331-F376 HydrophobicContact CD1-CD1 4.29Å; L331-M377 HydrophobicContact CD1-CG 3.67Å; L331-M377 HydrophobicContact CD1-SD 4.09Å
332	P	77.1	Confident	86.1	Confident	93 Å²	93	66.4 Å²	66.4	60%	0.604	35%	0.346	S	S	*	.	H	α-helix	trans	-62.7	-37.2	-175.9	27.1	-34.3	0	0	0	112.1	L334 R335	P332-L334 VanDerWaalsContact C-N 3.31Å; P332-L334 PolarHBondContact O-N 3Å; P332-R335 WeakPolarHBondContact O-CB 3.44Å; P332-R335 PolarHBondContact O-N 3.3Å
333	D	81.5	Confident	86	Confident	127 Å²	127	69.2 Å²	69.2	68%	0.679	37%	0.367	S	S	*	.	H	α-helix	trans	-63	-38.9	-176.3	-60	-29.4	0	0	0	111.4	L331 R335 Q336 Q337	L331-D333 VanDerWaalsContact C-N 3.28Å; L331-D333 PolarHBondContact O-N 2.86Å; D333-R335 PolarHBondContact O-N 2.88Å; D333-Q336 PolarHBondContact O-N 3.03Å; D333-Q337 VanDerWaalsContact O-CG 3.29Å; D333-Q337 WeakPolarHBondContact O-CG 3.41Å
334	L	82.4	Confident	85.9	Confident	16 Å²	16	77.4 Å²	77.4	8%	0.084	40%	0.398	C	S	.	.	H	α-helix	trans	-68.5	-21.3	-174.9	-167.2	63.8	0	0	0	113.3	L331 P332 Q336 Q337 K342 T345 F376	L331-L334 HydrophobicContact CB-CB 4.35Å; L331-L334 HydrophobicContact CD1-CD2 4.47Å; L331-L334 PolarHBondContact O-N 3.42Å; P332-L334 VanDerWaalsContact C-N 3.31Å; P332-L334 PolarHBondContact O-N 3Å; L334-Q336 PolarHBondContact O-N 3.2Å; L334-Q337 PolarHBondContact O-N 3.41Å; L334-K342 HydrophobicContact CD1-CG 4.06Å; L334-K342 WeakPolarHBondContact O-CE 3.47Å; L334-T345 HydrophobicContact CD2-CG2 4.43Å; L334-F376 HydrophobicContact CD2-CD1 3.75Å; L334-F376 HydrophobicContact CD2-CE1 3.18Å; L334-F376 HydrophobicContact CD2-CZ 3.78Å; L334-F376 HydrophobicContact CG-CE1 4.48Å
335	R	83.3	Confident	85.7	Confident	97 Å²	97	77.6 Å²	77.6	37%	0.366	40%	0.401	S	S	.	.	H	α-helix	trans	-60.5	-45.3	-179.7	-177.6	178.5	174.1	179.7	-0.7	111.8	Y328 P332 D333	Y328-R335 HydrophobicContact CD2-CB 4.12Å; Y328-R335 HydrophobicContact CD2-CG 4.03Å; Y328-R335 HydrophobicContact CE2-CG 4.31Å; Y328-R335 HydrophobicContact CG-CB 4.15Å; P332-R335 WeakPolarHBondContact O-CB 3.44Å; P332-R335 PolarHBondContact O-N 3.3Å; D333-R335 PolarHBondContact O-N 2.88Å
336	Q	85.1	Confident	85.6	Confident	184 Å²	184	77.4 Å²	77.4	86%	0.86	40%	0.4	S	S	*	.	S	Bend	trans	-91.2	-4.4	-174.5	-65.9	-178.2	-9	0	0	113.8	D333 L334	D333-Q336 PolarHBondContact O-N 3.03Å; L334-Q336 PolarHBondContact O-N 3.2Å
337	Q	87.4	Confident	85.6	Confident	84 Å²	84	80.9 Å²	80.9	39%	0.393	42%	0.418	S	S	.	.	S	Bend	trans	-72.3	153.4	-176.8	-66.4	-61	-35.4	0	0	113.1	D333 L334 V341 K342	D333-Q337 VanDerWaalsContact O-CG 3.29Å; D333-Q337 WeakPolarHBondContact O-CG 3.41Å; L334-Q337 PolarHBondContact O-N 3.41Å; Q337-V341 HydrophobicContact CB-CB 4Å; Q337-V341 HydrophobicContact CB-CG1 4Å; Q337-V341 HydrophobicContact CG-CB 4.49Å; Q337-V341 HydrophobicContact CG-CG1 4.02Å; Q337-K342 VanDerWaalsContact O-CE 3.29Å; Q337-K342 WeakPolarHBondContact O-CE 3.15Å; Q337-K342 PolarHBondContact O-NZ 2.88Å
338	S	88.8	Confident	85.5	Confident	66 Å²	66	82.6 Å²	82.6	46%	0.462	44%	0.438	S	S	.	.			trans	-63.3	158.8	174.6	71.3	0	0	0	0	111.9	V340 V341 K342	S338-V340 PolarHBondContact O-N 3.4Å; S338-V341 PolarHBondContact O-N 3Å; S338-K342 PolarHBondContact O-N 3.33Å
339	I	85.9	Confident	85.5	Confident	142 Å²	142	81.3 Å²	81.3	73%	0.728	43%	0.434	S	S	*	.	H	α-helix	trans	-57.1	-33	177.7	-62.5	168.6	0	0	0	111	K342 C343	I339-K342 PolarHBondContact O-N 3.46Å; I339-C343 WeakPolarHBondContact O-CB 3.42Å; I339-C343 PolarHBondContact O-N 2.95Å
340	V	88.6	Confident	85.7	Confident	94 Å²	94	80.1 Å²	80.1	57%	0.57	43%	0.431	S	S	*	.	H	α-helix	trans	-62.8	-46.8	178.8	179.6	0	0	0	0	111.5	S338 K342 C343 W344	S338-V340 PolarHBondContact O-N 3.4Å; V340-K342 VanDerWaalsContact C-N 3.33Å; V340-K342 PolarHBondContact O-N 3.45Å; V340-C343 WeakPolarHBondContact O-CB 3.4Å; V340-C343 PolarHBondContact O-N 2.93Å; V340-W344 VanDerWaalsContact O-CD1 3.23Å; V340-W344 PolarHBondContact O-N 3.16Å
341	V	88.6	Confident	85.9	Confident	55 Å²	55	80.9 Å²	80.9	33%	0.333	44%	0.439	S	S	.	.	H	α-helix	trans	-66.5	-37.9	178.4	175.8	0	0	0	0	111.1	Q337 S338 C343 W344 T345	Q337-V341 HydrophobicContact CB-CB 4Å; Q337-V341 HydrophobicContact CB-CG1 4Å; Q337-V341 HydrophobicContact CG-CB 4.49Å; Q337-V341 HydrophobicContact CG-CG1 4.02Å; S338-V341 PolarHBondContact O-N 3Å; V341-C343 VanDerWaalsContact C-N 3.33Å; V341-C343 PolarHBondContact O-N 3.06Å; V341-W344 PolarHBondContact O-N 2.94Å; V341-T345 PolarHBondContact O-N 3.05Å; V341-T345 PolarHBondContact O-OG1 3.22Å
342	K	87.1	Confident	86	Confident	56 Å²	56	80 Å²	80	24%	0.243	44%	0.439	C	S	.	.	H	α-helix	trans	-61.7	-42	173.2	-68.2	173.7	179.9	167.7	0	111.1	L334 Q337 S338 I339 V340 T345 V346	L334-K342 HydrophobicContact CD1-CG 4.06Å; L334-K342 WeakPolarHBondContact O-CE 3.47Å; Q337-K342 VanDerWaalsContact O-CE 3.29Å; Q337-K342 WeakPolarHBondContact O-CE 3.15Å; Q337-K342 PolarHBondContact O-NZ 2.88Å; S338-K342 PolarHBondContact O-N 3.33Å; I339-K342 PolarHBondContact O-N 3.46Å; V340-K342 VanDerWaalsContact C-N 3.33Å; V340-K342 PolarHBondContact O-N 3.45Å; K342-T345 WeakPolarHBondContact O-CB 3.38Å; K342-T345 PolarHBondContact O-N 3.04Å; K342-V346 WeakPolarHBondContact O-CG2 3.19Å; K342-V346 PolarHBondContact O-N 2.98Å
343	C	87	Confident	86.5	Confident	81 Å²	81	75.8 Å²	75.8	55%	0.547	41%	0.411	S	S	.	.	H	α-helix	trans	-62.3	-45	175.4	-168.8	0	0	0	0	112.1	I339 V340 V341 T345 V346 L347	I339-C343 WeakPolarHBondContact O-CB 3.42Å; I339-C343 PolarHBondContact O-N 2.95Å; V340-C343 WeakPolarHBondContact O-CB 3.4Å; V340-C343 PolarHBondContact O-N 2.93Å; V341-C343 VanDerWaalsContact C-N 3.33Å; V341-C343 PolarHBondContact O-N 3.06Å; C343-T345 VanDerWaalsContact C-N 3.28Å; C343-T345 PolarHBondContact O-N 2.94Å; C343-V346 PolarHBondContact O-N 3.3Å; C343-L347 PolarHBondContact O-N 3.42Å
344	W	88.8	Confident	86.7	Confident	172 Å²	172	72.3 Å²	72.3	65%	0.652	40%	0.396	S	S	*	.	H	α-helix	trans	-60.1	-37.9	173.3	-81.9	109.9	0	0	0	112.8	V340 V341 L347 G348	V340-W344 VanDerWaalsContact O-CD1 3.23Å; V340-W344 PolarHBondContact O-N 3.16Å; V341-W344 PolarHBondContact O-N 2.94Å; W344-L347 HydrophobicContact CE3-CD2 4.35Å; W344-L347 HydrophobicContact CZ3-CD2 4.29Å; W344-L347 PolarHBondContact O-N 3.48Å; W344-G348 PolarHBondContact O-N 2.72Å
345	T	84.8	Confident	86.9	Confident	45 Å²	45	78.7 Å²	78.7	28%	0.276	42%	0.423	S	S	.	.	H	α-helix	trans	-64	-45.5	175.3	-54.1	0	0	0	0	110.9	L334 V341 K342 C343 L347 G348 V349	L334-T345 HydrophobicContact CD2-CG2 4.43Å; V341-T345 PolarHBondContact O-N 3.05Å; V341-T345 PolarHBondContact O-OG1 3.22Å; K342-T345 WeakPolarHBondContact O-CB 3.38Å; K342-T345 PolarHBondContact O-N 3.04Å; C343-T345 VanDerWaalsContact C-N 3.28Å; C343-T345 PolarHBondContact O-N 2.94Å; T345-L347 PolarHBondContact O-N 2.93Å; T345-G348 PolarHBondContact O-N 2.95Å; T345-V349 WeakPolarHBondContact O-CG2 3.18Å; T345-V349 PolarHBondContact O-N 3.14Å
346	V	87.8	Confident	87	Confident	56 Å²	56	76 Å²	76	34%	0.339	42%	0.415	S	S	.	.	H	α-helix	trans	-60.4	-45.9	175.5	173.9	0	0	0	0	110.7	K342 C343 G348 V349 T350 V380 V384	K342-V346 WeakPolarHBondContact O-CG2 3.19Å; K342-V346 PolarHBondContact O-N 2.98Å; C343-V346 PolarHBondContact O-N 3.3Å; V346-G348 VanDerWaalsContact C-N 3.34Å; V346-G348 PolarHBondContact O-N 2.91Å; V346-V349 PolarHBondContact O-N 3.42Å; V346-V349 VanDerWaalsContact O-N 3.16Å; V346-T350 PolarHBondContact O-N 2.7Å; V346-T350 PolarHBondContact O-OG1 3.31Å; V346-V380 HydrophobicContact CB-CG1 4.5Å; V346-V380 HydrophobicContact CG1-CG1 4.48Å; V346-V380 HydrophobicContact CG2-CG1 4.02Å; V346-V380 HydrophobicContact CG2-CG2 4.46Å; V346-V384 HydrophobicContact CG1-CG2 3.87Å
347	L	87.4	Confident	87	Confident	92 Å²	92	67.6 Å²	67.6	48%	0.482	38%	0.378	S	S	.	.	H	α-helix	trans	-61.4	-41.9	177.3	-171.6	146.8	0	0	0	112	C343 W344 T345 V349 T350 V351	C343-L347 PolarHBondContact O-N 3.42Å; W344-L347 HydrophobicContact CE3-CD2 4.35Å; W344-L347 HydrophobicContact CZ3-CD2 4.29Å; W344-L347 PolarHBondContact O-N 3.48Å; T345-L347 PolarHBondContact O-N 2.93Å; L347-V349 VanDerWaalsContact C-N 3.34Å; L347-V349 PolarHBondContact O-N 2.93Å; L347-T350 WeakPolarHBondContact O-CB 3.31Å; L347-T350 PolarHBondContact O-N 3.44Å; L347-V351 PolarHBondContact O-N 3.1Å
348	G	87.8	Confident	86.9	Confident	43 Å²	43	68 Å²	68	44%	0.443	38%	0.382	S	S	.	.	H	α-helix	trans	-60.6	-41.5	173.4	0	0	0	0	0	112.6	W344 T345 V346 V351 G352	W344-G348 PolarHBondContact O-N 2.72Å; T345-G348 PolarHBondContact O-N 2.95Å; V346-G348 VanDerWaalsContact C-N 3.34Å; V346-G348 PolarHBondContact O-N 2.91Å; G348-V351 PolarHBondContact O-N 2.81Å; G348-G352 PolarHBondContact O-N 3.45Å
349	V	88.1	Confident	86.7	Confident	9 Å²	9	66.4 Å²	66.4	6%	0.055	37%	0.372	C	S	.	.	H	α-helix	trans	-66.8	-35.8	173.9	175.5	0	0	0	0	111.5	T345 V346 L347 V351 G352 L353 L356 M377 V380 V384	T345-V349 WeakPolarHBondContact O-CG2 3.18Å; T345-V349 PolarHBondContact O-N 3.14Å; V346-V349 PolarHBondContact O-N 3.42Å; V346-V349 VanDerWaalsContact O-N 3.16Å; L347-V349 VanDerWaalsContact C-N 3.34Å; L347-V349 PolarHBondContact O-N 2.93Å; V349-V351 PolarHBondContact O-N 2.58Å; V349-G352 CarbonylContact O-C 3.55Å; V349-G352 PolarHBondContact O-N 2.91Å; V349-L353 WeakPolarHBondContact O-CA 3.48Å; V349-L353 WeakPolarHBondContact O-CB 3.46Å; V349-L353 PolarHBondContact O-N 3.34Å; V349-L356 HydrophobicContact CG1-CD1 4.29Å; V349-M377 HydrophobicContact CG2-CE 3.71Å; V349-V380 HydrophobicContact CB-CG1 4.11Å; V349-V380 HydrophobicContact CG1-CG1 4.03Å; V349-V380 HydrophobicContact CG2-CG1 4.29Å; V349-V384 HydrophobicContact CG1-CG2 4.38Å
350	T	86.5	Confident	86.6	Confident	45 Å²	45	62 Å²	62	28%	0.276	35%	0.347	S	S	.	.	H	α-helix	trans	-57.6	-47.6	175.2	-55.4	0	0	0	0	112.6	V346 L347 V384 L388	V346-T350 PolarHBondContact O-N 2.7Å; V346-T350 PolarHBondContact O-OG1 3.31Å; L347-T350 WeakPolarHBondContact O-CB 3.31Å; L347-T350 PolarHBondContact O-N 3.44Å; T350-V384 VanDerWaalsContact CA-CG1 3.44Å; T350-V384 HydrophobicContact CG2-CG1 4.15Å; T350-L388 HydrophobicContact CG2-CD2 3.93Å; T350-L388 HydrophobicContact CG2-CG 4.3Å
351	V	86.8	Confident	86.2	Confident	105 Å²	105	64 Å²	64	64%	0.636	34%	0.344	S	S	*	.	H	α-helix	trans	-72.6	-36.6	176.7	-178.3	0	0	0	0	111	L347 G348 V349	L347-V351 PolarHBondContact O-N 3.1Å; G348-V351 PolarHBondContact O-N 2.81Å; V349-V351 PolarHBondContact O-N 2.58Å
352	G	85.8	Confident	85.9	Confident	18 Å²	18	67.2 Å²	67.2	19%	0.186	36%	0.358	C	S	.	.	H	α-helix	trans	-83.3	-12.5	-174.1	0	0	0	0	0	116.4	G348 V349 F355 L356	G348-G352 PolarHBondContact O-N 3.45Å; V349-G352 CarbonylContact O-C 3.55Å; V349-G352 PolarHBondContact O-N 2.91Å; G352-F355 WeakPolarHBondContact O-CB 3.29Å; G352-F355 PolarHBondContact O-N 3.43Å; G352-L356 WeakPolarHBondContact O-CG 3.34Å; G352-L356 PolarHBondContact O-N 3.1Å
353	L	86.6	Confident	85.6	Confident	5 Å²	5	70 Å²	70	3%	0.026	37%	0.374	C	S	.	.	H	α-helix	trans	-51.5	-47.7	-171.9	-169.1	68.5	0	0	0	114.7	V349 F355 L356 A357 A381 V384 L388 P697 F700	V349-L353 WeakPolarHBondContact O-CA 3.48Å; V349-L353 WeakPolarHBondContact O-CB 3.46Å; V349-L353 PolarHBondContact O-N 3.34Å; L353-F355 VanDerWaalsContact C-N 3.31Å; L353-F355 PolarHBondContact O-N 2.88Å; L353-L356 PolarHBondContact O-N 2.92Å; L353-A357 PolarHBondContact O-N 3.11Å; L353-A381 HydrophobicContact CD1-CB 3.9Å; L353-V384 HydrophobicContact CD2-CG1 4.24Å; L353-L388 HydrophobicContact CD2-CD1 4.23Å; L353-P697 HydrophobicContact CD1-CG 4.07Å; L353-P697 HydrophobicContact CD2-CG 4.28Å; L353-F700 HydrophobicContact CD2-CE2 4.17Å; L353-F700 HydrophobicContact CG-CE2 4.14Å
354	P	85.8	Confident	85.1	Confident	54 Å²	54	68.7 Å²	68.7	35%	0.351	36%	0.364	S	S	.	.	H	α-helix	trans	-62.9	-37.5	178.5	23.6	-33.5	0	0	0	112.4	I358 F700	P354-I358 WeakPolarHBondContact O-CD1 3.44Å; P354-I358 VanDerWaalsContact O-CG1 3.31Å; P354-I358 WeakPolarHBondContact O-CG1 3.39Å; P354-I358 PolarHBondContact O-N 2.83Å; P354-F700 HydrophobicContact CB-CZ 4.11Å
355	F	87.4	Confident	84.5	Confident	150 Å²	150	65.5 Å²	65.5	66%	0.658	37%	0.367	S	S	*	.	H	α-helix	trans	-70.4	-40.6	178.2	-58.9	-77.9	0	0	0	111.9	G352 L353 A357 I358 A359	G352-F355 WeakPolarHBondContact O-CB 3.29Å; G352-F355 PolarHBondContact O-N 3.43Å; L353-F355 VanDerWaalsContact C-N 3.31Å; L353-F355 PolarHBondContact O-N 2.88Å; F355-A357 VanDerWaalsContact C-N 3.34Å; F355-A357 PolarHBondContact O-N 3.04Å; F355-I358 PolarHBondContact O-N 3.22Å; F355-A359 WeakPolarHBondContact O-CB 3.45Å; F355-A359 PolarHBondContact O-N 3.39Å
356	L	85.6	Confident	84.5	Confident	40 Å²	40	64 Å²	64	21%	0.209	36%	0.358	C	S	.	.	H	α-helix	trans	-63.2	-39.7	176.5	-69.1	172	0	0	0	111.8	V349 G352 L353 A359 Y360	V349-L356 HydrophobicContact CG1-CD1 4.29Å; G352-L356 WeakPolarHBondContact O-CG 3.34Å; G352-L356 PolarHBondContact O-N 3.1Å; L353-L356 PolarHBondContact O-N 2.92Å; L356-A359 PolarHBondContact O-N 3.4Å; L356-Y360 WeakPolarHBondContact O-CB 3.47Å; L356-Y360 PolarHBondContact O-N 3.48Å
357	A	84.4	Confident	84.3	Confident	8 Å²	8	69.8 Å²	69.8	7%	0.066	38%	0.379	C	S	.	.	H	α-helix	trans	-63.4	-44.9	176.2	0	0	0	0	0	112	L353 F355 Y360 W361 L696 F700	L353-A357 PolarHBondContact O-N 3.11Å; F355-A357 VanDerWaalsContact C-N 3.34Å; F355-A357 PolarHBondContact O-N 3.04Å; A357-Y360 PolarHBondContact O-N 2.89Å; A357-W361 PolarHBondContact O-N 3.49Å; A357-W361 VanDerWaalsContact O-N 3.14Å; A357-L696 HydrophobicContact CB-CD2 4.08Å; A357-F700 HydrophobicContact CB-CB 4.11Å; A357-F700 HydrophobicContact CB-CD1 4.01Å; A357-F700 HydrophobicContact CB-CD2 3.98Å; A357-F700 HydrophobicContact CB-CE1 4.45Å; A357-F700 HydrophobicContact CB-CE2 4.42Å; A357-F700 HydrophobicContact CB-CG 3.76Å
358	I	84.5	Confident	84	Confident	93 Å²	93	70.1 Å²	70.1	48%	0.477	38%	0.381	S	S	.	.	H	α-helix	trans	-64.8	-44.6	177	-65.8	165.6	0	0	0	110.8	P354 F355 Y360 W361 I362	P354-I358 WeakPolarHBondContact O-CD1 3.44Å; P354-I358 VanDerWaalsContact O-CG1 3.31Å; P354-I358 WeakPolarHBondContact O-CG1 3.39Å; P354-I358 PolarHBondContact O-N 2.83Å; F355-I358 PolarHBondContact O-N 3.22Å; I358-Y360 VanDerWaalsContact C-N 3.33Å; I358-Y360 PolarHBondContact O-N 3.36Å; I358-W361 PolarHBondContact O-N 3.04Å; I358-W361 VanDerWaalsContact O-N 3.15Å; I358-I362 HydrophobicContact CG2-CD1 3.61Å; I358-I362 HydrophobicContact CG2-CG1 4.36Å; I358-I362 WeakPolarHBondContact O-CG1 3.48Å; I358-I362 PolarHBondContact O-N 2.99Å
359	A	84.6	Confident	83.7	Confident	32 Å²	32	68.2 Å²	68.2	26%	0.264	36%	0.36	S	S	.	.	H	α-helix	trans	-60.8	-40.8	178.7	0	0	0	0	0	112.4	F355 L356 W361 M363	F355-A359 WeakPolarHBondContact O-CB 3.45Å; F355-A359 PolarHBondContact O-N 3.39Å; L356-A359 PolarHBondContact O-N 3.4Å; A359-W361 VanDerWaalsContact C-N 3.33Å; A359-M363 CarbonylContact O-C 3.58Å; A359-M363 PolarHBondContact O-N 2.91Å
360	Y	83.9	Confident	83.4	Confident	48 Å²	48	72.7 Å²	72.7	19%	0.188	38%	0.381	C	S	.	.	H	α-helix	trans	-65.6	-35.9	175.8	-176.4	-100.2	0	0	0	112.5	L356 A357 I358 P364 L372 T695 L696	L356-Y360 WeakPolarHBondContact O-CB 3.47Å; L356-Y360 PolarHBondContact O-N 3.48Å; A357-Y360 PolarHBondContact O-N 2.89Å; I358-Y360 VanDerWaalsContact C-N 3.33Å; I358-Y360 PolarHBondContact O-N 3.36Å; Y360-P364 HydrophobicContact CE2-CB 4.43Å; Y360-L372 HydrophobicContact CD2-CD2 3.94Å; Y360-L372 HydrophobicContact CG-CD2 3.86Å; Y360-T695 WeakPolarHBondContact CE1-OG1 3.47Å; Y360-T695 PolarHBondContact OH-OG1 3.02Å; Y360-L696 HydrophobicContact CD1-CD1 4.1Å; Y360-L696 HydrophobicContact CD1-CD2 3.96Å; Y360-L696 HydrophobicContact CD1-CG 4Å; Y360-L696 HydrophobicContact CE1-CG 4.37Å; Y360-L696 HydrophobicContact CG-CD2 4.43Å
361	W	81.6	Confident	83.3	Confident	136 Å²	136	73.1 Å²	73.1	52%	0.515	38%	0.381	S	S	.	.	H	α-helix	trans	-69.7	-43	178.8	-170.5	54.5	0	0	0	112.5	A357 I358 A359 V703	A357-W361 PolarHBondContact O-N 3.49Å; A357-W361 VanDerWaalsContact O-N 3.14Å; I358-W361 PolarHBondContact O-N 3.04Å; I358-W361 VanDerWaalsContact O-N 3.15Å; A359-W361 VanDerWaalsContact C-N 3.33Å; W361-V703 HydrophobicContact CZ2-CG1 4.28Å
362	I	81.9	Confident	83.1	Confident	124 Å²	124	68.5 Å²	68.5	64%	0.636	35%	0.353	S	S	*	.	H	α-helix	trans	-76.3	-43.6	-178.5	-61.4	170.5	0	0	0	111.3	I358	I358-I362 HydrophobicContact CG2-CD1 3.61Å; I358-I362 HydrophobicContact CG2-CG1 4.36Å; I358-I362 WeakPolarHBondContact O-CG1 3.48Å; I358-I362 PolarHBondContact O-N 2.99Å
363	M	81.1	Confident	83	Confident	115 Å²	115	71.9 Å²	71.9	57%	0.567	36%	0.36	S	S	*	.			trans	-138.3	75	-172.7	-157	163.5	93.7	0	0	112.4	A359 C365 S366	A359-M363 CarbonylContact O-C 3.58Å; A359-M363 PolarHBondContact O-N 2.91Å; M363-C365 PolarHBondContact O-N 3.17Å; M363-S366 VanDerWaalsContact O-CB 3.3Å; M363-S366 WeakPolarHBondContact O-CB 3.23Å; M363-S366 PolarHBondContact O-N 3.28Å; M363-S366 VanDerWaalsContact O-N 3.15Å; M363-S366 PolarHBondContact O-OG 3.3Å
364	P	76.3	Confident	83	Confident	53 Å²	53	71.6 Å²	71.6	34%	0.344	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-23	-177.1	25.8	-34.9	0	0	0	113.6	Y360 S366	Y360-P364 HydrophobicContact CE2-CB 4.43Å; P364-S366 VanDerWaalsContact C-N 3.34Å
365	C	75.9	Confident	83.2	Confident	104 Å²	104	69 Å²	69	70%	0.703	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	2.9	179.4	-60.9	0	0	0	0	113.6	M363	M363-C365 PolarHBondContact O-N 3.17Å
366	S	85.3	Confident	83.3	Confident	15 Å²	15	62.8 Å²	62.8	11%	0.105	31%	0.314	C	S	.	.	S	Bend	trans	-69.3	162.6	176.5	67.6	0	0	0	0	112.4	M363 P364 L368 G369 Q370	M363-S366 VanDerWaalsContact O-CB 3.3Å; M363-S366 WeakPolarHBondContact O-CB 3.23Å; M363-S366 PolarHBondContact O-N 3.28Å; M363-S366 VanDerWaalsContact O-N 3.15Å; M363-S366 PolarHBondContact O-OG 3.3Å; P364-S366 VanDerWaalsContact C-N 3.34Å; S366-L368 PolarHBondContact O-N 3.46Å; S366-G369 WeakPolarHBondContact O-CA 3.46Å; S366-G369 PolarHBondContact O-N 3.39Å; S366-G369 PolarHBondContact OG-N 2.95Å; S366-Q370 PolarHBondContact O-N 2.99Å
367	K	83.2	Confident	83.5	Confident	177 Å²	177	61.7 Å²	61.7	77%	0.77	31%	0.308	S	S	*	.	H	α-helix	trans	-54.4	-40	170.9	-68.6	-172	178.2	-177.3	0	111.7	Q370 I371	K367-Q370 PolarHBondContact O-N 3.32Å; K367-I371 VanDerWaalsContact O-CG1 3.27Å; K367-I371 WeakPolarHBondContact O-CG1 3.41Å; K367-I371 PolarHBondContact O-N 3Å
368	L	81.4	Confident	83.7	Confident	99 Å²	99	61.3 Å²	61.3	52%	0.518	31%	0.305	S	S	.	.	H	α-helix	trans	-65.9	-39	175.3	-68.5	175.8	0	0	0	112.5	S366 I371 L372	S366-L368 PolarHBondContact O-N 3.46Å; L368-I371 PolarHBondContact O-N 3.4Å; L368-L372 PolarHBondContact O-N 3.11Å
369	G	80.4	Confident	84.1	Confident	2 Å²	2	57.9 Å²	57.9	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-65.5	-37.9	175.1	0	0	0	0	0	113	S366 L372 R373	S366-G369 WeakPolarHBondContact O-CA 3.46Å; S366-G369 PolarHBondContact O-N 3.39Å; S366-G369 PolarHBondContact OG-N 2.95Å; G369-L372 PolarHBondContact O-N 3.45Å; G369-R373 PolarHBondContact O-N 2.94Å; G369-R373 VanDerWaalsContact O-N 3.11Å
370	Q	81.7	Confident	84.4	Confident	104 Å²	104	56.7 Å²	56.7	49%	0.486	28%	0.276	S	S	.	.	H	α-helix	trans	-66.3	-40.8	172.7	-68.9	178	-5.9	0	0	111.8	S366 K367 R373 S374	S366-Q370 PolarHBondContact O-N 2.99Å; K367-Q370 PolarHBondContact O-N 3.32Å; Q370-R373 PolarHBondContact O-N 3.33Å; Q370-S374 PolarHBondContact O-N 3.31Å
371	I	84.6	Confident	84.7	Confident	54 Å²	54	54.4 Å²	54.4	28%	0.277	27%	0.267	S	S	.	.	H	α-helix	trans	-61.9	-44.7	174.4	-69.2	163.8	0	0	0	110.8	L331 K367 L368 R373 S374 M377	L331-I371 HydrophobicContact CD1-CG2 4.47Å; L331-I371 HydrophobicContact CD2-CG2 4.35Å; K367-I371 VanDerWaalsContact O-CG1 3.27Å; K367-I371 WeakPolarHBondContact O-CG1 3.41Å; K367-I371 PolarHBondContact O-N 3Å; L368-I371 PolarHBondContact O-N 3.4Å; I371-R373 PolarHBondContact O-N 3.08Å; I371-S374 VanDerWaalsContact O-CB 3.25Å; I371-S374 WeakPolarHBondContact O-CB 3.22Å; I371-S374 PolarHBondContact O-N 3.4Å; I371-S374 VanDerWaalsContact O-N 3.08Å; I371-S374 PolarHBondContact O-OG 3.36Å; I371-M377 HydrophobicContact CG2-CE 4.3Å; I371-M377 HydrophobicContact CG2-CG 3.96Å; I371-M377 WeakPolarHBondContact O-CB 3.48Å; I371-M377 WeakPolarHBondContact O-CG 3.23Å
372	L	82.9	Confident	85.1	Confident	8 Å²	8	49.7 Å²	49.7	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-67.5	-24.4	178.4	-167.1	67.8	0	0	0	113	Y360 L368 G369 S374 K378 L696	Y360-L372 HydrophobicContact CD2-CD2 3.94Å; Y360-L372 HydrophobicContact CG-CD2 3.86Å; L368-L372 PolarHBondContact O-N 3.11Å; G369-L372 PolarHBondContact O-N 3.45Å; L372-S374 VanDerWaalsContact C-N 3.27Å; L372-K378 WeakPolarHBondContact O-CG 3.45Å; L372-L696 HydrophobicContact CD2-CD2 4.29Å
373	R	84.3	Confident	85.5	Confident	88 Å²	88	44.6 Å²	44.6	33%	0.332	23%	0.227	S	C	.	.	H	α-helix	trans	-76.1	-13.6	174	-165.5	177.9	179.6	176.6	-1.3	112.8	R296 G369 Q370 I371 K378 E692	R296-R373 PolarHBondContact NH2-O 2.63Å; R296-R373 VanDerWaalsContact NH2-O 3.09Å; G369-R373 PolarHBondContact O-N 2.94Å; G369-R373 VanDerWaalsContact O-N 3.11Å; Q370-R373 PolarHBondContact O-N 3.33Å; I371-R373 PolarHBondContact O-N 3.08Å; R373-K378 WeakPolarHBondContact O-CE 3.49Å; R373-E692 IonicContact CZ-OE1 2.72Å; R373-E692 IonicContact NH2-OE1 3.41Å; R373-E692 PolarHBondContact NH2-OE1 3.32Å; R373-E692 IonicContact NH2-OE2 2.82Å; R373-E692 PolarHBondContact NH2-OE2 3.24Å; R373-E692 VanDerWaalsContact NH2-OE2 3.12Å
374	S	86.9	Confident	86.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-61.9	139.4	173.4	71.2	0	0	0	0	110.4	E329 Q370 I371 L372 F376 M377 K378	E329-S374 VanDerWaalsContact O-CB 3.22Å; E329-S374 WeakPolarHBondContact O-CB 3.3Å; Q370-S374 PolarHBondContact O-N 3.31Å; I371-S374 VanDerWaalsContact O-CB 3.25Å; I371-S374 WeakPolarHBondContact O-CB 3.22Å; I371-S374 PolarHBondContact O-N 3.4Å; I371-S374 VanDerWaalsContact O-N 3.08Å; I371-S374 PolarHBondContact O-OG 3.36Å; L372-S374 VanDerWaalsContact C-N 3.27Å; S374-F376 VanDerWaalsContact C-N 3.31Å; S374-F376 PolarHBondContact O-N 3.34Å; S374-M377 PolarHBondContact O-N 3.27Å; S374-M377 WeakPolarHBondContact OG-CB 3.27Å; S374-M377 WeakPolarHBondContact OG-CG 3.22Å; S374-M377 PolarHBondContact OG-N 2.87Å; S374-K378 WeakPolarHBondContact O-CG 2.98Å; S374-K378 PolarHBondContact O-N 3.01Å; S374-K378 VanDerWaalsContact O-N 3.14Å
375	P	90.1	Very high	86.9	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.2	-42	-176.2	-26.1	36.5	0	0	0	113.3	W327 M377 K378 F379 F690	W327-P375 HydrophobicContact CD2-CB 4.32Å; W327-P375 HydrophobicContact CE3-CB 3.59Å; W327-P375 HydrophobicContact CZ3-CB 3.85Å; P375-M377 PolarHBondContact O-N 2.78Å; P375-K378 PolarHBondContact O-N 3.33Å; P375-F379 PolarHBondContact O-N 3.4Å; P375-F690 HydrophobicContact CB-CD1 3.67Å; P375-F690 HydrophobicContact CB-CE1 3.84Å; P375-F690 HydrophobicContact CG-CD1 3.55Å; P375-F690 HydrophobicContact CG-CE1 3.81Å
376	F	89.4	Confident	87.7	Confident	19 Å²	19	33 Å²	33	8%	0.083	16%	0.157	C	C	.	.	H	α-helix	trans	-58.6	-46.9	177.3	176.7	-100.3	0	0	0	112.4	W327 Y328 L331 L334 S374 K378 F379 V380	W327-F376 AromaticContact CE2-CD2 3.93Å; W327-F376 HydrophobicContact CZ2-CB 4.33Å; W327-F376 HydrophobicContact CZ2-CD2 4.06Å; W327-F376 AromaticContact NE1-CD2 3.41Å; W327-F376 WeakPolarHBondContact O-CB 3.45Å; W327-F376 PolarHBondContact O-N 3.3Å; Y328-F376 HydrophobicContact CD1-CB 4.46Å; Y328-F376 HydrophobicContact CD1-CG 4.33Å; Y328-F376 AromaticContact CE1-CD2 3.88Å; Y328-F376 HydrophobicContact CE1-CD2 3.88Å; Y328-F376 HydrophobicContact CE1-CE2 4.15Å; Y328-F376 HydrophobicContact CE1-CG 4.04Å; L331-F376 HydrophobicContact CD1-CD1 4.29Å; L334-F376 HydrophobicContact CD2-CD1 3.75Å; L334-F376 HydrophobicContact CD2-CE1 3.18Å; L334-F376 HydrophobicContact CD2-CZ 3.78Å; L334-F376 HydrophobicContact CG-CE1 4.48Å; S374-F376 VanDerWaalsContact C-N 3.31Å; S374-F376 PolarHBondContact O-N 3.34Å; F376-K378 VanDerWaalsContact C-N 3.34Å; F376-K378 PolarHBondContact O-N 3.29Å; F376-F379 PolarHBondContact O-N 3.24Å; F376-V380 HydrophobicContact CD1-CG2 4.21Å; F376-V380 HydrophobicContact CD2-CG2 4.35Å; F376-V380 HydrophobicContact CE1-CG2 3.68Å; F376-V380 HydrophobicContact CE2-CG2 3.89Å; F376-V380 HydrophobicContact CZ-CG2 3.53Å; F376-V380 WeakPolarHBondContact O-CG2 3.22Å; F376-V380 PolarHBondContact O-N 3.15Å
377	M	88.8	Confident	87.9	Confident	16 Å²	16	35.7 Å²	35.7	8%	0.079	17%	0.173	C	C	.	.	H	α-helix	trans	-67.7	-34.4	-179.7	-69.8	-64	-73	0	0	112.4	L331 V349 I371 S374 P375 V380 A381	L331-M377 HydrophobicContact CD1-CG 3.67Å; L331-M377 HydrophobicContact CD1-SD 4.09Å; V349-M377 HydrophobicContact CG2-CE 3.71Å; I371-M377 HydrophobicContact CG2-CE 4.3Å; I371-M377 HydrophobicContact CG2-CG 3.96Å; I371-M377 WeakPolarHBondContact O-CB 3.48Å; I371-M377 WeakPolarHBondContact O-CG 3.23Å; S374-M377 PolarHBondContact O-N 3.27Å; S374-M377 WeakPolarHBondContact OG-CB 3.27Å; S374-M377 WeakPolarHBondContact OG-CG 3.22Å; S374-M377 PolarHBondContact OG-N 2.87Å; P375-M377 PolarHBondContact O-N 2.78Å; M377-V380 PolarHBondContact O-N 3.46Å; M377-A381 VanDerWaalsContact O-CB 3.25Å; M377-A381 WeakPolarHBondContact O-CB 3.35Å; M377-A381 PolarHBondContact O-N 3.47Å
378	K	89.9	Confident	88.4	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-58.7	-50.9	171.2	-64.2	-177	-168.7	179.8	0	110.5	L372 R373 S374 P375 F376 V380 A381 H382 Y689 D691 G693	L372-K378 WeakPolarHBondContact O-CG 3.45Å; R373-K378 WeakPolarHBondContact O-CE 3.49Å; S374-K378 WeakPolarHBondContact O-CG 2.98Å; S374-K378 PolarHBondContact O-N 3.01Å; S374-K378 VanDerWaalsContact O-N 3.14Å; P375-K378 PolarHBondContact O-N 3.33Å; F376-K378 VanDerWaalsContact C-N 3.34Å; F376-K378 PolarHBondContact O-N 3.29Å; K378-V380 PolarHBondContact O-N 3.14Å; K378-A381 PolarHBondContact O-N 2.83Å; K378-H382 PolarHBondContact O-CD2 3.14Å; K378-H382 PolarHBondContact O-N 2.84Å; K378-Y689 HydrophobicContact CB-CD1 3.87Å; K378-Y689 PolarHBondContact NZ-O 3.4Å; K378-Y689 VanDerWaalsContact NZ-O 3.11Å; K378-D691 PolarHBondContact NZ-O 3.23Å; K378-G693 PolarHBondContact NZ-O 3.38Å
379	F	91.3	Very high	89	Confident	22 Å²	22	25.5 Å²	25.5	10%	0.096	13%	0.127	C	C	.	.	H	α-helix	trans	-58.1	-48.2	179.3	168.4	-100.9	0	0	0	112.1	W327 P375 F376 A381 H382 A383 I549 A552 L685 Y689	W327-F379 HydrophobicContact CH2-CB 3.49Å; W327-F379 VanDerWaalsContact CH2-CB 3.49Å; W327-F379 HydrophobicContact CH2-CD1 4.35Å; W327-F379 HydrophobicContact CH2-CD2 4.44Å; W327-F379 AromaticContact CH2-CG 3.86Å; W327-F379 HydrophobicContact CH2-CG 3.86Å; W327-F379 HydrophobicContact CZ2-CB 3.88Å; W327-F379 HydrophobicContact CZ2-CD1 4.04Å; W327-F379 HydrophobicContact CZ2-CG 4.02Å; P375-F379 PolarHBondContact O-N 3.4Å; F376-F379 PolarHBondContact O-N 3.24Å; F379-A381 VanDerWaalsContact C-N 3.34Å; F379-A381 PolarHBondContact O-N 2.93Å; F379-H382 PolarHBondContact O-N 2.99Å; F379-A383 WeakPolarHBondContact O-CB 3.48Å; F379-A383 PolarHBondContact O-N 3.02Å; F379-I549 HydrophobicContact CE2-CG2 4.48Å; F379-I549 HydrophobicContact CZ-CG2 3.9Å; F379-A552 HydrophobicContact CE1-CB 4.02Å; F379-A552 HydrophobicContact CE2-CB 4.22Å; F379-A552 HydrophobicContact CZ-CB 3.48Å; F379-A552 VanDerWaalsContact CZ-CB 3.48Å; F379-L685 HydrophobicContact CE2-CD2 4.16Å; F379-Y689 HydrophobicContact CB-CD1 4.41Å; F379-Y689 HydrophobicContact CB-CD2 4.35Å; F379-Y689 HydrophobicContact CB-CE1 4.36Å; F379-Y689 HydrophobicContact CB-CE2 4.31Å; F379-Y689 HydrophobicContact CB-CG 4.41Å; F379-Y689 AromaticContact CD2-CE2 3.83Å; F379-Y689 HydrophobicContact CD2-CE2 3.83Å; F379-Y689 AromaticContact CD2-CZ 3.99Å
380	V	91	Very high	89.6	Confident	7 Å²	7	25.9 Å²	25.9	4%	0.042	13%	0.129	C	C	.	.	H	α-helix	trans	-60.6	-44.2	177	174.7	0	0	0	0	110.9	V346 V349 F376 M377 K378 H382 A383 V384	V346-V380 HydrophobicContact CB-CG1 4.5Å; V346-V380 HydrophobicContact CG1-CG1 4.48Å; V346-V380 HydrophobicContact CG2-CG1 4.02Å; V346-V380 HydrophobicContact CG2-CG2 4.46Å; V349-V380 HydrophobicContact CB-CG1 4.11Å; V349-V380 HydrophobicContact CG1-CG1 4.03Å; V349-V380 HydrophobicContact CG2-CG1 4.29Å; F376-V380 HydrophobicContact CD1-CG2 4.21Å; F376-V380 HydrophobicContact CD2-CG2 4.35Å; F376-V380 HydrophobicContact CE1-CG2 3.68Å; F376-V380 HydrophobicContact CE2-CG2 3.89Å; F376-V380 HydrophobicContact CZ-CG2 3.53Å; F376-V380 WeakPolarHBondContact O-CG2 3.22Å; F376-V380 PolarHBondContact O-N 3.15Å; M377-V380 PolarHBondContact O-N 3.46Å; K378-V380 PolarHBondContact O-N 3.14Å; V380-H382 PolarHBondContact O-N 2.96Å; V380-A383 PolarHBondContact O-N 3.35Å; V380-V384 HydrophobicContact CG1-CG2 3.97Å; V380-V384 WeakPolarHBondContact O-CB 3.13Å; V380-V384 WeakPolarHBondContact O-CG2 3.17Å; V380-V384 PolarHBondContact O-N 3.09Å
381	A	90.4	Very high	90.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62.1	-40.8	178.9	0	0	0	0	0	112.8	L353 M377 K378 F379 S385 P697	L353-A381 HydrophobicContact CD1-CB 3.9Å; M377-A381 VanDerWaalsContact O-CB 3.25Å; M377-A381 WeakPolarHBondContact O-CB 3.35Å; M377-A381 PolarHBondContact O-N 3.47Å; K378-A381 PolarHBondContact O-N 2.83Å; F379-A381 VanDerWaalsContact C-N 3.34Å; F379-A381 PolarHBondContact O-N 2.93Å; A381-S385 WeakPolarHBondContact O-CB 3.36Å; A381-S385 PolarHBondContact O-N 3.04Å; A381-P697 HydrophobicContact CB-CG 4.21Å
382	H	90.1	Very high	90.6	Very high	37 Å²	37	21.6 Å²	21.6	17%	0.171	12%	0.118	C	C	.	.	H	α-helix	trans	-67.4	-44.6	174.6	-77.4	-75.1	0	0	0	112.2	K378 F379 V380 S385 F386 Y689 R694 P697	K378-H382 PolarHBondContact O-CD2 3.14Å; K378-H382 PolarHBondContact O-N 2.84Å; F379-H382 PolarHBondContact O-N 2.99Å; V380-H382 PolarHBondContact O-N 2.96Å; H382-S385 PolarHBondContact O-N 3.38Å; H382-F386 WeakPolarHBondContact O-CB 3.43Å; H382-F386 PolarHBondContact O-N 3.06Å; H382-Y689 HydrophobicContact CB-CE1 4.48Å; H382-Y689 AromaticContact CD2-CE1 3.66Å; H382-R694 PolarHBondContact NE2-O 2.84Å; H382-P697 VanDerWaalsContact CE1-CA 3.49Å; H382-P697 WeakPolarHBondContact CE1-CA 3.33Å
383	A	91.5	Very high	91.1	Very high	17 Å²	17	21.6 Å²	21.6	14%	0.14	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-46.4	176.7	0	0	0	0	0	111.6	F379 V380 F386 T387 I549	F379-A383 WeakPolarHBondContact O-CB 3.48Å; F379-A383 PolarHBondContact O-N 3.02Å; V380-A383 PolarHBondContact O-N 3.35Å; A383-F386 PolarHBondContact O-N 2.67Å; A383-T387 WeakPolarHBondContact O-CG2 3.48Å; A383-T387 PolarHBondContact O-N 3.36Å; A383-T387 PolarHBondContact O-OG1 3.19Å; A383-I549 HydrophobicContact CB-CD1 3.9Å; A383-I549 HydrophobicContact CB-CG1 4.43Å; A383-I549 HydrophobicContact CB-CG2 4.4Å
384	V	92.1	Very high	91.6	Very high	3 Å²	3	20.5 Å²	20.5	2%	0.018	12%	0.121	C	C	.	.	H	α-helix	trans	-63.7	-43.8	177.6	164.4	0	0	0	0	111.9	V346 V349 T350 L353 V380 F386 T387 L388	V346-V384 HydrophobicContact CG1-CG2 3.87Å; V349-V384 HydrophobicContact CG1-CG2 4.38Å; T350-V384 VanDerWaalsContact CA-CG1 3.44Å; T350-V384 HydrophobicContact CG2-CG1 4.15Å; L353-V384 HydrophobicContact CD2-CG1 4.24Å; V380-V384 HydrophobicContact CG1-CG2 3.97Å; V380-V384 WeakPolarHBondContact O-CB 3.13Å; V380-V384 WeakPolarHBondContact O-CG2 3.17Å; V380-V384 PolarHBondContact O-N 3.09Å; V384-F386 VanDerWaalsContact C-N 3.26Å; V384-F386 PolarHBondContact O-N 3.46Å; V384-T387 WeakPolarHBondContact CA-OG1 3.27Å; V384-T387 PolarHBondContact O-N 3.05Å; V384-T387 PolarHBondContact O-OG1 3.29Å; V384-L388 HydrophobicContact CG1-CD1 4.18Å; V384-L388 WeakPolarHBondContact O-CB 3.42Å; V384-L388 VanDerWaalsContact O-CG 3.3Å; V384-L388 WeakPolarHBondContact O-CG 3.35Å; V384-L388 PolarHBondContact O-N 3.37Å
385	S	92.9	Very high	91.9	Very high	5 Å²	5	24 Å²	24	4%	0.035	14%	0.143	C	C	.	.	H	α-helix	trans	-59.8	-41.4	175.2	168.2	0	0	0	0	111.7	A381 H382 L388 F389 W437 A698	A381-S385 WeakPolarHBondContact O-CB 3.36Å; A381-S385 PolarHBondContact O-N 3.04Å; H382-S385 PolarHBondContact O-N 3.38Å; S385-L388 PolarHBondContact O-N 3.11Å; S385-F389 PolarHBondContact O-N 3.28Å; S385-W437 PolarHBondContact O-NE1 3Å; S385-W437 PolarHBondContact OG-NE1 3.37Å; S385-A698 WeakPolarHBondContact CB-O 3.31Å; S385-A698 PolarHBondContact OG-O 2.71Å
386	F	92.6	Very high	91.9	Very high	20 Å²	20	24.8 Å²	24.8	9%	0.088	15%	0.146	C	C	.	.	H	α-helix	trans	-68.6	-39.6	179.8	-174.8	-107.8	0	0	0	112.4	H382 A383 V384 L388 F389 L390 S542 R545 I546 I549	H382-F386 WeakPolarHBondContact O-CB 3.43Å; H382-F386 PolarHBondContact O-N 3.06Å; A383-F386 PolarHBondContact O-N 2.67Å; V384-F386 VanDerWaalsContact C-N 3.26Å; V384-F386 PolarHBondContact O-N 3.46Å; F386-L388 VanDerWaalsContact C-N 3.34Å; F386-F389 HydrophobicContact CD2-CD1 4.24Å; F386-F389 AromaticContact CE2-CD1 3.91Å; F386-F389 HydrophobicContact CE2-CD1 3.91Å; F386-F389 HydrophobicContact CE2-CE1 4.39Å; F386-F389 WeakPolarHBondContact O-CB 3.42Å; F386-F389 PolarHBondContact O-N 3.2Å; F386-L390 HydrophobicContact CD1-CD1 4.29Å; F386-L390 HydrophobicContact CE1-CD1 3.69Å; F386-L390 HydrophobicContact CE1-CD2 4.43Å; F386-L390 HydrophobicContact CE1-CG 4.06Å; F386-L390 HydrophobicContact CZ-CD1 4.11Å; F386-L390 HydrophobicContact CZ-CD2 4Å; F386-L390 HydrophobicContact CZ-CG 4.04Å; F386-L390 PolarHBondContact O-N 3.39Å; F386-S542 VanDerWaalsContact CZ-O 3.3Å; F386-S542 WeakPolarHBondContact CZ-O 3.49Å; F386-R545 HydrophobicContact CE1-CB 4.06Å; F386-R545 HydrophobicContact CE1-CG 4.46Å; F386-R545 HydrophobicContact CE2-CB 4.32Å; F386-R545 HydrophobicContact CE2-CG 4.39Å; F386-R545 HydrophobicContact CZ-CB 3.62Å; F386-R545 HydrophobicContact CZ-CG 4.08Å; F386-I546 HydrophobicContact CE1-CG1 4.06Å; F386-I549 HydrophobicContact CD1-CD1 4.26Å
387	T	91.4	Very high	91.9	Very high	71 Å²	71	25.5 Å²	25.5	44%	0.436	16%	0.156	S	C	.	.	H	α-helix	trans	-66.7	-36	173.8	56.1	0	0	0	0	112.1	A383 V384 F389 L390 G391	A383-T387 WeakPolarHBondContact O-CG2 3.48Å; A383-T387 PolarHBondContact O-N 3.36Å; A383-T387 PolarHBondContact O-OG1 3.19Å; V384-T387 WeakPolarHBondContact CA-OG1 3.27Å; V384-T387 PolarHBondContact O-N 3.05Å; V384-T387 PolarHBondContact O-OG1 3.29Å; T387-F389 VanDerWaalsContact C-N 3.34Å; T387-L390 PolarHBondContact O-N 3.3Å; T387-G391 PolarHBondContact O-N 2.74Å
388	L	92.6	Very high	91.9	Very high	61 Å²	61	26.9 Å²	26.9	32%	0.319	17%	0.167	S	C	.	.	H	α-helix	trans	-63	-39.3	171	-72.5	173.7	0	0	0	111.9	T350 L353 V384 S385 F386 G391 L392	T350-L388 HydrophobicContact CG2-CD2 3.93Å; T350-L388 HydrophobicContact CG2-CG 4.3Å; L353-L388 HydrophobicContact CD2-CD1 4.23Å; V384-L388 HydrophobicContact CG1-CD1 4.18Å; V384-L388 WeakPolarHBondContact O-CB 3.42Å; V384-L388 VanDerWaalsContact O-CG 3.3Å; V384-L388 WeakPolarHBondContact O-CG 3.35Å; V384-L388 PolarHBondContact O-N 3.37Å; S385-L388 PolarHBondContact O-N 3.11Å; F386-L388 VanDerWaalsContact C-N 3.34Å; L388-G391 PolarHBondContact O-N 3.29Å; L388-L392 WeakPolarHBondContact O-CG 3.42Å; L388-L392 PolarHBondContact O-N 3.2Å
389	F	94.4	Very high	91.6	Very high	1 Å²	1	34.1 Å²	34.1	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-60.4	-46.2	173.6	169.8	-103.1	0	0	0	112.2	S385 F386 T387 G391 L392 L393 I434 W437 V438 M441 F473	S385-F389 PolarHBondContact O-N 3.28Å; F386-F389 HydrophobicContact CD2-CD1 4.24Å; F386-F389 AromaticContact CE2-CD1 3.91Å; F386-F389 HydrophobicContact CE2-CD1 3.91Å; F386-F389 HydrophobicContact CE2-CE1 4.39Å; F386-F389 WeakPolarHBondContact O-CB 3.42Å; F386-F389 PolarHBondContact O-N 3.2Å; T387-F389 VanDerWaalsContact C-N 3.34Å; F389-G391 VanDerWaalsContact C-N 3.34Å; F389-G391 PolarHBondContact O-N 3.21Å; F389-L392 WeakPolarHBondContact O-CB 3.25Å; F389-L392 PolarHBondContact O-N 2.84Å; F389-L393 HydrophobicContact CD1-CD1 4.32Å; F389-L393 HydrophobicContact CE1-CD1 3.72Å; F389-L393 HydrophobicContact CE1-CG 4.38Å; F389-L393 HydrophobicContact CZ-CD1 3.9Å; F389-L393 HydrophobicContact CZ-CD2 4.32Å; F389-L393 HydrophobicContact CZ-CG 4.26Å; F389-L393 PolarHBondContact O-N 3.13Å; F389-I434 HydrophobicContact CE2-CG2 4Å; F389-W437 HydrophobicContact CB-CG 4.31Å; F389-W437 HydrophobicContact CD2-CB 3.64Å; F389-W437 AromaticContact CD2-CD1 3.96Å; F389-W437 AromaticContact CD2-CG 3.85Å; F389-W437 HydrophobicContact CD2-CG 3.85Å; F389-W437 HydrophobicContact CE2-CB 4.08Å; F389-W437 HydrophobicContact CG-CG 4.49Å; F389-V438 HydrophobicContact CE2-CG2 4.18Å; F389-V438 HydrophobicContact CZ-CG2 4.39Å; F389-M441 HydrophobicContact CD1-CE 4.3Å; F389-M441 HydrophobicContact CD2-CE 4.2Å; F389-M441 HydrophobicContact CE1-CE 3.94Å; F389-M441 HydrophobicContact CE2-CE 3.8Å; F389-M441 HydrophobicContact CG-CE 4.42Å; F389-M441 HydrophobicContact CZ-CE 3.67Å; F389-F473 HydrophobicContact CZ-CE2 4.2Å; F389-F473 HydrophobicContact CZ-CZ 4.05Å
390	L	93.6	Very high	91.3	Very high	10 Å²	10	40.1 Å²	40.1	5%	0.052	23%	0.228	C	C	.	.	H	α-helix	trans	-62.6	-41.4	174.6	-65.3	178.8	0	0	0	111.8	F386 T387 L392 L393 V394 F543 I546	F386-L390 HydrophobicContact CD1-CD1 4.29Å; F386-L390 HydrophobicContact CE1-CD1 3.69Å; F386-L390 HydrophobicContact CE1-CD2 4.43Å; F386-L390 HydrophobicContact CE1-CG 4.06Å; F386-L390 HydrophobicContact CZ-CD1 4.11Å; F386-L390 HydrophobicContact CZ-CD2 4Å; F386-L390 HydrophobicContact CZ-CG 4.04Å; F386-L390 PolarHBondContact O-N 3.39Å; T387-L390 PolarHBondContact O-N 3.3Å; L390-L392 VanDerWaalsContact C-N 3.31Å; L390-L392 PolarHBondContact O-N 3.5Å; L390-L393 HydrophobicContact CD2-CD1 4.27Å; L390-L393 WeakPolarHBondContact O-CB 3.25Å; L390-L393 PolarHBondContact O-N 3Å; L390-L393 VanDerWaalsContact O-N 3.17Å; L390-V394 WeakPolarHBondContact O-CG2 3.22Å; L390-V394 PolarHBondContact O-N 3.41Å; L390-V394 VanDerWaalsContact O-N 3.08Å; L390-F543 HydrophobicContact CB-CE1 4.26Å; L390-F543 HydrophobicContact CB-CZ 4.39Å; L390-F543 HydrophobicContact CD1-CD1 4.06Å; L390-F543 HydrophobicContact CD1-CE1 4.14Å; L390-F543 HydrophobicContact CD2-CD1 4.17Å; L390-F543 HydrophobicContact CD2-CD2 4.31Å; L390-F543 HydrophobicContact CD2-CE1 4.22Å; L390-F543 HydrophobicContact CD2-CE2 4.36Å; L390-F543 HydrophobicContact CD2-CG 4.21Å; L390-F543 HydrophobicContact CD2-CZ 4.31Å; L390-F543 HydrophobicContact CG-CE1 4.46Å; L390-I546 HydrophobicContact CD1-CD1 3.65Å; L390-I546 HydrophobicContact CD1-CG1 3.72Å
391	G	93.2	Very high	91.1	Very high	36 Å²	36	46.6 Å²	46.6	37%	0.371	26%	0.256	S	S	.	.	H	α-helix	trans	-57.6	-42.8	173.2	0	0	0	0	0	112.4	T387 L388 F389 L393 V394 V395	T387-G391 PolarHBondContact O-N 2.74Å; L388-G391 PolarHBondContact O-N 3.29Å; F389-G391 VanDerWaalsContact C-N 3.34Å; F389-G391 PolarHBondContact O-N 3.21Å; G391-L393 VanDerWaalsContact C-N 3.35Å; G391-L393 PolarHBondContact O-N 3.18Å; G391-V394 PolarHBondContact O-N 3.44Å; G391-V395 WeakPolarHBondContact O-CG2 3.48Å; G391-V395 PolarHBondContact O-N 3.34Å
392	L	93.2	Very high	90.6	Very high	33 Å²	33	55.9 Å²	55.9	17%	0.173	30%	0.299	C	S	.	.	H	α-helix	trans	-63.8	-36.3	175.6	-74.6	171.8	0	0	0	112.8	L388 F389 L390 V394 V395 N396 L433 I434 W437	L388-L392 WeakPolarHBondContact O-CG 3.42Å; L388-L392 PolarHBondContact O-N 3.2Å; F389-L392 WeakPolarHBondContact O-CB 3.25Å; F389-L392 PolarHBondContact O-N 2.84Å; L390-L392 VanDerWaalsContact C-N 3.31Å; L390-L392 PolarHBondContact O-N 3.5Å; L392-V394 VanDerWaalsContact C-N 3.34Å; L392-V395 PolarHBondContact O-N 3.5Å; L392-N396 WeakPolarHBondContact O-CB 3.45Å; L392-N396 PolarHBondContact O-N 2.95Å; L392-L433 HydrophobicContact CD1-CB 4.5Å; L392-I434 HydrophobicContact CB-CG1 4.38Å; L392-W437 HydrophobicContact CD1-CD2 4.29Å; L392-W437 HydrophobicContact CD1-CE3 3.8Å; L392-W437 HydrophobicContact CD1-CH2 3.75Å; L392-W437 HydrophobicContact CD1-CZ2 4.23Å; L392-W437 HydrophobicContact CD1-CZ3 3.51Å
393	L	94.2	Very high	90.1	Very high	8 Å²	8	56.1 Å²	56.1	4%	0.042	31%	0.312	C	S	.	.	H	α-helix	trans	-63.9	-40.9	173.6	-66.3	176.5	0	0	0	111.6	F389 L390 G391 N396 A397 I434 F473 Y535 V539 S542	F389-L393 HydrophobicContact CD1-CD1 4.32Å; F389-L393 HydrophobicContact CE1-CD1 3.72Å; F389-L393 HydrophobicContact CE1-CG 4.38Å; F389-L393 HydrophobicContact CZ-CD1 3.9Å; F389-L393 HydrophobicContact CZ-CD2 4.32Å; F389-L393 HydrophobicContact CZ-CG 4.26Å; F389-L393 PolarHBondContact O-N 3.13Å; L390-L393 HydrophobicContact CD2-CD1 4.27Å; L390-L393 WeakPolarHBondContact O-CB 3.25Å; L390-L393 PolarHBondContact O-N 3Å; L390-L393 VanDerWaalsContact O-N 3.17Å; G391-L393 VanDerWaalsContact C-N 3.35Å; G391-L393 PolarHBondContact O-N 3.18Å; L393-N396 PolarHBondContact O-N 3.37Å; L393-A397 PolarHBondContact O-N 3.47Å; L393-I434 HydrophobicContact CD2-CD1 3.92Å; L393-I434 HydrophobicContact CD2-CG1 4.26Å; L393-I434 HydrophobicContact CD2-CG2 4.06Å; L393-F473 HydrophobicContact CD1-CZ 4.45Å; L393-Y535 HydrophobicContact CD2-CE2 4.45Å; L393-Y535 VanDerWaalsContact CD2-OH 3.3Å; L393-Y535 WeakPolarHBondContact CD2-OH 3.42Å; L393-V539 HydrophobicContact CD1-CG2 4.35Å; L393-V539 HydrophobicContact CD2-CG2 4.34Å; L393-S542 VanDerWaalsContact CD1-OG 3.32Å; L393-S542 WeakPolarHBondContact CD1-OG 3.4Å
394	V	94.1	Very high	89.6	Confident	65 Å²	65	60.4 Å²	60.4	39%	0.394	34%	0.336	S	S	.	.	H	α-helix	trans	-66.3	-43.8	176.3	177	0	0	0	0	110.9	L390 G391 L392 N396 A397 S398 F401 F543	L390-V394 WeakPolarHBondContact O-CG2 3.22Å; L390-V394 PolarHBondContact O-N 3.41Å; L390-V394 VanDerWaalsContact O-N 3.08Å; G391-V394 PolarHBondContact O-N 3.44Å; L392-V394 VanDerWaalsContact C-N 3.34Å; V394-N396 VanDerWaalsContact C-N 3.31Å; V394-N396 PolarHBondContact O-N 3.48Å; V394-A397 CarbonylContact O-C 3.55Å; V394-A397 WeakPolarHBondContact O-CA 3.36Å; V394-A397 WeakPolarHBondContact O-CB 3.39Å; V394-A397 PolarHBondContact O-N 3.49Å; V394-S398 PolarHBondContact O-N 2.87Å; V394-F401 HydrophobicContact CG1-CE2 4.39Å; V394-F401 HydrophobicContact CG1-CZ 3.96Å; V394-F543 HydrophobicContact CG2-CZ 4.06Å
395	V	92.9	Very high	89	Confident	74 Å²	74	69.5 Å²	69.5	45%	0.448	38%	0.375	S	S	.	.	H	α-helix	trans	-62.7	-36.9	175.3	172.3	0	0	0	0	111.4	G391 L392 A397 S398 T430	G391-V395 WeakPolarHBondContact O-CG2 3.48Å; G391-V395 PolarHBondContact O-N 3.34Å; L392-V395 PolarHBondContact O-N 3.5Å; V395-A397 PolarHBondContact O-N 3.4Å; V395-S398 PolarHBondContact O-N 3.26Å; V395-S398 VanDerWaalsContact O-N 3.1Å; V395-S398 PolarHBondContact O-OG 3.28Å; V395-T430 HydrophobicContact CG1-CG2 4.36Å
396	N	90.9	Very high	88.3	Confident	15 Å²	15	73.1 Å²	73.1	8%	0.08	39%	0.394	C	S	.	.	H	α-helix	trans	-64.2	-21.4	174.5	-165.9	50	0	0	0	113.4	L392 L393 V394 R400 T430 I434 Y535	L392-N396 WeakPolarHBondContact O-CB 3.45Å; L392-N396 PolarHBondContact O-N 2.95Å; L393-N396 PolarHBondContact O-N 3.37Å; V394-N396 VanDerWaalsContact C-N 3.31Å; V394-N396 PolarHBondContact O-N 3.48Å; N396-R400 PolarHBondContact O-NH2 2.9Å; N396-T430 PolarHBondContact OD1-OG1 3.26Å; N396-I434 HydrophobicContact CB-CD1 3.94Å; N396-Y535 PolarHBondContact ND2-OH 3.1Å
397	A	89.7	Confident	87.9	Confident	35 Å²	35	77.2 Å²	77.2	29%	0.289	42%	0.416	S	S	.	.	H	α-helix	trans	-94.2	-16.4	174.6	0	0	0	0	0	113.3	L393 V394 V395 D399 R400 F401	L393-A397 PolarHBondContact O-N 3.47Å; V394-A397 CarbonylContact O-C 3.55Å; V394-A397 WeakPolarHBondContact O-CA 3.36Å; V394-A397 WeakPolarHBondContact O-CB 3.39Å; V394-A397 PolarHBondContact O-N 3.49Å; V395-A397 PolarHBondContact O-N 3.4Å; A397-D399 VanDerWaalsContact C-N 3.31Å; A397-D399 PolarHBondContact O-N 3.29Å; A397-R400 PolarHBondContact O-N 2.81Å; A397-R400 VanDerWaalsContact O-N 3.15Å; A397-F401 HydrophobicContact CB-CE1 3.96Å; A397-F401 WeakPolarHBondContact O-CD1 3.34Å
398	S	88.3	Confident	87.6	Confident	44 Å²	44	78 Å²	78	31%	0.308	42%	0.423	S	S	.	.	H	α-helix	trans	-64.6	-32	-166.7	63.2	0	0	0	0	114.1	V394 V395 R400 F401	V394-S398 PolarHBondContact O-N 2.87Å; V395-S398 PolarHBondContact O-N 3.26Å; V395-S398 VanDerWaalsContact O-N 3.1Å; V395-S398 PolarHBondContact O-OG 3.28Å; S398-R400 PolarHBondContact O-N 3.4Å; S398-F401 PolarHBondContact O-N 3.44Å; S398-F401 VanDerWaalsContact O-N 3.08Å
399	D	82.8	Confident	87.3	Confident	152 Å²	152	79.9 Å²	79.9	81%	0.813	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-14.1	179.2	-64.6	-12.2	0	0	0	113.2	A397	A397-D399 VanDerWaalsContact C-N 3.31Å; A397-D399 PolarHBondContact O-N 3.29Å
400	R	85.8	Confident	86.7	Confident	148 Å²	148	84.9 Å²	84.9	56%	0.558	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	5.2	-177.9	-68.3	173.6	-82.2	168.4	-5.8	113.9	N396 A397 S398 E402 G403 V404	N396-R400 PolarHBondContact O-NH2 2.9Å; A397-R400 PolarHBondContact O-N 2.81Å; A397-R400 VanDerWaalsContact O-N 3.15Å; S398-R400 PolarHBondContact O-N 3.4Å; R400-E402 PolarHBondContact O-N 2.94Å; R400-G403 PolarHBondContact O-N 3.03Å; R400-V404 HydrophobicContact CG-CG2 4.32Å
401	F	87.1	Confident	86.3	Confident	143 Å²	143	87.9 Å²	87.9	63%	0.627	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-33.3	-176	-74.2	-5	0	0	0	114	V394 A397 S398 G403	V394-F401 HydrophobicContact CG1-CE2 4.39Å; V394-F401 HydrophobicContact CG1-CZ 3.96Å; A397-F401 HydrophobicContact CB-CE1 3.96Å; A397-F401 WeakPolarHBondContact O-CD1 3.34Å; S398-F401 PolarHBondContact O-N 3.44Å; S398-F401 VanDerWaalsContact O-N 3.08Å; F401-G403 PolarHBondContact O-N 3.2Å
402	E	79.4	Confident	85.6	Confident	196 Å²	196	89.9 Å²	89.9	92%	0.916	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	2.3	174.2	-65.8	-178	172.4	0	0	113.2	R400	R400-E402 PolarHBondContact O-N 2.94Å
403	G	79.3	Confident	85.1	Confident	42 Å²	42	90.7 Å²	90.7	43%	0.433	48%	0.483	S	S	.	.			trans	91.6	162.5	-172	0	0	0	0	0	112.9	R400 F401	R400-G403 PolarHBondContact O-N 3.03Å; F401-G403 PolarHBondContact O-N 3.2Å
404	V	82.3	Confident	84.4	Confident	107 Å²	107	95 Å²	95	65%	0.648	51%	0.506	S	S	*	.			trans	-84	129.2	-179.6	-176	0	0	0	0	109.3	R400 N406	R400-V404 HydrophobicContact CG-CG2 4.32Å; V404-N406 VanDerWaalsContact C-N 3.31Å; V404-N406 PolarHBondContact O-N 3.36Å
405	K	78.8	Confident	83.7	Confident	193 Å²	193	97.9 Å²	97.9	84%	0.839	52%	0.515	S	S	*	.	S	Bend	trans	-70.1	-22.7	-176.9	-63.9	-177.5	-179.4	179.4	0	114.3
406	N	78.8	Confident	83	Confident	82 Å²	82	98 Å²	98	44%	0.439	52%	0.517	S	S	.	.	S	Bend	trans	-109.9	146.6	-173.5	-55.5	-26.3	0	0	0	111.3	V404	V404-N406 VanDerWaalsContact C-N 3.31Å; V404-N406 PolarHBondContact O-N 3.36Å
407	L	83.8	Confident	82.5	Confident	106 Å²	106	101.8 Å²	101.8	56%	0.555	53%	0.53	S	S	*	.			trans	-72.7	150.5	174.8	-78	79.5	0	0	0	110.8	N409 E410	L407-N409 PolarHBondContact O-N 3.02Å; L407-E410 HydrophobicContact CB-CG 4.36Å; L407-E410 PolarHBondContact O-N 3.4Å
408	P	85.2	Confident	82.2	Confident	88 Å²	88	101.7 Å²	101.7	57%	0.571	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-15.2	179	-24.6	34.3	0	0	0	115.6	A518 R519	P408-A518 WeakPolarHBondContact O-CB 3.46Å; P408-R519 PolarHBondContact O-N 3.27Å
409	N	85.6	Confident	82.1	Confident	100 Å²	100	99.6 Å²	99.6	54%	0.535	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-13.1	-176.5	-63.3	-14.5	0	0	0	113.2	L407 A518 N520	L407-N409 PolarHBondContact O-N 3.02Å; N409-A518 WeakPolarHBondContact O-CB 3.39Å; N409-N520 WeakPolarHBondContact OD1-CB 3.37Å; N409-N520 PolarHBondContact OD1-ND2 2.99Å
410	E	82.9	Confident	82.3	Confident	105 Å²	105	93.7 Å²	93.7	49%	0.491	48%	0.476	S	S	.	.			trans	-95.3	135.7	-175.4	-67.4	177.6	170	0	0	111.2	L407	L407-E410 HydrophobicContact CB-CG 4.36Å; L407-E410 PolarHBondContact O-N 3.4Å
411	T	83.3	Confident	82.3	Confident	73 Å²	73	86.9 Å²	86.9	45%	0.448	45%	0.451	S	S	.	.			trans	-109.5	113.7	178.4	50.8	0	0	0	0	110.3	F420 A518	T411-F420 HydrophobicContact CG2-CB 4.46Å; T411-F420 HydrophobicContact CG2-CD1 3.86Å; T411-F420 HydrophobicContact CG2-CD2 4.15Å; T411-F420 HydrophobicContact CG2-CE1 4.09Å; T411-F420 HydrophobicContact CG2-CE2 4.37Å; T411-F420 HydrophobicContact CG2-CG 3.89Å; T411-F420 HydrophobicContact CG2-CZ 4.34Å; T411-A518 HydrophobicContact CG2-CB 3.86Å
412	I	79.9	Confident	82.3	Confident	78 Å²	78	81.1 Å²	81.1	40%	0.4	43%	0.427	S	S	.	.			trans	-113.3	117.1	177.7	-54.6	179.1	0	0	0	109.1	K423	I412-K423 WeakPolarHBondContact O-CD 3.19Å; I412-K423 PolarHBondContact O-NZ 3.25Å
413	T	82.1	Confident	82.6	Confident	50 Å²	50	74.4 Å²	74.4	31%	0.307	40%	0.395	S	S	.	.			trans	-108	150.4	175.6	53.5	0	0	0	0	109.9	H415 Q418 F420	T413-H415 WeakPolarHBondContact CB-O 3.34Å; T413-H415 PolarHBondContact OG1-O 3.07Å; T413-Q418 VanDerWaalsContact CG2-O 3.27Å; T413-Q418 WeakPolarHBondContact CG2-O 3.48Å; T413-F420 HydrophobicContact CG2-CB 4.11Å; T413-F420 HydrophobicContact CG2-CD2 4.41Å
414	D	79.7	Confident	82.8	Confident	99 Å²	99	74.7 Å²	74.7	53%	0.529	39%	0.389	S	S	.	.	S	Bend	trans	-81.2	-30	178.5	-61.3	-42.3	0	0	0	111.4	K423	D414-K423 VanDerWaalsContact CG-NZ 3.26Å; D414-K423 WeakPolarHBondContact OD1-CE 3.4Å; D414-K423 IonicContact OD1-NZ 2.85Å; D414-K423 PolarHBondContact OD1-NZ 3.45Å; D414-K423 WeakPolarHBondContact OD2-CD 3.47Å; D414-K423 WeakPolarHBondContact OD2-CE 3.38Å; D414-K423 IonicContact OD2-NZ 3.8Å; D414-K423 PolarHBondContact OD2-NZ 3.13Å
415	H	79.4	Confident	83	Confident	126 Å²	126	69.6 Å²	69.6	58%	0.583	36%	0.358	S	S	*	.	S	Bend	trans	-124.2	141.7	172	-57	-56.5	0	0	0	109.5	T413 R417 Q418	T413-H415 WeakPolarHBondContact CB-O 3.34Å; T413-H415 PolarHBondContact OG1-O 3.07Å; H415-R417 PolarHBondContact O-N 2.93Å; H415-R417 VanDerWaalsContact O-N 3.17Å; H415-Q418 HydrophobicContact CB-CB 4.22Å; H415-Q418 WeakPolarHBondContact O-CB 3.39Å; H415-Q418 PolarHBondContact O-N 3.36Å
416	P	78.9	Confident	83.4	Confident	75 Å²	75	65 Å²	65	49%	0.487	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-21.8	-177.6	26	-34.4	0	0	0	113.4	D502 L503	P416-D502 WeakPolarHBondContact CB-OD1 3.47Å; P416-D502 WeakPolarHBondContact CG-OD1 3.34Å; P416-L503 VanDerWaalsContact O-CB 3.26Å; P416-L503 WeakPolarHBondContact O-CB 3.39Å; P416-L503 PolarHBondContact O-N 3.12Å
417	R	80.1	Confident	83.9	Confident	96 Å²	96	63.1 Å²	63.1	36%	0.362	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-6.9	176.8	-148.3	172.1	172.6	-163.2	-6.8	114.1	H415 Q491 D495 V498	H415-R417 PolarHBondContact O-N 2.93Å; H415-R417 VanDerWaalsContact O-N 3.17Å; R417-Q491 PolarHBondContact O-NE2 3.17Å; R417-Q491 VanDerWaalsContact O-NE2 3.12Å; R417-D495 PolarHBondContact NH2-O 3.4Å; R417-V498 PolarHBondContact NH2-O 2.96Å
418	Q	83.6	Confident	84.2	Confident	33 Å²	33	60 Å²	60	15%	0.154	31%	0.314	C	S	.	.	S	Bend	trans	-83.8	131.5	-178.7	-172.2	-174.4	25.1	0	0	111.1	T413 H415 F420	T413-Q418 VanDerWaalsContact CG2-O 3.27Å; T413-Q418 WeakPolarHBondContact CG2-O 3.48Å; H415-Q418 HydrophobicContact CB-CB 4.22Å; H415-Q418 WeakPolarHBondContact O-CB 3.39Å; H415-Q418 PolarHBondContact O-N 3.36Å; Q418-F420 PolarHBondContact O-N 2.73Å
419	V	85.9	Confident	84.4	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.326	C	S	.	.			trans	-69.3	124.7	171.9	178.3	0	0	0	0	109.3	R421 V422 V494 L503 F515	V419-R421 HydrophobicContact CG1-CB 4.12Å; V419-R421 PolarHBondContact O-N 3.29Å; V419-V422 HydrophobicContact CB-CG2 4.29Å; V419-V422 PolarHBondContact O-N 3.4Å; V419-V494 HydrophobicContact CG2-CG2 4Å; V419-L503 HydrophobicContact CG2-CD2 4Å; V419-F515 HydrophobicContact CG1-CB 3.67Å; V419-F515 WeakPolarHBondContact CG1-O 3.48Å
420	F	86.1	Confident	84.7	Confident	28 Å²	28	63.2 Å²	63.2	12%	0.123	31%	0.312	C	S	.	.	H	α-helix	trans	-49.7	-35.3	-178.9	177.9	-110.1	0	0	0	113.5	T411 T413 Q418 V422 K423 T424	T411-F420 HydrophobicContact CG2-CB 4.46Å; T411-F420 HydrophobicContact CG2-CD1 3.86Å; T411-F420 HydrophobicContact CG2-CD2 4.15Å; T411-F420 HydrophobicContact CG2-CE1 4.09Å; T411-F420 HydrophobicContact CG2-CE2 4.37Å; T411-F420 HydrophobicContact CG2-CG 3.89Å; T411-F420 HydrophobicContact CG2-CZ 4.34Å; T413-F420 HydrophobicContact CG2-CB 4.11Å; T413-F420 HydrophobicContact CG2-CD2 4.41Å; Q418-F420 PolarHBondContact O-N 2.73Å; F420-V422 VanDerWaalsContact C-N 3.32Å; F420-V422 PolarHBondContact O-N 3.03Å; F420-K423 PolarHBondContact O-N 3.37Å; F420-T424 HydrophobicContact CE1-CG2 3.96Å; F420-T424 HydrophobicContact CE2-CG2 4.13Å; F420-T424 HydrophobicContact CZ-CG2 3.75Å; F420-T424 PolarHBondContact O-N 3.06Å; F420-T424 PolarHBondContact O-OG1 2.95Å
421	R	86.3	Confident	85.1	Confident	4 Å²	4	59.1 Å²	59.1	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-63.6	-31.2	179.4	-158.7	72	-175.7	-149.1	-7.4	115	V419 K423 T424 T425 A487 F515 D526	V419-R421 HydrophobicContact CG1-CB 4.12Å; V419-R421 PolarHBondContact O-N 3.29Å; R421-K423 VanDerWaalsContact C-N 3.35Å; R421-T424 WeakPolarHBondContact CA-OG1 3.45Å; R421-T424 PolarHBondContact O-N 2.95Å; R421-T424 PolarHBondContact O-OG1 3.48Å; R421-T424 VanDerWaalsContact O-OG1 3.06Å; R421-T425 HydrophobicContact CG-CG2 4.06Å; R421-T425 WeakPolarHBondContact O-CB 3.42Å; R421-T425 WeakPolarHBondContact O-CG2 3.49Å; R421-T425 PolarHBondContact O-N 3.35Å; R421-T425 VanDerWaalsContact O-N 3.09Å; R421-T425 PolarHBondContact O-OG1 2.93Å; R421-A487 HydrophobicContact CB-CB 3.95Å; R421-A487 HydrophobicContact CG-CB 3.73Å; R421-F515 HydrophobicContact CB-CB 4.01Å; R421-F515 HydrophobicContact CB-CD1 4.24Å; R421-F515 WeakPolarHBondContact CB-O 3.43Å; R421-F515 HydrophobicContact CG-CD1 3.96Å; R421-F515 PolarHBondContact N-O 3.05Å; R421-D526 IonicContact CZ-OD2 3.27Å; R421-D526 IonicContact NH1-OD2 2.78Å; R421-D526 IonicContact NH2-OD1 2.76Å; R421-D526 IonicContact NH2-OD2 2.66Å; R421-D526 PolarHBondContact NH2-OD2 2.98Å
422	V	86.4	Confident	85.5	Confident	23 Å²	23	59.4 Å²	59.4	14%	0.139	29%	0.29	C	S	.	.	H	α-helix	trans	-66.3	-42.5	-179.7	177.5	0	0	0	0	110.2	V419 F420 T424 T425 Q426 A487 Q491	V419-V422 HydrophobicContact CB-CG2 4.29Å; V419-V422 PolarHBondContact O-N 3.4Å; F420-V422 VanDerWaalsContact C-N 3.32Å; F420-V422 PolarHBondContact O-N 3.03Å; V422-T424 VanDerWaalsContact C-N 3.31Å; V422-T424 PolarHBondContact O-N 3.28Å; V422-T425 PolarHBondContact O-N 3.33Å; V422-Q426 PolarHBondContact O-N 2.8Å; V422-Q426 VanDerWaalsContact O-N 3.12Å; V422-A487 HydrophobicContact CG2-CB 4.12Å; V422-Q491 HydrophobicContact CG2-CB 3.9Å; V422-Q491 HydrophobicContact CG2-CG 4.45Å
423	K	85.4	Confident	86.1	Confident	55 Å²	55	59.2 Å²	59.2	24%	0.239	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-35	178.8	-172.9	176.3	179.5	173.7	0	113.1	I412 D414 F420 R421 Q426	I412-K423 WeakPolarHBondContact O-CD 3.19Å; I412-K423 PolarHBondContact O-NZ 3.25Å; D414-K423 VanDerWaalsContact CG-NZ 3.26Å; D414-K423 WeakPolarHBondContact OD1-CE 3.4Å; D414-K423 IonicContact OD1-NZ 2.85Å; D414-K423 PolarHBondContact OD1-NZ 3.45Å; D414-K423 WeakPolarHBondContact OD2-CD 3.47Å; D414-K423 WeakPolarHBondContact OD2-CE 3.38Å; D414-K423 IonicContact OD2-NZ 3.8Å; D414-K423 PolarHBondContact OD2-NZ 3.13Å; F420-K423 PolarHBondContact O-N 3.37Å; R421-K423 VanDerWaalsContact C-N 3.35Å; K423-Q426 WeakPolarHBondContact O-CG 3.49Å; K423-Q426 PolarHBondContact O-NE2 3.03Å
424	T	84.6	Confident	86.6	Confident	48 Å²	48	56.8 Å²	56.8	29%	0.294	28%	0.275	S	S	.	.	H	α-helix	trans	-83.3	-26.2	-178.2	51.3	0	0	0	0	113.7	F420 R421 V422	F420-T424 HydrophobicContact CE1-CG2 3.96Å; F420-T424 HydrophobicContact CE2-CG2 4.13Å; F420-T424 HydrophobicContact CZ-CG2 3.75Å; F420-T424 PolarHBondContact O-N 3.06Å; F420-T424 PolarHBondContact O-OG1 2.95Å; R421-T424 WeakPolarHBondContact CA-OG1 3.45Å; R421-T424 PolarHBondContact O-N 2.95Å; R421-T424 PolarHBondContact O-OG1 3.48Å; R421-T424 VanDerWaalsContact O-OG1 3.06Å; V422-T424 VanDerWaalsContact C-N 3.31Å; V422-T424 PolarHBondContact O-N 3.28Å
425	T	86	Confident	87.3	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-103.3	-4.7	-175.5	58.8	0	0	0	0	114.4	R421 V422 A483	R421-T425 HydrophobicContact CG-CG2 4.06Å; R421-T425 WeakPolarHBondContact O-CB 3.42Å; R421-T425 WeakPolarHBondContact O-CG2 3.49Å; R421-T425 PolarHBondContact O-N 3.35Å; R421-T425 VanDerWaalsContact O-N 3.09Å; R421-T425 PolarHBondContact O-OG1 2.93Å; V422-T425 PolarHBondContact O-N 3.33Å; T425-A483 HydrophobicContact CG2-CB 4.2Å
426	Q	86.8	Confident	87.9	Confident	96 Å²	96	54.1 Å²	54.1	45%	0.449	26%	0.258	S	S	.	.	S	Bend	trans	-60.8	145.8	175.2	66.3	-172.5	-26.9	0	0	112.2	V422 K423	V422-Q426 PolarHBondContact O-N 2.8Å; V422-Q426 VanDerWaalsContact O-N 3.12Å; K423-Q426 WeakPolarHBondContact O-CG 3.49Å; K423-Q426 PolarHBondContact O-NE2 3.03Å
427	F	89.5	Confident	88.7	Confident	42 Å²	42	51.9 Å²	51.9	18%	0.184	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-80.5	128.1	178.5	-70.7	-80.9	0	0	0	110.9	M432 M435 R480 L481 F484	F427-M432 HydrophobicContact CB-CE 3.89Å; F427-M432 HydrophobicContact CB-CG 4.36Å; F427-M435 HydrophobicContact CD1-CE 3.59Å; F427-M435 HydrophobicContact CD1-SD 4.32Å; F427-M435 HydrophobicContact CE1-CE 3.89Å; F427-M435 HydrophobicContact CE1-SD 4.01Å; F427-M435 HydrophobicContact CG-CE 4.21Å; F427-R480 HydrophobicContact CE1-CG 4.14Å; F427-R480 HydrophobicContact CZ-CG 4.27Å; F427-L481 HydrophobicContact CE2-CD1 4.16Å; F427-L481 HydrophobicContact CZ-CB 4.36Å; F427-L481 HydrophobicContact CZ-CD1 4.38Å; F427-F484 HydrophobicContact CE2-CB 4.28Å; F427-F484 HydrophobicContact CE2-CD1 4.31Å; F427-F484 HydrophobicContact CE2-CG 4.24Å
428	S	90	Very high	89.4	Confident	41 Å²	41	47.5 Å²	47.5	29%	0.287	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-80	161.7	171.7	69.2	0	0	0	0	111.6	T430 E431 M432	S428-T430 VanDerWaalsContact C-N 3.26Å; S428-T430 PolarHBondContact O-N 3.43Å; S428-T430 PolarHBondContact OG-OG1 2.9Å; S428-E431 PolarHBondContact N-OE2 2.84Å; S428-E431 PolarHBondContact O-N 3.4Å; S428-E431 WeakPolarHBondContact OG-CB 3.42Å; S428-E431 VanDerWaalsContact OG-CG 3.25Å; S428-E431 WeakPolarHBondContact OG-CG 3.38Å; S428-E431 PolarHBondContact OG-N 3.15Å; S428-E431 VanDerWaalsContact OG-N 3.16Å; S428-M432 WeakPolarHBondContact O-CG 3.45Å; S428-M432 PolarHBondContact O-N 2.97Å
429	W	90.5	Very high	89.9	Confident	217 Å²	217	50.7 Å²	50.7	82%	0.822	24%	0.241	S	C	*	.	H	α-helix	trans	-60.4	-36.3	174.5	-70.2	108	0	0	0	112.6	M432 L433	W429-M432 HydrophobicContact CE3-SD 4.49Å; W429-M432 PolarHBondContact O-N 2.66Å; W429-L433 WeakPolarHBondContact O-CG 3.43Å; W429-L433 PolarHBondContact O-N 2.87Å; W429-L433 VanDerWaalsContact O-N 3.08Å
430	T	91.3	Very high	90.2	Very high	38 Å²	38	50.7 Å²	50.7	23%	0.233	24%	0.241	C	C	.	.	H	α-helix	trans	-63.9	-44.3	175.5	50.8	0	0	0	0	111.3	V395 N396 S428 M432 L433 I434	V395-T430 HydrophobicContact CG1-CG2 4.36Å; N396-T430 PolarHBondContact OD1-OG1 3.26Å; S428-T430 VanDerWaalsContact C-N 3.26Å; S428-T430 PolarHBondContact O-N 3.43Å; S428-T430 PolarHBondContact OG-OG1 2.9Å; T430-M432 PolarHBondContact O-N 3.17Å; T430-L433 WeakPolarHBondContact O-CB 3.39Å; T430-L433 PolarHBondContact O-N 2.66Å; T430-I434 VanDerWaalsContact O-CG1 3.3Å; T430-I434 WeakPolarHBondContact O-CG1 3.35Å; T430-I434 PolarHBondContact O-N 2.84Å
431	E	90.4	Very high	90.5	Very high	19 Å²	19	49.9 Å²	49.9	9%	0.089	24%	0.238	C	C	.	.	H	α-helix	trans	-62.8	-40.2	175.8	-73.3	174.7	175.6	0	0	112	S428 L433 I434 M435 R480	S428-E431 PolarHBondContact N-OE2 2.84Å; S428-E431 PolarHBondContact O-N 3.4Å; S428-E431 WeakPolarHBondContact OG-CB 3.42Å; S428-E431 VanDerWaalsContact OG-CG 3.25Å; S428-E431 WeakPolarHBondContact OG-CG 3.38Å; S428-E431 PolarHBondContact OG-N 3.15Å; S428-E431 VanDerWaalsContact OG-N 3.16Å; E431-L433 VanDerWaalsContact C-N 3.32Å; E431-L433 PolarHBondContact O-N 3.21Å; E431-I434 PolarHBondContact O-N 3.27Å; E431-M435 WeakPolarHBondContact O-CG 3.49Å; E431-M435 PolarHBondContact O-N 3.45Å; E431-R480 VanDerWaalsContact CD-NH2 3.28Å; E431-R480 IonicContact OE1-CZ 3.12Å; E431-R480 IonicContact OE1-NE 3.19Å; E431-R480 IonicContact OE1-NH1 3.53Å; E431-R480 IonicContact OE1-NH2 3.29Å; E431-R480 PolarHBondContact OE1-NH2 2.73Å; E431-R480 IonicContact OE2-CZ 3.17Å; E431-R480 IonicContact OE2-NE 2.66Å; E431-R480 PolarHBondContact OE2-NE 3.38Å; E431-R480 IonicContact OE2-NH2 3.72Å; E431-R480 PolarHBondContact OE2-NH2 3.37Å
432	M	91.9	Very high	90.8	Very high	80 Å²	80	52 Å²	52	39%	0.394	25%	0.249	S	C	.	.	H	α-helix	trans	-63.1	-37	174.8	-68.8	-166.2	-173.9	0	0	113	F427 S428 W429 T430 M435 K436	F427-M432 HydrophobicContact CB-CE 3.89Å; F427-M432 HydrophobicContact CB-CG 4.36Å; S428-M432 WeakPolarHBondContact O-CG 3.45Å; S428-M432 PolarHBondContact O-N 2.97Å; W429-M432 HydrophobicContact CE3-SD 4.49Å; W429-M432 PolarHBondContact O-N 2.66Å; T430-M432 PolarHBondContact O-N 3.17Å; M432-M435 HydrophobicContact CB-CE 4.32Å; M432-M435 HydrophobicContact CG-CE 3.93Å; M432-K436 WeakPolarHBondContact O-CG 3.47Å; M432-K436 PolarHBondContact O-N 3.33Å; M432-K436 VanDerWaalsContact O-N 3.16Å
433	L	92.3	Very high	91	Very high	73 Å²	73	56.8 Å²	56.8	38%	0.382	27%	0.265	S	S	.	.	H	α-helix	trans	-65.4	-47.5	172.8	-70.1	172.2	0	0	0	110.8	L392 W429 T430 E431 M435 K436 W437	L392-L433 HydrophobicContact CD1-CB 4.5Å; W429-L433 WeakPolarHBondContact O-CG 3.43Å; W429-L433 PolarHBondContact O-N 2.87Å; W429-L433 VanDerWaalsContact O-N 3.08Å; T430-L433 WeakPolarHBondContact O-CB 3.39Å; T430-L433 PolarHBondContact O-N 2.66Å; E431-L433 VanDerWaalsContact C-N 3.32Å; E431-L433 PolarHBondContact O-N 3.21Å; L433-M435 VanDerWaalsContact C-N 3.29Å; L433-M435 PolarHBondContact O-N 3.05Å; L433-K436 WeakPolarHBondContact O-CB 3.22Å; L433-K436 PolarHBondContact O-N 3.12Å; L433-W437 HydrophobicContact CB-CE3 4.48Å; L433-W437 HydrophobicContact CB-CZ3 4.34Å; L433-W437 HydrophobicContact CD2-CZ3 4.47Å; L433-W437 PolarHBondContact O-N 3.46Å
434	I	94.4	Very high	91.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-56.5	-44.8	177.1	-66.1	161.4	0	0	0	110.5	F389 L392 L393 N396 T430 E431 K436 W437 V438 F477	F389-I434 HydrophobicContact CE2-CG2 4Å; L392-I434 HydrophobicContact CB-CG1 4.38Å; L393-I434 HydrophobicContact CD2-CD1 3.92Å; L393-I434 HydrophobicContact CD2-CG1 4.26Å; L393-I434 HydrophobicContact CD2-CG2 4.06Å; N396-I434 HydrophobicContact CB-CD1 3.94Å; T430-I434 VanDerWaalsContact O-CG1 3.3Å; T430-I434 WeakPolarHBondContact O-CG1 3.35Å; T430-I434 PolarHBondContact O-N 2.84Å; E431-I434 PolarHBondContact O-N 3.27Å; I434-K436 VanDerWaalsContact C-N 3.33Å; I434-K436 PolarHBondContact O-N 2.77Å; I434-W437 WeakPolarHBondContact O-CB 3.35Å; I434-W437 PolarHBondContact O-N 3.4Å; I434-W437 VanDerWaalsContact O-N 3.13Å; I434-V438 HydrophobicContact CG2-CG2 4.39Å; I434-V438 WeakPolarHBondContact O-CG2 3.5Å; I434-V438 PolarHBondContact O-N 2.93Å; I434-F477 HydrophobicContact CG2-CE2 4.39Å; I434-F477 HydrophobicContact CG2-CZ 3.77Å
435	M	93.3	Very high	91.4	Very high	47 Å²	47	53.6 Å²	53.6	23%	0.232	25%	0.25	C	C	.	.	H	α-helix	trans	-58.8	-41.6	176.2	-74.2	-172.1	-71.9	0	0	112.4	F427 E431 M432 L433 W437 V438 L439 F477	F427-M435 HydrophobicContact CD1-CE 3.59Å; F427-M435 HydrophobicContact CD1-SD 4.32Å; F427-M435 HydrophobicContact CE1-CE 3.89Å; F427-M435 HydrophobicContact CE1-SD 4.01Å; F427-M435 HydrophobicContact CG-CE 4.21Å; E431-M435 WeakPolarHBondContact O-CG 3.49Å; E431-M435 PolarHBondContact O-N 3.45Å; M432-M435 HydrophobicContact CB-CE 4.32Å; M432-M435 HydrophobicContact CG-CE 3.93Å; L433-M435 VanDerWaalsContact C-N 3.29Å; L433-M435 PolarHBondContact O-N 3.05Å; M435-W437 PolarHBondContact O-N 3.23Å; M435-V438 PolarHBondContact O-N 3.17Å; M435-L439 WeakPolarHBondContact O-CG 3.47Å; M435-L439 PolarHBondContact O-N 3.09Å; M435-F477 HydrophobicContact CG-CD1 3.77Å; M435-F477 HydrophobicContact CG-CD2 4.09Å; M435-F477 HydrophobicContact CG-CE1 3.71Å; M435-F477 HydrophobicContact CG-CE2 4.03Å; M435-F477 HydrophobicContact CG-CG 3.99Å; M435-F477 HydrophobicContact CG-CZ 3.85Å; M435-F477 HydrophobicContact SD-CD1 4Å; M435-F477 HydrophobicContact SD-CE1 4.41Å; M435-F477 HydrophobicContact SD-CG 4.3Å
436	K	92.5	Very high	91.6	Very high	121 Å²	121	56.6 Å²	56.6	53%	0.526	27%	0.27	S	S	.	.	H	α-helix	trans	-63.1	-39.7	174.7	-72.5	176.6	-177.9	178.5	0	112.3	M432 L433 I434 G440 P699	M432-K436 WeakPolarHBondContact O-CG 3.47Å; M432-K436 PolarHBondContact O-N 3.33Å; M432-K436 VanDerWaalsContact O-N 3.16Å; L433-K436 WeakPolarHBondContact O-CB 3.22Å; L433-K436 PolarHBondContact O-N 3.12Å; I434-K436 VanDerWaalsContact C-N 3.33Å; I434-K436 PolarHBondContact O-N 2.77Å; K436-G440 PolarHBondContact O-N 3.36Å; K436-P699 HydrophobicContact CB-CB 4.49Å
437	W	94.9	Very high	91.5	Very high	29 Å²	29	57 Å²	57	11%	0.11	27%	0.27	C	S	.	.	H	α-helix	trans	-64.2	-46.2	175	-107.5	-90.1	0	0	0	112	S385 F389 L392 L433 I434 M435 L439 G440 M441 P699	S385-W437 PolarHBondContact O-NE1 3Å; S385-W437 PolarHBondContact OG-NE1 3.37Å; F389-W437 HydrophobicContact CB-CG 4.31Å; F389-W437 HydrophobicContact CD2-CB 3.64Å; F389-W437 AromaticContact CD2-CD1 3.96Å; F389-W437 AromaticContact CD2-CG 3.85Å; F389-W437 HydrophobicContact CD2-CG 3.85Å; F389-W437 HydrophobicContact CE2-CB 4.08Å; F389-W437 HydrophobicContact CG-CG 4.49Å; L392-W437 HydrophobicContact CD1-CD2 4.29Å; L392-W437 HydrophobicContact CD1-CE3 3.8Å; L392-W437 HydrophobicContact CD1-CH2 3.75Å; L392-W437 HydrophobicContact CD1-CZ2 4.23Å; L392-W437 HydrophobicContact CD1-CZ3 3.51Å; L433-W437 HydrophobicContact CB-CE3 4.48Å; L433-W437 HydrophobicContact CB-CZ3 4.34Å; L433-W437 HydrophobicContact CD2-CZ3 4.47Å; L433-W437 PolarHBondContact O-N 3.46Å; I434-W437 WeakPolarHBondContact O-CB 3.35Å; I434-W437 PolarHBondContact O-N 3.4Å; I434-W437 VanDerWaalsContact O-N 3.13Å; M435-W437 PolarHBondContact O-N 3.23Å; W437-L439 VanDerWaalsContact C-N 3.35Å; W437-L439 PolarHBondContact O-N 3.49Å; W437-G440 WeakPolarHBondContact O-CA 3.41Å; W437-G440 PolarHBondContact O-N 2.88Å; W437-G440 VanDerWaalsContact O-N 3.12Å; W437-M441 WeakPolarHBondContact O-CG 3.39Å; W437-M441 PolarHBondContact O-N 3.32Å; W437-P699 HydrophobicContact CD2-CB 4.25Å; W437-P699 HydrophobicContact CD2-CG 3.95Å; W437-P699 VanDerWaalsContact CE2-CD 3.49Å; W437-P699 HydrophobicContact CE3-CB 4.34Å; W437-P699 HydrophobicContact CE3-CG 3.92Å; W437-P699 HydrophobicContact CG-CB 4.49Å; W437-P699 HydrophobicContact CH2-CG 4.1Å; W437-P699 HydrophobicContact CZ2-CG 4.12Å; W437-P699 HydrophobicContact CZ3-CG 3.99Å
438	V	95.4	Very high	91.3	Very high	3 Å²	3	56.1 Å²	56.1	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-43.6	178.3	171.2	0	0	0	0	110.9	F389 I434 M435 G440 M441 I442 L470 F473 F477	F389-V438 HydrophobicContact CE2-CG2 4.18Å; F389-V438 HydrophobicContact CZ-CG2 4.39Å; I434-V438 HydrophobicContact CG2-CG2 4.39Å; I434-V438 WeakPolarHBondContact O-CG2 3.5Å; I434-V438 PolarHBondContact O-N 2.93Å; M435-V438 PolarHBondContact O-N 3.17Å; V438-G440 VanDerWaalsContact C-N 3.32Å; V438-G440 PolarHBondContact O-N 3.23Å; V438-M441 HydrophobicContact CG2-CE 4.1Å; V438-M441 PolarHBondContact O-N 3.34Å; V438-I442 HydrophobicContact CG1-CD1 3.84Å; V438-I442 HydrophobicContact CG1-CG1 4.43Å; V438-I442 VanDerWaalsContact O-CG1 3.28Å; V438-I442 WeakPolarHBondContact O-CG1 3.34Å; V438-I442 PolarHBondContact O-N 3.46Å; V438-L470 HydrophobicContact CG1-CD2 4.35Å; V438-F473 HydrophobicContact CG1-CB 4.02Å; V438-F473 HydrophobicContact CG2-CB 4.28Å; V438-F473 HydrophobicContact CG2-CD1 4.39Å; V438-F473 HydrophobicContact CG2-CD2 4.39Å; V438-F473 HydrophobicContact CG2-CG 4.12Å; V438-F477 HydrophobicContact CG2-CE2 4.18Å
439	L	93	Very high	91.3	Very high	100 Å²	100	56.7 Å²	56.7	52%	0.524	27%	0.266	S	S	.	.	H	α-helix	trans	-59.8	-41.3	173.2	-73.2	171	0	0	0	112.5	M435 W437 I442 W443 L702	M435-L439 WeakPolarHBondContact O-CG 3.47Å; M435-L439 PolarHBondContact O-N 3.09Å; W437-L439 VanDerWaalsContact C-N 3.35Å; W437-L439 PolarHBondContact O-N 3.49Å; L439-I442 PolarHBondContact O-N 3.36Å; L439-W443 WeakPolarHBondContact O-CB 3.13Å; L439-W443 PolarHBondContact O-N 3.49Å; L439-L702 HydrophobicContact CB-CD1 4.12Å
440	G	92.3	Very high	91.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-43.4	174.3	0	0	0	0	0	112.5	K436 W437 V438 W443 S444 N701	K436-G440 PolarHBondContact O-N 3.36Å; W437-G440 WeakPolarHBondContact O-CA 3.41Å; W437-G440 PolarHBondContact O-N 2.88Å; W437-G440 VanDerWaalsContact O-N 3.12Å; V438-G440 VanDerWaalsContact C-N 3.32Å; V438-G440 PolarHBondContact O-N 3.23Å; G440-W443 PolarHBondContact O-N 3.35Å; G440-S444 PolarHBondContact O-N 3.35Å; G440-S444 VanDerWaalsContact O-N 3.09Å; G440-N701 VanDerWaalsContact CA-OD1 3.23Å; G440-N701 WeakPolarHBondContact CA-OD1 3.37Å; G440-N701 PolarHBondContact O-ND2 3.06Å
441	M	92.7	Very high	90.7	Very high	11 Å²	11	58.2 Å²	58.2	5%	0.054	28%	0.28	C	S	.	.	H	α-helix	trans	-64.9	-44.9	176.5	-69.8	-171.8	-73.9	0	0	111.7	F389 W437 V438 W443 S444 E445 L470 R545 A698	F389-M441 HydrophobicContact CD1-CE 4.3Å; F389-M441 HydrophobicContact CD2-CE 4.2Å; F389-M441 HydrophobicContact CE1-CE 3.94Å; F389-M441 HydrophobicContact CE2-CE 3.8Å; F389-M441 HydrophobicContact CG-CE 4.42Å; F389-M441 HydrophobicContact CZ-CE 3.67Å; W437-M441 WeakPolarHBondContact O-CG 3.39Å; W437-M441 PolarHBondContact O-N 3.32Å; V438-M441 HydrophobicContact CG2-CE 4.1Å; V438-M441 PolarHBondContact O-N 3.34Å; M441-W443 VanDerWaalsContact C-N 3.29Å; M441-W443 PolarHBondContact O-N 3.49Å; M441-S444 WeakPolarHBondContact O-CA 3.24Å; M441-S444 WeakPolarHBondContact O-CB 3.35Å; M441-S444 PolarHBondContact O-N 3.46Å; M441-E445 PolarHBondContact O-N 3.15Å; M441-L470 HydrophobicContact CB-CD1 4.23Å; M441-L470 HydrophobicContact CB-CD2 3.69Å; M441-L470 HydrophobicContact CE-CD2 4.1Å; M441-L470 HydrophobicContact SD-CD2 4.44Å; M441-R545 PolarHBondContact SD-NH1 3.31Å; M441-A698 HydrophobicContact CG-CB 4.14Å
442	I	93.3	Very high	90.2	Very high	48 Å²	48	61.4 Å²	61.4	25%	0.246	30%	0.297	C	S	.	.	H	α-helix	trans	-56.4	-45	174.9	-68.4	164.2	0	0	0	110.8	V438 L439 S444 E445 C446 L470 V474	V438-I442 HydrophobicContact CG1-CD1 3.84Å; V438-I442 HydrophobicContact CG1-CG1 4.43Å; V438-I442 VanDerWaalsContact O-CG1 3.28Å; V438-I442 WeakPolarHBondContact O-CG1 3.34Å; V438-I442 PolarHBondContact O-N 3.46Å; L439-I442 PolarHBondContact O-N 3.36Å; I442-S444 VanDerWaalsContact C-N 3.26Å; I442-S444 PolarHBondContact O-N 3.47Å; I442-E445 PolarHBondContact O-N 3.36Å; I442-C446 WeakPolarHBondContact O-CB 3.46Å; I442-C446 PolarHBondContact O-N 2.9Å; I442-C446 PolarHBondContact O-SG 2.91Å; I442-L470 HydrophobicContact CG1-CB 4.23Å; I442-L470 HydrophobicContact CG1-CD1 4.25Å; I442-L470 HydrophobicContact CG1-CD2 4.38Å; I442-V474 HydrophobicContact CD1-CG2 3.44Å; I442-V474 VanDerWaalsContact CD1-CG2 3.44Å
443	W	90.8	Very high	89.9	Confident	125 Å²	125	58.7 Å²	58.7	47%	0.473	29%	0.29	S	S	.	.	H	α-helix	trans	-62.9	-33.4	177.6	-175.7	-124.9	0	0	0	113.2	L439 G440 M441 K447 L702	L439-W443 WeakPolarHBondContact O-CB 3.13Å; L439-W443 PolarHBondContact O-N 3.49Å; G440-W443 PolarHBondContact O-N 3.35Å; M441-W443 VanDerWaalsContact C-N 3.29Å; M441-W443 PolarHBondContact O-N 3.49Å; W443-K447 VanDerWaalsContact CE2-CE 3.42Å; W443-K447 VanDerWaalsContact NE1-NZ 3.12Å; W443-K447 WeakPolarHBondContact O-CG 3.29Å; W443-K447 PolarHBondContact O-N 2.86Å; W443-L702 HydrophobicContact CB-CD2 4.06Å; W443-L702 HydrophobicContact CG-CD2 4.37Å
444	S	88.6	Confident	89.7	Confident	24 Å²	24	59.6 Å²	59.6	17%	0.168	30%	0.3	C	S	.	.	H	α-helix	trans	-67.6	-48.2	174	-166.6	0	0	0	0	111.6	G440 M441 I442 C446 K447 E448	G440-S444 PolarHBondContact O-N 3.35Å; G440-S444 VanDerWaalsContact O-N 3.09Å; M441-S444 WeakPolarHBondContact O-CA 3.24Å; M441-S444 WeakPolarHBondContact O-CB 3.35Å; M441-S444 PolarHBondContact O-N 3.46Å; I442-S444 VanDerWaalsContact C-N 3.26Å; I442-S444 PolarHBondContact O-N 3.47Å; S444-C446 PolarHBondContact O-N 3.23Å; S444-K447 WeakPolarHBondContact O-CB 2.97Å; S444-K447 PolarHBondContact O-N 3.36Å; S444-K447 VanDerWaalsContact O-N 3.14Å; S444-E448 PolarHBondContact O-N 3.01Å; S444-E448 VanDerWaalsContact O-N 3.09Å
445	E	90.5	Very high	89.4	Confident	12 Å²	12	69.2 Å²	69.2	6%	0.056	34%	0.337	C	S	.	.	H	α-helix	trans	-63.5	-40.1	178.8	-61.4	-49.3	146.3	0	0	111.8	M441 I442 K447 E448 I449 Y457 L470 R545	M441-E445 PolarHBondContact O-N 3.15Å; I442-E445 PolarHBondContact O-N 3.36Å; E445-K447 PolarHBondContact O-N 3.35Å; E445-E448 WeakPolarHBondContact O-CB 3.4Å; E445-E448 PolarHBondContact O-N 3.14Å; E445-E448 VanDerWaalsContact O-N 3.11Å; E445-I449 WeakPolarHBondContact O-CG1 3.39Å; E445-I449 PolarHBondContact O-N 3.45Å; E445-Y457 PolarHBondContact OE2-OH 2.86Å; E445-L470 HydrophobicContact CB-CD1 4.39Å; E445-L470 HydrophobicContact CG-CD1 3.44Å; E445-L470 VanDerWaalsContact CG-CD1 3.44Å; E445-R545 IonicContact OE1-NH2 3.54Å; E445-R545 PolarHBondContact OE1-NH2 3.4Å
446	C	89.5	Confident	89	Confident	63 Å²	63	71.9 Å²	71.9	43%	0.426	35%	0.348	S	S	.	.	H	α-helix	trans	-59.4	-36.2	174.8	-70.6	0	0	0	0	112.5	I442 S444 W450	I442-C446 WeakPolarHBondContact O-CB 3.46Å; I442-C446 PolarHBondContact O-N 2.9Å; I442-C446 PolarHBondContact O-SG 2.91Å; S444-C446 PolarHBondContact O-N 3.23Å; C446-W450 WeakPolarHBondContact O-CB 3.21Å; C446-W450 PolarHBondContact O-N 3.31Å
447	K	85	Confident	88.8	Confident	103 Å²	103	66.6 Å²	66.6	45%	0.448	33%	0.325	S	S	.	.	H	α-helix	trans	-69.9	-38.2	175.6	-75.3	175.9	177	173.3	0	112	W443 S444 E445 W450 S451	W443-K447 VanDerWaalsContact CE2-CE 3.42Å; W443-K447 VanDerWaalsContact NE1-NZ 3.12Å; W443-K447 WeakPolarHBondContact O-CG 3.29Å; W443-K447 PolarHBondContact O-N 2.86Å; S444-K447 WeakPolarHBondContact O-CB 2.97Å; S444-K447 PolarHBondContact O-N 3.36Å; S444-K447 VanDerWaalsContact O-N 3.14Å; E445-K447 PolarHBondContact O-N 3.35Å; K447-W450 PolarHBondContact O-N 3.33Å; K447-S451 PolarHBondContact O-N 3.42Å; K447-S451 PolarHBondContact O-OG 3.22Å
448	E	85.4	Confident	88.6	Confident	25 Å²	25	70.4 Å²	70.4	12%	0.117	35%	0.347	C	S	.	.	H	α-helix	trans	-63.9	-47.9	176.3	-167	159.3	147.3	0	0	111.9	S444 E445 W450 S451 D452 Y457 N463 R694	S444-E448 PolarHBondContact O-N 3.01Å; S444-E448 VanDerWaalsContact O-N 3.09Å; E445-E448 WeakPolarHBondContact O-CB 3.4Å; E445-E448 PolarHBondContact O-N 3.14Å; E445-E448 VanDerWaalsContact O-N 3.11Å; E448-W450 PolarHBondContact O-N 2.89Å; E448-S451 PolarHBondContact O-N 3.49Å; E448-S451 VanDerWaalsContact O-N 3.13Å; E448-S451 PolarHBondContact O-OG 3.34Å; E448-D452 PolarHBondContact O-N 3.05Å; E448-Y457 HydrophobicContact CB-CE2 4.35Å; E448-Y457 HydrophobicContact CG-CD2 4.14Å; E448-Y457 HydrophobicContact CG-CE2 4.17Å; E448-N463 PolarHBondContact OE1-ND2 2.63Å; E448-R694 VanDerWaalsContact CD-NH2 3.34Å; E448-R694 VanDerWaalsContact CG-NH2 3.26Å; E448-R694 IonicContact OE2-CZ 2.73Å; E448-R694 IonicContact OE2-NH1 3.19Å; E448-R694 PolarHBondContact OE2-NH1 3.12Å; E448-R694 IonicContact OE2-NH2 2.83Å; E448-R694 PolarHBondContact OE2-NH2 3.02Å
449	I	89.3	Confident	88	Confident	53 Å²	53	76.4 Å²	76.4	27%	0.272	38%	0.376	S	S	.	.	H	α-helix	trans	-60.1	-35.3	177.1	-64.8	165.6	0	0	0	110.7	E445 G453 Y457	E445-I449 WeakPolarHBondContact O-CG1 3.39Å; E445-I449 PolarHBondContact O-N 3.45Å; I449-G453 VanDerWaalsContact O-CA 3.28Å; I449-G453 WeakPolarHBondContact O-CA 3.45Å; I449-G453 PolarHBondContact O-N 3.39Å; I449-Y457 HydrophobicContact CD1-CE1 4.23Å; I449-Y457 HydrophobicContact CD1-CE2 4.29Å; I449-Y457 HydrophobicContact CG1-CD1 4.06Å; I449-Y457 HydrophobicContact CG1-CD2 3.57Å; I449-Y457 HydrophobicContact CG1-CE1 4.11Å; I449-Y457 HydrophobicContact CG1-CE2 3.59Å; I449-Y457 HydrophobicContact CG1-CG 3.81Å
450	W	87.1	Confident	87.6	Confident	206 Å²	206	74.6 Å²	74.6	78%	0.78	37%	0.365	S	S	*	.	H	α-helix	trans	-71.8	-37.2	177.1	-162.2	-68.2	0	0	0	113	C446 K447 E448	C446-W450 WeakPolarHBondContact O-CB 3.21Å; C446-W450 PolarHBondContact O-N 3.31Å; K447-W450 PolarHBondContact O-N 3.33Å; E448-W450 PolarHBondContact O-N 2.89Å
451	S	81.6	Confident	87.3	Confident	81 Å²	81	80.7 Å²	80.7	57%	0.566	40%	0.397	S	S	*	.	H	α-helix	trans	-74.9	-45	180	58.9	0	0	0	0	112.4	K447 E448	K447-S451 PolarHBondContact O-N 3.42Å; K447-S451 PolarHBondContact O-OG 3.22Å; E448-S451 PolarHBondContact O-N 3.49Å; E448-S451 VanDerWaalsContact O-N 3.13Å; E448-S451 PolarHBondContact O-OG 3.34Å
452	D	80.5	Confident	87	Confident	85 Å²	85	85.5 Å²	85.5	46%	0.455	41%	0.414	S	S	.	.	H	α-helix	trans	-93.2	-23.9	-168.1	-61.4	3.9	0	0	0	111.4	E448	E448-D452 PolarHBondContact O-N 3.05Å
453	G	86.3	Confident	86.9	Confident	23 Å²	23	83.8 Å²	83.8	24%	0.237	41%	0.406	C	S	.	.			trans	83.6	157.2	-173.1	0	0	0	0	0	112.6	I449 R455 E456 Y457	I449-G453 VanDerWaalsContact O-CA 3.28Å; I449-G453 WeakPolarHBondContact O-CA 3.45Å; I449-G453 PolarHBondContact O-N 3.39Å; G453-R455 VanDerWaalsContact C-N 3.33Å; G453-R455 PolarHBondContact O-N 2.93Å; G453-E456 PolarHBondContact O-N 2.76Å; G453-Y457 WeakPolarHBondContact O-CB 3.29Å; G453-Y457 PolarHBondContact O-N 3.17Å
454	P	88.3	Confident	86.9	Confident	92 Å²	92	80.9 Å²	80.9	60%	0.597	40%	0.402	S	S	*	.	H	α-helix	trans	-67.3	-31.7	-171.1	25.4	-34.6	0	0	0	113.4	I458	P454-I458 VanDerWaalsContact O-CG1 3.32Å; P454-I458 WeakPolarHBondContact O-CG1 3.33Å; P454-I458 PolarHBondContact O-N 2.94Å
455	R	87.9	Confident	86.9	Confident	203 Å²	203	82.2 Å²	82.2	77%	0.766	41%	0.407	S	S	*	.	H	α-helix	trans	-67	-47.3	-178.5	-176.1	-179.6	179.2	-174.5	0.4	111.6	G453 M459	G453-R455 VanDerWaalsContact C-N 3.33Å; G453-R455 PolarHBondContact O-N 2.93Å; R455-M459 VanDerWaalsContact O-CG 3.3Å; R455-M459 WeakPolarHBondContact O-CG 3.49Å; R455-M459 PolarHBondContact O-N 3.39Å
456	E	85.1	Confident	87	Confident	102 Å²	102	81.8 Å²	81.8	48%	0.477	41%	0.405	S	S	.	.	H	α-helix	trans	-69.6	-39.5	-178.8	-161.3	65.2	-169.2	0	0	110.6	G453 I458 M459	G453-E456 PolarHBondContact O-N 2.76Å; E456-I458 PolarHBondContact O-N 3.3Å; E456-M459 PolarHBondContact O-N 3.11Å
457	Y	88.3	Confident	87.2	Confident	10 Å²	10	84.6 Å²	84.6	4%	0.039	41%	0.41	C	S	.	.	H	α-helix	trans	-57.9	-46.6	177.7	-173.6	-87	0	0	0	112.7	E445 E448 I449 G453 M459 H460 N463 F467	E445-Y457 PolarHBondContact OE2-OH 2.86Å; E448-Y457 HydrophobicContact CB-CE2 4.35Å; E448-Y457 HydrophobicContact CG-CD2 4.14Å; E448-Y457 HydrophobicContact CG-CE2 4.17Å; I449-Y457 HydrophobicContact CD1-CE1 4.23Å; I449-Y457 HydrophobicContact CD1-CE2 4.29Å; I449-Y457 HydrophobicContact CG1-CD1 4.06Å; I449-Y457 HydrophobicContact CG1-CD2 3.57Å; I449-Y457 HydrophobicContact CG1-CE1 4.11Å; I449-Y457 HydrophobicContact CG1-CE2 3.59Å; I449-Y457 HydrophobicContact CG1-CG 3.81Å; G453-Y457 WeakPolarHBondContact O-CB 3.29Å; G453-Y457 PolarHBondContact O-N 3.17Å; Y457-M459 VanDerWaalsContact C-N 3.3Å; Y457-M459 PolarHBondContact O-N 3.37Å; Y457-H460 PolarHBondContact O-N 2.98Å; Y457-N463 HydrophobicContact CD1-CB 4.11Å; Y457-N463 HydrophobicContact CD2-CB 4.1Å; Y457-N463 WeakPolarHBondContact CD2-ND2 3.49Å; Y457-N463 HydrophobicContact CE1-CB 3.77Å; Y457-N463 WeakPolarHBondContact CE1-O 3.25Å; Y457-N463 HydrophobicContact CE2-CB 3.79Å; Y457-N463 HydrophobicContact CG-CB 4.26Å; Y457-N463 WeakPolarHBondContact O-CB 3.48Å; Y457-N463 PolarHBondContact OH-O 2.82Å; Y457-F467 HydrophobicContact CE1-CB 4.41Å
458	I	89.7	Confident	87.6	Confident	109 Å²	109	80.8 Å²	80.8	56%	0.559	40%	0.4	S	S	*	.	H	α-helix	trans	-70.7	-25.2	-177.7	-67.2	168.9	0	0	0	112.3	P454 E456 H460 V464	P454-I458 VanDerWaalsContact O-CG1 3.32Å; P454-I458 WeakPolarHBondContact O-CG1 3.33Å; P454-I458 PolarHBondContact O-N 2.94Å; E456-I458 PolarHBondContact O-N 3.3Å; I458-H460 PolarHBondContact O-N 3.26Å; I458-V464 HydrophobicContact CG2-CG2 4.39Å
459	M	83.8	Confident	88	Confident	129 Å²	129	79.6 Å²	79.6	64%	0.635	39%	0.394	S	S	*	.	H	α-helix	trans	-67.4	-18.7	177.5	-70.5	-70.4	154.7	0	0	112.6	R455 E456 Y457	R455-M459 VanDerWaalsContact O-CG 3.3Å; R455-M459 WeakPolarHBondContact O-CG 3.49Å; R455-M459 PolarHBondContact O-N 3.39Å; E456-M459 PolarHBondContact O-N 3.11Å; Y457-M459 VanDerWaalsContact C-N 3.3Å; Y457-M459 PolarHBondContact O-N 3.37Å
460	H	83.9	Confident	88.3	Confident	62 Å²	62	77.4 Å²	77.4	29%	0.287	38%	0.383	S	S	.	.	S	Bend	trans	-93.6	107.5	173.2	-67.5	-22.9	0	0	0	110.8	Y457 I458 W462 N463 V464 K684	Y457-H460 PolarHBondContact O-N 2.98Å; I458-H460 PolarHBondContact O-N 3.26Å; H460-W462 PolarHBondContact O-N 3.42Å; H460-W462 VanDerWaalsContact O-N 3.13Å; H460-N463 HydrophobicContact CB-CB 4.15Å; H460-N463 WeakPolarHBondContact O-CB 3.31Å; H460-N463 PolarHBondContact O-N 3.27Å; H460-V464 PolarHBondContact O-N 3.34Å; H460-K684 PolarHBondContact CE1-NZ 2.82Å; H460-K684 PolarHBondContact NE2-NZ 3.28Å
461	L	85.1	Confident	88.7	Confident	129 Å²	129	70.2 Å²	70.2	68%	0.675	36%	0.364	S	S	*	.	H	α-helix	trans	-54.8	-34	-179	-71.2	170.8	0	0	0	113.3	V464 L465	L461-V464 PolarHBondContact O-N 2.96Å; L461-L465 PolarHBondContact O-N 3.5Å
462	W	87.4	Confident	89.5	Confident	111 Å²	111	68.2 Å²	68.2	42%	0.42	35%	0.346	S	S	.	.	H	α-helix	trans	-67.2	-39.6	178.5	-66	111.3	0	0	0	112.4	H460 V464 L465 D466 A547 Y548	H460-W462 PolarHBondContact O-N 3.42Å; H460-W462 VanDerWaalsContact O-N 3.13Å; W462-V464 VanDerWaalsContact C-N 3.26Å; W462-V464 PolarHBondContact O-N 3.41Å; W462-L465 HydrophobicContact CE3-CD1 4.42Å; W462-L465 HydrophobicContact CZ3-CD1 4.4Å; W462-L465 WeakPolarHBondContact O-CB 3.31Å; W462-L465 PolarHBondContact O-N 2.98Å; W462-L465 VanDerWaalsContact O-N 3.11Å; W462-D466 PolarHBondContact O-N 2.93Å; W462-A547 HydrophobicContact CH2-CB 3.59Å; W462-A547 HydrophobicContact CZ2-CB 4.38Å; W462-A547 HydrophobicContact CZ3-CB 3.88Å; W462-Y548 HydrophobicContact CB-CE1 3.62Å; W462-Y548 HydrophobicContact CB-CE2 4.14Å; W462-Y548 WeakPolarHBondContact CB-OH 3.39Å; W462-Y548 HydrophobicContact CE3-CE2 4.17Å; W462-Y548 HydrophobicContact CG-CE1 4.2Å; W462-Y548 PolarHBondContact O-OH 3.4Å
463	N	90.3	Very high	90.2	Very high	13 Å²	13	64.1 Å²	64.1	7%	0.07	33%	0.325	C	S	.	.	H	α-helix	trans	-64.4	-33.7	176.2	-71.2	25.8	0	0	0	111.5	E448 Y457 H460 F467 Y548	E448-N463 PolarHBondContact OE1-ND2 2.63Å; Y457-N463 HydrophobicContact CD1-CB 4.11Å; Y457-N463 HydrophobicContact CD2-CB 4.1Å; Y457-N463 WeakPolarHBondContact CD2-ND2 3.49Å; Y457-N463 HydrophobicContact CE1-CB 3.77Å; Y457-N463 WeakPolarHBondContact CE1-O 3.25Å; Y457-N463 HydrophobicContact CE2-CB 3.79Å; Y457-N463 HydrophobicContact CG-CB 4.26Å; Y457-N463 WeakPolarHBondContact O-CB 3.48Å; Y457-N463 PolarHBondContact OH-O 2.82Å; H460-N463 HydrophobicContact CB-CB 4.15Å; H460-N463 WeakPolarHBondContact O-CB 3.31Å; H460-N463 PolarHBondContact O-N 3.27Å; N463-F467 WeakPolarHBondContact O-CB 3.25Å; N463-F467 PolarHBondContact O-N 3.47Å; N463-Y548 PolarHBondContact N-OH 3.15Å
464	V	90.4	Very high	90.7	Very high	64 Å²	64	66 Å²	66	39%	0.388	33%	0.331	S	S	.	.	H	α-helix	trans	-68.2	-40.4	172.8	179	0	0	0	0	111.3	I458 H460 L461 W462 F467 G468	I458-V464 HydrophobicContact CG2-CG2 4.39Å; H460-V464 PolarHBondContact O-N 3.34Å; L461-V464 PolarHBondContact O-N 2.96Å; W462-V464 VanDerWaalsContact C-N 3.26Å; W462-V464 PolarHBondContact O-N 3.41Å; V464-F467 PolarHBondContact O-N 3.2Å; V464-G468 PolarHBondContact O-N 3.46Å
465	L	90.6	Very high	91.1	Very high	52 Å²	52	63.5 Å²	63.5	27%	0.272	32%	0.318	S	S	.	.	H	α-helix	trans	-62.1	-45.1	175	-171.1	160.1	0	0	0	111.1	L461 W462 G468 M469	L461-L465 PolarHBondContact O-N 3.5Å; W462-L465 HydrophobicContact CE3-CD1 4.42Å; W462-L465 HydrophobicContact CZ3-CD1 4.4Å; W462-L465 WeakPolarHBondContact O-CB 3.31Å; W462-L465 PolarHBondContact O-N 2.98Å; W462-L465 VanDerWaalsContact O-N 3.11Å; L465-G468 PolarHBondContact O-N 3.27Å; L465-M469 WeakPolarHBondContact O-CB 3.38Å; L465-M469 PolarHBondContact O-N 3.3Å
466	D	91	Very high	91.5	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-43.9	178.3	-79.8	-11.6	0	0	0	112	W462 G468 M469 L470 R545 Y548	W462-D466 PolarHBondContact O-N 2.93Å; D466-G468 VanDerWaalsContact C-N 3.33Å; D466-G468 PolarHBondContact O-N 3.09Å; D466-M469 PolarHBondContact O-N 3.34Å; D466-L470 VanDerWaalsContact O-CG 3.31Å; D466-L470 WeakPolarHBondContact O-CG 3.4Å; D466-L470 PolarHBondContact O-N 2.89Å; D466-R545 VanDerWaalsContact CG-NE 3.35Å; D466-R545 WeakPolarHBondContact OD1-CD 3.25Å; D466-R545 IonicContact OD1-CZ 3.1Å; D466-R545 IonicContact OD1-NE 2.84Å; D466-R545 PolarHBondContact OD1-NE 2.99Å; D466-R545 VanDerWaalsContact OD1-NE 3.15Å; D466-R545 IonicContact OD2-CZ 3.62Å; D466-R545 IonicContact OD2-NE 2.99Å; D466-R545 PolarHBondContact OD2-NE 2.87Å; D466-R545 IonicContact OD2-NH2 3.58Å; D466-R545 PolarHBondContact OD2-NH2 2.95Å; D466-Y548 VanDerWaalsContact OD2-CE2 3.26Å; D466-Y548 WeakPolarHBondContact OD2-CE2 3.31Å; D466-Y548 VanDerWaalsContact OD2-CZ 3.29Å; D466-Y548 PolarHBondContact OD2-OH 3.15Å
467	F	93.7	Very high	92	Very high	122 Å²	122	50 Å²	50	54%	0.535	26%	0.264	S	S	.	.	H	α-helix	trans	-60.3	-43.7	173.4	-179.7	-97	0	0	0	111.7	Y457 N463 V464 L470 S471	Y457-F467 HydrophobicContact CE1-CB 4.41Å; N463-F467 WeakPolarHBondContact O-CB 3.25Å; N463-F467 PolarHBondContact O-N 3.47Å; V464-F467 PolarHBondContact O-N 3.2Å; F467-L470 PolarHBondContact O-N 3.46Å; F467-S471 WeakPolarHBondContact O-CB 3.48Å; F467-S471 PolarHBondContact O-N 3.42Å; F467-S471 PolarHBondContact O-OG 3.33Å
468	G	93.7	Very high	92.3	Very high	22 Å²	22	53 Å²	53	23%	0.227	28%	0.283	C	S	.	.	H	α-helix	trans	-59.1	-51.5	175.2	0	0	0	0	0	112.2	V464 L465 D466 L470 S471 I472	V464-G468 PolarHBondContact O-N 3.46Å; L465-G468 PolarHBondContact O-N 3.27Å; D466-G468 VanDerWaalsContact C-N 3.33Å; D466-G468 PolarHBondContact O-N 3.09Å; G468-L470 PolarHBondContact O-N 2.76Å; G468-S471 PolarHBondContact O-N 3.09Å; G468-S471 PolarHBondContact O-OG 3.23Å; G468-I472 VanDerWaalsContact O-CG1 3.31Å; G468-I472 WeakPolarHBondContact O-CG1 3.5Å; G468-I472 PolarHBondContact O-N 2.75Å
469	M	95.1	Very high	92.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-56.8	-48.1	177.9	174.8	-89.3	-66.3	0	0	112	L465 D466 S471 I472 F473 L541	L465-M469 WeakPolarHBondContact O-CB 3.38Å; L465-M469 PolarHBondContact O-N 3.3Å; D466-M469 PolarHBondContact O-N 3.34Å; M469-S471 PolarHBondContact O-N 3.36Å; M469-I472 PolarHBondContact O-N 3.18Å; M469-F473 HydrophobicContact CG-CD2 4.14Å; M469-F473 HydrophobicContact CG-CE2 3.99Å; M469-F473 WeakPolarHBondContact O-CD2 3.32Å; M469-F473 PolarHBondContact O-N 3.31Å; M469-F473 HydrophobicContact SD-CD2 3.51Å; M469-F473 VanDerWaalsContact SD-CD2 3.51Å; M469-F473 HydrophobicContact SD-CE2 3.5Å; M469-F473 WeakPolarHBondContact SD-CE2 3.36Å; M469-L541 HydrophobicContact CB-CB 4.02Å; M469-L541 HydrophobicContact CB-CD1 4.48Å; M469-L541 HydrophobicContact CG-CB 3.94Å
470	L	95.1	Very high	93	Very high	8 Å²	8	44.1 Å²	44.1	4%	0.042	24%	0.239	C	C	.	.	H	α-helix	trans	-66.4	-38.9	179.1	-66.9	172.7	0	0	0	112.1	V438 M441 I442 E445 D466 F467 G468 I472 F473 V474	V438-L470 HydrophobicContact CG1-CD2 4.35Å; M441-L470 HydrophobicContact CB-CD1 4.23Å; M441-L470 HydrophobicContact CB-CD2 3.69Å; M441-L470 HydrophobicContact CE-CD2 4.1Å; M441-L470 HydrophobicContact SD-CD2 4.44Å; I442-L470 HydrophobicContact CG1-CB 4.23Å; I442-L470 HydrophobicContact CG1-CD1 4.25Å; I442-L470 HydrophobicContact CG1-CD2 4.38Å; E445-L470 HydrophobicContact CB-CD1 4.39Å; E445-L470 HydrophobicContact CG-CD1 3.44Å; E445-L470 VanDerWaalsContact CG-CD1 3.44Å; D466-L470 VanDerWaalsContact O-CG 3.31Å; D466-L470 WeakPolarHBondContact O-CG 3.4Å; D466-L470 PolarHBondContact O-N 2.89Å; F467-L470 PolarHBondContact O-N 3.46Å; G468-L470 PolarHBondContact O-N 2.76Å; L470-I472 VanDerWaalsContact C-N 3.32Å; L470-I472 PolarHBondContact O-N 3.2Å; L470-F473 PolarHBondContact O-N 3.29Å; L470-V474 WeakPolarHBondContact O-CG2 3.46Å; L470-V474 PolarHBondContact O-N 2.85Å
471	S	96	Very high	93.5	Very high	54 Å²	54	45 Å²	45	38%	0.378	25%	0.246	S	C	.	.	H	α-helix	trans	-63.2	-38.1	176.9	72.4	0	0	0	0	112.3	F467 G468 M469 V474 A475	F467-S471 WeakPolarHBondContact O-CB 3.48Å; F467-S471 PolarHBondContact O-N 3.42Å; F467-S471 PolarHBondContact O-OG 3.33Å; G468-S471 PolarHBondContact O-N 3.09Å; G468-S471 PolarHBondContact O-OG 3.23Å; M469-S471 PolarHBondContact O-N 3.36Å; S471-V474 PolarHBondContact O-N 3.14Å; S471-A475 WeakPolarHBondContact O-CB 3.38Å; S471-A475 PolarHBondContact O-N 3.02Å
472	I	96.8	Very high	93.9	Very high	39 Å²	39	43.5 Å²	43.5	20%	0.2	24%	0.236	C	C	.	.	H	α-helix	trans	-68.7	-40.5	176.1	-63.5	167.1	0	0	0	110.7	G468 M469 L470 V474 A475 S476 L534 I537 A538 L541	G468-I472 VanDerWaalsContact O-CG1 3.31Å; G468-I472 WeakPolarHBondContact O-CG1 3.5Å; G468-I472 PolarHBondContact O-N 2.75Å; M469-I472 PolarHBondContact O-N 3.18Å; L470-I472 VanDerWaalsContact C-N 3.32Å; L470-I472 PolarHBondContact O-N 3.2Å; I472-V474 PolarHBondContact O-N 3.35Å; I472-A475 PolarHBondContact O-N 3.24Å; I472-S476 WeakPolarHBondContact O-CB 3.31Å; I472-S476 PolarHBondContact O-N 3.09Å; I472-L534 HydrophobicContact CG2-CB 3.98Å; I472-L534 HydrophobicContact CG2-CD2 4.21Å; I472-L534 WeakPolarHBondContact CG2-O 3.44Å; I472-I537 HydrophobicContact CD1-CG2 4.16Å; I472-A538 HydrophobicContact CB-CB 4.36Å; I472-A538 HydrophobicContact CG2-CB 3.88Å; I472-L541 HydrophobicContact CD1-CD1 3.72Å
473	F	96.2	Very high	94.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.8	-46.8	172.6	-88.6	-63.2	0	0	0	111.8	F389 L393 V438 M469 L470 A475 S476 F477 Y535 A538	F389-F473 HydrophobicContact CZ-CE2 4.2Å; F389-F473 HydrophobicContact CZ-CZ 4.05Å; L393-F473 HydrophobicContact CD1-CZ 4.45Å; V438-F473 HydrophobicContact CG1-CB 4.02Å; V438-F473 HydrophobicContact CG2-CB 4.28Å; V438-F473 HydrophobicContact CG2-CD1 4.39Å; V438-F473 HydrophobicContact CG2-CD2 4.39Å; V438-F473 HydrophobicContact CG2-CG 4.12Å; M469-F473 HydrophobicContact CG-CD2 4.14Å; M469-F473 HydrophobicContact CG-CE2 3.99Å; M469-F473 WeakPolarHBondContact O-CD2 3.32Å; M469-F473 PolarHBondContact O-N 3.31Å; M469-F473 HydrophobicContact SD-CD2 3.51Å; M469-F473 VanDerWaalsContact SD-CD2 3.51Å; M469-F473 HydrophobicContact SD-CE2 3.5Å; M469-F473 WeakPolarHBondContact SD-CE2 3.36Å; L470-F473 PolarHBondContact O-N 3.29Å; F473-A475 PolarHBondContact O-N 3.28Å; F473-S476 PolarHBondContact O-N 2.71Å; F473-F477 HydrophobicContact CB-CD2 4.48Å; F473-F477 HydrophobicContact CB-CE2 4.3Å; F473-F477 AromaticContact CD1-CE2 3.96Å; F473-F477 HydrophobicContact CD1-CE2 3.96Å; F473-F477 HydrophobicContact CD1-CZ 4.43Å; F473-F477 WeakPolarHBondContact O-CD2 3.16Å; F473-F477 PolarHBondContact O-N 3.12Å; F473-Y535 HydrophobicContact CD1-CD2 4.29Å; F473-Y535 HydrophobicContact CD1-CE2 4.38Å; F473-Y535 HydrophobicContact CE1-CD2 4.04Å; F473-Y535 AromaticContact CE1-CE2 3.88Å; F473-Y535 HydrophobicContact CE1-CE2 3.88Å; F473-A538 HydrophobicContact CD1-CB 3.73Å; F473-A538 HydrophobicContact CD2-CB 3.76Å; F473-A538 HydrophobicContact CE1-CB 3.65Å; F473-A538 HydrophobicContact CE2-CB 3.69Å; F473-A538 HydrophobicContact CG-CB 3.77Å; F473-A538 HydrophobicContact CZ-CB 3.63Å
474	V	96.4	Very high	94.3	Very high	61 Å²	61	40.6 Å²	40.6	37%	0.37	23%	0.228	S	C	.	.	H	α-helix	trans	-61.1	-45.5	177.5	173.6	0	0	0	0	110.9	I442 L470 S471 I472 S476 F477 T478	I442-V474 HydrophobicContact CD1-CG2 3.44Å; I442-V474 VanDerWaalsContact CD1-CG2 3.44Å; L470-V474 WeakPolarHBondContact O-CG2 3.46Å; L470-V474 PolarHBondContact O-N 2.85Å; S471-V474 PolarHBondContact O-N 3.14Å; I472-V474 PolarHBondContact O-N 3.35Å; V474-S476 VanDerWaalsContact C-N 3.33Å; V474-S476 PolarHBondContact O-N 3.09Å; V474-F477 PolarHBondContact O-N 2.91Å; V474-T478 HydrophobicContact CG1-CG2 4.21Å; V474-T478 VanDerWaalsContact O-CG2 3.26Å; V474-T478 WeakPolarHBondContact O-CG2 3.44Å; V474-T478 PolarHBondContact O-N 2.92Å; V474-T478 PolarHBondContact O-OG1 3.19Å; V474-T478 VanDerWaalsContact O-OG1 3.1Å
475	A	96.8	Very high	94.4	Very high	40 Å²	40	42 Å²	42	33%	0.331	23%	0.232	S	C	.	.	H	α-helix	trans	-61.4	-39.2	177.3	0	0	0	0	0	112.7	S471 I472 F473 T478 A479 L534	S471-A475 WeakPolarHBondContact O-CB 3.38Å; S471-A475 PolarHBondContact O-N 3.02Å; I472-A475 PolarHBondContact O-N 3.24Å; F473-A475 PolarHBondContact O-N 3.28Å; A475-T478 WeakPolarHBondContact CA-OG1 3.48Å; A475-T478 PolarHBondContact O-OG1 3.17Å; A475-A479 WeakPolarHBondContact O-CB 3.47Å; A475-A479 PolarHBondContact O-N 3.24Å; A475-L534 HydrophobicContact CB-CD1 3.99Å
476	S	96.5	Very high	94.4	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.014	24%	0.242	C	C	.	.	H	α-helix	trans	-65	-46.8	175.4	174.9	0	0	0	0	112.1	I472 F473 V474 A479 R480 S531 Y535	I472-S476 WeakPolarHBondContact O-CB 3.31Å; I472-S476 PolarHBondContact O-N 3.09Å; F473-S476 PolarHBondContact O-N 2.71Å; V474-S476 VanDerWaalsContact C-N 3.33Å; V474-S476 PolarHBondContact O-N 3.09Å; S476-A479 PolarHBondContact O-N 3.11Å; S476-R480 PolarHBondContact O-N 3.46Å; S476-S531 WeakPolarHBondContact O-CB 3.17Å; S476-S531 PolarHBondContact O-OG 3.2Å; S476-S531 PolarHBondContact OG-O 3.07Å; S476-S531 PolarHBondContact OG-OG 3.18Å; S476-Y535 WeakPolarHBondContact OG-CB 3.41Å
477	F	95.4	Very high	94.4	Very high	21 Å²	21	44.6 Å²	44.6	9%	0.092	24%	0.241	C	C	.	.	H	α-helix	trans	-68.3	-35.6	179.5	-71.5	-54.8	0	0	0	112.7	I434 M435 V438 F473 V474 R480 L481 Y535	I434-F477 HydrophobicContact CG2-CE2 4.39Å; I434-F477 HydrophobicContact CG2-CZ 3.77Å; M435-F477 HydrophobicContact CG-CD1 3.77Å; M435-F477 HydrophobicContact CG-CD2 4.09Å; M435-F477 HydrophobicContact CG-CE1 3.71Å; M435-F477 HydrophobicContact CG-CE2 4.03Å; M435-F477 HydrophobicContact CG-CG 3.99Å; M435-F477 HydrophobicContact CG-CZ 3.85Å; M435-F477 HydrophobicContact SD-CD1 4Å; M435-F477 HydrophobicContact SD-CE1 4.41Å; M435-F477 HydrophobicContact SD-CG 4.3Å; V438-F477 HydrophobicContact CG2-CE2 4.18Å; F473-F477 HydrophobicContact CB-CD2 4.48Å; F473-F477 HydrophobicContact CB-CE2 4.3Å; F473-F477 AromaticContact CD1-CE2 3.96Å; F473-F477 HydrophobicContact CD1-CE2 3.96Å; F473-F477 HydrophobicContact CD1-CZ 4.43Å; F473-F477 WeakPolarHBondContact O-CD2 3.16Å; F473-F477 PolarHBondContact O-N 3.12Å; V474-F477 PolarHBondContact O-N 2.91Å; F477-R480 PolarHBondContact O-N 3.28Å; F477-L481 WeakPolarHBondContact O-CB 3.47Å; F477-L481 PolarHBondContact O-N 2.84Å; F477-Y535 HydrophobicContact CZ-CE2 4.32Å
478	T	95.2	Very high	94.3	Very high	72 Å²	72	40.1 Å²	40.1	44%	0.442	23%	0.225	S	C	.	.	H	α-helix	trans	-67.5	-41.6	174.9	56.4	0	0	0	0	111.4	V474 A475 R480 L481 M482	V474-T478 HydrophobicContact CG1-CG2 4.21Å; V474-T478 VanDerWaalsContact O-CG2 3.26Å; V474-T478 WeakPolarHBondContact O-CG2 3.44Å; V474-T478 PolarHBondContact O-N 2.92Å; V474-T478 PolarHBondContact O-OG1 3.19Å; V474-T478 VanDerWaalsContact O-OG1 3.1Å; A475-T478 WeakPolarHBondContact CA-OG1 3.48Å; A475-T478 PolarHBondContact O-OG1 3.17Å; T478-R480 VanDerWaalsContact C-N 3.31Å; T478-R480 PolarHBondContact O-N 3.02Å; T478-L481 PolarHBondContact O-N 3.43Å; T478-M482 VanDerWaalsContact O-CG 3.3Å; T478-M482 WeakPolarHBondContact O-CG 3.48Å; T478-M482 PolarHBondContact O-N 2.91Å
479	A	95	Very high	94.1	Very high	17 Å²	17	46.6 Å²	46.6	14%	0.14	25%	0.247	C	C	.	.	H	α-helix	trans	-60.5	-40.5	173.4	0	0	0	0	0	112	A475 S476 M482 A483	A475-A479 WeakPolarHBondContact O-CB 3.47Å; A475-A479 PolarHBondContact O-N 3.24Å; S476-A479 PolarHBondContact O-N 3.11Å; A479-M482 PolarHBondContact O-N 3.34Å; A479-A483 PolarHBondContact O-N 3.38Å
480	R	93.3	Very high	93.8	Very high	34 Å²	34	46.9 Å²	46.9	13%	0.128	25%	0.25	C	C	.	.	H	α-helix	trans	-65.1	-45.1	174.7	-163.1	171.3	178.7	104.2	-7.1	112.4	F427 E431 S476 F477 T478 M482 A483 F484 S531	F427-R480 HydrophobicContact CE1-CG 4.14Å; F427-R480 HydrophobicContact CZ-CG 4.27Å; E431-R480 VanDerWaalsContact CD-NH2 3.28Å; E431-R480 IonicContact OE1-CZ 3.12Å; E431-R480 IonicContact OE1-NE 3.19Å; E431-R480 IonicContact OE1-NH1 3.53Å; E431-R480 IonicContact OE1-NH2 3.29Å; E431-R480 PolarHBondContact OE1-NH2 2.73Å; E431-R480 IonicContact OE2-CZ 3.17Å; E431-R480 IonicContact OE2-NE 2.66Å; E431-R480 PolarHBondContact OE2-NE 3.38Å; E431-R480 IonicContact OE2-NH2 3.72Å; E431-R480 PolarHBondContact OE2-NH2 3.37Å; S476-R480 PolarHBondContact O-N 3.46Å; F477-R480 PolarHBondContact O-N 3.28Å; T478-R480 VanDerWaalsContact C-N 3.31Å; T478-R480 PolarHBondContact O-N 3.02Å; R480-M482 VanDerWaalsContact C-N 3.29Å; R480-M482 PolarHBondContact O-N 2.92Å; R480-A483 WeakPolarHBondContact O-CB 3.46Å; R480-A483 PolarHBondContact O-N 3.21Å; R480-A483 VanDerWaalsContact O-N 3.15Å; R480-F484 PolarHBondContact O-N 3.41Å; R480-S531 WeakPolarHBondContact CB-OG 3.38Å
481	L	93.6	Very high	93.5	Very high	80 Å²	80	47.8 Å²	47.8	42%	0.419	25%	0.254	S	S	.	.	H	α-helix	trans	-59.5	-41.9	175.8	-178.5	63.7	0	0	0	111	F427 F477 T478 F484 L485	F427-L481 HydrophobicContact CE2-CD1 4.16Å; F427-L481 HydrophobicContact CZ-CB 4.36Å; F427-L481 HydrophobicContact CZ-CD1 4.38Å; F477-L481 WeakPolarHBondContact O-CB 3.47Å; F477-L481 PolarHBondContact O-N 2.84Å; T478-L481 PolarHBondContact O-N 3.43Å; L481-F484 PolarHBondContact O-N 2.9Å; L481-L485 HydrophobicContact CD1-CG 4.43Å; L481-L485 HydrophobicContact CG-CD1 4.25Å; L481-L485 HydrophobicContact CG-CG 4.49Å; L481-L485 WeakPolarHBondContact O-CB 3.49Å; L481-L485 VanDerWaalsContact O-CG 3.29Å; L481-L485 WeakPolarHBondContact O-CG 3.34Å; L481-L485 PolarHBondContact O-N 3.1Å
482	M	93.2	Very high	93.2	Very high	98 Å²	98	51 Å²	51	48%	0.483	26%	0.263	S	S	.	.	H	α-helix	trans	-63.9	-39.4	175.2	-71.5	-60	-66.6	0	0	112.6	T478 A479 R480 L485 K486	T478-M482 VanDerWaalsContact O-CG 3.3Å; T478-M482 WeakPolarHBondContact O-CG 3.48Å; T478-M482 PolarHBondContact O-N 2.91Å; A479-M482 PolarHBondContact O-N 3.34Å; R480-M482 VanDerWaalsContact C-N 3.29Å; R480-M482 PolarHBondContact O-N 2.92Å; M482-L485 HydrophobicContact SD-CD1 4.46Å; M482-K486 WeakPolarHBondContact O-CG 3.32Å; M482-K486 PolarHBondContact O-N 3.08Å; M482-K486 VanDerWaalsContact O-N 3.16Å
483	A	92.6	Very high	92.8	Very high	6 Å²	6	53.2 Å²	53.2	5%	0.05	27%	0.269	C	S	.	.	H	α-helix	trans	-62.8	-45.1	174	0	0	0	0	0	111.4	T425 A479 R480 K486 A487 P527	T425-A483 HydrophobicContact CG2-CB 4.2Å; A479-A483 PolarHBondContact O-N 3.38Å; R480-A483 WeakPolarHBondContact O-CB 3.46Å; R480-A483 PolarHBondContact O-N 3.21Å; R480-A483 VanDerWaalsContact O-N 3.15Å; A483-K486 PolarHBondContact O-N 3.01Å; A483-A487 WeakPolarHBondContact O-CB 3.34Å; A483-A487 PolarHBondContact O-N 3.32Å; A483-P527 HydrophobicContact CB-CB 4.33Å
484	F	93.4	Very high	92.3	Very high	58 Å²	58	53.2 Å²	53.2	25%	0.254	27%	0.269	S	S	.	.	H	α-helix	trans	-63.3	-44.4	178	176.1	-102.9	0	0	0	112.6	F427 R480 L481 K486 A487 S488	F427-F484 HydrophobicContact CE2-CB 4.28Å; F427-F484 HydrophobicContact CE2-CD1 4.31Å; F427-F484 HydrophobicContact CE2-CG 4.24Å; R480-F484 PolarHBondContact O-N 3.41Å; L481-F484 PolarHBondContact O-N 2.9Å; F484-K486 PolarHBondContact O-N 2.92Å; F484-A487 PolarHBondContact O-N 3.17Å; F484-S488 WeakPolarHBondContact O-CB 3.28Å; F484-S488 PolarHBondContact O-N 3.49Å; F484-S488 PolarHBondContact O-OG 3.07Å
485	L	92.6	Very high	91.8	Very high	92 Å²	92	54.1 Å²	54.1	48%	0.482	27%	0.272	S	S	.	.	H	α-helix	trans	-62.2	-41.7	177.8	-72.2	174.3	0	0	0	111.9	L481 M482 S488 K489	L481-L485 HydrophobicContact CD1-CG 4.43Å; L481-L485 HydrophobicContact CG-CD1 4.25Å; L481-L485 HydrophobicContact CG-CG 4.49Å; L481-L485 WeakPolarHBondContact O-CB 3.49Å; L481-L485 VanDerWaalsContact O-CG 3.29Å; L481-L485 WeakPolarHBondContact O-CG 3.34Å; L481-L485 PolarHBondContact O-N 3.1Å; M482-L485 HydrophobicContact SD-CD1 4.46Å; L485-S488 PolarHBondContact O-N 3.45Å; L485-K489 WeakPolarHBondContact O-CB 3.39Å; L485-K489 PolarHBondContact O-N 3.44Å
486	K	91.6	Very high	91.2	Very high	111 Å²	111	59.3 Å²	59.3	48%	0.483	29%	0.291	S	S	.	.	H	α-helix	trans	-66.5	-43.3	176.2	-74.4	-175.7	177.4	-174.8	0	112.1	M482 A483 F484 S488 K489 A490 F515	M482-K486 WeakPolarHBondContact O-CG 3.32Å; M482-K486 PolarHBondContact O-N 3.08Å; M482-K486 VanDerWaalsContact O-N 3.16Å; A483-K486 PolarHBondContact O-N 3.01Å; F484-K486 PolarHBondContact O-N 2.92Å; K486-S488 VanDerWaalsContact C-N 3.34Å; K486-K489 PolarHBondContact O-N 3.45Å; K486-A490 PolarHBondContact O-N 3.34Å; K486-F515 HydrophobicContact CB-CE1 4.17Å; K486-F515 HydrophobicContact CB-CZ 3.94Å
487	A	90.5	Very high	90.5	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63	-40.8	175.6	0	0	0	0	0	111.9	R421 V422 A483 F484 A490 Q491	R421-A487 HydrophobicContact CB-CB 3.95Å; R421-A487 HydrophobicContact CG-CB 3.73Å; V422-A487 HydrophobicContact CG2-CB 4.12Å; A483-A487 WeakPolarHBondContact O-CB 3.34Å; A483-A487 PolarHBondContact O-N 3.32Å; F484-A487 PolarHBondContact O-N 3.17Å; A487-A490 WeakPolarHBondContact O-CB 3.44Å; A487-A490 PolarHBondContact O-N 3.12Å; A487-Q491 PolarHBondContact O-N 3.12Å
488	S	90.8	Very high	89.7	Confident	28 Å²	28	64.1 Å²	64.1	20%	0.196	31%	0.314	C	S	.	.	H	α-helix	trans	-65.3	-40.4	177.2	-58.9	0	0	0	0	112	F484 L485 K486 A490 Q491 Q492	F484-S488 WeakPolarHBondContact O-CB 3.28Å; F484-S488 PolarHBondContact O-N 3.49Å; F484-S488 PolarHBondContact O-OG 3.07Å; L485-S488 PolarHBondContact O-N 3.45Å; K486-S488 VanDerWaalsContact C-N 3.34Å; S488-A490 VanDerWaalsContact C-N 3.33Å; S488-A490 PolarHBondContact O-N 2.9Å; S488-Q491 PolarHBondContact O-N 3.3Å; S488-Q492 WeakPolarHBondContact O-CG 3.47Å; S488-Q492 PolarHBondContact O-N 2.84Å
489	K	90.8	Very high	88.5	Confident	157 Å²	157	66.3 Å²	66.3	68%	0.683	33%	0.33	S	S	*	.	H	α-helix	trans	-63.8	-38.7	174.1	-171.4	178.9	-179.8	-177.4	0	111.9	L485 K486 Q492 Y493	L485-K489 WeakPolarHBondContact O-CB 3.39Å; L485-K489 PolarHBondContact O-N 3.44Å; K486-K489 PolarHBondContact O-N 3.45Å; K489-Q492 PolarHBondContact O-N 2.93Å; K489-Y493 PolarHBondContact O-N 3.49Å
490	A	88.3	Confident	87.2	Confident	7 Å²	7	69.1 Å²	69.1	6%	0.058	34%	0.342	C	S	.	.	H	α-helix	trans	-64.9	-41.5	175.1	0	0	0	0	0	111.8	K486 A487 S488 Y493 V494 V512 F515	K486-A490 PolarHBondContact O-N 3.34Å; A487-A490 WeakPolarHBondContact O-CB 3.44Å; A487-A490 PolarHBondContact O-N 3.12Å; S488-A490 VanDerWaalsContact C-N 3.33Å; S488-A490 PolarHBondContact O-N 2.9Å; A490-Y493 WeakPolarHBondContact O-CB 3.3Å; A490-Y493 PolarHBondContact O-N 3.33Å; A490-V494 WeakPolarHBondContact O-CG2 3.49Å; A490-V494 PolarHBondContact O-N 3.48Å; A490-V494 VanDerWaalsContact O-N 3.1Å; A490-V512 HydrophobicContact CB-CG1 4.37Å; A490-F515 HydrophobicContact CB-CB 4.25Å; A490-F515 HydrophobicContact CB-CD2 3.53Å; A490-F515 HydrophobicContact CB-CE2 4.11Å; A490-F515 HydrophobicContact CB-CG 4.03Å
491	Q	88.8	Confident	86	Confident	27 Å²	27	75.6 Å²	75.6	13%	0.126	37%	0.374	C	S	.	.	H	α-helix	trans	-61.5	-47.8	173.9	-174.1	66	49.5	0	0	112	R417 V422 A487 S488 Y493 V494 D495	R417-Q491 PolarHBondContact O-NE2 3.17Å; R417-Q491 VanDerWaalsContact O-NE2 3.12Å; V422-Q491 HydrophobicContact CG2-CB 3.9Å; V422-Q491 HydrophobicContact CG2-CG 4.45Å; A487-Q491 PolarHBondContact O-N 3.12Å; S488-Q491 PolarHBondContact O-N 3.3Å; Q491-Y493 PolarHBondContact O-N 3.08Å; Q491-V494 WeakPolarHBondContact O-CB 3.32Å; Q491-V494 PolarHBondContact O-N 3.46Å; Q491-V494 VanDerWaalsContact O-N 3.1Å; Q491-D495 PolarHBondContact NE2-OD1 2.79Å; Q491-D495 PolarHBondContact O-N 3.03Å
492	Q	88.9	Confident	84.8	Confident	122 Å²	122	75.2 Å²	75.2	57%	0.57	37%	0.372	S	S	*	.	H	α-helix	trans	-57.9	-37.9	177.2	-74.1	175.6	-8.8	0	0	112.3	S488 K489 M496	S488-Q492 WeakPolarHBondContact O-CG 3.47Å; S488-Q492 PolarHBondContact O-N 2.84Å; K489-Q492 PolarHBondContact O-N 2.93Å; Q492-M496 WeakPolarHBondContact O-CB 3.43Å; Q492-M496 WeakPolarHBondContact O-CG 3.44Å; Q492-M496 PolarHBondContact O-N 3.22Å; Q492-M496 VanDerWaalsContact O-N 3.14Å
493	Y	88.2	Confident	83.9	Confident	85 Å²	85	71.5 Å²	71.5	33%	0.333	35%	0.354	S	S	.	.	H	α-helix	trans	-63.5	-47	175.6	-179.6	-90.6	0	0	0	111.8	K489 A490 Q491 M496 H497 P509 V512	K489-Y493 PolarHBondContact O-N 3.49Å; A490-Y493 WeakPolarHBondContact O-CB 3.3Å; A490-Y493 PolarHBondContact O-N 3.33Å; Q491-Y493 PolarHBondContact O-N 3.08Å; Y493-M496 PolarHBondContact O-N 3.46Å; Y493-H497 AromaticContact CD2-CE1 3.85Å; Y493-H497 AromaticContact CD2-ND1 3.55Å; Y493-H497 HydrophobicContact CE1-CB 4.28Å; Y493-H497 HydrophobicContact CE2-CB 4.42Å; Y493-H497 AromaticContact CE2-CE1 3.93Å; Y493-H497 AromaticContact CE2-CG 3.87Å; Y493-H497 AromaticContact CE2-ND1 3.68Å; Y493-H497 WeakPolarHBondContact O-CB 3.1Å; Y493-H497 PolarHBondContact O-N 3.44Å; Y493-H497 PolarHBondContact O-ND1 3.31Å; Y493-H497 VanDerWaalsContact O-ND1 3.09Å; Y493-P509 HydrophobicContact CE1-CG 4.03Å; Y493-V512 HydrophobicContact CD1-CB 4.45Å; Y493-V512 HydrophobicContact CD1-CG1 4.17Å; Y493-V512 HydrophobicContact CD1-CG2 3.71Å; Y493-V512 HydrophobicContact CE1-CG2 4.04Å; Y493-V512 HydrophobicContact CG-CG2 4.22Å
494	V	85.8	Confident	82.8	Confident	0 Å²	0	76 Å²	76	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-60.2	-45.8	177.1	170.5	0	0	0	0	110.9	V419 A490 Q491 M496 V498 L503 L508 V512	V419-V494 HydrophobicContact CG2-CG2 4Å; A490-V494 WeakPolarHBondContact O-CG2 3.49Å; A490-V494 PolarHBondContact O-N 3.48Å; A490-V494 VanDerWaalsContact O-N 3.1Å; Q491-V494 WeakPolarHBondContact O-CB 3.32Å; Q491-V494 PolarHBondContact O-N 3.46Å; Q491-V494 VanDerWaalsContact O-N 3.1Å; V494-M496 VanDerWaalsContact C-N 3.27Å; V494-M496 PolarHBondContact O-N 2.95Å; V494-V498 HydrophobicContact CG1-CB 4.32Å; V494-V498 HydrophobicContact CG1-CG2 4.33Å; V494-V498 WeakPolarHBondContact O-CB 3.3Å; V494-V498 PolarHBondContact O-N 2.86Å; V494-L503 HydrophobicContact CB-CD1 4.48Å; V494-L503 HydrophobicContact CG1-CD1 3.55Å; V494-L503 HydrophobicContact CG2-CD1 4.03Å; V494-L508 HydrophobicContact CG2-CD2 4Å; V494-V512 HydrophobicContact CG2-CG1 3.83Å
495	D	85.6	Confident	81.6	Confident	79 Å²	79	79.7 Å²	79.7	42%	0.422	41%	0.408	S	S	.	.	H	α-helix	trans	-63	-33.6	-179	-63.3	-21.1	0	0	0	112.4	R417 Q491	R417-D495 PolarHBondContact NH2-O 3.4Å; Q491-D495 PolarHBondContact NE2-OD1 2.79Å; Q491-D495 PolarHBondContact O-N 3.03Å
496	M	85.3	Confident	80.6	Confident	150 Å²	150	76.1 Å²	76.1	74%	0.739	39%	0.392	S	S	*	.	H	α-helix	trans	-86.5	-36.1	-178.6	-73.5	-179.4	62.7	0	0	114.6	Q492 Y493 V494	Q492-M496 WeakPolarHBondContact O-CB 3.43Å; Q492-M496 WeakPolarHBondContact O-CG 3.44Å; Q492-M496 PolarHBondContact O-N 3.22Å; Q492-M496 VanDerWaalsContact O-N 3.14Å; Y493-M496 PolarHBondContact O-N 3.46Å; V494-M496 VanDerWaalsContact C-N 3.27Å; V494-M496 PolarHBondContact O-N 2.95Å
497	H	81.9	Confident	79.7	Confident	109 Å²	109	76.9 Å²	76.9	51%	0.505	41%	0.411	S	S	.	.	H	α-helix	trans	-111.9	-14.8	-167.1	-61.3	81.5	0	0	0	114.2	Y493 P499	Y493-H497 AromaticContact CD2-CE1 3.85Å; Y493-H497 AromaticContact CD2-ND1 3.55Å; Y493-H497 HydrophobicContact CE1-CB 4.28Å; Y493-H497 HydrophobicContact CE2-CB 4.42Å; Y493-H497 AromaticContact CE2-CE1 3.93Å; Y493-H497 AromaticContact CE2-CG 3.87Å; Y493-H497 AromaticContact CE2-ND1 3.68Å; Y493-H497 WeakPolarHBondContact O-CB 3.1Å; Y493-H497 PolarHBondContact O-N 3.44Å; Y493-H497 PolarHBondContact O-ND1 3.31Å; Y493-H497 VanDerWaalsContact O-ND1 3.09Å; H497-P499 WeakPolarHBondContact O-CD 3.29Å
498	V	78.2	Confident	79.1	Confident	15 Å²	15	78.4 Å²	78.4	9%	0.091	42%	0.419	C	S	.	.			trans	-104.2	113.2	179.5	-177.6	0	0	0	0	109.4	R417 V494 D500 A506 L508	R417-V498 PolarHBondContact NH2-O 2.96Å; V494-V498 HydrophobicContact CG1-CB 4.32Å; V494-V498 HydrophobicContact CG1-CG2 4.33Å; V494-V498 WeakPolarHBondContact O-CB 3.3Å; V494-V498 PolarHBondContact O-N 2.86Å; V498-D500 HydrophobicContact CG1-CB 4.13Å; V498-A506 HydrophobicContact CG1-CB 3.58Å; V498-L508 HydrophobicContact CG2-CD2 3.9Å
499	P	69.4	Low	78.8	Confident	117 Å²	117	79.8 Å²	79.8	76%	0.76	43%	0.428	S	S	*	.			trans	-81.2	-17.6	178.6	31.8	-33.7	0	0	0	113.5	H497	H497-P499 WeakPolarHBondContact O-CD 3.29Å
500	D	69.4	Low	78.4	Confident	77 Å²	77	79.2 Å²	79.2	41%	0.412	43%	0.432	S	S	.	.			trans	-68.2	143.4	-177.7	-61.6	-39.7	0	0	0	112.4	V498 D502	V498-D500 HydrophobicContact CG1-CB 4.13Å; D500-D502 VanDerWaalsContact C-N 3.34Å
501	E	66.7	Low	78.2	Confident	169 Å²	169	86.8 Å²	86.8	79%	0.79	47%	0.466	S	S	*	.	S	Bend	trans	-69.2	-31.6	177.7	-67.5	-167.2	161.7	0	0	112.4
502	D	69	Low	78	Confident	72 Å²	72	86.3 Å²	86.3	39%	0.385	47%	0.465	S	S	.	.			trans	-114.3	123.9	-178	-72.8	-13.5	0	0	0	112.3	P416 D500 S504 N505	P416-D502 WeakPolarHBondContact CB-OD1 3.47Å; P416-D502 WeakPolarHBondContact CG-OD1 3.34Å; D500-D502 VanDerWaalsContact C-N 3.34Å; D502-S504 VanDerWaalsContact C-N 3.25Å; D502-S504 PolarHBondContact O-N 3.44Å; D502-N505 PolarHBondContact O-N 3.22Å
503	L	73.8	Confident	77.8	Confident	20 Å²	20	81 Å²	81	11%	0.105	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-21.2	-177.2	-170.3	61	0	0	0	113.8	P416 V419 V494 N505 L508 T516	P416-L503 VanDerWaalsContact O-CB 3.26Å; P416-L503 WeakPolarHBondContact O-CB 3.39Å; P416-L503 PolarHBondContact O-N 3.12Å; V419-L503 HydrophobicContact CG2-CD2 4Å; V494-L503 HydrophobicContact CB-CD1 4.48Å; V494-L503 HydrophobicContact CG1-CD1 3.55Å; V494-L503 HydrophobicContact CG2-CD1 4.03Å; L503-N505 VanDerWaalsContact C-N 3.3Å; L503-N505 PolarHBondContact O-N 2.83Å; L503-L508 HydrophobicContact CD1-CD1 3.76Å; L503-L508 HydrophobicContact CD1-CD2 4.07Å; L503-L508 HydrophobicContact CD1-CG 4.36Å; L503-L508 HydrophobicContact CG-CD1 4.19Å; L503-T516 HydrophobicContact CD2-CG2 3.83Å; L503-T516 HydrophobicContact CG-CG2 4.44Å
504	S	69.6	Low	77.8	Confident	102 Å²	102	78.2 Å²	78.2	71%	0.713	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-23.3	-177.1	57.1	0	0	0	0	114	D502	D502-S504 VanDerWaalsContact C-N 3.25Å; D502-S504 PolarHBondContact O-N 3.44Å
505	N	68.6	Low	77.9	Confident	134 Å²	134	79.9 Å²	79.9	72%	0.717	44%	0.438	S	S	*	.	S	Bend	trans	-99.9	-9.3	-175.4	-66.1	-7	0	0	0	112.9	D502 L503	D502-N505 PolarHBondContact O-N 3.22Å; L503-N505 VanDerWaalsContact C-N 3.3Å; L503-N505 PolarHBondContact O-N 2.83Å
506	A	70.8	Confident	77.9	Confident	17 Å²	17	77.9 Å²	77.9	14%	0.14	43%	0.429	C	S	.	.	S	Bend	trans	-86.6	138	-177.8	0	0	0	0	0	112.6	V498 L508	V498-A506 HydrophobicContact CG1-CB 3.58Å; A506-L508 PolarHBondContact O-N 3.33Å
507	S	72.6	Confident	78.1	Confident	127 Å²	127	75 Å²	75	89%	0.888	41%	0.411	S	S	*	.			trans	-79.2	103.1	173	50.3	0	0	0	0	111
508	L	79.9	Confident	78.3	Confident	33 Å²	33	70.2 Å²	70.2	17%	0.173	39%	0.39	C	S	.	.			trans	-93.5	148.2	-179.7	-66.3	161	0	0	0	111.5	V494 V498 L503 A506 V512 A513 T516	V494-L508 HydrophobicContact CG2-CD2 4Å; V498-L508 HydrophobicContact CG2-CD2 3.9Å; L503-L508 HydrophobicContact CD1-CD1 3.76Å; L503-L508 HydrophobicContact CD1-CD2 4.07Å; L503-L508 HydrophobicContact CD1-CG 4.36Å; L503-L508 HydrophobicContact CG-CD1 4.19Å; A506-L508 PolarHBondContact O-N 3.33Å; L508-V512 HydrophobicContact CD2-CG1 4.11Å; L508-A513 HydrophobicContact CB-CB 4.16Å; L508-T516 HydrophobicContact CD1-CG2 4.12Å
509	P	84.1	Confident	78.8	Confident	57 Å²	57	75 Å²	75	37%	0.37	41%	0.406	S	S	.	.			trans	-59	143.8	165.4	-19.4	30.6	0	0	0	111.1	Y493 E511 V512 A513	Y493-P509 HydrophobicContact CE1-CG 4.03Å; P509-E511 PolarHBondContact O-N 3.46Å; P509-V512 PolarHBondContact O-N 2.94Å; P509-A513 PolarHBondContact O-N 3.23Å
510	D	81.6	Confident	79.7	Confident	145 Å²	145	73.7 Å²	73.7	78%	0.775	39%	0.393	S	S	*	.	H	α-helix	trans	-53	-33.1	-176.7	-71.6	-22.9	0	0	0	113.8	Y514	D510-Y514 PolarHBondContact O-N 2.65Å; D510-Y514 VanDerWaalsContact O-N 3.16Å
511	E	83.6	Confident	80.7	Confident	166 Å²	166	76.3 Å²	76.3	78%	0.776	40%	0.401	S	S	*	.	H	α-helix	trans	-66.7	-34.2	177.4	-62.6	-170.6	171.7	0	0	113.2	P509 F515	P509-E511 PolarHBondContact O-N 3.46Å; E511-F515 WeakPolarHBondContact O-CD2 3.39Å; E511-F515 VanDerWaalsContact O-CE2 3.32Å; E511-F515 WeakPolarHBondContact O-CE2 3.14Å
512	V	84.9	Confident	81.8	Confident	16 Å²	16	69.6 Å²	69.6	10%	0.097	37%	0.368	C	S	.	.	H	α-helix	trans	-87.6	-38	179.3	-177.3	0	0	0	0	110.1	A490 Y493 V494 L508 P509 Y514 F515	A490-V512 HydrophobicContact CB-CG1 4.37Å; Y493-V512 HydrophobicContact CD1-CB 4.45Å; Y493-V512 HydrophobicContact CD1-CG1 4.17Å; Y493-V512 HydrophobicContact CD1-CG2 3.71Å; Y493-V512 HydrophobicContact CE1-CG2 4.04Å; Y493-V512 HydrophobicContact CG-CG2 4.22Å; V494-V512 HydrophobicContact CG2-CG1 3.83Å; L508-V512 HydrophobicContact CD2-CG1 4.11Å; P509-V512 PolarHBondContact O-N 2.94Å; V512-Y514 PolarHBondContact O-N 3.36Å; V512-F515 PolarHBondContact O-N 2.9Å
513	A	84.8	Confident	82.9	Confident	11 Å²	11	74 Å²	74	9%	0.091	38%	0.379	C	S	.	.	H	α-helix	trans	-58.3	-32.5	175.4	0	0	0	0	0	112.4	L508 P509 F515 T516	L508-A513 HydrophobicContact CB-CB 4.16Å; P509-A513 PolarHBondContact O-N 3.23Å; A513-F515 PolarHBondContact O-N 3.11Å; A513-F515 VanDerWaalsContact O-N 3.14Å; A513-T516 PolarHBondContact O-N 3.45Å; A513-T516 PolarHBondContact O-OG1 2.51Å
514	Y	88.8	Confident	83.7	Confident	27 Å²	27	79 Å²	79	11%	0.106	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-53.9	-35.3	174.3	174.9	-106.3	0	0	0	113.5	D510 V512 T516 Y517 R523 D526	D510-Y514 PolarHBondContact O-N 2.65Å; D510-Y514 VanDerWaalsContact O-N 3.16Å; V512-Y514 PolarHBondContact O-N 3.36Å; Y514-T516 VanDerWaalsContact C-N 3.27Å; Y514-T516 PolarHBondContact O-N 3.02Å; Y514-Y517 HydrophobicContact CD2-CD2 4.2Å; Y514-Y517 PolarHBondContact O-N 3.27Å; Y514-R523 HydrophobicContact CE2-CG 3.78Å; Y514-R523 PolarHBondContact OH-N 3.34Å; Y514-D526 PolarHBondContact OH-OD1 3.42Å
515	F	86.9	Confident	84.7	Confident	34 Å²	34	78.5 Å²	78.5	15%	0.149	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-79.3	-5.8	-177.8	-62.2	-69.9	0	0	0	113.8	V419 R421 K486 A490 E511 V512 A513	V419-F515 HydrophobicContact CG1-CB 3.67Å; V419-F515 WeakPolarHBondContact CG1-O 3.48Å; R421-F515 HydrophobicContact CB-CB 4.01Å; R421-F515 HydrophobicContact CB-CD1 4.24Å; R421-F515 WeakPolarHBondContact CB-O 3.43Å; R421-F515 HydrophobicContact CG-CD1 3.96Å; R421-F515 PolarHBondContact N-O 3.05Å; K486-F515 HydrophobicContact CB-CE1 4.17Å; K486-F515 HydrophobicContact CB-CZ 3.94Å; A490-F515 HydrophobicContact CB-CB 4.25Å; A490-F515 HydrophobicContact CB-CD2 3.53Å; A490-F515 HydrophobicContact CB-CE2 4.11Å; A490-F515 HydrophobicContact CB-CG 4.03Å; E511-F515 WeakPolarHBondContact O-CD2 3.39Å; E511-F515 VanDerWaalsContact O-CE2 3.32Å; E511-F515 WeakPolarHBondContact O-CE2 3.14Å; V512-F515 PolarHBondContact O-N 2.9Å; A513-F515 PolarHBondContact O-N 3.11Å; A513-F515 VanDerWaalsContact O-N 3.14Å
516	T	86.3	Confident	85.9	Confident	38 Å²	38	72.6 Å²	72.6	23%	0.233	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-90.1	-14	171.9	67.3	0	0	0	0	112.5	L503 L508 A513 Y514	L503-T516 HydrophobicContact CD2-CG2 3.83Å; L503-T516 HydrophobicContact CG-CG2 4.44Å; L508-T516 HydrophobicContact CD1-CG2 4.12Å; A513-T516 PolarHBondContact O-N 3.45Å; A513-T516 PolarHBondContact O-OG1 2.51Å; Y514-T516 VanDerWaalsContact C-N 3.27Å; Y514-T516 PolarHBondContact O-N 3.02Å
517	Y	88.4	Confident	86.9	Confident	90 Å²	90	73.4 Å²	73.4	35%	0.353	38%	0.382	S	S	.	.			trans	-74.5	147.4	-175.7	-62.7	-31.1	0	0	0	115.1	Y514 K521 W522	Y514-Y517 HydrophobicContact CD2-CD2 4.2Å; Y514-Y517 PolarHBondContact O-N 3.27Å; Y517-K521 HydrophobicContact CD1-CD 4.36Å; Y517-K521 HydrophobicContact CD2-CB 4.35Å; Y517-K521 HydrophobicContact CG-CB 4.35Å; Y517-K521 HydrophobicContact CG-CD 4.26Å; Y517-W522 PolarHBondContact O-NE1 2.95Å; Y517-W522 VanDerWaalsContact O-NE1 3.07Å
518	A	87.2	Confident	87.9	Confident	8 Å²	8	67.6 Å²	67.6	7%	0.066	34%	0.34	C	S	.	.			trans	-71.6	169.4	172.1	0	0	0	0	0	112.8	P408 N409 T411 N520 K521 W522	P408-A518 WeakPolarHBondContact O-CB 3.46Å; N409-A518 WeakPolarHBondContact O-CB 3.39Å; T411-A518 HydrophobicContact CG2-CB 3.86Å; A518-N520 PolarHBondContact O-N 2.92Å; A518-N520 VanDerWaalsContact O-N 3.15Å; A518-N520 PolarHBondContact O-OD1 2.96Å; A518-K521 PolarHBondContact O-N 3.42Å; A518-K521 VanDerWaalsContact O-N 3.14Å; A518-W522 PolarHBondContact O-NE1 3.32Å
519	R	88.3	Confident	88.5	Confident	116 Å²	116	68.8 Å²	68.8	44%	0.438	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-59.5	-30.5	-170.2	-171.4	172.7	-179.3	125.8	0.6	113.9	P408 K521 W522 E532	P408-R519 PolarHBondContact O-N 3.27Å; R519-K521 PolarHBondContact O-N 2.79Å; R519-W522 HydrophobicContact CB-CD2 4.25Å; R519-W522 HydrophobicContact CB-CE3 4.48Å; R519-W522 HydrophobicContact CB-CH2 4.49Å; R519-W522 HydrophobicContact CB-CZ2 4.26Å; R519-W522 HydrophobicContact CG-CD2 4.1Å; R519-W522 HydrophobicContact CG-CE3 3.88Å; R519-W522 HydrophobicContact CG-CH2 4.36Å; R519-W522 HydrophobicContact CG-CZ3 4.02Å; R519-W522 PolarHBondContact O-N 3.17Å; R519-E532 IonicContact CZ-OE2 2.82Å; R519-E532 VanDerWaalsContact CZ-OE2 3.27Å; R519-E532 IonicContact NH1-OE1 2.8Å; R519-E532 PolarHBondContact NH1-OE1 3.07Å; R519-E532 IonicContact NH1-OE2 2.72Å; R519-E532 PolarHBondContact NH1-OE2 2.91Å; R519-E532 IonicContact NH2-OE2 3.5Å; R519-E532 PolarHBondContact NH2-OE2 3.3Å
520	N	88.8	Confident	89	Confident	89 Å²	89	70 Å²	70	48%	0.476	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-61.8	-26.2	178.9	62.8	-11.3	0	0	0	114.7	N409 A518	N409-N520 WeakPolarHBondContact OD1-CB 3.37Å; N409-N520 PolarHBondContact OD1-ND2 2.99Å; A518-N520 PolarHBondContact O-N 2.92Å; A518-N520 VanDerWaalsContact O-N 3.15Å; A518-N520 PolarHBondContact O-OD1 2.96Å
521	K	89.8	Confident	89.7	Confident	132 Å²	132	63.2 Å²	63.2	57%	0.574	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-104.8	6.8	-178.3	-69.1	-179.1	-176.9	-178.3	0	113	Y517 A518 R519	Y517-K521 HydrophobicContact CD1-CD 4.36Å; Y517-K521 HydrophobicContact CD2-CB 4.35Å; Y517-K521 HydrophobicContact CG-CB 4.35Å; Y517-K521 HydrophobicContact CG-CD 4.26Å; A518-K521 PolarHBondContact O-N 3.42Å; A518-K521 VanDerWaalsContact O-N 3.14Å; R519-K521 PolarHBondContact O-N 2.79Å
522	W	91.3	Very high	90.1	Very high	27 Å²	27	58.3 Å²	58.3	10%	0.102	29%	0.29	C	S	.	.	S	Bend	trans	-67.5	145.7	177.9	-67.4	1.2	0	0	0	110.8	Y517 A518 R519 Q528 I529	Y517-W522 PolarHBondContact O-NE1 2.95Å; Y517-W522 VanDerWaalsContact O-NE1 3.07Å; A518-W522 PolarHBondContact O-NE1 3.32Å; R519-W522 HydrophobicContact CB-CD2 4.25Å; R519-W522 HydrophobicContact CB-CE3 4.48Å; R519-W522 HydrophobicContact CB-CH2 4.49Å; R519-W522 HydrophobicContact CB-CZ2 4.26Å; R519-W522 HydrophobicContact CG-CD2 4.1Å; R519-W522 HydrophobicContact CG-CE3 3.88Å; R519-W522 HydrophobicContact CG-CH2 4.36Å; R519-W522 HydrophobicContact CG-CZ3 4.02Å; R519-W522 PolarHBondContact O-N 3.17Å; W522-Q528 HydrophobicContact CH2-CG 4.28Å; W522-Q528 HydrophobicContact CZ3-CB 4.32Å; W522-Q528 HydrophobicContact CZ3-CG 3.91Å; W522-I529 HydrophobicContact CB-CD1 4.33Å; W522-I529 HydrophobicContact CE3-CD1 4.24Å; W522-I529 HydrophobicContact CE3-CG1 4Å
523	R	90.7	Very high	90.6	Very high	166 Å²	166	59.3 Å²	59.3	63%	0.626	30%	0.303	S	S	*	.			trans	-65.5	142.2	175.5	-66.4	-178.5	-175.7	-158.6	1.8	109.3	Y514 S525 D526	Y514-R523 HydrophobicContact CE2-CG 3.78Å; Y514-R523 PolarHBondContact OH-N 3.34Å; R523-S525 PolarHBondContact O-N 3Å; R523-S525 VanDerWaalsContact O-N 3.15Å; R523-D526 WeakPolarHBondContact O-CB 3.42Å; R523-D526 PolarHBondContact O-N 2.89Å
524	P	90.4	Very high	91.2	Very high	125 Å²	125	61.2 Å²	61.2	81%	0.812	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-29.1	179.3	-27.1	35.1	0	0	0	114.3	D526	P524-D526 VanDerWaalsContact C-N 3.33Å
525	S	91.9	Very high	91.5	Very high	90 Å²	90	62 Å²	62	63%	0.629	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	17.6	178.3	55.9	0	0	0	0	113.8	R523	R523-S525 PolarHBondContact O-N 3Å; R523-S525 VanDerWaalsContact O-N 3.15Å
526	D	92.7	Very high	91.9	Very high	11 Å²	11	63 Å²	63	6%	0.059	33%	0.329	C	S	.	.			trans	-64.9	132.9	-176.8	-176.9	83.2	0	0	0	111.9	R421 Y514 R523 P524 Q528 I529 I530	R421-D526 IonicContact CZ-OD2 3.27Å; R421-D526 IonicContact NH1-OD2 2.78Å; R421-D526 IonicContact NH2-OD1 2.76Å; R421-D526 IonicContact NH2-OD2 2.66Å; R421-D526 PolarHBondContact NH2-OD2 2.98Å; Y514-D526 PolarHBondContact OH-OD1 3.42Å; R523-D526 WeakPolarHBondContact O-CB 3.42Å; R523-D526 PolarHBondContact O-N 2.89Å; P524-D526 VanDerWaalsContact C-N 3.33Å; D526-Q528 PolarHBondContact O-N 2.97Å; D526-Q528 VanDerWaalsContact O-N 3.07Å; D526-Q528 VanDerWaalsContact OD2-CB 3.31Å; D526-Q528 WeakPolarHBondContact OD2-CB 3.35Å; D526-Q528 PolarHBondContact OD2-N 3.45Å; D526-I529 HydrophobicContact CB-CD1 4.24Å; D526-I529 HydrophobicContact CB-CG1 4.37Å; D526-I529 PolarHBondContact O-N 2.9Å; D526-I530 PolarHBondContact O-N 2.76Å
527	P	92.9	Very high	92.4	Very high	34 Å²	34	65.5 Å²	65.5	22%	0.221	34%	0.34	C	S	.	.	H	α-helix	trans	-58.8	-25.8	-173.7	-26	34	0	0	0	114.9	A483 S531	A483-P527 HydrophobicContact CB-CB 4.33Å; P527-S531 VanDerWaalsContact O-CB 3.31Å; P527-S531 WeakPolarHBondContact O-CB 3.21Å; P527-S531 PolarHBondContact O-N 3.27Å
528	Q	92.1	Very high	92.7	Very high	5 Å²	5	61.2 Å²	61.2	2%	0.023	32%	0.324	C	S	.	.	H	α-helix	trans	-69.8	-40.8	177.3	-178.7	68.8	19.6	0	0	111.7	W522 D526 I530 S531 E532	W522-Q528 HydrophobicContact CH2-CG 4.28Å; W522-Q528 HydrophobicContact CZ3-CB 4.32Å; W522-Q528 HydrophobicContact CZ3-CG 3.91Å; D526-Q528 PolarHBondContact O-N 2.97Å; D526-Q528 VanDerWaalsContact O-N 3.07Å; D526-Q528 VanDerWaalsContact OD2-CB 3.31Å; D526-Q528 WeakPolarHBondContact OD2-CB 3.35Å; D526-Q528 PolarHBondContact OD2-N 3.45Å; Q528-I530 VanDerWaalsContact C-N 3.34Å; Q528-S531 WeakPolarHBondContact O-CB 3.37Å; Q528-S531 PolarHBondContact O-N 3.34Å; Q528-E532 PolarHBondContact NE2-OE1 3.25Å; Q528-E532 WeakPolarHBondContact O-CG 3.13Å; Q528-E532 PolarHBondContact O-N 3.37Å
529	I	93.1	Very high	93.1	Very high	58 Å²	58	62.4 Å²	62.4	30%	0.297	33%	0.33	S	S	.	.	H	α-helix	trans	-66.2	-42.5	178.8	-57.5	176.9	0	0	0	109.5	W522 D526 S531 E532 G533	W522-I529 HydrophobicContact CB-CD1 4.33Å; W522-I529 HydrophobicContact CE3-CD1 4.24Å; W522-I529 HydrophobicContact CE3-CG1 4Å; D526-I529 HydrophobicContact CB-CD1 4.24Å; D526-I529 HydrophobicContact CB-CG1 4.37Å; D526-I529 PolarHBondContact O-N 2.9Å; I529-S531 VanDerWaalsContact C-N 3.34Å; I529-S531 PolarHBondContact O-N 2.9Å; I529-E532 PolarHBondContact O-N 2.92Å; I529-G533 PolarHBondContact O-N 3.25Å
530	I	94.8	Very high	93.5	Very high	82 Å²	82	61.9 Å²	61.9	42%	0.421	34%	0.339	S	S	.	.	H	α-helix	trans	-61.5	-45	175.3	-61.4	174	0	0	0	110.3	D526 Q528 G533 L534	D526-I530 PolarHBondContact O-N 2.76Å; Q528-I530 VanDerWaalsContact C-N 3.34Å; I530-G533 PolarHBondContact O-N 3.39Å; I530-L534 HydrophobicContact CG2-CD1 3.91Å; I530-L534 HydrophobicContact CG2-CG 4.31Å; I530-L534 WeakPolarHBondContact O-CB 3.35Å; I530-L534 WeakPolarHBondContact O-CG 3.49Å; I530-L534 PolarHBondContact O-N 3.24Å
531	S	95.1	Very high	93.7	Very high	2 Å²	2	60 Å²	60	1%	0.014	33%	0.329	C	S	.	.	H	α-helix	trans	-58.7	-48.4	176.7	179.6	0	0	0	0	112	S476 R480 P527 Q528 I529 L534 Y535	S476-S531 WeakPolarHBondContact O-CB 3.17Å; S476-S531 PolarHBondContact O-OG 3.2Å; S476-S531 PolarHBondContact OG-O 3.07Å; S476-S531 PolarHBondContact OG-OG 3.18Å; R480-S531 WeakPolarHBondContact CB-OG 3.38Å; P527-S531 VanDerWaalsContact O-CB 3.31Å; P527-S531 WeakPolarHBondContact O-CB 3.21Å; P527-S531 PolarHBondContact O-N 3.27Å; Q528-S531 WeakPolarHBondContact O-CB 3.37Å; Q528-S531 PolarHBondContact O-N 3.34Å; I529-S531 VanDerWaalsContact C-N 3.34Å; I529-S531 PolarHBondContact O-N 2.9Å; S531-L534 PolarHBondContact O-N 3.42Å; S531-Y535 WeakPolarHBondContact O-CB 3.25Å; S531-Y535 PolarHBondContact O-N 3.21Å
532	E	93.3	Very high	93.9	Very high	64 Å²	64	53.8 Å²	53.8	30%	0.299	30%	0.302	S	S	.	.	H	α-helix	trans	-62.8	-42.3	178.7	-73.8	173.8	-165.2	0	0	112	R519 Q528 I529 Y535 A536	R519-E532 IonicContact CZ-OE2 2.82Å; R519-E532 VanDerWaalsContact CZ-OE2 3.27Å; R519-E532 IonicContact NH1-OE1 2.8Å; R519-E532 PolarHBondContact NH1-OE1 3.07Å; R519-E532 IonicContact NH1-OE2 2.72Å; R519-E532 PolarHBondContact NH1-OE2 2.91Å; R519-E532 IonicContact NH2-OE2 3.5Å; R519-E532 PolarHBondContact NH2-OE2 3.3Å; Q528-E532 PolarHBondContact NE2-OE1 3.25Å; Q528-E532 WeakPolarHBondContact O-CG 3.13Å; Q528-E532 PolarHBondContact O-N 3.37Å; I529-E532 PolarHBondContact O-N 2.92Å; E532-Y535 PolarHBondContact O-N 3.48Å; E532-A536 PolarHBondContact O-N 2.91Å
533	G	95.4	Very high	94	Very high	37 Å²	37	56.7 Å²	56.7	38%	0.381	32%	0.315	S	S	.	.	H	α-helix	trans	-63.9	-48.7	177	0	0	0	0	0	112.8	I529 I530 Y535 A536 I537	I529-G533 PolarHBondContact O-N 3.25Å; I530-G533 PolarHBondContact O-N 3.39Å; G533-Y535 VanDerWaalsContact C-N 3.35Å; G533-Y535 PolarHBondContact O-N 2.96Å; G533-A536 PolarHBondContact O-N 3.36Å; G533-I537 WeakPolarHBondContact O-CG1 3.42Å; G533-I537 PolarHBondContact O-N 3.49Å
534	L	96.4	Very high	94	Very high	51 Å²	51	51 Å²	51	27%	0.267	30%	0.302	S	S	.	.	H	α-helix	trans	-65.1	-38.5	176.3	-68.3	177.9	0	0	0	111.8	I472 A475 I530 S531 A536 I537 A538	I472-L534 HydrophobicContact CG2-CB 3.98Å; I472-L534 HydrophobicContact CG2-CD2 4.21Å; I472-L534 WeakPolarHBondContact CG2-O 3.44Å; A475-L534 HydrophobicContact CB-CD1 3.99Å; I530-L534 HydrophobicContact CG2-CD1 3.91Å; I530-L534 HydrophobicContact CG2-CG 4.31Å; I530-L534 WeakPolarHBondContact O-CB 3.35Å; I530-L534 WeakPolarHBondContact O-CG 3.49Å; I530-L534 PolarHBondContact O-N 3.24Å; S531-L534 PolarHBondContact O-N 3.42Å; L534-A536 PolarHBondContact O-N 3.12Å; L534-I537 PolarHBondContact O-N 3.17Å; L534-A538 WeakPolarHBondContact O-CB 3.23Å; L534-A538 PolarHBondContact O-N 3.16Å
535	Y	95.7	Very high	93.9	Very high	43 Å²	43	47 Å²	47	17%	0.169	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-44.6	176.5	-174.1	-106.4	0	0	0	111.4	L393 N396 F473 S476 F477 S531 E532 G533 I537 A538 V539	L393-Y535 HydrophobicContact CD2-CE2 4.45Å; L393-Y535 VanDerWaalsContact CD2-OH 3.3Å; L393-Y535 WeakPolarHBondContact CD2-OH 3.42Å; N396-Y535 PolarHBondContact ND2-OH 3.1Å; F473-Y535 HydrophobicContact CD1-CD2 4.29Å; F473-Y535 HydrophobicContact CD1-CE2 4.38Å; F473-Y535 HydrophobicContact CE1-CD2 4.04Å; F473-Y535 AromaticContact CE1-CE2 3.88Å; F473-Y535 HydrophobicContact CE1-CE2 3.88Å; S476-Y535 WeakPolarHBondContact OG-CB 3.41Å; F477-Y535 HydrophobicContact CZ-CE2 4.32Å; S531-Y535 WeakPolarHBondContact O-CB 3.25Å; S531-Y535 PolarHBondContact O-N 3.21Å; E532-Y535 PolarHBondContact O-N 3.48Å; G533-Y535 VanDerWaalsContact C-N 3.35Å; G533-Y535 PolarHBondContact O-N 2.96Å; Y535-I537 PolarHBondContact O-N 3.18Å; Y535-A538 WeakPolarHBondContact O-CB 3.49Å; Y535-A538 PolarHBondContact O-N 3.19Å; Y535-V539 HydrophobicContact CD1-CG2 4.08Å; Y535-V539 HydrophobicContact CE1-CG2 3.79Å; Y535-V539 HydrophobicContact CE2-CG2 4.48Å; Y535-V539 VanDerWaalsContact O-CG2 3.31Å; Y535-V539 WeakPolarHBondContact O-CG2 3.38Å; Y535-V539 PolarHBondContact O-N 3.5Å
536	A	95.6	Very high	93.8	Very high	55 Å²	55	45.8 Å²	45.8	46%	0.455	26%	0.256	S	S	.	.	H	α-helix	trans	-60.8	-43.6	178	0	0	0	0	0	112.1	E532 G533 L534 A538 V539 V540	E532-A536 PolarHBondContact O-N 2.91Å; G533-A536 PolarHBondContact O-N 3.36Å; L534-A536 PolarHBondContact O-N 3.12Å; A536-A538 VanDerWaalsContact C-N 3.35Å; A536-V539 PolarHBondContact O-N 3.45Å; A536-V540 PolarHBondContact O-N 3.18Å; A536-V540 VanDerWaalsContact O-N 3.17Å
537	I	96.2	Very high	93.5	Very high	91 Å²	91	46 Å²	46	47%	0.467	26%	0.26	S	S	.	.	H	α-helix	trans	-61.4	-45.2	174.8	-64.2	168.7	0	0	0	110.4	I472 G533 L534 Y535 V539 V540 L541	I472-I537 HydrophobicContact CD1-CG2 4.16Å; G533-I537 WeakPolarHBondContact O-CG1 3.42Å; G533-I537 PolarHBondContact O-N 3.49Å; L534-I537 PolarHBondContact O-N 3.17Å; Y535-I537 PolarHBondContact O-N 3.18Å; I537-V539 VanDerWaalsContact C-N 3.33Å; I537-V539 PolarHBondContact O-N 3.3Å; I537-V540 PolarHBondContact O-N 3.5Å; I537-L541 HydrophobicContact CG2-CD1 4.08Å; I537-L541 HydrophobicContact CG2-CG 4.46Å; I537-L541 WeakPolarHBondContact O-CG 3.48Å; I537-L541 PolarHBondContact O-N 3.4Å
538	A	95.6	Very high	93.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-38	179	0	0	0	0	0	112.6	I472 F473 L534 Y535 A536 L541 S542	I472-A538 HydrophobicContact CB-CB 4.36Å; I472-A538 HydrophobicContact CG2-CB 3.88Å; F473-A538 HydrophobicContact CD1-CB 3.73Å; F473-A538 HydrophobicContact CD2-CB 3.76Å; F473-A538 HydrophobicContact CE1-CB 3.65Å; F473-A538 HydrophobicContact CE2-CB 3.69Å; F473-A538 HydrophobicContact CG-CB 3.77Å; F473-A538 HydrophobicContact CZ-CB 3.63Å; L534-A538 WeakPolarHBondContact O-CB 3.23Å; L534-A538 PolarHBondContact O-N 3.16Å; Y535-A538 WeakPolarHBondContact O-CB 3.49Å; Y535-A538 PolarHBondContact O-N 3.19Å; A536-A538 VanDerWaalsContact C-N 3.35Å; A538-L541 PolarHBondContact O-N 2.93Å; A538-S542 WeakPolarHBondContact O-CB 3.33Å; A538-S542 PolarHBondContact O-N 2.9Å
539	V	95.3	Very high	93	Very high	33 Å²	33	49.5 Å²	49.5	20%	0.2	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-47.7	174.5	171.3	0	0	0	0	110.6	L393 Y535 A536 I537 L541 S542 F543	L393-V539 HydrophobicContact CD1-CG2 4.35Å; L393-V539 HydrophobicContact CD2-CG2 4.34Å; Y535-V539 HydrophobicContact CD1-CG2 4.08Å; Y535-V539 HydrophobicContact CE1-CG2 3.79Å; Y535-V539 HydrophobicContact CE2-CG2 4.48Å; Y535-V539 VanDerWaalsContact O-CG2 3.31Å; Y535-V539 WeakPolarHBondContact O-CG2 3.38Å; Y535-V539 PolarHBondContact O-N 3.5Å; A536-V539 PolarHBondContact O-N 3.45Å; I537-V539 VanDerWaalsContact C-N 3.33Å; I537-V539 PolarHBondContact O-N 3.3Å; V539-L541 PolarHBondContact O-N 2.86Å; V539-S542 WeakPolarHBondContact O-CB 3.32Å; V539-S542 PolarHBondContact O-N 3.19Å; V539-S542 VanDerWaalsContact O-N 3.13Å; V539-S542 PolarHBondContact O-OG 3.22Å; V539-F543 HydrophobicContact CG1-CD2 4.16Å; V539-F543 HydrophobicContact CG1-CE2 3.99Å; V539-F543 WeakPolarHBondContact O-CD2 3.41Å; V539-F543 PolarHBondContact O-N 2.93Å
540	V	95.7	Very high	92.7	Very high	105 Å²	105	49.8 Å²	49.8	64%	0.636	27%	0.273	S	S	*	.	H	α-helix	trans	-60.5	-46.8	177.7	174.7	0	0	0	0	111.5	A536 I537 S542 F543 S544	A536-V540 PolarHBondContact O-N 3.18Å; A536-V540 VanDerWaalsContact O-N 3.17Å; I537-V540 PolarHBondContact O-N 3.5Å; V540-S542 PolarHBondContact O-N 3.19Å; V540-F543 PolarHBondContact O-N 3.34Å; V540-S544 PolarHBondContact O-N 3.49Å
541	L	94.2	Very high	92.4	Very high	50 Å²	50	46.5 Å²	46.5	26%	0.262	26%	0.258	S	S	.	.	H	α-helix	trans	-64.5	-28.8	176.7	-67.8	176.7	0	0	0	112.6	M469 I472 I537 A538 V539 S544	M469-L541 HydrophobicContact CB-CB 4.02Å; M469-L541 HydrophobicContact CB-CD1 4.48Å; M469-L541 HydrophobicContact CG-CB 3.94Å; I472-L541 HydrophobicContact CD1-CD1 3.72Å; I537-L541 HydrophobicContact CG2-CD1 4.08Å; I537-L541 HydrophobicContact CG2-CG 4.46Å; I537-L541 WeakPolarHBondContact O-CG 3.48Å; I537-L541 PolarHBondContact O-N 3.4Å; A538-L541 PolarHBondContact O-N 2.93Å; V539-L541 PolarHBondContact O-N 2.86Å; L541-S544 PolarHBondContact O-N 2.87Å; L541-S544 PolarHBondContact O-OG 2.89Å
542	S	93.4	Very high	92.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67.5	-41	174.4	75.6	0	0	0	0	111.6	F386 L393 A538 V539 V540 S544 R545	F386-S542 VanDerWaalsContact CZ-O 3.3Å; F386-S542 WeakPolarHBondContact CZ-O 3.49Å; L393-S542 VanDerWaalsContact CD1-OG 3.32Å; L393-S542 WeakPolarHBondContact CD1-OG 3.4Å; A538-S542 WeakPolarHBondContact O-CB 3.33Å; A538-S542 PolarHBondContact O-N 2.9Å; V539-S542 WeakPolarHBondContact O-CB 3.32Å; V539-S542 PolarHBondContact O-N 3.19Å; V539-S542 VanDerWaalsContact O-N 3.13Å; V539-S542 PolarHBondContact O-OG 3.22Å; V540-S542 PolarHBondContact O-N 3.19Å; S542-S544 VanDerWaalsContact C-N 3.3Å; S542-S544 PolarHBondContact O-N 2.96Å; S542-R545 VanDerWaalsContact O-CB 3.24Å; S542-R545 WeakPolarHBondContact O-CB 3.5Å; S542-R545 PolarHBondContact O-N 3.37Å; S542-R545 VanDerWaalsContact O-N 3.15Å
543	F	93.1	Very high	91.9	Very high	88 Å²	88	48.1 Å²	48.1	39%	0.386	27%	0.273	S	S	.	.	H	α-helix	trans	-65	-32.3	177.3	-84.1	-81	0	0	0	113.2	L390 V394 V539 V540 R545 I546	L390-F543 HydrophobicContact CB-CE1 4.26Å; L390-F543 HydrophobicContact CB-CZ 4.39Å; L390-F543 HydrophobicContact CD1-CD1 4.06Å; L390-F543 HydrophobicContact CD1-CE1 4.14Å; L390-F543 HydrophobicContact CD2-CD1 4.17Å; L390-F543 HydrophobicContact CD2-CD2 4.31Å; L390-F543 HydrophobicContact CD2-CE1 4.22Å; L390-F543 HydrophobicContact CD2-CE2 4.36Å; L390-F543 HydrophobicContact CD2-CG 4.21Å; L390-F543 HydrophobicContact CD2-CZ 4.31Å; L390-F543 HydrophobicContact CG-CE1 4.46Å; V394-F543 HydrophobicContact CG2-CZ 4.06Å; V539-F543 HydrophobicContact CG1-CD2 4.16Å; V539-F543 HydrophobicContact CG1-CE2 3.99Å; V539-F543 WeakPolarHBondContact O-CD2 3.41Å; V539-F543 PolarHBondContact O-N 2.93Å; V540-F543 PolarHBondContact O-N 3.34Å; F543-R545 PolarHBondContact O-N 3.33Å; F543-I546 HydrophobicContact CD1-CD1 4.18Å; F543-I546 WeakPolarHBondContact O-CG1 3.41Å; F543-I546 PolarHBondContact O-N 2.92Å
544	S	90.6	Very high	91.6	Very high	48 Å²	48	53.3 Å²	53.3	34%	0.336	29%	0.287	S	S	.	.	H	α-helix	trans	-64.8	-22.9	177.1	73	0	0	0	0	112.9	V540 L541 S542 I546 A547	V540-S544 PolarHBondContact O-N 3.49Å; L541-S544 PolarHBondContact O-N 2.87Å; L541-S544 PolarHBondContact O-OG 2.89Å; S542-S544 VanDerWaalsContact C-N 3.3Å; S542-S544 PolarHBondContact O-N 2.96Å; S544-I546 PolarHBondContact O-N 3.37Å; S544-A547 VanDerWaalsContact O-CB 3.25Å; S544-A547 WeakPolarHBondContact O-CB 3.49Å; S544-A547 PolarHBondContact O-N 2.93Å; S544-A547 VanDerWaalsContact O-N 3.15Å
545	R	89.4	Confident	91.2	Very high	39 Å²	39	54.6 Å²	54.6	15%	0.147	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-65	-16.4	176.7	-161.8	-177.3	-166.9	-174.1	6.8	113.7	F386 M441 E445 D466 S542 F543 A547 Y548	F386-R545 HydrophobicContact CE1-CB 4.06Å; F386-R545 HydrophobicContact CE1-CG 4.46Å; F386-R545 HydrophobicContact CE2-CB 4.32Å; F386-R545 HydrophobicContact CE2-CG 4.39Å; F386-R545 HydrophobicContact CZ-CB 3.62Å; F386-R545 HydrophobicContact CZ-CG 4.08Å; M441-R545 PolarHBondContact SD-NH1 3.31Å; E445-R545 IonicContact OE1-NH2 3.54Å; E445-R545 PolarHBondContact OE1-NH2 3.4Å; D466-R545 VanDerWaalsContact CG-NE 3.35Å; D466-R545 WeakPolarHBondContact OD1-CD 3.25Å; D466-R545 IonicContact OD1-CZ 3.1Å; D466-R545 IonicContact OD1-NE 2.84Å; D466-R545 PolarHBondContact OD1-NE 2.99Å; D466-R545 VanDerWaalsContact OD1-NE 3.15Å; D466-R545 IonicContact OD2-CZ 3.62Å; D466-R545 IonicContact OD2-NE 2.99Å; D466-R545 PolarHBondContact OD2-NE 2.87Å; D466-R545 IonicContact OD2-NH2 3.58Å; D466-R545 PolarHBondContact OD2-NH2 2.95Å; S542-R545 VanDerWaalsContact O-CB 3.24Å; S542-R545 WeakPolarHBondContact O-CB 3.5Å; S542-R545 PolarHBondContact O-N 3.37Å; S542-R545 VanDerWaalsContact O-N 3.15Å; F543-R545 PolarHBondContact O-N 3.33Å; R545-A547 PolarHBondContact O-N 3.26Å; R545-A547 VanDerWaalsContact O-N 3.07Å; R545-Y548 HydrophobicContact CB-CD2 4.44Å; R545-Y548 HydrophobicContact CG-CD2 3.53Å; R545-Y548 HydrophobicContact CG-CE2 3.79Å; R545-Y548 WeakPolarHBondContact O-CD2 3.26Å; R545-Y548 PolarHBondContact O-N 3.14Å
546	I	88.8	Confident	90.9	Very high	66 Å²	66	57.7 Å²	57.7	34%	0.338	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-55.6	-27.9	172	-64.7	173.5	0	0	0	111.1	F386 L390 F543 S544 Y548 I549 L550	F386-I546 HydrophobicContact CE1-CG1 4.06Å; L390-I546 HydrophobicContact CD1-CD1 3.65Å; L390-I546 HydrophobicContact CD1-CG1 3.72Å; F543-I546 HydrophobicContact CD1-CD1 4.18Å; F543-I546 WeakPolarHBondContact O-CG1 3.41Å; F543-I546 PolarHBondContact O-N 2.92Å; S544-I546 PolarHBondContact O-N 3.37Å; I546-Y548 PolarHBondContact O-N 3.38Å; I546-I549 PolarHBondContact O-N 2.89Å; I546-L550 PolarHBondContact O-N 3.36Å
547	A	88	Confident	90.7	Very high	16 Å²	16	55.1 Å²	55.1	13%	0.132	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-54.1	-23.9	174.8	0	0	0	0	0	113.7	W462 S544 R545 I549 P551 Q560	W462-A547 HydrophobicContact CH2-CB 3.59Å; W462-A547 HydrophobicContact CZ2-CB 4.38Å; W462-A547 HydrophobicContact CZ3-CB 3.88Å; S544-A547 VanDerWaalsContact O-CB 3.25Å; S544-A547 WeakPolarHBondContact O-CB 3.49Å; S544-A547 PolarHBondContact O-N 2.93Å; S544-A547 VanDerWaalsContact O-N 3.15Å; R545-A547 PolarHBondContact O-N 3.26Å; R545-A547 VanDerWaalsContact O-N 3.07Å; A547-I549 VanDerWaalsContact C-N 3.28Å; A547-I549 PolarHBondContact O-N 3.02Å; A547-P551 VanDerWaalsContact O-CD 3.25Å; A547-P551 WeakPolarHBondContact O-CD 3.29Å; A547-Q560 PolarHBondContact O-NE2 3.39Å; A547-Q560 PolarHBondContact O-OE1 3.33Å
548	Y	85	Confident	90.5	Very high	62 Å²	62	52.2 Å²	52.2	24%	0.243	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-69.9	-23.7	175.3	-79.3	-82.9	0	0	0	114.5	W462 N463 D466 R545 I546 P551	W462-Y548 HydrophobicContact CB-CE1 3.62Å; W462-Y548 HydrophobicContact CB-CE2 4.14Å; W462-Y548 WeakPolarHBondContact CB-OH 3.39Å; W462-Y548 HydrophobicContact CE3-CE2 4.17Å; W462-Y548 HydrophobicContact CG-CE1 4.2Å; W462-Y548 PolarHBondContact O-OH 3.4Å; N463-Y548 PolarHBondContact N-OH 3.15Å; D466-Y548 VanDerWaalsContact OD2-CE2 3.26Å; D466-Y548 WeakPolarHBondContact OD2-CE2 3.31Å; D466-Y548 VanDerWaalsContact OD2-CZ 3.29Å; D466-Y548 PolarHBondContact OD2-OH 3.15Å; R545-Y548 HydrophobicContact CB-CD2 4.44Å; R545-Y548 HydrophobicContact CG-CD2 3.53Å; R545-Y548 HydrophobicContact CG-CE2 3.79Å; R545-Y548 WeakPolarHBondContact O-CD2 3.26Å; R545-Y548 PolarHBondContact O-N 3.14Å; I546-Y548 PolarHBondContact O-N 3.38Å; Y548-P551 WeakPolarHBondContact O-CD 3.37Å
549	I	87.8	Confident	90.2	Very high	49 Å²	49	57 Å²	57	25%	0.251	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-29.9	-175.7	-57.5	170.8	0	0	0	110.4	F379 A383 F386 I546 A547 A552	F379-I549 HydrophobicContact CE2-CG2 4.48Å; F379-I549 HydrophobicContact CZ-CG2 3.9Å; A383-I549 HydrophobicContact CB-CD1 3.9Å; A383-I549 HydrophobicContact CB-CG1 4.43Å; A383-I549 HydrophobicContact CB-CG2 4.4Å; F386-I549 HydrophobicContact CD1-CD1 4.26Å; I546-I549 PolarHBondContact O-N 2.89Å; A547-I549 VanDerWaalsContact C-N 3.28Å; A547-I549 PolarHBondContact O-N 3.02Å; I549-A552 VanDerWaalsContact O-CB 3.32Å; I549-A552 WeakPolarHBondContact O-CB 3.37Å; I549-A552 PolarHBondContact O-N 3.24Å; I549-A552 VanDerWaalsContact O-N 3.15Å
550	L	87.1	Confident	89.9	Confident	64 Å²	64	57 Å²	57	34%	0.335	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-55	-36.3	-178	-69.3	-179.4	0	0	0	115.3	I546 A552 N553 F556	I546-L550 PolarHBondContact O-N 3.36Å; L550-A552 PolarHBondContact O-N 3.48Å; L550-A552 VanDerWaalsContact O-N 3.15Å; L550-N553 PolarHBondContact O-N 3.02Å; L550-N553 VanDerWaalsContact O-N 3.14Å; L550-F556 HydrophobicContact CD2-CB 4.32Å; L550-F556 HydrophobicContact CD2-CD2 4.26Å; L550-F556 HydrophobicContact CD2-CG 4.43Å
551	P	89.5	Confident	89.6	Confident	14 Å²	14	53.7 Å²	53.7	9%	0.091	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-65.4	-18.5	179.4	-20.4	32.4	0	0	0	113.9	A547 Y548 N553 W678	A547-P551 VanDerWaalsContact O-CD 3.25Å; A547-P551 WeakPolarHBondContact O-CD 3.29Å; Y548-P551 WeakPolarHBondContact O-CD 3.37Å; P551-N553 PolarHBondContact O-N 2.94Å; P551-W678 PolarHBondContact O-NE1 3.37Å
552	A	88.8	Confident	89.2	Confident	35 Å²	35	51.5 Å²	51.5	29%	0.289	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-70	-21	178	0	0	0	0	0	112.5	F379 I549 L550 L685	F379-A552 HydrophobicContact CE1-CB 4.02Å; F379-A552 HydrophobicContact CE2-CB 4.22Å; F379-A552 HydrophobicContact CZ-CB 3.48Å; F379-A552 VanDerWaalsContact CZ-CB 3.48Å; I549-A552 VanDerWaalsContact O-CB 3.32Å; I549-A552 WeakPolarHBondContact O-CB 3.37Å; I549-A552 PolarHBondContact O-N 3.24Å; I549-A552 VanDerWaalsContact O-N 3.15Å; L550-A552 PolarHBondContact O-N 3.48Å; L550-A552 VanDerWaalsContact O-N 3.15Å; A552-L685 HydrophobicContact CB-CD2 4.03Å
553	N	88.9	Confident	88.9	Confident	64 Å²	64	56.6 Å²	56.6	34%	0.342	30%	0.298	S	S	.	.	S	Bend	trans	-91.9	142.4	178.1	-170.5	22.9	0	0	0	111.6	L550 P551 S555 F556 G557	L550-N553 PolarHBondContact O-N 3.02Å; L550-N553 VanDerWaalsContact O-N 3.14Å; P551-N553 PolarHBondContact O-N 2.94Å; N553-S555 PolarHBondContact ND2-OG 3.4Å; N553-F556 HydrophobicContact CB-CB 4.45Å; N553-F556 HydrophobicContact CB-CD2 4.25Å; N553-F556 WeakPolarHBondContact ND2-CD2 3.39Å; N553-G557 PolarHBondContact O-N 2.95Å
554	E	88.7	Confident	88.6	Confident	146 Å²	146	54 Å²	54	68%	0.682	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-39.6	179.5	-179.3	169.6	-160.9	0	0	112.9	P558 W678	E554-P558 VanDerWaalsContact O-CD 3.22Å; E554-P558 WeakPolarHBondContact O-CD 3.43Å; E554-W678 VanDerWaalsContact CA-CZ2 3.43Å; E554-W678 HydrophobicContact CB-CH2 3.81Å; E554-W678 HydrophobicContact CB-CZ2 4.04Å; E554-W678 HydrophobicContact CG-CH2 3.71Å; E554-W678 HydrophobicContact CG-CZ2 4.4Å; E554-W678 HydrophobicContact CG-CZ3 4.33Å
555	S	87.8	Confident	88.3	Confident	79 Å²	79	54.7 Å²	54.7	55%	0.552	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-32.2	-178.5	65.1	0	0	0	0	113.9	N553	N553-S555 PolarHBondContact ND2-OG 3.4Å
556	F	89.9	Confident	88.3	Confident	108 Å²	108	53.6 Å²	53.6	47%	0.474	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-21.6	-175.7	-64.2	-50.8	0	0	0	113.8	L550 N553 Q560	L550-F556 HydrophobicContact CD2-CB 4.32Å; L550-F556 HydrophobicContact CD2-CD2 4.26Å; L550-F556 HydrophobicContact CD2-CG 4.43Å; N553-F556 HydrophobicContact CB-CB 4.45Å; N553-F556 HydrophobicContact CB-CD2 4.25Å; N553-F556 WeakPolarHBondContact ND2-CD2 3.39Å; F556-Q560 PolarHBondContact O-N 3.28Å; F556-Q560 VanDerWaalsContact O-N 3.09Å
557	G	91.4	Very high	88.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.4	-56	-175.1	0	0	0	0	0	114.2	N553 L559 Q560 I561 W678	N553-G557 PolarHBondContact O-N 2.95Å; G557-L559 VanDerWaalsContact C-N 3.29Å; G557-L559 PolarHBondContact O-N 3.33Å; G557-Q560 PolarHBondContact O-N 3.28Å; G557-I561 WeakPolarHBondContact O-CG1 3.3Å; G557-I561 PolarHBondContact O-N 2.91Å; G557-I561 VanDerWaalsContact O-N 3.11Å; G557-W678 VanDerWaalsContact CA-CD1 3.44Å
558	P	91.8	Very high	88.1	Confident	31 Å²	31	58.5 Å²	58.5	20%	0.201	31%	0.309	C	S	.	.	H	α-helix	trans	-56.8	-42.3	178.1	-25.8	35	0	0	0	112.8	E554 Q560 I561 S562 W678	E554-P558 VanDerWaalsContact O-CD 3.22Å; E554-P558 WeakPolarHBondContact O-CD 3.43Å; P558-Q560 VanDerWaalsContact C-N 3.33Å; P558-Q560 PolarHBondContact O-N 3.06Å; P558-I561 PolarHBondContact O-N 3.46Å; P558-S562 PolarHBondContact O-N 3.1Å; P558-S562 PolarHBondContact O-OG 3.15Å; P558-W678 HydrophobicContact CB-CB 4.43Å; P558-W678 HydrophobicContact CG-CB 3.94Å; P558-W678 HydrophobicContact CG-CD2 3.95Å; P558-W678 HydrophobicContact CG-CE3 4.14Å; P558-W678 HydrophobicContact CG-CG 3.84Å
559	L	88.3	Confident	88.2	Confident	100 Å²	100	58.1 Å²	58.1	52%	0.524	31%	0.311	S	S	.	.	H	α-helix	trans	-59.9	-40.9	178	-179.7	64.1	0	0	0	112.6	G557 S562 L563	G557-L559 VanDerWaalsContact C-N 3.29Å; G557-L559 PolarHBondContact O-N 3.33Å; L559-S562 PolarHBondContact O-OG 3.17Å; L559-L563 WeakPolarHBondContact O-CB 3.47Å; L559-L563 PolarHBondContact O-N 3.13Å; L559-L563 VanDerWaalsContact O-N 3.17Å
560	Q	89.8	Confident	88.3	Confident	32 Å²	32	57.7 Å²	57.7	15%	0.15	31%	0.309	C	S	.	.	H	α-helix	trans	-70.1	-40.8	178.3	-176.5	-171.4	-6.6	0	0	112	A547 F556 G557 P558 L563 G564	A547-Q560 PolarHBondContact O-NE2 3.39Å; A547-Q560 PolarHBondContact O-OE1 3.33Å; F556-Q560 PolarHBondContact O-N 3.28Å; F556-Q560 VanDerWaalsContact O-N 3.09Å; G557-Q560 PolarHBondContact O-N 3.28Å; P558-Q560 VanDerWaalsContact C-N 3.33Å; P558-Q560 PolarHBondContact O-N 3.06Å; Q560-L563 PolarHBondContact O-N 3.16Å; Q560-G564 PolarHBondContact O-N 2.9Å
561	I	88.8	Confident	88.3	Confident	37 Å²	37	61.2 Å²	61.2	19%	0.19	32%	0.322	C	S	.	.	H	α-helix	trans	-68.7	-39.3	-178.2	-62.3	-62.3	0	0	0	111	G557 P558 G564 R565 E677 A681	G557-I561 WeakPolarHBondContact O-CG1 3.3Å; G557-I561 PolarHBondContact O-N 2.91Å; G557-I561 VanDerWaalsContact O-N 3.11Å; P558-I561 PolarHBondContact O-N 3.46Å; I561-G564 PolarHBondContact O-N 3.31Å; I561-R565 WeakPolarHBondContact O-CG 3.42Å; I561-R565 PolarHBondContact O-N 3.01Å; I561-E677 HydrophobicContact CG2-CB 3.99Å; I561-A681 HydrophobicContact CD1-CB 3.7Å; I561-A681 HydrophobicContact CG1-CB 4.27Å
562	S	87.4	Confident	88	Confident	4 Å²	4	67.7 Å²	67.7	3%	0.028	35%	0.349	C	S	.	.	H	α-helix	trans	-63	-45.4	173.7	62.1	0	0	0	0	111.4	P558 L559 G564 R565 T566	P558-S562 PolarHBondContact O-N 3.1Å; P558-S562 PolarHBondContact O-OG 3.15Å; L559-S562 PolarHBondContact O-OG 3.17Å; S562-G564 PolarHBondContact O-N 2.97Å; S562-R565 PolarHBondContact O-N 3.47Å; S562-T566 WeakPolarHBondContact O-CG2 3.43Å; S562-T566 PolarHBondContact O-N 3.12Å; S562-T566 PolarHBondContact O-OG1 2.88Å
563	L	86.7	Confident	87.9	Confident	107 Å²	107	67.6 Å²	67.6	56%	0.56	34%	0.342	S	S	*	.	H	α-helix	trans	-60.3	-43.3	175.7	-173.8	145.8	0	0	0	112.7	L559 Q560 R565 T566 V567	L559-L563 WeakPolarHBondContact O-CB 3.47Å; L559-L563 PolarHBondContact O-N 3.13Å; L559-L563 VanDerWaalsContact O-N 3.17Å; Q560-L563 PolarHBondContact O-N 3.16Å; L563-R565 PolarHBondContact O-N 2.88Å; L563-T566 PolarHBondContact O-N 3.13Å; L563-T566 PolarHBondContact O-OG1 3.49Å; L563-V567 HydrophobicContact CD2-CG2 4.29Å; L563-V567 VanDerWaalsContact O-CG2 3.26Å; L563-V567 WeakPolarHBondContact O-CG2 3.45Å; L563-V567 PolarHBondContact O-N 3.03Å; L563-V567 VanDerWaalsContact O-N 3.13Å
564	G	86	Confident	87.8	Confident	34 Å²	34	67.8 Å²	67.8	35%	0.351	34%	0.341	S	S	.	.	H	α-helix	trans	-63.2	-27.6	178.9	0	0	0	0	0	113.5	Q560 I561 S562	Q560-G564 PolarHBondContact O-N 2.9Å; I561-G564 PolarHBondContact O-N 3.31Å; S562-G564 PolarHBondContact O-N 2.97Å
565	R	85.2	Confident	87.9	Confident	62 Å²	62	65.6 Å²	65.6	23%	0.234	34%	0.338	C	S	.	.	H	α-helix	trans	-83.2	-44.5	177.9	-73.5	170.6	158.9	-131.2	-26.7	112.8	I561 S562 L563 V567 K568 D569 I670 E677	I561-R565 WeakPolarHBondContact O-CG 3.42Å; I561-R565 PolarHBondContact O-N 3.01Å; S562-R565 PolarHBondContact O-N 3.47Å; L563-R565 PolarHBondContact O-N 2.88Å; R565-V567 PolarHBondContact O-N 3.15Å; R565-K568 WeakPolarHBondContact O-CB 3.32Å; R565-K568 PolarHBondContact O-N 3.04Å; R565-D569 PolarHBondContact O-N 3.01Å; R565-I670 HydrophobicContact CB-CD1 3.59Å; R565-I670 HydrophobicContact CB-CG1 4.4Å; R565-I670 HydrophobicContact CB-CG2 4.34Å; R565-E677 IonicContact CZ-OE1 2.72Å; R565-E677 IonicContact CZ-OE2 3.16Å; R565-E677 IonicContact NE-OE2 3.42Å; R565-E677 PolarHBondContact NE-OE2 2.96Å; R565-E677 VanDerWaalsContact NH1-CD 3.28Å; R565-E677 IonicContact NH1-OE1 3.7Å; R565-E677 PolarHBondContact NH1-OE1 3.26Å; R565-E677 IonicContact NH1-OE2 3.06Å; R565-E677 IonicContact NH2-OE1 2.61Å; R565-E677 PolarHBondContact NH2-OE1 3.46Å; R565-E677 IonicContact NH2-OE2 3.22Å; R565-E677 PolarHBondContact NH2-OE2 3.49Å
566	T	89.5	Confident	88	Confident	15 Å²	15	65.9 Å²	65.9	9%	0.092	33%	0.332	C	S	.	.	H	α-helix	trans	-57.9	-36.9	175.4	56.5	0	0	0	0	110.6	S562 L563 K568 D569 I570 Y667 I670	S562-T566 WeakPolarHBondContact O-CG2 3.43Å; S562-T566 PolarHBondContact O-N 3.12Å; S562-T566 PolarHBondContact O-OG1 2.88Å; L563-T566 PolarHBondContact O-N 3.13Å; L563-T566 PolarHBondContact O-OG1 3.49Å; T566-K568 VanDerWaalsContact C-N 3.32Å; T566-K568 PolarHBondContact O-N 2.6Å; T566-D569 PolarHBondContact O-N 3.2Å; T566-D569 VanDerWaalsContact O-N 3.15Å; T566-I570 VanDerWaalsContact O-CG1 3.23Å; T566-I570 WeakPolarHBondContact O-CG1 3.43Å; T566-I570 PolarHBondContact O-N 2.57Å; T566-Y667 HydrophobicContact CG2-CD2 4.35Å; T566-I670 HydrophobicContact CG2-CD1 4.16Å
567	V	87.5	Confident	88	Confident	57 Å²	57	62.2 Å²	62.2	35%	0.345	32%	0.316	S	S	.	.	H	α-helix	trans	-57.7	-39.5	172.3	170.3	0	0	0	0	113	L563 R565 D569 I570 F571	L563-V567 HydrophobicContact CD2-CG2 4.29Å; L563-V567 VanDerWaalsContact O-CG2 3.26Å; L563-V567 WeakPolarHBondContact O-CG2 3.45Å; L563-V567 PolarHBondContact O-N 3.03Å; L563-V567 VanDerWaalsContact O-N 3.13Å; R565-V567 PolarHBondContact O-N 3.15Å; V567-D569 VanDerWaalsContact C-N 3.33Å; V567-D569 PolarHBondContact O-N 2.69Å; V567-I570 PolarHBondContact O-N 2.83Å; V567-F571 HydrophobicContact CG1-CD2 4.04Å; V567-F571 HydrophobicContact CG1-CE2 3.61Å; V567-F571 WeakPolarHBondContact O-CD2 3.23Å; V567-F571 PolarHBondContact O-N 3.43Å
568	K	84.6	Confident	88.1	Confident	129 Å²	129	66.9 Å²	66.9	56%	0.561	34%	0.34	S	S	*	.	H	α-helix	trans	-66.2	-35.5	177.1	-69.3	179.1	-179.7	178.5	0	112.3	R565 T566	R565-K568 WeakPolarHBondContact O-CB 3.32Å; R565-K568 PolarHBondContact O-N 3.04Å; T566-K568 VanDerWaalsContact C-N 3.32Å; T566-K568 PolarHBondContact O-N 2.6Å
569	D	86	Confident	88.2	Confident	54 Å²	54	71.6 Å²	71.6	29%	0.289	36%	0.361	S	S	.	.	H	α-helix	trans	-75.5	-35.3	176.6	-67.4	-38.8	0	0	0	112	R565 T566 V567 F571 K572 F573	R565-D569 PolarHBondContact O-N 3.01Å; T566-D569 PolarHBondContact O-N 3.2Å; T566-D569 VanDerWaalsContact O-N 3.15Å; V567-D569 VanDerWaalsContact C-N 3.33Å; V567-D569 PolarHBondContact O-N 2.69Å; D569-F571 VanDerWaalsContact C-N 3.25Å; D569-F571 PolarHBondContact O-N 2.97Å; D569-K572 WeakPolarHBondContact O-CB 3.25Å; D569-K572 PolarHBondContact O-N 2.96Å; D569-K572 VanDerWaalsContact O-N 3.11Å; D569-K572 IonicContact OD1-NZ 3.9Å; D569-K572 PolarHBondContact OD1-NZ 3.11Å; D569-F573 PolarHBondContact O-N 3.38Å
570	I	89.8	Confident	88.5	Confident	39 Å²	39	68.3 Å²	68.3	20%	0.2	35%	0.345	C	S	.	.	H	α-helix	trans	-55.3	-41.8	171.1	-68.8	167.8	0	0	0	110.8	T566 V567 K572 F573 M574 L659 I663	T566-I570 VanDerWaalsContact O-CG1 3.23Å; T566-I570 WeakPolarHBondContact O-CG1 3.43Å; T566-I570 PolarHBondContact O-N 2.57Å; V567-I570 PolarHBondContact O-N 2.83Å; I570-K572 VanDerWaalsContact C-N 3.28Å; I570-K572 PolarHBondContact O-N 2.95Å; I570-F573 PolarHBondContact O-N 3.37Å; I570-F573 VanDerWaalsContact O-N 3.12Å; I570-M574 HydrophobicContact CG2-CG 3.93Å; I570-M574 WeakPolarHBondContact O-CG 3.43Å; I570-M574 PolarHBondContact O-N 2.93Å; I570-L659 HydrophobicContact CG1-CD1 4.11Å; I570-L659 HydrophobicContact CG2-CD1 4.26Å; I570-I663 HydrophobicContact CD1-CD1 3.61Å; I570-I663 HydrophobicContact CD1-CG1 3.93Å; I570-I663 HydrophobicContact CG1-CD1 3.81Å; I570-I663 HydrophobicContact CG1-CG1 3.76Å
571	F	87	Confident	88.7	Confident	139 Å²	139	67.4 Å²	67.4	61%	0.61	34%	0.341	S	S	*	.	H	α-helix	trans	-60.4	-33.7	179.1	-83.3	-66.5	0	0	0	113.9	V567 D569 F573 M574	V567-F571 HydrophobicContact CG1-CD2 4.04Å; V567-F571 HydrophobicContact CG1-CE2 3.61Å; V567-F571 WeakPolarHBondContact O-CD2 3.23Å; V567-F571 PolarHBondContact O-N 3.43Å; D569-F571 VanDerWaalsContact C-N 3.25Å; D569-F571 PolarHBondContact O-N 2.97Å; F571-F573 VanDerWaalsContact C-N 3.34Å; F571-M574 PolarHBondContact O-N 3.02Å
572	K	85.2	Confident	89	Confident	150 Å²	150	68.3 Å²	68.3	65%	0.652	35%	0.348	S	S	*	.	H	α-helix	trans	-64.9	-41.4	176.1	-62.2	171.4	-173.3	155	0	110.8	D569 I570	D569-K572 WeakPolarHBondContact O-CB 3.25Å; D569-K572 PolarHBondContact O-N 2.96Å; D569-K572 VanDerWaalsContact O-N 3.11Å; D569-K572 IonicContact OD1-NZ 3.9Å; D569-K572 PolarHBondContact OD1-NZ 3.11Å; I570-K572 VanDerWaalsContact C-N 3.28Å; I570-K572 PolarHBondContact O-N 2.95Å
573	F	85.2	Confident	89.4	Confident	33 Å²	33	71.1 Å²	71.1	15%	0.145	37%	0.371	C	S	.	.	H	α-helix	trans	-73.9	-34.3	178.4	-173.6	-95.6	0	0	0	112.8	D569 I570 F571 V575 I576 F577 L655 M658 L659	D569-F573 PolarHBondContact O-N 3.38Å; I570-F573 PolarHBondContact O-N 3.37Å; I570-F573 VanDerWaalsContact O-N 3.12Å; F571-F573 VanDerWaalsContact C-N 3.34Å; F573-V575 PolarHBondContact O-N 3.13Å; F573-I576 PolarHBondContact O-N 3.49Å; F573-F577 PolarHBondContact O-N 3.25Å; F573-L655 HydrophobicContact CE1-CB 4.45Å; F573-L655 HydrophobicContact CE1-CD2 4.42Å; F573-L655 HydrophobicContact CZ-CB 4.4Å; F573-L655 HydrophobicContact CZ-CD2 3.8Å; F573-M658 HydrophobicContact CE2-CB 4.36Å; F573-M658 HydrophobicContact CZ-CB 4.07Å; F573-L659 HydrophobicContact CB-CD1 4.4Å; F573-L659 HydrophobicContact CD1-CB 4.15Å; F573-L659 HydrophobicContact CD1-CD1 3.74Å; F573-L659 HydrophobicContact CD1-CG 4.41Å; F573-L659 HydrophobicContact CE1-CB 3.87Å; F573-L659 HydrophobicContact CE1-CD1 4.34Å; F573-L659 HydrophobicContact CG-CD1 4.26Å
574	M	87.7	Confident	89.9	Confident	67 Å²	67	67.9 Å²	67.9	33%	0.33	35%	0.353	S	S	.	.	H	α-helix	trans	-56.5	-23.7	177.6	-80.3	-63.4	-143.5	0	0	113.4	I570 F571 F577 I578	I570-M574 HydrophobicContact CG2-CG 3.93Å; I570-M574 WeakPolarHBondContact O-CG 3.43Å; I570-M574 PolarHBondContact O-N 2.93Å; F571-M574 PolarHBondContact O-N 3.02Å; M574-F577 WeakPolarHBondContact O-CB 3.48Å; M574-F577 PolarHBondContact O-N 3.25Å; M574-F577 HydrophobicContact SD-CB 4.2Å; M574-F577 HydrophobicContact SD-CD1 4.14Å; M574-F577 HydrophobicContact SD-CG 4.17Å; M574-I578 WeakPolarHBondContact O-CB 3.47Å; M574-I578 WeakPolarHBondContact O-CD1 3.49Å; M574-I578 VanDerWaalsContact O-CG1 3.23Å; M574-I578 WeakPolarHBondContact O-CG1 3.44Å; M574-I578 PolarHBondContact O-N 3.29Å
575	V	90.6	Very high	90.3	Very high	101 Å²	101	67.3 Å²	67.3	61%	0.612	34%	0.341	S	S	*	.	H	α-helix	trans	-61.4	-45.9	174.8	179.3	0	0	0	0	111.6	F573 F577 I578 M579	F573-V575 PolarHBondContact O-N 3.13Å; V575-F577 VanDerWaalsContact C-N 3.33Å; V575-I578 PolarHBondContact O-N 3.45Å; V575-M579 PolarHBondContact O-N 2.98Å; V575-M579 VanDerWaalsContact O-N 3.09Å
576	I	90.2	Very high	90.8	Very high	84 Å²	84	68.1 Å²	68.1	43%	0.431	35%	0.349	S	S	.	.	H	α-helix	trans	-66.5	-41.3	177.7	-61	173.5	0	0	0	109.6	F573 I578 M579 V580	F573-I576 PolarHBondContact O-N 3.49Å; I576-I578 PolarHBondContact O-N 3.49Å; I576-M579 PolarHBondContact O-N 3.32Å; I576-V580 WeakPolarHBondContact O-CG2 3.11Å; I576-V580 PolarHBondContact O-N 3.46Å; I576-V580 VanDerWaalsContact O-N 3.09Å
577	F	90.3	Very high	91.1	Very high	32 Å²	32	68.9 Å²	68.9	14%	0.14	36%	0.36	C	S	.	.	H	α-helix	trans	-58.1	-49.1	177.1	-173.9	-85.1	0	0	0	112.2	F573 M574 V575 M579 V580 F581 I618 M651 L655	F573-F577 PolarHBondContact O-N 3.25Å; M574-F577 WeakPolarHBondContact O-CB 3.48Å; M574-F577 PolarHBondContact O-N 3.25Å; M574-F577 HydrophobicContact SD-CB 4.2Å; M574-F577 HydrophobicContact SD-CD1 4.14Å; M574-F577 HydrophobicContact SD-CG 4.17Å; V575-F577 VanDerWaalsContact C-N 3.33Å; F577-M579 VanDerWaalsContact C-N 3.32Å; F577-M579 PolarHBondContact O-N 3.48Å; F577-V580 PolarHBondContact O-N 2.91Å; F577-F581 VanDerWaalsContact O-CB 3.27Å; F577-F581 WeakPolarHBondContact O-CB 3.43Å; F577-F581 PolarHBondContact O-N 3.04Å; F577-I618 HydrophobicContact CE1-CD1 4.1Å; F577-I618 HydrophobicContact CZ-CD1 3.68Å; F577-I618 HydrophobicContact CZ-CG1 4.37Å; F577-M651 HydrophobicContact CD1-CE 3.95Å; F577-M651 HydrophobicContact CD2-CE 3.62Å; F577-M651 HydrophobicContact CE1-CE 3.55Å; F577-M651 HydrophobicContact CE2-CE 3.2Å; F577-M651 HydrophobicContact CG-CE 3.98Å; F577-M651 HydrophobicContact CZ-CE 3.17Å; F577-L655 HydrophobicContact CD2-CB 4.35Å; F577-L655 HydrophobicContact CD2-CD1 4.27Å
578	I	92.2	Very high	91.5	Very high	98 Å²	98	66.2 Å²	66.2	50%	0.503	34%	0.344	S	S	.	.	H	α-helix	trans	-63.9	-39	179	-68	164	0	0	0	110.8	M574 V575 I576 F581 V582	M574-I578 WeakPolarHBondContact O-CB 3.47Å; M574-I578 WeakPolarHBondContact O-CD1 3.49Å; M574-I578 VanDerWaalsContact O-CG1 3.23Å; M574-I578 WeakPolarHBondContact O-CG1 3.44Å; M574-I578 PolarHBondContact O-N 3.29Å; V575-I578 PolarHBondContact O-N 3.45Å; I576-I578 PolarHBondContact O-N 3.49Å; I578-F581 PolarHBondContact O-N 3.38Å; I578-V582 HydrophobicContact CG2-CG2 4.17Å; I578-V582 WeakPolarHBondContact O-CB 3.42Å; I578-V582 VanDerWaalsContact O-CG2 3.31Å; I578-V582 WeakPolarHBondContact O-CG2 3.41Å; I578-V582 PolarHBondContact O-N 3.05Å
579	M	93.8	Very high	92	Very high	130 Å²	130	62.7 Å²	62.7	64%	0.64	33%	0.328	S	S	*	.	H	α-helix	trans	-61.2	-48	178.5	-173.9	179.8	70.1	0	0	111.9	V575 I576 F577 A583	V575-M579 PolarHBondContact O-N 2.98Å; V575-M579 VanDerWaalsContact O-N 3.09Å; I576-M579 PolarHBondContact O-N 3.32Å; F577-M579 VanDerWaalsContact C-N 3.32Å; F577-M579 PolarHBondContact O-N 3.48Å; M579-A583 WeakPolarHBondContact O-CB 3.45Å; M579-A583 PolarHBondContact O-N 2.89Å; M579-A583 VanDerWaalsContact O-N 3.13Å
580	V	94.2	Very high	92.4	Very high	30 Å²	30	64.6 Å²	64.6	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-64.9	-44.7	176.4	177.3	0	0	0	0	110.5	I576 F577 V582 A583 F584 T650 M651 L655	I576-V580 WeakPolarHBondContact O-CG2 3.11Å; I576-V580 PolarHBondContact O-N 3.46Å; I576-V580 VanDerWaalsContact O-N 3.09Å; F577-V580 PolarHBondContact O-N 2.91Å; V580-V582 PolarHBondContact O-N 3.35Å; V580-A583 PolarHBondContact O-N 3.38Å; V580-F584 HydrophobicContact CG1-CD2 3.77Å; V580-F584 HydrophobicContact CG1-CE2 3.77Å; V580-F584 WeakPolarHBondContact O-CD2 3.28Å; V580-F584 PolarHBondContact O-N 3.21Å; V580-F584 VanDerWaalsContact O-N 3.14Å; V580-T650 HydrophobicContact CG1-CG2 4.15Å; V580-M651 HydrophobicContact CB-SD 4.13Å; V580-M651 HydrophobicContact CG1-SD 3.65Å; V580-L655 HydrophobicContact CB-CD1 4.32Å; V580-L655 HydrophobicContact CG1-CD1 4.43Å; V580-L655 HydrophobicContact CG2-CD1 4.33Å
581	F	94.6	Very high	92.6	Very high	14 Å²	14	64.2 Å²	64.2	6%	0.061	34%	0.337	C	S	.	.	H	α-helix	trans	-56.5	-49	178.7	-177.8	-87.2	0	0	0	112.4	F577 I578 A583 F584 M585 F611 L614 F615 I618 Y647 M651	F577-F581 VanDerWaalsContact O-CB 3.27Å; F577-F581 WeakPolarHBondContact O-CB 3.43Å; F577-F581 PolarHBondContact O-N 3.04Å; I578-F581 PolarHBondContact O-N 3.38Å; F581-A583 PolarHBondContact O-N 3.07Å; F581-F584 PolarHBondContact O-N 2.97Å; F581-M585 HydrophobicContact CE1-SD 4.48Å; F581-M585 VanDerWaalsContact O-CB 3.31Å; F581-M585 WeakPolarHBondContact O-CB 3.31Å; F581-M585 PolarHBondContact O-N 3.29Å; F581-F611 AromaticContact CE1-CD2 3.51Å; F581-F611 HydrophobicContact CE1-CD2 3.51Å; F581-F611 AromaticContact CE1-CE2 3.67Å; F581-F611 HydrophobicContact CE1-CE2 3.67Å; F581-F611 HydrophobicContact CE1-CG 4.49Å; F581-F611 AromaticContact CZ-CD2 3.9Å; F581-F611 HydrophobicContact CZ-CD2 3.9Å; F581-F611 HydrophobicContact CZ-CE2 4.02Å; F581-L614 HydrophobicContact CE2-CB 3.72Å; F581-L614 HydrophobicContact CZ-CB 3.92Å; F581-F615 HydrophobicContact CE2-CB 4.46Å; F581-F615 HydrophobicContact CZ-CB 4.25Å; F581-I618 HydrophobicContact CD2-CD1 4.15Å; F581-I618 HydrophobicContact CE2-CD1 4.05Å; F581-Y647 HydrophobicContact CD2-CE2 4.24Å; F581-Y647 WeakPolarHBondContact CD2-OH 3.46Å; F581-Y647 WeakPolarHBondContact CE2-OH 3.3Å; F581-M651 HydrophobicContact CB-CE 4.2Å; F581-M651 HydrophobicContact CD2-CE 4.26Å
582	V	95.4	Very high	92.9	Very high	56 Å²	56	57.6 Å²	57.6	34%	0.339	31%	0.308	S	S	.	.	H	α-helix	trans	-66	-38.4	179.7	171.4	0	0	0	0	111.6	I578 V580 M585 I586	I578-V582 HydrophobicContact CG2-CG2 4.17Å; I578-V582 WeakPolarHBondContact O-CB 3.42Å; I578-V582 VanDerWaalsContact O-CG2 3.31Å; I578-V582 WeakPolarHBondContact O-CG2 3.41Å; I578-V582 PolarHBondContact O-N 3.05Å; V580-V582 PolarHBondContact O-N 3.35Å; V582-M585 HydrophobicContact CG1-CE 4.36Å; V582-M585 PolarHBondContact O-N 3.35Å; V582-I586 HydrophobicContact CG1-CD1 3.72Å; V582-I586 HydrophobicContact CG1-CG1 4.3Å; V582-I586 WeakPolarHBondContact O-CG1 3.26Å; V582-I586 PolarHBondContact O-N 3.3Å
583	A	96.3	Very high	93.3	Very high	63 Å²	63	52 Å²	52	52%	0.521	29%	0.288	S	S	.	.	H	α-helix	trans	-59.8	-48	177.6	0	0	0	0	0	112	M579 V580 F581 G587	M579-A583 WeakPolarHBondContact O-CB 3.45Å; M579-A583 PolarHBondContact O-N 2.89Å; M579-A583 VanDerWaalsContact O-N 3.13Å; V580-A583 PolarHBondContact O-N 3.38Å; F581-A583 PolarHBondContact O-N 3.07Å; A583-G587 PolarHBondContact O-N 3.04Å
584	F	95.8	Very high	93.6	Very high	39 Å²	39	60.2 Å²	60.2	17%	0.171	32%	0.319	C	S	.	.	H	α-helix	trans	-70.7	-35.6	176.4	-79.5	-79.6	0	0	0	112.8	V580 F581 G587 M588 L614 L643 V646 Y647	V580-F584 HydrophobicContact CG1-CD2 3.77Å; V580-F584 HydrophobicContact CG1-CE2 3.77Å; V580-F584 WeakPolarHBondContact O-CD2 3.28Å; V580-F584 PolarHBondContact O-N 3.21Å; V580-F584 VanDerWaalsContact O-N 3.14Å; F581-F584 PolarHBondContact O-N 2.97Å; F584-G587 PolarHBondContact O-N 3.48Å; F584-M588 WeakPolarHBondContact O-CB 3.34Å; F584-M588 VanDerWaalsContact O-CG 3.3Å; F584-M588 WeakPolarHBondContact O-CG 3.13Å; F584-M588 PolarHBondContact O-N 2.87Å; F584-L614 HydrophobicContact CB-CD1 4.44Å; F584-L643 HydrophobicContact CE1-CD2 4.43Å; F584-V646 HydrophobicContact CE1-CG1 4.28Å; F584-V646 HydrophobicContact CZ-CG1 3.96Å; F584-Y647 HydrophobicContact CB-CD2 3.56Å; F584-Y647 HydrophobicContact CB-CE2 4.2Å; F584-Y647 HydrophobicContact CB-CG 4.43Å; F584-Y647 HydrophobicContact CD1-CD2 4.34Å; F584-Y647 AromaticContact CD2-CD2 3.86Å; F584-Y647 HydrophobicContact CD2-CD2 3.86Å; F584-Y647 AromaticContact CG-CD2 3.68Å; F584-Y647 HydrophobicContact CG-CD2 3.68Å; F584-Y647 HydrophobicContact CG-CG 4.36Å
585	M	95.6	Very high	93.7	Very high	21 Å²	21	58.7 Å²	58.7	10%	0.103	31%	0.31	C	S	.	.	H	α-helix	trans	-59.1	-49	175	-177	-160.7	69	0	0	111.6	F581 V582 F589 V607 F611 L614	F581-M585 HydrophobicContact CE1-SD 4.48Å; F581-M585 VanDerWaalsContact O-CB 3.31Å; F581-M585 WeakPolarHBondContact O-CB 3.31Å; F581-M585 PolarHBondContact O-N 3.29Å; V582-M585 HydrophobicContact CG1-CE 4.36Å; V582-M585 PolarHBondContact O-N 3.35Å; M585-F589 VanDerWaalsContact O-CB 3.26Å; M585-F589 WeakPolarHBondContact O-CB 3.12Å; M585-F589 PolarHBondContact O-N 3.04Å; M585-V607 HydrophobicContact CE-CG1 3.98Å; M585-V607 HydrophobicContact SD-CG1 4.2Å; M585-F611 HydrophobicContact SD-CB 4.01Å; M585-F611 HydrophobicContact SD-CD2 4.27Å; M585-L614 HydrophobicContact CB-CD1 3.8Å; M585-L614 HydrophobicContact CG-CD1 4.44Å
586	I	96.3	Very high	93.5	Very high	80 Å²	80	60 Å²	60	41%	0.41	31%	0.312	S	S	.	.	H	α-helix	trans	-67.3	-39.5	177.7	-64.7	172.2	0	0	0	110.4	V582 F589 N590	V582-I586 HydrophobicContact CG1-CD1 3.72Å; V582-I586 HydrophobicContact CG1-CG1 4.3Å; V582-I586 WeakPolarHBondContact O-CG1 3.26Å; V582-I586 PolarHBondContact O-N 3.3Å; I586-F589 PolarHBondContact O-N 3.21Å; I586-N590 WeakPolarHBondContact O-CB 3.4Å; I586-N590 VanDerWaalsContact O-CG 3.25Å; I586-N590 PolarHBondContact O-N 2.9Å
587	G	95.9	Very high	93.2	Very high	30 Å²	30	59.2 Å²	59.2	31%	0.309	33%	0.325	S	S	.	.	H	α-helix	trans	-59.1	-48.3	176	0	0	0	0	0	113	A583 F584 N590 L591	A583-G587 PolarHBondContact O-N 3.04Å; F584-G587 PolarHBondContact O-N 3.48Å; G587-N590 PolarHBondContact O-N 3.34Å; G587-L591 WeakPolarHBondContact O-CB 3.38Å; G587-L591 PolarHBondContact O-N 3.25Å; G587-L591 VanDerWaalsContact O-N 3.11Å
588	M	93.9	Very high	92.8	Very high	2 Å²	2	58 Å²	58	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-68.2	-40	177.7	-68.8	-65.8	-76.1	0	0	112.1	F584 L591 Y592 F604 L643	F584-M588 WeakPolarHBondContact O-CB 3.34Å; F584-M588 VanDerWaalsContact O-CG 3.3Å; F584-M588 WeakPolarHBondContact O-CG 3.13Å; F584-M588 PolarHBondContact O-N 2.87Å; M588-L591 PolarHBondContact O-N 3.48Å; M588-Y592 HydrophobicContact CE-CD2 4.19Å; M588-Y592 HydrophobicContact CE-CE2 3.76Å; M588-Y592 WeakPolarHBondContact O-CD2 3.47Å; M588-Y592 PolarHBondContact O-N 3.24Å; M588-Y592 HydrophobicContact SD-CE2 4.42Å; M588-F604 HydrophobicContact CB-CD1 3.65Å; M588-F604 HydrophobicContact CB-CE1 4.06Å; M588-F604 HydrophobicContact CB-CG 4.29Å; M588-F604 HydrophobicContact CE-CD1 4.05Å; M588-F604 HydrophobicContact CE-CD2 3.97Å; M588-F604 HydrophobicContact CE-CE1 3.8Å; M588-F604 HydrophobicContact CE-CE2 3.74Å; M588-F604 HydrophobicContact CE-CG 4.12Å; M588-F604 HydrophobicContact CE-CZ 3.65Å; M588-F604 HydrophobicContact CG-CD1 4.33Å; M588-F604 HydrophobicContact CG-CE1 4.26Å; M588-L643 HydrophobicContact SD-CB 3.69Å; M588-L643 HydrophobicContact SD-CD1 4.19Å
589	F	95.4	Very high	92.5	Very high	54 Å²	54	53.9 Å²	53.9	24%	0.237	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-48.5	174.3	168.9	-110.4	0	0	0	111.6	M585 I586 L591 Y592 S593 T605 V607	M585-F589 VanDerWaalsContact O-CB 3.26Å; M585-F589 WeakPolarHBondContact O-CB 3.12Å; M585-F589 PolarHBondContact O-N 3.04Å; I586-F589 PolarHBondContact O-N 3.21Å; F589-L591 VanDerWaalsContact C-N 3.26Å; F589-L591 PolarHBondContact O-N 3.18Å; F589-Y592 PolarHBondContact O-N 3.09Å; F589-S593 WeakPolarHBondContact O-CA 3.22Å; F589-S593 WeakPolarHBondContact O-CB 3.42Å; F589-S593 PolarHBondContact O-N 3.39Å; F589-S593 PolarHBondContact O-OG 3.11Å; F589-T605 WeakPolarHBondContact CE2-O 3.37Å; F589-V607 HydrophobicContact CD1-CG2 3.95Å; F589-V607 HydrophobicContact CD2-CG2 3.98Å; F589-V607 HydrophobicContact CE1-CG2 3.89Å; F589-V607 HydrophobicContact CE2-CG2 3.93Å; F589-V607 HydrophobicContact CG-CG2 3.98Å; F589-V607 HydrophobicContact CZ-CG2 3.87Å
590	N	95.4	Very high	92	Very high	95 Å²	95	54.7 Å²	54.7	51%	0.508	30%	0.297	S	S	.	.	H	α-helix	trans	-62.4	-35.2	179.5	-74.4	-13	0	0	0	111.9	I586 G587 S593	I586-N590 WeakPolarHBondContact O-CB 3.4Å; I586-N590 VanDerWaalsContact O-CG 3.25Å; I586-N590 PolarHBondContact O-N 2.9Å; G587-N590 PolarHBondContact O-N 3.34Å; N590-S593 PolarHBondContact O-OG 2.73Å
591	L	94.1	Very high	91.5	Very high	31 Å²	31	55.9 Å²	55.9	16%	0.162	30%	0.302	C	S	.	.	H	α-helix	trans	-68.7	-41.9	177.2	-171.5	68.4	0	0	0	112.7	G587 M588 F589 I636 I639 L643	G587-L591 WeakPolarHBondContact O-CB 3.38Å; G587-L591 PolarHBondContact O-N 3.25Å; G587-L591 VanDerWaalsContact O-N 3.11Å; M588-L591 PolarHBondContact O-N 3.48Å; F589-L591 VanDerWaalsContact C-N 3.26Å; F589-L591 PolarHBondContact O-N 3.18Å; L591-I636 HydrophobicContact CD1-CD1 3.91Å; L591-I636 HydrophobicContact CD1-CG2 3.97Å; L591-I636 HydrophobicContact CD2-CG2 4.42Å; L591-I636 HydrophobicContact CG-CG2 3.95Å; L591-I639 HydrophobicContact CD1-CG2 4.12Å; L591-I639 HydrophobicContact CD2-CB 4.42Å; L591-I639 HydrophobicContact CD2-CG2 3.91Å; L591-L643 HydrophobicContact CD2-CD1 4.16Å
592	Y	93.6	Very high	91.1	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-104.5	-7.1	-170.2	-74.6	-69.1	0	0	0	115.7	M588 F589 Y594 Y595 K599 F604 V627 L629 I636 G640	M588-Y592 HydrophobicContact CE-CD2 4.19Å; M588-Y592 HydrophobicContact CE-CE2 3.76Å; M588-Y592 WeakPolarHBondContact O-CD2 3.47Å; M588-Y592 PolarHBondContact O-N 3.24Å; M588-Y592 HydrophobicContact SD-CE2 4.42Å; F589-Y592 PolarHBondContact O-N 3.09Å; Y592-Y594 VanDerWaalsContact C-N 3.28Å; Y592-Y594 PolarHBondContact O-N 2.98Å; Y592-Y595 HydrophobicContact CD1-CD2 4.4Å; Y592-Y595 PolarHBondContact O-N 3.24Å; Y592-K599 HydrophobicContact CD1-CD 3.99Å; Y592-F604 WeakPolarHBondContact CB-O 3.37Å; Y592-F604 HydrophobicContact CD2-CB 3.76Å; Y592-F604 HydrophobicContact CD2-CD2 4.26Å; Y592-F604 HydrophobicContact CD2-CG 4.19Å; Y592-F604 HydrophobicContact CG-CB 3.99Å; Y592-V627 WeakPolarHBondContact OH-CG1 3.29Å; Y592-V627 PolarHBondContact OH-O 3.31Å; Y592-L629 HydrophobicContact CD1-CD2 4.14Å; Y592-L629 HydrophobicContact CE1-CD1 4.08Å; Y592-L629 HydrophobicContact CE1-CD2 3.99Å; Y592-L629 HydrophobicContact CE1-CG 4.05Å; Y592-I636 HydrophobicContact CE1-CG2 4.29Å; Y592-G640 WeakPolarHBondContact OH-CA 3.39Å
593	S	93.1	Very high	90.8	Very high	32 Å²	32	56.6 Å²	56.6	22%	0.224	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-54.3	-39.2	-178.7	57	0	0	0	0	113.7	F589 N590 Y595	F589-S593 WeakPolarHBondContact O-CA 3.22Å; F589-S593 WeakPolarHBondContact O-CB 3.42Å; F589-S593 PolarHBondContact O-N 3.39Å; F589-S593 PolarHBondContact O-OG 3.11Å; N590-S593 PolarHBondContact O-OG 2.73Å; S593-Y595 VanDerWaalsContact C-N 3.26Å; S593-Y595 PolarHBondContact O-N 3.39Å
594	Y	91.8	Very high	90.6	Very high	206 Å²	206	53.6 Å²	53.6	81%	0.808	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-74.8	-10.2	179.3	-61.4	-75.9	0	0	0	114.5	Y592	Y592-Y594 VanDerWaalsContact C-N 3.28Å; Y592-Y594 PolarHBondContact O-N 2.98Å
595	Y	88.9	Confident	90.4	Very high	35 Å²	35	52.3 Å²	52.3	14%	0.137	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-99.8	25.6	-175	-66.1	-82.4	0	0	0	113.2	Y592 S593 G597 A598 L629 H633 I636	Y592-Y595 HydrophobicContact CD1-CD2 4.4Å; Y592-Y595 PolarHBondContact O-N 3.24Å; S593-Y595 VanDerWaalsContact C-N 3.26Å; S593-Y595 PolarHBondContact O-N 3.39Å; Y595-G597 PolarHBondContact O-N 3.47Å; Y595-A598 HydrophobicContact CD1-CB 4.34Å; Y595-A598 PolarHBondContact O-N 3.08Å; Y595-L629 HydrophobicContact CD1-CD2 3.63Å; Y595-L629 HydrophobicContact CD2-CD2 4.33Å; Y595-L629 HydrophobicContact CE1-CD2 4.31Å; Y595-L629 HydrophobicContact CG-CD2 3.63Å; Y595-H633 AromaticContact CE1-ND1 3.54Å; Y595-H633 AromaticContact CZ-ND1 3.71Å; Y595-H633 PolarHBondContact OH-ND1 3.02Å; Y595-I636 HydrophobicContact CE2-CG1 4.5Å; Y595-I636 HydrophobicContact CE2-CG2 3.88Å
596	L	86.9	Confident	90.3	Very high	127 Å²	127	54.2 Å²	54.2	67%	0.665	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	125	174.6	-170.4	71.8	0	0	0	110.4	A598 T605	L596-A598 PolarHBondContact O-N 3.36Å; L596-T605 HydrophobicContact CD1-CG2 4.07Å
597	G	82.9	Confident	90.2	Very high	68 Å²	68	53.8 Å²	53.8	70%	0.701	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	-14.7	-176.1	0	0	0	0	0	115.2	Y595	Y595-G597 PolarHBondContact O-N 3.47Å
598	A	82.1	Confident	90	Very high	8 Å²	8	58.2 Å²	58.2	7%	0.066	31%	0.307	C	S	.	.	S	Bend	trans	-96.2	12.9	-179.5	0	0	0	0	0	114.1	Y595 L596 K630 Y631	Y595-A598 HydrophobicContact CD1-CB 4.34Å; Y595-A598 PolarHBondContact O-N 3.08Å; L596-A598 PolarHBondContact O-N 3.36Å; A598-K630 WeakPolarHBondContact O-CB 3.49Å; A598-K630 PolarHBondContact O-N 3.24Å; A598-Y631 HydrophobicContact CB-CD2 3.59Å; A598-Y631 HydrophobicContact CB-CE2 3.38Å
599	K	85.8	Confident	89.9	Confident	11 Å²	11	60.6 Å²	60.6	5%	0.048	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-120.5	159	179.4	-65.3	-175.6	73.7	173.4	0	111.1	Y592 N601 A603 T605 S626 L629 K630	Y592-K599 HydrophobicContact CD1-CD 3.99Å; K599-N601 VanDerWaalsContact CB-O 3.26Å; K599-N601 WeakPolarHBondContact CB-O 3.47Å; K599-A603 PolarHBondContact NZ-O 3.44Å; K599-T605 HydrophobicContact CD-CG2 4.25Å; K599-S626 WeakPolarHBondContact CE-O 3.31Å; K599-S626 PolarHBondContact NZ-O 2.72Å; K599-L629 HydrophobicContact CD-CD2 4.15Å; K599-L629 HydrophobicContact CG-CD2 3.71Å; K599-K630 VanDerWaalsContact O-CE 3.22Å; K599-K630 WeakPolarHBondContact O-CE 3.38Å; K599-K630 PolarHBondContact O-NZ 2.88Å
600	Y	83.2	Confident	89.8	Confident	147 Å²	147	58 Å²	58	58%	0.576	31%	0.307	S	S	*	.	S	Bend	trans	-73.8	-40.1	172.4	-68.7	-79.8	0	0	0	111.6	V628 K630	Y600-V628 HydrophobicContact CD2-CG1 4.19Å; Y600-V628 HydrophobicContact CE2-CG1 4.08Å; Y600-K630 HydrophobicContact CD2-CG 4.17Å; Y600-K630 HydrophobicContact CE1-CG 4.27Å; Y600-K630 HydrophobicContact CE2-CG 3.87Å; Y600-K630 HydrophobicContact CG-CG 4.5Å
601	N	84.4	Confident	89.8	Confident	54 Å²	54	58.2 Å²	58.2	29%	0.289	30%	0.303	S	S	.	.	S	Bend	trans	-111.9	146.7	175.2	-72.8	-22.3	0	0	0	110.6	K599 A603 E623	K599-N601 VanDerWaalsContact CB-O 3.26Å; K599-N601 WeakPolarHBondContact CB-O 3.47Å; N601-A603 HydrophobicContact CB-CB 4.34Å; N601-A603 PolarHBondContact O-N 2.97Å; N601-E623 PolarHBondContact ND2-OE2 3.03Å; N601-E623 VanDerWaalsContact ND2-OE2 3.12Å
602	P	86.3	Confident	89.8	Confident	82 Å²	82	60.1 Å²	60.1	53%	0.532	31%	0.31	S	S	.	.			trans	-69.3	3.4	177.7	30	-35.6	0	0	0	113.8	T605	P602-T605 PolarHBondContact O-N 3.22Å; P602-T605 PolarHBondContact O-OG1 3.26Å
603	A	89.6	Confident	89.7	Confident	4 Å²	4	61 Å²	61	3%	0.033	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	138.6	179.7	0	0	0	0	0	113.5	K599 N601 T605 T613	K599-A603 PolarHBondContact NZ-O 3.44Å; N601-A603 HydrophobicContact CB-CB 4.34Å; N601-A603 PolarHBondContact O-N 2.97Å; A603-T605 PolarHBondContact O-N 3.35Å; A603-T613 HydrophobicContact CB-CG2 3.41Å; A603-T613 VanDerWaalsContact CB-CG2 3.41Å
604	F	91.3	Very high	89.7	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	1.1	176.7	-48.3	-68.2	0	0	0	116.9	M588 Y592 S610 T613 L614 V627 Y644	M588-F604 HydrophobicContact CB-CD1 3.65Å; M588-F604 HydrophobicContact CB-CE1 4.06Å; M588-F604 HydrophobicContact CB-CG 4.29Å; M588-F604 HydrophobicContact CE-CD1 4.05Å; M588-F604 HydrophobicContact CE-CD2 3.97Å; M588-F604 HydrophobicContact CE-CE1 3.8Å; M588-F604 HydrophobicContact CE-CE2 3.74Å; M588-F604 HydrophobicContact CE-CG 4.12Å; M588-F604 HydrophobicContact CE-CZ 3.65Å; M588-F604 HydrophobicContact CG-CD1 4.33Å; M588-F604 HydrophobicContact CG-CE1 4.26Å; Y592-F604 WeakPolarHBondContact CB-O 3.37Å; Y592-F604 HydrophobicContact CD2-CB 3.76Å; Y592-F604 HydrophobicContact CD2-CD2 4.26Å; Y592-F604 HydrophobicContact CD2-CG 4.19Å; Y592-F604 HydrophobicContact CG-CB 3.99Å; F604-S610 WeakPolarHBondContact CA-OG 3.41Å; F604-S610 PolarHBondContact O-OG 3.42Å; F604-T613 WeakPolarHBondContact CD1-OG1 3.4Å; F604-T613 WeakPolarHBondContact CE1-OG1 3.41Å; F604-T613 WeakPolarHBondContact CZ-OG1 3.07Å; F604-L614 HydrophobicContact CE1-CD2 3.79Å; F604-L614 HydrophobicContact CE1-CG 3.9Å; F604-L614 HydrophobicContact CZ-CD2 4.25Å; F604-V627 HydrophobicContact CE2-CG2 4.36Å; F604-Y644 HydrophobicContact CZ-CD2 4.2Å; F604-Y644 HydrophobicContact CZ-CE2 4.31Å
605	T	91.8	Very high	89.8	Confident	12 Å²	12	53.3 Å²	53.3	7%	0.074	28%	0.282	C	S	.	.	S	Bend	trans	-81.3	-33.2	-176.7	60.3	0	0	0	0	112.9	F589 L596 K599 P602 A603	F589-T605 WeakPolarHBondContact CE2-O 3.37Å; L596-T605 HydrophobicContact CD1-CG2 4.07Å; K599-T605 HydrophobicContact CD-CG2 4.25Å; P602-T605 PolarHBondContact O-N 3.22Å; P602-T605 PolarHBondContact O-OG1 3.26Å; A603-T605 PolarHBondContact O-N 3.35Å
606	T	93.3	Very high	90	Very high	61 Å²	61	57.6 Å²	57.6	37%	0.374	30%	0.298	S	S	.	.	S	Bend	trans	-120.2	159	175.4	64.6	0	0	0	0	109.3	E608 E609 S610	T606-E608 VanDerWaalsContact C-N 3.26Å; T606-E608 PolarHBondContact O-N 3.07Å; T606-E609 PolarHBondContact O-N 3.19Å; T606-E609 WeakPolarHBondContact OG1-CB 3.49Å; T606-E609 WeakPolarHBondContact OG1-CG 3.38Å; T606-E609 PolarHBondContact OG1-N 3.23Å; T606-S610 WeakPolarHBondContact O-CB 3.41Å; T606-S610 PolarHBondContact O-N 2.92Å; T606-S610 PolarHBondContact O-OG 3.15Å
607	V	93.8	Very high	90.2	Very high	71 Å²	71	51.8 Å²	51.8	43%	0.43	27%	0.268	S	S	.	.	H	α-helix	trans	-60.3	-38.7	177.9	179.9	0	0	0	0	111.3	M585 F589 F611	M585-V607 HydrophobicContact CE-CG1 3.98Å; M585-V607 HydrophobicContact SD-CG1 4.2Å; F589-V607 HydrophobicContact CD1-CG2 3.95Å; F589-V607 HydrophobicContact CD2-CG2 3.98Å; F589-V607 HydrophobicContact CE1-CG2 3.89Å; F589-V607 HydrophobicContact CE2-CG2 3.93Å; F589-V607 HydrophobicContact CG-CG2 3.98Å; F589-V607 HydrophobicContact CZ-CG2 3.87Å; V607-F611 WeakPolarHBondContact O-CB 3.49Å; V607-F611 PolarHBondContact O-N 3Å
608	E	93.2	Very high	90.6	Very high	122 Å²	122	49.8 Å²	49.8	57%	0.57	24%	0.242	S	C	*	.	H	α-helix	trans	-65.6	-46.3	178.2	-171.9	-171.6	153.5	0	0	112.1	T606 F611 K612	T606-E608 VanDerWaalsContact C-N 3.26Å; T606-E608 PolarHBondContact O-N 3.07Å; E608-F611 WeakPolarHBondContact O-CB 3.27Å; E608-F611 PolarHBondContact O-N 3.15Å; E608-K612 WeakPolarHBondContact O-CG 3.24Å; E608-K612 PolarHBondContact O-N 2.88Å; E608-K612 WeakPolarHBondContact OE1-CE 3.3Å; E608-K612 IonicContact OE1-NZ 2.75Å; E608-K612 PolarHBondContact OE1-NZ 3.26Å
609	E	91.4	Very high	91	Very high	52 Å²	52	55.7 Å²	55.7	24%	0.243	27%	0.266	C	S	.	.	H	α-helix	trans	-71	-34.4	178.8	-67.5	-56.3	142.9	0	0	111.9	T606 F611 K612 T613	T606-E609 PolarHBondContact O-N 3.19Å; T606-E609 WeakPolarHBondContact OG1-CB 3.49Å; T606-E609 WeakPolarHBondContact OG1-CG 3.38Å; T606-E609 PolarHBondContact OG1-N 3.23Å; E609-F611 VanDerWaalsContact C-N 3.33Å; E609-K612 PolarHBondContact O-N 3.27Å; E609-K612 IonicContact OE1-NZ 2.71Å; E609-K612 PolarHBondContact OE1-NZ 3.05Å; E609-T613 VanDerWaalsContact O-CG2 3.22Å; E609-T613 WeakPolarHBondContact O-CG2 3.25Å; E609-T613 PolarHBondContact O-N 3.23Å; E609-T613 PolarHBondContact O-OG1 2.71Å; E609-T613 VanDerWaalsContact O-OG1 3.07Å
610	S	93.7	Very high	91.2	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-59	-43.3	168.9	-65.3	0	0	0	0	112.1	F604 T606 T613 L614	F604-S610 WeakPolarHBondContact CA-OG 3.41Å; F604-S610 PolarHBondContact O-OG 3.42Å; T606-S610 WeakPolarHBondContact O-CB 3.41Å; T606-S610 PolarHBondContact O-N 2.92Å; T606-S610 PolarHBondContact O-OG 3.15Å; S610-T613 PolarHBondContact O-OG1 3.43Å; S610-L614 WeakPolarHBondContact O-CG 3.3Å; S610-L614 PolarHBondContact O-N 3.42Å; S610-L614 VanDerWaalsContact O-N 3.17Å
611	F	94.6	Very high	91.5	Very high	99 Å²	99	57.1 Å²	57.1	43%	0.434	30%	0.299	S	S	.	.	H	α-helix	trans	-61.6	-50.3	176.3	174.3	-87.7	0	0	0	110.5	F581 M585 V607 E608 E609 T613 F615	F581-F611 AromaticContact CE1-CD2 3.51Å; F581-F611 HydrophobicContact CE1-CD2 3.51Å; F581-F611 AromaticContact CE1-CE2 3.67Å; F581-F611 HydrophobicContact CE1-CE2 3.67Å; F581-F611 HydrophobicContact CE1-CG 4.49Å; F581-F611 AromaticContact CZ-CD2 3.9Å; F581-F611 HydrophobicContact CZ-CD2 3.9Å; F581-F611 HydrophobicContact CZ-CE2 4.02Å; M585-F611 HydrophobicContact SD-CB 4.01Å; M585-F611 HydrophobicContact SD-CD2 4.27Å; V607-F611 WeakPolarHBondContact O-CB 3.49Å; V607-F611 PolarHBondContact O-N 3Å; E608-F611 WeakPolarHBondContact O-CB 3.27Å; E608-F611 PolarHBondContact O-N 3.15Å; E609-F611 VanDerWaalsContact C-N 3.33Å; F611-T613 PolarHBondContact O-N 3.24Å; F611-F615 HydrophobicContact CE1-CB 4.34Å; F611-F615 HydrophobicContact CZ-CD2 4.48Å; F611-F615 WeakPolarHBondContact O-CB 3.5Å; F611-F615 PolarHBondContact O-N 3.25Å
612	K	93.5	Very high	91.8	Very high	71 Å²	71	55.7 Å²	55.7	31%	0.309	29%	0.293	S	S	.	.	H	α-helix	trans	-58.3	-47.6	-180	-72.6	173.9	-170.6	160.2	0	111.6	E608 E609 F615 W616	E608-K612 WeakPolarHBondContact O-CG 3.24Å; E608-K612 PolarHBondContact O-N 2.88Å; E608-K612 WeakPolarHBondContact OE1-CE 3.3Å; E608-K612 IonicContact OE1-NZ 2.75Å; E608-K612 PolarHBondContact OE1-NZ 3.26Å; E609-K612 PolarHBondContact O-N 3.27Å; E609-K612 IonicContact OE1-NZ 2.71Å; E609-K612 PolarHBondContact OE1-NZ 3.05Å; K612-F615 PolarHBondContact O-N 3.35Å; K612-W616 PolarHBondContact O-N 3.37Å
613	T	92.8	Very high	91.9	Very high	18 Å²	18	57.1 Å²	57.1	11%	0.11	29%	0.292	C	S	.	.	H	α-helix	trans	-68.8	-39.8	-174.6	56.2	0	0	0	0	112.7	A603 F604 E609 S610 F611 S617 S622	A603-T613 HydrophobicContact CB-CG2 3.41Å; A603-T613 VanDerWaalsContact CB-CG2 3.41Å; F604-T613 WeakPolarHBondContact CD1-OG1 3.4Å; F604-T613 WeakPolarHBondContact CE1-OG1 3.41Å; F604-T613 WeakPolarHBondContact CZ-OG1 3.07Å; E609-T613 VanDerWaalsContact O-CG2 3.22Å; E609-T613 WeakPolarHBondContact O-CG2 3.25Å; E609-T613 PolarHBondContact O-N 3.23Å; E609-T613 PolarHBondContact O-OG1 2.71Å; E609-T613 VanDerWaalsContact O-OG1 3.07Å; S610-T613 PolarHBondContact O-OG1 3.43Å; F611-T613 PolarHBondContact O-N 3.24Å; T613-S617 WeakPolarHBondContact O-CB 3.41Å; T613-S617 PolarHBondContact O-N 3.33Å; T613-S617 VanDerWaalsContact O-N 3.14Å; T613-S622 WeakPolarHBondContact O-CB 3.16Å; T613-S622 PolarHBondContact O-OG 3.49Å
614	L	93.6	Very high	91.7	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-71.6	-37.3	173.3	-68.2	-177.7	0	0	0	112.3	F581 F584 M585 F604 S610 S617 I618 Y644 Y647	F581-L614 HydrophobicContact CE2-CB 3.72Å; F581-L614 HydrophobicContact CZ-CB 3.92Å; F584-L614 HydrophobicContact CB-CD1 4.44Å; M585-L614 HydrophobicContact CB-CD1 3.8Å; M585-L614 HydrophobicContact CG-CD1 4.44Å; F604-L614 HydrophobicContact CE1-CD2 3.79Å; F604-L614 HydrophobicContact CE1-CG 3.9Å; F604-L614 HydrophobicContact CZ-CD2 4.25Å; S610-L614 WeakPolarHBondContact O-CG 3.3Å; S610-L614 PolarHBondContact O-N 3.42Å; S610-L614 VanDerWaalsContact O-N 3.17Å; L614-S617 PolarHBondContact O-N 2.83Å; L614-S617 PolarHBondContact O-OG 3.25Å; L614-I618 PolarHBondContact O-N 3.26Å; L614-Y644 HydrophobicContact CD2-CD2 4.09Å; L614-Y644 HydrophobicContact CD2-CE2 4.17Å; L614-Y647 HydrophobicContact CB-CE2 4.47Å; L614-Y647 HydrophobicContact CD1-CE2 4.33Å; L614-Y647 HydrophobicContact CD2-CD1 4.03Å; L614-Y647 HydrophobicContact CD2-CD2 4.38Å; L614-Y647 HydrophobicContact CD2-CE1 3.99Å; L614-Y647 HydrophobicContact CD2-CE2 4.24Å; L614-Y647 HydrophobicContact CD2-CG 4.25Å; L614-Y647 PolarHBondContact O-OH 2.92Å; L614-Y647 VanDerWaalsContact O-OH 3.05Å
615	F	93.4	Very high	91.5	Very high	77 Å²	77	65.5 Å²	65.5	34%	0.338	34%	0.339	S	S	.	.	H	α-helix	trans	-61.3	-48.5	177.5	177.4	-97.5	0	0	0	111.2	F581 F611 K612 S617 I618 F619	F581-F615 HydrophobicContact CE2-CB 4.46Å; F581-F615 HydrophobicContact CZ-CB 4.25Å; F611-F615 HydrophobicContact CE1-CB 4.34Å; F611-F615 HydrophobicContact CZ-CD2 4.48Å; F611-F615 WeakPolarHBondContact O-CB 3.5Å; F611-F615 PolarHBondContact O-N 3.25Å; K612-F615 PolarHBondContact O-N 3.35Å; F615-S617 VanDerWaalsContact C-N 3.28Å; F615-S617 PolarHBondContact O-N 3.3Å; F615-I618 PolarHBondContact O-N 2.85Å; F615-F619 AromaticContact CE1-CE2 3.98Å; F615-F619 HydrophobicContact CE1-CE2 3.98Å; F615-F619 HydrophobicContact CE2-CE2 4.24Å; F615-F619 AromaticContact CZ-CE2 3.78Å; F615-F619 HydrophobicContact CZ-CE2 3.78Å
616	W	93.1	Very high	91.2	Very high	125 Å²	125	65 Å²	65	47%	0.473	34%	0.336	S	S	.	.	H	α-helix	trans	-71.2	-21.1	178.6	-69.3	121.1	0	0	0	113.5	K612 I618 F619 G620 L621	K612-W616 PolarHBondContact O-N 3.37Å; W616-I618 VanDerWaalsContact C-N 3.34Å; W616-F619 HydrophobicContact CE3-CD2 4.26Å; W616-F619 PolarHBondContact O-N 2.97Å; W616-G620 PolarHBondContact O-N 2.89Å; W616-L621 HydrophobicContact CB-CB 4.32Å; W616-L621 HydrophobicContact CE3-CD1 3.78Å; W616-L621 HydrophobicContact CZ3-CD1 4Å; W616-L621 PolarHBondContact O-N 3.49Å
617	S	91.3	Very high	91.1	Very high	5 Å²	5	62.1 Å²	62.1	4%	0.035	32%	0.318	C	S	.	.	H	α-helix	trans	-71.5	-27.2	176.5	73.6	0	0	0	0	113.3	T613 L614 F615 F619 G620 S622 Y644 Y647	T613-S617 WeakPolarHBondContact O-CB 3.41Å; T613-S617 PolarHBondContact O-N 3.33Å; T613-S617 VanDerWaalsContact O-N 3.14Å; L614-S617 PolarHBondContact O-N 2.83Å; L614-S617 PolarHBondContact O-OG 3.25Å; F615-S617 VanDerWaalsContact C-N 3.28Å; F615-S617 PolarHBondContact O-N 3.3Å; S617-F619 PolarHBondContact O-N 3.29Å; S617-G620 PolarHBondContact O-N 3.43Å; S617-S622 VanDerWaalsContact CB-CB 3.48Å; S617-Y644 WeakPolarHBondContact CB-OH 3.4Å; S617-Y647 WeakPolarHBondContact OG-CE1 3.39Å
618	I	91.2	Very high	90.8	Very high	27 Å²	27	60.4 Å²	60.4	14%	0.138	31%	0.308	C	S	.	.	H	α-helix	trans	-57	-34.8	172.2	-62.6	156.6	0	0	0	111	F577 F581 L614 F615 W616 Y647 M651	F577-I618 HydrophobicContact CE1-CD1 4.1Å; F577-I618 HydrophobicContact CZ-CD1 3.68Å; F577-I618 HydrophobicContact CZ-CG1 4.37Å; F581-I618 HydrophobicContact CD2-CD1 4.15Å; F581-I618 HydrophobicContact CE2-CD1 4.05Å; L614-I618 PolarHBondContact O-N 3.26Å; F615-I618 PolarHBondContact O-N 2.85Å; W616-I618 VanDerWaalsContact C-N 3.34Å; I618-Y647 WeakPolarHBondContact CG1-OH 3.23Å; I618-M651 HydrophobicContact CD1-CE 4.46Å
619	F	90.3	Very high	90.6	Very high	131 Å²	131	55 Å²	55	58%	0.575	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	3	178.7	-59	-73.8	0	0	0	113.6	F615 W616 S617 L621	F615-F619 AromaticContact CE1-CE2 3.98Å; F615-F619 HydrophobicContact CE1-CE2 3.98Å; F615-F619 HydrophobicContact CE2-CE2 4.24Å; F615-F619 AromaticContact CZ-CE2 3.78Å; F615-F619 HydrophobicContact CZ-CE2 3.78Å; W616-F619 HydrophobicContact CE3-CD2 4.26Å; W616-F619 PolarHBondContact O-N 2.97Å; S617-F619 PolarHBondContact O-N 3.29Å; F619-L621 VanDerWaalsContact C-N 3.27Å; F619-L621 HydrophobicContact CB-CD1 4.4Å; F619-L621 HydrophobicContact CB-CG 4.37Å; F619-L621 PolarHBondContact O-N 3.39Å
620	G	89.5	Confident	90.4	Very high	65 Å²	65	57.7 Å²	57.7	67%	0.67	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	14.5	-177.4	0	0	0	0	0	115	W616 S617	W616-G620 PolarHBondContact O-N 2.89Å; S617-G620 PolarHBondContact O-N 3.43Å
621	L	90.4	Very high	90	Very high	123 Å²	123	64.5 Å²	64.5	64%	0.644	32%	0.32	S	S	*	.			trans	-92.3	3.4	-179.6	-65.1	175.8	0	0	0	113.5	W616 F619	W616-L621 HydrophobicContact CB-CB 4.32Å; W616-L621 HydrophobicContact CE3-CD1 3.78Å; W616-L621 HydrophobicContact CZ3-CD1 4Å; W616-L621 PolarHBondContact O-N 3.49Å; F619-L621 VanDerWaalsContact C-N 3.27Å; F619-L621 HydrophobicContact CB-CD1 4.4Å; F619-L621 HydrophobicContact CB-CG 4.37Å; F619-L621 PolarHBondContact O-N 3.39Å
622	S	89	Confident	89.5	Confident	24 Å²	24	67.6 Å²	67.6	17%	0.168	34%	0.342	C	S	.	.	S	Bend	trans	-98	131.3	-179.4	-176.2	0	0	0	0	111.8	T613 S617 Y644	T613-S622 WeakPolarHBondContact O-CB 3.16Å; T613-S622 PolarHBondContact O-OG 3.49Å; S617-S622 VanDerWaalsContact CB-CB 3.48Å; S622-Y644 VanDerWaalsContact CB-OH 3.29Å; S622-Y644 WeakPolarHBondContact CB-OH 3.36Å; S622-Y644 PolarHBondContact OG-OH 3.33Å
623	E	88.4	Confident	89.4	Confident	112 Å²	112	68.9 Å²	68.9	52%	0.523	35%	0.349	S	S	.	.			trans	-77.6	139.9	-178.8	-63.5	178.7	173.8	0	0	112.3	N601 I625 S626	N601-E623 PolarHBondContact ND2-OE2 3.03Å; N601-E623 VanDerWaalsContact ND2-OE2 3.12Å; E623-I625 PolarHBondContact O-N 3.06Å; E623-S626 VanDerWaalsContact O-CB 3.23Å; E623-S626 WeakPolarHBondContact O-CB 3.44Å; E623-S626 PolarHBondContact O-N 3.33Å; E623-S626 PolarHBondContact O-OG 2.73Å
624	V	86.1	Confident	89.2	Confident	87 Å²	87	74.8 Å²	74.8	53%	0.527	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-66.3	-25.9	174.4	-179.5	0	0	0	0	112.1	S626 V627 Y641	V624-S626 PolarHBondContact O-N 2.83Å; V624-S626 VanDerWaalsContact O-N 3.08Å; V624-V627 PolarHBondContact O-N 3.39Å; V624-V627 VanDerWaalsContact O-N 3.12Å; V624-Y641 HydrophobicContact CG1-CD1 4.4Å; V624-Y641 HydrophobicContact CG1-CE1 3.72Å
625	I	86.8	Confident	89.2	Confident	93 Å²	93	82 Å²	82	48%	0.477	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-61	-19.7	176.5	-56.6	169.5	0	0	0	111.5	E623 V627 V628	E623-I625 PolarHBondContact O-N 3.06Å; I625-V627 PolarHBondContact O-N 2.91Å; I625-V627 VanDerWaalsContact O-N 3.15Å; I625-V628 PolarHBondContact O-N 3.43Å; I625-V628 VanDerWaalsContact O-N 3.16Å
626	S	86.3	Confident	89.1	Confident	3 Å²	3	80 Å²	80	2%	0.021	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-61	-19.4	174.8	66.9	0	0	0	0	114.5	K599 E623 V624	K599-S626 WeakPolarHBondContact CE-O 3.31Å; K599-S626 PolarHBondContact NZ-O 2.72Å; E623-S626 VanDerWaalsContact O-CB 3.23Å; E623-S626 WeakPolarHBondContact O-CB 3.44Å; E623-S626 PolarHBondContact O-N 3.33Å; E623-S626 PolarHBondContact O-OG 2.73Å; V624-S626 PolarHBondContact O-N 2.83Å; V624-S626 VanDerWaalsContact O-N 3.08Å
627	V	90	Very high	89	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-91.3	-24.6	179.3	-177	0	0	0	0	111.8	Y592 F604 V624 I625 Y641 Y644	Y592-V627 WeakPolarHBondContact OH-CG1 3.29Å; Y592-V627 PolarHBondContact OH-O 3.31Å; F604-V627 HydrophobicContact CE2-CG2 4.36Å; V624-V627 PolarHBondContact O-N 3.39Å; V624-V627 VanDerWaalsContact O-N 3.12Å; I625-V627 PolarHBondContact O-N 2.91Å; I625-V627 VanDerWaalsContact O-N 3.15Å; V627-Y641 HydrophobicContact CB-CD1 4.25Å; V627-Y641 HydrophobicContact CB-CE1 4.06Å; V627-Y641 HydrophobicContact CG1-CD1 3.87Å; V627-Y641 HydrophobicContact CG1-CD2 4.41Å; V627-Y641 HydrophobicContact CG1-CE1 4.03Å; V627-Y641 HydrophobicContact CG1-CG 4.04Å; V627-Y644 HydrophobicContact CG2-CD1 4.2Å; V627-Y644 HydrophobicContact CG2-CG 4.26Å
628	V	89.1	Confident	89.1	Confident	34 Å²	34	79.2 Å²	79.2	21%	0.206	40%	0.4	C	S	.	.			trans	-68.9	134.8	-176.4	-177.9	0	0	0	0	111.1	Y600 I625 Y641	Y600-V628 HydrophobicContact CD2-CG1 4.19Å; Y600-V628 HydrophobicContact CE2-CG1 4.08Å; I625-V628 PolarHBondContact O-N 3.43Å; I625-V628 VanDerWaalsContact O-N 3.16Å; V628-Y641 WeakPolarHBondContact CG2-OH 3.49Å
629	L	88	Confident	89.4	Confident	9 Å²	9	80.8 Å²	80.8	5%	0.047	41%	0.409	C	S	.	.	B	Isolated β-bridge	trans	-101.6	154.4	176.1	-68.2	157.9	0	0	0	110.2	Y592 Y595 K599 I636 E637	Y592-L629 HydrophobicContact CD1-CD2 4.14Å; Y592-L629 HydrophobicContact CE1-CD1 4.08Å; Y592-L629 HydrophobicContact CE1-CD2 3.99Å; Y592-L629 HydrophobicContact CE1-CG 4.05Å; Y595-L629 HydrophobicContact CD1-CD2 3.63Å; Y595-L629 HydrophobicContact CD2-CD2 4.33Å; Y595-L629 HydrophobicContact CE1-CD2 4.31Å; Y595-L629 HydrophobicContact CG-CD2 3.63Å; K599-L629 HydrophobicContact CD-CD2 4.15Å; K599-L629 HydrophobicContact CG-CD2 3.71Å; L629-I636 HydrophobicContact CD1-CB 4.15Å; L629-I636 HydrophobicContact CD1-CG2 3.94Å; L629-E637 HydrophobicContact CD1-CB 4.34Å
630	K	87.1	Confident	89.5	Confident	109 Å²	109	74.6 Å²	74.6	47%	0.474	38%	0.381	S	S	.	.	S	Bend	trans	-79.6	-19.6	172	-67.8	177.3	177.7	165.9	0	112.9	A598 K599 Y600	A598-K630 WeakPolarHBondContact O-CB 3.49Å; A598-K630 PolarHBondContact O-N 3.24Å; K599-K630 VanDerWaalsContact O-CE 3.22Å; K599-K630 WeakPolarHBondContact O-CE 3.38Å; K599-K630 PolarHBondContact O-NZ 2.88Å; Y600-K630 HydrophobicContact CD2-CG 4.17Å; Y600-K630 HydrophobicContact CE1-CG 4.27Å; Y600-K630 HydrophobicContact CE2-CG 3.87Å; Y600-K630 HydrophobicContact CG-CG 4.5Å
631	Y	85.4	Confident	89.8	Confident	142 Å²	142	75.4 Å²	75.4	56%	0.557	37%	0.365	S	S	*	.	S	Bend	trans	-95.1	154.9	178.1	-67.2	-58.7	0	0	0	111.6	A598 H633	A598-Y631 HydrophobicContact CB-CD2 3.59Å; A598-Y631 HydrophobicContact CB-CE2 3.38Å; Y631-H633 PolarHBondContact O-N 2.88Å
632	D	83.9	Confident	90	Very high	165 Å²	165	73.8 Å²	73.8	88%	0.882	36%	0.36	S	S	*	.	S	Bend	trans	-71.9	23.8	179.2	-63.4	-38.1	0	0	0	114.4	K634	D632-K634 PolarHBondContact O-N 3.06Å
633	H	90.9	Very high	90.3	Very high	98 Å²	98	75.2 Å²	75.2	45%	0.454	37%	0.365	S	S	.	.			trans	-76	61	176.3	-70.7	-165.4	0	0	0	111.1	Y595 Y631 F635 I636 E637	Y595-H633 AromaticContact CE1-ND1 3.54Å; Y595-H633 AromaticContact CZ-ND1 3.71Å; Y595-H633 PolarHBondContact OH-ND1 3.02Å; Y631-H633 PolarHBondContact O-N 2.88Å; H633-F635 PolarHBondContact O-N 3.1Å; H633-F635 VanDerWaalsContact O-N 3.13Å; H633-I636 PolarHBondContact O-N 3.43Å; H633-I636 VanDerWaalsContact O-N 3.07Å; H633-E637 PolarHBondContact O-N 2.93Å
634	K	88.9	Confident	90.6	Very high	142 Å²	142	70.7 Å²	70.7	62%	0.617	34%	0.343	S	S	*	.	H	α-helix	trans	-59.8	-27.7	-173.4	-164.3	164.5	-172.4	168.8	0	113.6	D632 N638	D632-K634 PolarHBondContact O-N 3.06Å; K634-N638 WeakPolarHBondContact O-CB 3.44Å; K634-N638 PolarHBondContact O-N 3.37Å; K634-N638 PolarHBondContact O-ND2 2.97Å; K634-N638 PolarHBondContact O-OD1 3.44Å
635	F	93.3	Very high	91	Very high	150 Å²	150	68.1 Å²	68.1	66%	0.658	33%	0.334	S	S	*	.	H	α-helix	trans	-62.1	-47.9	174.8	-179.4	-100.1	0	0	0	112	H633 N638 I639	H633-F635 PolarHBondContact O-N 3.1Å; H633-F635 VanDerWaalsContact O-N 3.13Å; F635-N638 PolarHBondContact O-N 2.9Å; F635-I639 HydrophobicContact CD1-CG1 4.34Å; F635-I639 HydrophobicContact CE1-CG1 3.93Å; F635-I639 HydrophobicContact CE2-CD1 4.43Å; F635-I639 HydrophobicContact CE2-CG1 4.33Å; F635-I639 HydrophobicContact CZ-CD1 4.12Å; F635-I639 HydrophobicContact CZ-CG1 3.92Å; F635-I639 WeakPolarHBondContact O-CG1 3.3Å; F635-I639 PolarHBondContact O-N 2.89Å
636	I	92.6	Very high	91.4	Very high	35 Å²	35	67 Å²	67	18%	0.179	33%	0.332	C	S	.	.	H	α-helix	trans	-67.6	-39.8	-180	-62.2	-64.7	0	0	0	110.6	L591 Y592 Y595 L629 H633 I639 G640	L591-I636 HydrophobicContact CD1-CD1 3.91Å; L591-I636 HydrophobicContact CD1-CG2 3.97Å; L591-I636 HydrophobicContact CD2-CG2 4.42Å; L591-I636 HydrophobicContact CG-CG2 3.95Å; Y592-I636 HydrophobicContact CE1-CG2 4.29Å; Y595-I636 HydrophobicContact CE2-CG1 4.5Å; Y595-I636 HydrophobicContact CE2-CG2 3.88Å; L629-I636 HydrophobicContact CD1-CB 4.15Å; L629-I636 HydrophobicContact CD1-CG2 3.94Å; H633-I636 PolarHBondContact O-N 3.43Å; H633-I636 VanDerWaalsContact O-N 3.07Å; I636-I639 PolarHBondContact O-N 2.9Å; I636-G640 PolarHBondContact O-N 3.08Å
637	E	91.4	Very high	91.8	Very high	35 Å²	35	66.9 Å²	66.9	16%	0.164	33%	0.331	C	S	.	.	H	α-helix	trans	-59.5	-46.5	174.3	-160.7	-170.9	161.4	0	0	111.6	L629 H633 I639 G640 Y641	L629-E637 HydrophobicContact CD1-CB 4.34Å; H633-E637 PolarHBondContact O-N 2.93Å; E637-I639 PolarHBondContact O-N 3.42Å; E637-G640 PolarHBondContact O-N 3.46Å; E637-Y641 HydrophobicContact CG-CD2 4.1Å; E637-Y641 HydrophobicContact CG-CE2 3.54Å; E637-Y641 WeakPolarHBondContact O-CD2 3.42Å; E637-Y641 PolarHBondContact O-N 3.12Å; E637-Y641 WeakPolarHBondContact OE1-CE2 3.33Å; E637-Y641 PolarHBondContact OE1-OH 2.84Å
638	N	93.3	Very high	91.9	Very high	80 Å²	80	68.7 Å²	68.7	43%	0.428	34%	0.341	S	S	.	.	H	α-helix	trans	-61.4	-44.3	176.4	-71.1	-13.2	0	0	0	112.2	K634 F635 G640 Y641 V642	K634-N638 WeakPolarHBondContact O-CB 3.44Å; K634-N638 PolarHBondContact O-N 3.37Å; K634-N638 PolarHBondContact O-ND2 2.97Å; K634-N638 PolarHBondContact O-OD1 3.44Å; F635-N638 PolarHBondContact O-N 2.9Å; N638-G640 VanDerWaalsContact C-N 3.29Å; N638-G640 PolarHBondContact O-N 3.17Å; N638-Y641 PolarHBondContact O-N 3.16Å; N638-V642 WeakPolarHBondContact O-CG2 3.26Å; N638-V642 PolarHBondContact O-N 3.44Å
639	I	95.9	Very high	92.2	Very high	60 Å²	60	71.1 Å²	71.1	31%	0.308	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-40	175.7	-66.6	-63.6	0	0	0	110.7	L591 F635 I636 E637 V642 L643	L591-I639 HydrophobicContact CD1-CG2 4.12Å; L591-I639 HydrophobicContact CD2-CB 4.42Å; L591-I639 HydrophobicContact CD2-CG2 3.91Å; F635-I639 HydrophobicContact CD1-CG1 4.34Å; F635-I639 HydrophobicContact CE1-CG1 3.93Å; F635-I639 HydrophobicContact CE2-CD1 4.43Å; F635-I639 HydrophobicContact CE2-CG1 4.33Å; F635-I639 HydrophobicContact CZ-CD1 4.12Å; F635-I639 HydrophobicContact CZ-CG1 3.92Å; F635-I639 WeakPolarHBondContact O-CG1 3.3Å; F635-I639 PolarHBondContact O-N 2.89Å; I636-I639 PolarHBondContact O-N 2.9Å; E637-I639 PolarHBondContact O-N 3.42Å; I639-V642 PolarHBondContact O-N 3.21Å; I639-L643 HydrophobicContact CG2-CD1 3.97Å; I639-L643 HydrophobicContact CG2-CG 4.3Å; I639-L643 WeakPolarHBondContact O-CB 3.44Å; I639-L643 WeakPolarHBondContact O-CG 3.46Å; I639-L643 PolarHBondContact O-N 2.87Å
640	G	93.5	Very high	92.4	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-62.6	-43.2	174.7	0	0	0	0	0	113.3	Y592 I636 E637 N638 V642 L643 Y644	Y592-G640 WeakPolarHBondContact OH-CA 3.39Å; I636-G640 PolarHBondContact O-N 3.08Å; E637-G640 PolarHBondContact O-N 3.46Å; N638-G640 VanDerWaalsContact C-N 3.29Å; N638-G640 PolarHBondContact O-N 3.17Å; G640-V642 VanDerWaalsContact C-N 3.33Å; G640-V642 PolarHBondContact O-N 3.42Å; G640-L643 PolarHBondContact O-N 3.17Å; G640-Y644 WeakPolarHBondContact O-CB 3.4Å; G640-Y644 PolarHBondContact O-N 2.98Å
641	Y	94.5	Very high	92.5	Very high	82 Å²	82	67.6 Å²	67.6	32%	0.322	34%	0.343	S	S	.	.	H	α-helix	trans	-61.6	-42.1	174.1	-76.7	-58.2	0	0	0	112	V624 V627 V628 E637 N638 G645	V624-Y641 HydrophobicContact CG1-CD1 4.4Å; V624-Y641 HydrophobicContact CG1-CE1 3.72Å; V627-Y641 HydrophobicContact CB-CD1 4.25Å; V627-Y641 HydrophobicContact CB-CE1 4.06Å; V627-Y641 HydrophobicContact CG1-CD1 3.87Å; V627-Y641 HydrophobicContact CG1-CD2 4.41Å; V627-Y641 HydrophobicContact CG1-CE1 4.03Å; V627-Y641 HydrophobicContact CG1-CG 4.04Å; V628-Y641 WeakPolarHBondContact CG2-OH 3.49Å; E637-Y641 HydrophobicContact CG-CD2 4.1Å; E637-Y641 HydrophobicContact CG-CE2 3.54Å; E637-Y641 WeakPolarHBondContact O-CD2 3.42Å; E637-Y641 PolarHBondContact O-N 3.12Å; E637-Y641 WeakPolarHBondContact OE1-CE2 3.33Å; E637-Y641 PolarHBondContact OE1-OH 2.84Å; N638-Y641 PolarHBondContact O-N 3.16Å; Y641-G645 WeakPolarHBondContact O-CA 3.38Å; Y641-G645 PolarHBondContact O-N 3.34Å
642	V	95.4	Very high	92.7	Very high	89 Å²	89	63.2 Å²	63.2	54%	0.539	33%	0.331	S	S	.	.	H	α-helix	trans	-65.3	-49.9	178.4	171.9	0	0	0	0	110.5	N638 I639 G640 Y644 G645 V646	N638-V642 WeakPolarHBondContact O-CG2 3.26Å; N638-V642 PolarHBondContact O-N 3.44Å; I639-V642 PolarHBondContact O-N 3.21Å; G640-V642 VanDerWaalsContact C-N 3.33Å; G640-V642 PolarHBondContact O-N 3.42Å; V642-Y644 PolarHBondContact O-N 3.19Å; V642-G645 PolarHBondContact O-N 2.63Å; V642-V646 HydrophobicContact CG1-CG2 4.28Å; V642-V646 WeakPolarHBondContact O-CB 3.35Å; V642-V646 VanDerWaalsContact O-CG2 3.24Å; V642-V646 WeakPolarHBondContact O-CG2 3.43Å; V642-V646 PolarHBondContact O-N 3.18Å
643	L	95.4	Very high	92.9	Very high	55 Å²	55	59.3 Å²	59.3	29%	0.288	31%	0.313	S	S	.	.	H	α-helix	trans	-61.9	-44.1	179.6	-74.1	176.3	0	0	0	112	F584 M588 L591 I639 G640 Y647	F584-L643 HydrophobicContact CE1-CD2 4.43Å; M588-L643 HydrophobicContact SD-CB 3.69Å; M588-L643 HydrophobicContact SD-CD1 4.19Å; L591-L643 HydrophobicContact CD2-CD1 4.16Å; I639-L643 HydrophobicContact CG2-CD1 3.97Å; I639-L643 HydrophobicContact CG2-CG 4.3Å; I639-L643 WeakPolarHBondContact O-CB 3.44Å; I639-L643 WeakPolarHBondContact O-CG 3.46Å; I639-L643 PolarHBondContact O-N 2.87Å; G640-L643 PolarHBondContact O-N 3.17Å; L643-Y647 VanDerWaalsContact O-CB 3.23Å; L643-Y647 WeakPolarHBondContact O-CB 3.25Å; L643-Y647 PolarHBondContact O-N 3.21Å
644	Y	94.6	Very high	92.8	Very high	16 Å²	16	57.9 Å²	57.9	6%	0.063	31%	0.311	C	S	.	.	H	α-helix	trans	-68.8	-37.3	178	-173.4	-113.7	0	0	0	112.4	F604 L614 S617 S622 V627 G640 V642 N648	F604-Y644 HydrophobicContact CZ-CD2 4.2Å; F604-Y644 HydrophobicContact CZ-CE2 4.31Å; L614-Y644 HydrophobicContact CD2-CD2 4.09Å; L614-Y644 HydrophobicContact CD2-CE2 4.17Å; S617-Y644 WeakPolarHBondContact CB-OH 3.4Å; S622-Y644 VanDerWaalsContact CB-OH 3.29Å; S622-Y644 WeakPolarHBondContact CB-OH 3.36Å; S622-Y644 PolarHBondContact OG-OH 3.33Å; V627-Y644 HydrophobicContact CG2-CD1 4.2Å; V627-Y644 HydrophobicContact CG2-CG 4.26Å; G640-Y644 WeakPolarHBondContact O-CB 3.4Å; G640-Y644 PolarHBondContact O-N 2.98Å; V642-Y644 PolarHBondContact O-N 3.19Å; Y644-N648 VanDerWaalsContact CE1-ND2 3.32Å; Y644-N648 WeakPolarHBondContact CE1-ND2 3.32Å; Y644-N648 PolarHBondContact O-N 3.46Å; Y644-N648 PolarHBondContact O-ND2 3.41Å
645	G	93.8	Very high	92.8	Very high	33 Å²	33	51.8 Å²	51.8	34%	0.34	29%	0.285	S	S	.	.	H	α-helix	trans	-65.3	-49.2	174.5	0	0	0	0	0	112.2	Y641 V642 Y647 N648 V649	Y641-G645 WeakPolarHBondContact O-CA 3.38Å; Y641-G645 PolarHBondContact O-N 3.34Å; V642-G645 PolarHBondContact O-N 2.63Å; G645-Y647 VanDerWaalsContact C-N 3.32Å; G645-Y647 PolarHBondContact O-N 3.13Å; G645-N648 PolarHBondContact O-N 3.32Å; G645-V649 WeakPolarHBondContact O-CG2 3.38Å; G645-V649 PolarHBondContact O-N 3.02Å
646	V	95.4	Very high	92.6	Very high	69 Å²	69	47.8 Å²	47.8	42%	0.418	27%	0.271	S	S	.	.	H	α-helix	trans	-60.7	-43.5	175.6	172.9	0	0	0	0	110.4	F584 V642 N648 V649 T650	F584-V646 HydrophobicContact CE1-CG1 4.28Å; F584-V646 HydrophobicContact CZ-CG1 3.96Å; V642-V646 HydrophobicContact CG1-CG2 4.28Å; V642-V646 WeakPolarHBondContact O-CB 3.35Å; V642-V646 VanDerWaalsContact O-CG2 3.24Å; V642-V646 WeakPolarHBondContact O-CG2 3.43Å; V642-V646 PolarHBondContact O-N 3.18Å; V646-N648 PolarHBondContact O-N 3.5Å; V646-V649 PolarHBondContact O-N 3.18Å; V646-T650 WeakPolarHBondContact O-CB 3.47Å; V646-T650 PolarHBondContact O-N 3.39Å; V646-T650 PolarHBondContact O-OG1 3.23Å; V646-T650 VanDerWaalsContact O-OG1 3.07Å
647	Y	95.6	Very high	92.3	Very high	1 Å²	1	50.5 Å²	50.5	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-54.1	-50.9	173.7	169.3	-89.9	0	0	0	111.7	F581 F584 L614 S617 I618 L643 G645 V649 T650 M651	F581-Y647 HydrophobicContact CD2-CE2 4.24Å; F581-Y647 WeakPolarHBondContact CD2-OH 3.46Å; F581-Y647 WeakPolarHBondContact CE2-OH 3.3Å; F584-Y647 HydrophobicContact CB-CD2 3.56Å; F584-Y647 HydrophobicContact CB-CE2 4.2Å; F584-Y647 HydrophobicContact CB-CG 4.43Å; F584-Y647 HydrophobicContact CD1-CD2 4.34Å; F584-Y647 AromaticContact CD2-CD2 3.86Å; F584-Y647 HydrophobicContact CD2-CD2 3.86Å; F584-Y647 AromaticContact CG-CD2 3.68Å; F584-Y647 HydrophobicContact CG-CD2 3.68Å; F584-Y647 HydrophobicContact CG-CG 4.36Å; L614-Y647 HydrophobicContact CB-CE2 4.47Å; L614-Y647 HydrophobicContact CD1-CE2 4.33Å; L614-Y647 HydrophobicContact CD2-CD1 4.03Å; L614-Y647 HydrophobicContact CD2-CD2 4.38Å; L614-Y647 HydrophobicContact CD2-CE1 3.99Å; L614-Y647 HydrophobicContact CD2-CE2 4.24Å; L614-Y647 HydrophobicContact CD2-CG 4.25Å; L614-Y647 PolarHBondContact O-OH 2.92Å; L614-Y647 VanDerWaalsContact O-OH 3.05Å; S617-Y647 WeakPolarHBondContact OG-CE1 3.39Å; I618-Y647 WeakPolarHBondContact CG1-OH 3.23Å; L643-Y647 VanDerWaalsContact O-CB 3.23Å; L643-Y647 WeakPolarHBondContact O-CB 3.25Å; L643-Y647 PolarHBondContact O-N 3.21Å; G645-Y647 VanDerWaalsContact C-N 3.32Å; G645-Y647 PolarHBondContact O-N 3.13Å; Y647-V649 PolarHBondContact O-N 2.81Å; Y647-T650 PolarHBondContact O-N 3.44Å; Y647-M651 HydrophobicContact CD1-CG 4.34Å; Y647-M651 HydrophobicContact CD2-CG 3.64Å; Y647-M651 HydrophobicContact CE1-CB 4.37Å; Y647-M651 HydrophobicContact CE1-CG 4.04Å; Y647-M651 HydrophobicContact CE2-CE 4.4Å; Y647-M651 HydrophobicContact CE2-CG 3.39Å; Y647-M651 HydrophobicContact CE2-SD 4.16Å; Y647-M651 HydrophobicContact CG-CG 4.14Å; Y647-M651 VanDerWaalsContact O-CB 3.26Å; Y647-M651 WeakPolarHBondContact O-CB 3.22Å; Y647-M651 VanDerWaalsContact O-CG 3.22Å; Y647-M651 WeakPolarHBondContact O-CG 3.41Å; Y647-M651 PolarHBondContact O-N 3.46Å
648	N	92.6	Very high	92.2	Very high	39 Å²	39	53.8 Å²	53.8	21%	0.209	30%	0.302	C	S	.	.	H	α-helix	trans	-65.6	-38.3	-178.7	-74	-43.3	0	0	0	112.1	Y644 G645 V646 V652	Y644-N648 VanDerWaalsContact CE1-ND2 3.32Å; Y644-N648 WeakPolarHBondContact CE1-ND2 3.32Å; Y644-N648 PolarHBondContact O-N 3.46Å; Y644-N648 PolarHBondContact O-ND2 3.41Å; G645-N648 PolarHBondContact O-N 3.32Å; V646-N648 PolarHBondContact O-N 3.5Å; N648-V652 WeakPolarHBondContact O-CA 3.39Å; N648-V652 WeakPolarHBondContact O-CB 3.31Å; N648-V652 PolarHBondContact O-N 3.11Å
649	V	93.9	Very high	92	Very high	85 Å²	85	51.1 Å²	51.1	52%	0.515	29%	0.287	S	S	.	.	I	π-helix	trans	-62.7	-49.6	173.9	173.3	0	0	0	0	110.7	G645 V646 Y647 V653 V654	G645-V649 WeakPolarHBondContact O-CG2 3.38Å; G645-V649 PolarHBondContact O-N 3.02Å; V646-V649 PolarHBondContact O-N 3.18Å; Y647-V649 PolarHBondContact O-N 2.81Å; V649-V653 WeakPolarHBondContact O-CA 3.49Å; V649-V653 WeakPolarHBondContact O-CB 3.42Å; V649-V653 PolarHBondContact O-N 3.34Å; V649-V654 PolarHBondContact O-N 3.5Å; V649-V654 VanDerWaalsContact O-N 3.16Å
650	T	92.8	Very high	91.7	Very high	43 Å²	43	52.1 Å²	52.1	26%	0.264	29%	0.293	S	S	.	.	I	π-helix	trans	-65.5	-46.5	-179.2	-58.1	0	0	0	0	112	V580 V646 Y647 V654 L655	V580-T650 HydrophobicContact CG1-CG2 4.15Å; V646-T650 WeakPolarHBondContact O-CB 3.47Å; V646-T650 PolarHBondContact O-N 3.39Å; V646-T650 PolarHBondContact O-OG1 3.23Å; V646-T650 VanDerWaalsContact O-OG1 3.07Å; Y647-T650 PolarHBondContact O-N 3.44Å; T650-V654 WeakPolarHBondContact O-CB 3.46Å; T650-V654 PolarHBondContact O-N 3.12Å; T650-L655 WeakPolarHBondContact O-CG 3.26Å; T650-L655 PolarHBondContact O-N 3.22Å
651	M	90.5	Very high	91.5	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	32%	0.315	C	S	.	.	I	π-helix	trans	-75.5	-48.7	-175.1	-65.6	-63.2	-67.8	0	0	112.7	F577 V580 F581 I618 Y647 L655 L656	F577-M651 HydrophobicContact CD1-CE 3.95Å; F577-M651 HydrophobicContact CD2-CE 3.62Å; F577-M651 HydrophobicContact CE1-CE 3.55Å; F577-M651 HydrophobicContact CE2-CE 3.2Å; F577-M651 HydrophobicContact CG-CE 3.98Å; F577-M651 HydrophobicContact CZ-CE 3.17Å; V580-M651 HydrophobicContact CB-SD 4.13Å; V580-M651 HydrophobicContact CG1-SD 3.65Å; F581-M651 HydrophobicContact CB-CE 4.2Å; F581-M651 HydrophobicContact CD2-CE 4.26Å; I618-M651 HydrophobicContact CD1-CE 4.46Å; Y647-M651 HydrophobicContact CD1-CG 4.34Å; Y647-M651 HydrophobicContact CD2-CG 3.64Å; Y647-M651 HydrophobicContact CE1-CB 4.37Å; Y647-M651 HydrophobicContact CE1-CG 4.04Å; Y647-M651 HydrophobicContact CE2-CE 4.4Å; Y647-M651 HydrophobicContact CE2-CG 3.39Å; Y647-M651 HydrophobicContact CE2-SD 4.16Å; Y647-M651 HydrophobicContact CG-CG 4.14Å; Y647-M651 VanDerWaalsContact O-CB 3.26Å; Y647-M651 WeakPolarHBondContact O-CB 3.22Å; Y647-M651 VanDerWaalsContact O-CG 3.22Å; Y647-M651 WeakPolarHBondContact O-CG 3.41Å; Y647-M651 PolarHBondContact O-N 3.46Å; M651-L655 HydrophobicContact SD-CD1 3.66Å; M651-L656 PolarHBondContact O-N 3.06Å; M651-L656 VanDerWaalsContact O-N 3.1Å
652	V	88.2	Confident	91.2	Very high	49 Å²	49	56 Å²	56	30%	0.297	33%	0.325	S	S	.	.	I	π-helix	trans	-87.2	-43.2	-172.8	-175.2	0	0	0	0	111.2	N648 L656	N648-V652 WeakPolarHBondContact O-CA 3.39Å; N648-V652 WeakPolarHBondContact O-CB 3.31Å; N648-V652 PolarHBondContact O-N 3.11Å; V652-L656 HydrophobicContact CG1-CD2 4.44Å; V652-L656 WeakPolarHBondContact O-CB 3.23Å
653	V	87.8	Confident	90.9	Very high	84 Å²	84	54.1 Å²	54.1	51%	0.509	31%	0.311	S	S	.	.	I	π-helix	trans	-83.7	-42.5	-176.1	-175.3	0	0	0	0	111.7	V649 N657	V649-V653 WeakPolarHBondContact O-CA 3.49Å; V649-V653 WeakPolarHBondContact O-CB 3.42Å; V649-V653 PolarHBondContact O-N 3.34Å; V653-N657 VanDerWaalsContact O-CB 3.31Å; V653-N657 WeakPolarHBondContact O-CB 3.36Å; V653-N657 VanDerWaalsContact O-CG 3.29Å; V653-N657 PolarHBondContact O-ND2 3.34Å
654	V	89.6	Confident	90.6	Very high	67 Å²	67	55.9 Å²	55.9	41%	0.406	32%	0.321	S	S	.	.	I	π-helix	trans	-87.7	-63.6	-176.9	-176	0	0	0	0	110.7	V649 T650 L656 N657 M658	V649-V654 PolarHBondContact O-N 3.5Å; V649-V654 VanDerWaalsContact O-N 3.16Å; T650-V654 WeakPolarHBondContact O-CB 3.46Å; T650-V654 PolarHBondContact O-N 3.12Å; V654-L656 PolarHBondContact O-N 2.72Å; V654-N657 PolarHBondContact O-N 2.88Å; V654-M658 HydrophobicContact CG1-CG 4.5Å; V654-M658 HydrophobicContact CG1-SD 4.03Å; V654-M658 WeakPolarHBondContact O-CB 3.43Å; V654-M658 VanDerWaalsContact O-CG 3.29Å; V654-M658 WeakPolarHBondContact O-CG 3.48Å; V654-M658 PolarHBondContact O-N 3.42Å
655	L	89	Confident	90.4	Very high	15 Å²	15	58.6 Å²	58.6	8%	0.079	34%	0.342	C	S	.	.	I	π-helix	trans	-69.6	-37.9	-169.2	-66.7	177.2	0	0	0	113.5	F573 F577 V580 T650 M651 L659	F573-L655 HydrophobicContact CE1-CB 4.45Å; F573-L655 HydrophobicContact CE1-CD2 4.42Å; F573-L655 HydrophobicContact CZ-CB 4.4Å; F573-L655 HydrophobicContact CZ-CD2 3.8Å; F577-L655 HydrophobicContact CD2-CB 4.35Å; F577-L655 HydrophobicContact CD2-CD1 4.27Å; V580-L655 HydrophobicContact CB-CD1 4.32Å; V580-L655 HydrophobicContact CG1-CD1 4.43Å; V580-L655 HydrophobicContact CG2-CD1 4.33Å; T650-L655 WeakPolarHBondContact O-CG 3.26Å; T650-L655 PolarHBondContact O-N 3.22Å; M651-L655 HydrophobicContact SD-CD1 3.66Å; L655-L659 VanDerWaalsContact O-CB 3.32Å; L655-L659 WeakPolarHBondContact O-CB 3.45Å; L655-L659 PolarHBondContact O-N 2.85Å
656	L	87.9	Confident	90	Very high	66 Å²	66	57.7 Å²	57.7	35%	0.346	33%	0.331	S	S	.	.	H	α-helix	trans	-66	-44.1	176.6	-165.2	72	0	0	0	111.8	M651 V652 V654 L659 I660	M651-L656 PolarHBondContact O-N 3.06Å; M651-L656 VanDerWaalsContact O-N 3.1Å; V652-L656 HydrophobicContact CG1-CD2 4.44Å; V652-L656 WeakPolarHBondContact O-CB 3.23Å; V654-L656 PolarHBondContact O-N 2.72Å; L656-L659 WeakPolarHBondContact O-CB 3.47Å; L656-L659 PolarHBondContact O-N 3.44Å; L656-I660 HydrophobicContact CG-CD1 4.33Å; L656-I660 VanDerWaalsContact O-CG1 3.31Å; L656-I660 WeakPolarHBondContact O-CG1 3.31Å; L656-I660 PolarHBondContact O-N 3.45Å
657	N	88.2	Confident	89.7	Confident	92 Å²	92	58.2 Å²	58.2	49%	0.492	33%	0.326	S	S	.	.	H	α-helix	trans	-67.2	-38.3	178.5	-72.8	-22.9	0	0	0	112	V653 V654 I660 A661	V653-N657 VanDerWaalsContact O-CB 3.31Å; V653-N657 WeakPolarHBondContact O-CB 3.36Å; V653-N657 VanDerWaalsContact O-CG 3.29Å; V653-N657 PolarHBondContact O-ND2 3.34Å; V654-N657 PolarHBondContact O-N 2.88Å; N657-I660 PolarHBondContact O-N 3.19Å; N657-A661 WeakPolarHBondContact O-CB 3.4Å; N657-A661 PolarHBondContact O-N 3.01Å
658	M	88.7	Confident	89.3	Confident	103 Å²	103	64.3 Å²	64.3	51%	0.507	35%	0.354	S	S	.	.	H	α-helix	trans	-63.9	-40.8	172	-71.6	-169.7	87.5	0	0	111.7	F573 V654 I660 A661 M662	F573-M658 HydrophobicContact CE2-CB 4.36Å; F573-M658 HydrophobicContact CZ-CB 4.07Å; V654-M658 HydrophobicContact CG1-CG 4.5Å; V654-M658 HydrophobicContact CG1-SD 4.03Å; V654-M658 WeakPolarHBondContact O-CB 3.43Å; V654-M658 VanDerWaalsContact O-CG 3.29Å; V654-M658 WeakPolarHBondContact O-CG 3.48Å; V654-M658 PolarHBondContact O-N 3.42Å; M658-I660 PolarHBondContact O-N 3.34Å; M658-A661 PolarHBondContact O-N 3.25Å; M658-M662 WeakPolarHBondContact O-CB 3.19Å; M658-M662 VanDerWaalsContact O-CG 3.28Å; M658-M662 WeakPolarHBondContact O-CG 3.2Å; M658-M662 PolarHBondContact O-N 3.17Å
659	L	88.8	Confident	89	Confident	24 Å²	24	69.5 Å²	69.5	13%	0.126	38%	0.377	C	S	.	.	H	α-helix	trans	-61.1	-44.4	175.8	-179.5	60.5	0	0	0	111.4	I570 F573 L655 L656 M662 I663	I570-L659 HydrophobicContact CG1-CD1 4.11Å; I570-L659 HydrophobicContact CG2-CD1 4.26Å; F573-L659 HydrophobicContact CB-CD1 4.4Å; F573-L659 HydrophobicContact CD1-CB 4.15Å; F573-L659 HydrophobicContact CD1-CD1 3.74Å; F573-L659 HydrophobicContact CD1-CG 4.41Å; F573-L659 HydrophobicContact CE1-CB 3.87Å; F573-L659 HydrophobicContact CE1-CD1 4.34Å; F573-L659 HydrophobicContact CG-CD1 4.26Å; L655-L659 VanDerWaalsContact O-CB 3.32Å; L655-L659 WeakPolarHBondContact O-CB 3.45Å; L655-L659 PolarHBondContact O-N 2.85Å; L656-L659 WeakPolarHBondContact O-CB 3.47Å; L656-L659 PolarHBondContact O-N 3.44Å; L659-M662 PolarHBondContact O-N 3.13Å; L659-I663 HydrophobicContact CD1-CD1 3.99Å; L659-I663 HydrophobicContact CD1-CG1 4.25Å; L659-I663 HydrophobicContact CG-CD1 3.85Å; L659-I663 WeakPolarHBondContact O-CB 3.11Å; L659-I663 WeakPolarHBondContact O-CG1 3.47Å; L659-I663 PolarHBondContact O-N 3.46Å
660	I	89.6	Confident	88.4	Confident	82 Å²	82	66.1 Å²	66.1	42%	0.421	36%	0.356	S	S	.	.	H	α-helix	trans	-61.4	-46.5	176.6	-66.6	163.9	0	0	0	110.7	L656 N657 M658 M662 I663 N664	L656-I660 HydrophobicContact CG-CD1 4.33Å; L656-I660 VanDerWaalsContact O-CG1 3.31Å; L656-I660 WeakPolarHBondContact O-CG1 3.31Å; L656-I660 PolarHBondContact O-N 3.45Å; N657-I660 PolarHBondContact O-N 3.19Å; M658-I660 PolarHBondContact O-N 3.34Å; I660-M662 PolarHBondContact O-N 2.97Å; I660-I663 PolarHBondContact O-N 2.89Å; I660-N664 PolarHBondContact O-N 3.15Å
661	A	89.1	Confident	88	Confident	57 Å²	57	68.5 Å²	68.5	47%	0.471	36%	0.364	S	S	.	.	H	α-helix	trans	-61.4	-43.2	178.5	0	0	0	0	0	112.2	N657 M658 N664 S665	N657-A661 WeakPolarHBondContact O-CB 3.4Å; N657-A661 PolarHBondContact O-N 3.01Å; M658-A661 PolarHBondContact O-N 3.25Å; A661-N664 PolarHBondContact O-N 3.35Å; A661-S665 PolarHBondContact O-N 2.72Å; A661-S665 VanDerWaalsContact O-N 3.09Å
662	M	87.5	Confident	87.7	Confident	107 Å²	107	76.6 Å²	76.6	53%	0.527	40%	0.402	S	S	.	.	H	α-helix	trans	-64.8	-41.4	176.9	-73.7	-61.1	-57.4	0	0	112.3	M658 L659 I660 N664 S666	M658-M662 WeakPolarHBondContact O-CB 3.19Å; M658-M662 VanDerWaalsContact O-CG 3.28Å; M658-M662 WeakPolarHBondContact O-CG 3.2Å; M658-M662 PolarHBondContact O-N 3.17Å; L659-M662 PolarHBondContact O-N 3.13Å; I660-M662 PolarHBondContact O-N 2.97Å; M662-N664 VanDerWaalsContact C-N 3.34Å; M662-S666 WeakPolarHBondContact O-CB 3.34Å; M662-S666 PolarHBondContact O-N 3.43Å; M662-S666 PolarHBondContact O-OG 2.81Å
663	I	90.4	Very high	87.5	Confident	48 Å²	48	78.6 Å²	78.6	25%	0.246	41%	0.411	C	S	.	.	H	α-helix	trans	-62.5	-42.6	175.9	-69.9	165.4	0	0	0	110.4	I570 L659 I660 S666 Y667	I570-I663 HydrophobicContact CD1-CD1 3.61Å; I570-I663 HydrophobicContact CD1-CG1 3.93Å; I570-I663 HydrophobicContact CG1-CD1 3.81Å; I570-I663 HydrophobicContact CG1-CG1 3.76Å; L659-I663 HydrophobicContact CD1-CD1 3.99Å; L659-I663 HydrophobicContact CD1-CG1 4.25Å; L659-I663 HydrophobicContact CG-CD1 3.85Å; L659-I663 WeakPolarHBondContact O-CB 3.11Å; L659-I663 WeakPolarHBondContact O-CG1 3.47Å; L659-I663 PolarHBondContact O-N 3.46Å; I660-I663 PolarHBondContact O-N 2.89Å; I663-S666 PolarHBondContact O-N 2.99Å; I663-Y667 WeakPolarHBondContact O-CB 3.39Å; I663-Y667 PolarHBondContact O-N 2.9Å
664	N	89.3	Confident	87.6	Confident	93 Å²	93	75.8 Å²	75.8	50%	0.497	40%	0.395	S	S	.	.	H	α-helix	trans	-63.8	-46.3	179.8	-73.8	-15.3	0	0	0	112.3	I660 A661 M662 Y667 Q668	I660-N664 PolarHBondContact O-N 3.15Å; A661-N664 PolarHBondContact O-N 3.35Å; M662-N664 VanDerWaalsContact C-N 3.34Å; N664-Y667 PolarHBondContact O-N 3.15Å; N664-Q668 WeakPolarHBondContact O-CG 3.45Å; N664-Q668 PolarHBondContact O-N 2.78Å; N664-Q668 VanDerWaalsContact O-N 3.11Å
665	S	88.9	Confident	87.7	Confident	72 Å²	72	75.9 Å²	75.9	50%	0.503	39%	0.393	S	S	.	.	H	α-helix	trans	-62.2	-45.8	176.7	-173.8	0	0	0	0	111.5	A661 Y667 Q668 E669	A661-S665 PolarHBondContact O-N 2.72Å; A661-S665 VanDerWaalsContact O-N 3.09Å; S665-Y667 PolarHBondContact O-N 3.4Å; S665-Q668 PolarHBondContact O-N 3.21Å; S665-E669 PolarHBondContact O-N 3.4Å
666	S	87.3	Confident	87.8	Confident	15 Å²	15	77 Å²	77	11%	0.105	40%	0.401	C	S	.	.	H	α-helix	trans	-64.6	-40	178.7	-50.4	0	0	0	0	111.7	M662 I663 Q668 E669 I670	M662-S666 WeakPolarHBondContact O-CB 3.34Å; M662-S666 PolarHBondContact O-N 3.43Å; M662-S666 PolarHBondContact O-OG 2.81Å; I663-S666 PolarHBondContact O-N 2.99Å; S666-Q668 PolarHBondContact O-N 3Å; S666-E669 PolarHBondContact O-N 3.45Å; S666-I670 WeakPolarHBondContact O-CB 3.34Å; S666-I670 VanDerWaalsContact O-CD1 3.23Å; S666-I670 WeakPolarHBondContact O-CD1 3.42Å; S666-I670 WeakPolarHBondContact O-CG1 3.48Å; S666-I670 PolarHBondContact O-N 2.84Å
667	Y	87.9	Confident	88	Confident	79 Å²	79	74.8 Å²	74.8	31%	0.31	39%	0.389	S	S	.	.	H	α-helix	trans	-62.2	-42.8	178.3	179.8	-89.6	0	0	0	111.5	T566 I663 N664 S665 I670 E671	T566-Y667 HydrophobicContact CG2-CD2 4.35Å; I663-Y667 WeakPolarHBondContact O-CB 3.39Å; I663-Y667 PolarHBondContact O-N 2.9Å; N664-Y667 PolarHBondContact O-N 3.15Å; S665-Y667 PolarHBondContact O-N 3.4Å; Y667-I670 PolarHBondContact O-N 3.5Å; Y667-E671 HydrophobicContact CE1-CB 4.3Å; Y667-E671 HydrophobicContact CE1-CG 4.44Å; Y667-E671 WeakPolarHBondContact CE1-OE2 3.36Å; Y667-E671 WeakPolarHBondContact O-CB 3.44Å; Y667-E671 PolarHBondContact O-N 2.92Å; Y667-E671 PolarHBondContact OH-OE1 3.49Å; Y667-E671 VanDerWaalsContact OH-OE1 3.12Å
668	Q	88.1	Confident	88.3	Confident	129 Å²	129	70.8 Å²	70.8	60%	0.603	37%	0.367	S	S	*	.	H	α-helix	trans	-61.6	-47.2	177.8	-73.4	175.7	-12	0	0	112.1	N664 S665 S666 I670 E671	N664-Q668 WeakPolarHBondContact O-CG 3.45Å; N664-Q668 PolarHBondContact O-N 2.78Å; N664-Q668 VanDerWaalsContact O-N 3.11Å; S665-Q668 PolarHBondContact O-N 3.21Å; S666-Q668 PolarHBondContact O-N 3Å; Q668-I670 VanDerWaalsContact C-N 3.27Å; Q668-I670 PolarHBondContact O-N 2.77Å; Q668-E671 PolarHBondContact O-N 3.34Å
669	E	84.6	Confident	88.5	Confident	149 Å²	149	68.2 Å²	68.2	70%	0.696	35%	0.353	S	S	*	.	H	α-helix	trans	-61.7	-36.2	176.7	-171.8	-177.3	172.5	0	0	111.9	S665 S666	S665-E669 PolarHBondContact O-N 3.4Å; S666-E669 PolarHBondContact O-N 3.45Å
670	I	82.9	Confident	88.8	Confident	14 Å²	14	68.1 Å²	68.1	7%	0.072	35%	0.351	C	S	.	.	H	α-helix	trans	-77	-29.5	180	-67.5	161.5	0	0	0	112.3	R565 T566 S666 Y667 Q668 S674	R565-I670 HydrophobicContact CB-CD1 3.59Å; R565-I670 HydrophobicContact CB-CG1 4.4Å; R565-I670 HydrophobicContact CB-CG2 4.34Å; T566-I670 HydrophobicContact CG2-CD1 4.16Å; S666-I670 WeakPolarHBondContact O-CB 3.34Å; S666-I670 VanDerWaalsContact O-CD1 3.23Å; S666-I670 WeakPolarHBondContact O-CD1 3.42Å; S666-I670 WeakPolarHBondContact O-CG1 3.48Å; S666-I670 PolarHBondContact O-N 2.84Å; Y667-I670 PolarHBondContact O-N 3.5Å; Q668-I670 VanDerWaalsContact C-N 3.27Å; Q668-I670 PolarHBondContact O-N 2.77Å; I670-S674 PolarHBondContact O-N 3.17Å
671	E	83.7	Confident	88.8	Confident	93 Å²	93	65.5 Å²	65.5	44%	0.435	34%	0.342	S	S	.	.	H	α-helix	trans	-67.1	-37	-176.8	-173.8	164.9	-135	0	0	112	Y667 Q668 D673 S674	Y667-E671 HydrophobicContact CE1-CB 4.3Å; Y667-E671 HydrophobicContact CE1-CG 4.44Å; Y667-E671 WeakPolarHBondContact CE1-OE2 3.36Å; Y667-E671 WeakPolarHBondContact O-CB 3.44Å; Y667-E671 PolarHBondContact O-N 2.92Å; Y667-E671 PolarHBondContact OH-OE1 3.49Å; Y667-E671 VanDerWaalsContact OH-OE1 3.12Å; Q668-E671 PolarHBondContact O-N 3.34Å; E671-D673 VanDerWaalsContact C-N 3.28Å; E671-D673 PolarHBondContact O-N 3.31Å; E671-S674 VanDerWaalsContact O-CB 3.27Å; E671-S674 WeakPolarHBondContact O-CB 3.47Å; E671-S674 PolarHBondContact O-N 3.39Å; E671-S674 VanDerWaalsContact O-N 3.13Å; E671-S674 PolarHBondContact O-OG 3.49Å
672	E	84.4	Confident	89	Confident	171 Å²	171	64.4 Å²	64.4	80%	0.799	33%	0.326	S	S	*	.	H	α-helix	trans	-57.8	-37.5	179.5	-66.8	-176.1	173.8	0	0	112.9
673	D	84.9	Confident	89.3	Confident	91 Å²	91	59.3 Å²	59.3	49%	0.487	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	2.5	179.8	-82	-29.4	0	0	0	113.9	E671 D675 V676 E677	E671-D673 VanDerWaalsContact C-N 3.28Å; E671-D673 PolarHBondContact O-N 3.31Å; D673-D675 VanDerWaalsContact C-N 3.31Å; D673-D675 PolarHBondContact O-N 3.11Å; D673-D675 VanDerWaalsContact O-N 3.17Å; D673-V676 PolarHBondContact O-N 3.31Å; D673-V676 VanDerWaalsContact O-N 3.15Å; D673-E677 HydrophobicContact CB-CG 4.3Å; D673-E677 WeakPolarHBondContact O-CB 3.45Å; D673-E677 WeakPolarHBondContact O-CG 3.48Å; D673-E677 PolarHBondContact O-N 3.33Å; D673-E677 VanDerWaalsContact O-N 3.1Å
674	S	88.4	Confident	89.2	Confident	25 Å²	25	61.2 Å²	61.2	18%	0.175	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-31.3	-166.6	63.5	0	0	0	0	114.9	I670 E671 E677 W678	I670-S674 PolarHBondContact O-N 3.17Å; E671-S674 VanDerWaalsContact O-CB 3.27Å; E671-S674 WeakPolarHBondContact O-CB 3.47Å; E671-S674 PolarHBondContact O-N 3.39Å; E671-S674 VanDerWaalsContact O-N 3.13Å; E671-S674 PolarHBondContact O-OG 3.49Å; S674-E677 WeakPolarHBondContact O-CB 3.22Å; S674-W678 VanDerWaalsContact O-CB 3.23Å; S674-W678 WeakPolarHBondContact O-CB 3.43Å; S674-W678 PolarHBondContact O-N 3.02Å
675	D	91.4	Very high	89.2	Confident	68 Å²	68	58.2 Å²	58.2	36%	0.364	29%	0.291	S	S	.	.	H	α-helix	trans	-71.7	-42.9	177.5	177.5	44.2	0	0	0	112.1	D673 E677 W678 K679	D673-D675 VanDerWaalsContact C-N 3.31Å; D673-D675 PolarHBondContact O-N 3.11Å; D673-D675 VanDerWaalsContact O-N 3.17Å; D675-E677 VanDerWaalsContact C-N 3.31Å; D675-E677 PolarHBondContact O-N 3.48Å; D675-W678 PolarHBondContact O-N 3.26Å; D675-K679 WeakPolarHBondContact O-CB 3.47Å; D675-K679 WeakPolarHBondContact O-CG 3.39Å; D675-K679 PolarHBondContact O-N 2.98Å; D675-K679 WeakPolarHBondContact OD1-CE 3.46Å; D675-K679 IonicContact OD1-NZ 3.57Å; D675-K679 PolarHBondContact OD1-NZ 3.31Å; D675-K679 WeakPolarHBondContact OD2-CE 3.42Å; D675-K679 IonicContact OD2-NZ 2.6Å; D675-K679 PolarHBondContact OD2-NZ 3.46Å
676	V	92.8	Very high	89.3	Confident	40 Å²	40	55.4 Å²	55.4	24%	0.242	27%	0.269	C	S	.	.	H	α-helix	trans	-62.6	-44.4	176.9	173.7	0	0	0	0	110.1	K311 K312 A315 D673 F680	K311-V676 HydrophobicContact CB-CG1 3.98Å; K312-V676 HydrophobicContact CG-CG1 4.15Å; A315-V676 HydrophobicContact CB-CB 4.24Å; A315-V676 HydrophobicContact CB-CG1 3.79Å; A315-V676 HydrophobicContact CB-CG2 4.47Å; D673-V676 PolarHBondContact O-N 3.31Å; D673-V676 VanDerWaalsContact O-N 3.15Å; V676-F680 WeakPolarHBondContact O-CB 3.48Å; V676-F680 PolarHBondContact O-N 2.85Å
677	E	91.1	Very high	89.3	Confident	19 Å²	19	55.3 Å²	55.3	9%	0.089	27%	0.268	C	S	.	.	H	α-helix	trans	-57.5	-50	174.3	-69.8	-80.2	151.7	0	0	112.7	K311 I561 R565 D673 S674 D675 F680 A681	K311-E677 WeakPolarHBondContact CD-OE1 3.27Å; K311-E677 IonicContact NZ-OE1 3.57Å; K311-E677 PolarHBondContact NZ-OE1 3.14Å; K311-E677 IonicContact NZ-OE2 3.68Å; I561-E677 HydrophobicContact CG2-CB 3.99Å; R565-E677 IonicContact CZ-OE1 2.72Å; R565-E677 IonicContact CZ-OE2 3.16Å; R565-E677 IonicContact NE-OE2 3.42Å; R565-E677 PolarHBondContact NE-OE2 2.96Å; R565-E677 VanDerWaalsContact NH1-CD 3.28Å; R565-E677 IonicContact NH1-OE1 3.7Å; R565-E677 PolarHBondContact NH1-OE1 3.26Å; R565-E677 IonicContact NH1-OE2 3.06Å; R565-E677 IonicContact NH2-OE1 2.61Å; R565-E677 PolarHBondContact NH2-OE1 3.46Å; R565-E677 IonicContact NH2-OE2 3.22Å; R565-E677 PolarHBondContact NH2-OE2 3.49Å; D673-E677 HydrophobicContact CB-CG 4.3Å; D673-E677 WeakPolarHBondContact O-CB 3.45Å; D673-E677 WeakPolarHBondContact O-CG 3.48Å; D673-E677 PolarHBondContact O-N 3.33Å; D673-E677 VanDerWaalsContact O-N 3.1Å; S674-E677 WeakPolarHBondContact O-CB 3.22Å; D675-E677 VanDerWaalsContact C-N 3.31Å; D675-E677 PolarHBondContact O-N 3.48Å; E677-F680 WeakPolarHBondContact O-CB 3.46Å; E677-F680 PolarHBondContact O-N 3.35Å; E677-A681 PolarHBondContact O-N 3.46Å
678	W	93.8	Very high	89.2	Confident	8 Å²	8	54.2 Å²	54.2	3%	0.03	27%	0.271	C	S	.	.	H	α-helix	trans	-63.4	-47.6	178.9	164.9	58.7	0	0	0	111.4	P551 E554 G557 P558 S674 D675 F680 A681 R682	P551-W678 PolarHBondContact O-NE1 3.37Å; E554-W678 VanDerWaalsContact CA-CZ2 3.43Å; E554-W678 HydrophobicContact CB-CH2 3.81Å; E554-W678 HydrophobicContact CB-CZ2 4.04Å; E554-W678 HydrophobicContact CG-CH2 3.71Å; E554-W678 HydrophobicContact CG-CZ2 4.4Å; E554-W678 HydrophobicContact CG-CZ3 4.33Å; G557-W678 VanDerWaalsContact CA-CD1 3.44Å; P558-W678 HydrophobicContact CB-CB 4.43Å; P558-W678 HydrophobicContact CG-CB 3.94Å; P558-W678 HydrophobicContact CG-CD2 3.95Å; P558-W678 HydrophobicContact CG-CE3 4.14Å; P558-W678 HydrophobicContact CG-CG 3.84Å; S674-W678 VanDerWaalsContact O-CB 3.23Å; S674-W678 WeakPolarHBondContact O-CB 3.43Å; S674-W678 PolarHBondContact O-N 3.02Å; D675-W678 PolarHBondContact O-N 3.26Å; W678-F680 VanDerWaalsContact C-N 3.25Å; W678-F680 PolarHBondContact O-N 2.98Å; W678-A681 PolarHBondContact O-N 3.42Å; W678-A681 VanDerWaalsContact O-N 3.17Å; W678-R682 VanDerWaalsContact CZ2-NH1 3.28Å; W678-R682 VanDerWaalsContact O-CB 3.25Å; W678-R682 WeakPolarHBondContact O-CB 3.28Å; W678-R682 PolarHBondContact O-N 3.16Å
679	K	94.3	Very high	89.2	Confident	49 Å²	49	49.9 Å²	49.9	21%	0.213	25%	0.25	C	C	.	.	H	α-helix	trans	-59.7	-36.6	177.1	-75.6	170.3	178.2	160.3	0	112.2	A315 Q320 D675 A683	A315-K679 HydrophobicContact CB-CB 3.81Å; A315-K679 HydrophobicContact CB-CD 4.18Å; Q320-K679 PolarHBondContact NE2-O 3.38Å; D675-K679 WeakPolarHBondContact O-CB 3.47Å; D675-K679 WeakPolarHBondContact O-CG 3.39Å; D675-K679 PolarHBondContact O-N 2.98Å; D675-K679 WeakPolarHBondContact OD1-CE 3.46Å; D675-K679 IonicContact OD1-NZ 3.57Å; D675-K679 PolarHBondContact OD1-NZ 3.31Å; D675-K679 WeakPolarHBondContact OD2-CE 3.42Å; D675-K679 IonicContact OD2-NZ 2.6Å; D675-K679 PolarHBondContact OD2-NZ 3.46Å; K679-A683 VanDerWaalsContact O-CB 3.32Å; K679-A683 WeakPolarHBondContact O-CB 3.34Å; K679-A683 PolarHBondContact O-N 3.12Å
680	F	94.1	Very high	89.2	Confident	22 Å²	22	43.5 Å²	43.5	10%	0.096	22%	0.22	C	C	.	.	H	α-helix	trans	-65.3	-49.4	173.3	179.8	-97.6	0	0	0	112.1	I306 K311 V314 V676 E677 W678 R682 A683 K684	I306-F680 HydrophobicContact CB-CE2 4.27Å; I306-F680 HydrophobicContact CB-CZ 4.35Å; I306-F680 HydrophobicContact CG1-CE2 3.87Å; I306-F680 HydrophobicContact CG1-CZ 4.34Å; I306-F680 HydrophobicContact CG2-CE2 4.41Å; I306-F680 HydrophobicContact CG2-CZ 4.03Å; K311-F680 HydrophobicContact CB-CB 4.32Å; K311-F680 HydrophobicContact CB-CD2 4.22Å; K311-F680 HydrophobicContact CB-CG 4.29Å; K311-F680 HydrophobicContact CG-CB 4.41Å; K311-F680 HydrophobicContact CG-CD1 4.26Å; K311-F680 HydrophobicContact CG-CD2 4.04Å; K311-F680 HydrophobicContact CG-CE2 4.34Å; K311-F680 HydrophobicContact CG-CG 3.98Å; V314-F680 HydrophobicContact CB-CD2 4.01Å; V314-F680 HydrophobicContact CG1-CD2 4.35Å; V314-F680 HydrophobicContact CG2-CD2 4.12Å; V314-F680 HydrophobicContact CG2-CE2 4.26Å; V676-F680 WeakPolarHBondContact O-CB 3.48Å; V676-F680 PolarHBondContact O-N 2.85Å; E677-F680 WeakPolarHBondContact O-CB 3.46Å; E677-F680 PolarHBondContact O-N 3.35Å; W678-F680 VanDerWaalsContact C-N 3.25Å; W678-F680 PolarHBondContact O-N 2.98Å; F680-R682 VanDerWaalsContact C-N 3.31Å; F680-R682 PolarHBondContact O-N 3.01Å; F680-A683 PolarHBondContact O-N 3.29Å; F680-K684 PolarHBondContact O-N 3.09Å
681	A	91	Very high	88.8	Confident	27 Å²	27	46.8 Å²	46.8	22%	0.223	24%	0.238	C	C	.	.	H	α-helix	trans	-61.3	-40.6	177.1	0	0	0	0	0	112	I561 E677 W678 K684 L685	I561-A681 HydrophobicContact CD1-CB 3.7Å; I561-A681 HydrophobicContact CG1-CB 4.27Å; E677-A681 PolarHBondContact O-N 3.46Å; W678-A681 PolarHBondContact O-N 3.42Å; W678-A681 VanDerWaalsContact O-N 3.17Å; A681-K684 PolarHBondContact O-N 3.06Å; A681-L685 PolarHBondContact O-N 3.1Å
682	R	92.9	Very high	87.9	Confident	33 Å²	33	47.3 Å²	47.3	13%	0.125	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-44.8	174.9	-174.9	179.8	75.8	-178.9	4.1	112	W678 F680 L685 W686	W678-R682 VanDerWaalsContact CZ2-NH1 3.28Å; W678-R682 VanDerWaalsContact O-CB 3.25Å; W678-R682 WeakPolarHBondContact O-CB 3.28Å; W678-R682 PolarHBondContact O-N 3.16Å; F680-R682 VanDerWaalsContact C-N 3.31Å; F680-R682 PolarHBondContact O-N 3.01Å; R682-L685 WeakPolarHBondContact O-CB 3.41Å; R682-L685 PolarHBondContact O-N 3Å; R682-W686 VanDerWaalsContact CD-CZ2 3.41Å; R682-W686 HydrophobicContact CG-CD2 4.16Å; R682-W686 HydrophobicContact CG-CH2 4.14Å; R682-W686 HydrophobicContact CG-CZ2 3.56Å; R682-W686 VanDerWaalsContact NE-CH2 3.25Å; R682-W686 VanDerWaalsContact O-CG 3.31Å; R682-W686 PolarHBondContact O-N 3.02Å
683	A	92.5	Very high	86.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.9	-40	176	0	0	0	0	0	112.1	V314 L323 K679 F680 L685 W686 L687	V314-A683 HydrophobicContact CG1-CB 3.33Å; L323-A683 HydrophobicContact CD1-CB 3.83Å; K679-A683 VanDerWaalsContact O-CB 3.32Å; K679-A683 WeakPolarHBondContact O-CB 3.34Å; K679-A683 PolarHBondContact O-N 3.12Å; F680-A683 PolarHBondContact O-N 3.29Å; A683-L685 VanDerWaalsContact C-N 3.34Å; A683-L685 PolarHBondContact O-N 3.46Å; A683-W686 PolarHBondContact O-N 3.45Å; A683-L687 PolarHBondContact O-N 2.99Å
684	K	89.8	Confident	86.1	Confident	88 Å²	88	41.4 Å²	41.4	38%	0.383	22%	0.218	S	C	.	.	H	α-helix	trans	-60.3	-43.7	173.4	-172.4	177.7	-179.7	179	0	111.4	I306 H460 F680 A681 S688	I306-K684 HydrophobicContact CG2-CD 4.46Å; I306-K684 HydrophobicContact CG2-CG 4.33Å; H460-K684 PolarHBondContact CE1-NZ 2.82Å; H460-K684 PolarHBondContact NE2-NZ 3.28Å; F680-K684 PolarHBondContact O-N 3.09Å; A681-K684 PolarHBondContact O-N 3.06Å; K684-S688 PolarHBondContact O-N 3.42Å
685	L	89.3	Confident	85.5	Confident	31 Å²	31	41.1 Å²	41.1	16%	0.162	21%	0.214	C	C	.	.	H	α-helix	trans	-59.2	-49.5	173.8	178.8	67.6	0	0	0	111	F379 A552 A681 R682 A683 L687 S688 Y689	F379-L685 HydrophobicContact CE2-CD2 4.16Å; A552-L685 HydrophobicContact CB-CD2 4.03Å; A681-L685 PolarHBondContact O-N 3.1Å; R682-L685 WeakPolarHBondContact O-CB 3.41Å; R682-L685 PolarHBondContact O-N 3Å; A683-L685 VanDerWaalsContact C-N 3.34Å; A683-L685 PolarHBondContact O-N 3.46Å; L685-L687 PolarHBondContact O-N 3.44Å; L685-S688 WeakPolarHBondContact O-CB 3.49Å; L685-S688 PolarHBondContact O-N 2.98Å; L685-S688 PolarHBondContact O-OG 3.18Å; L685-Y689 HydrophobicContact CD1-CE2 3.95Å; L685-Y689 HydrophobicContact CG-CE2 4.43Å; L685-Y689 VanDerWaalsContact O-CD2 3.31Å; L685-Y689 WeakPolarHBondContact O-CD2 3.49Å
686	W	90.4	Very high	85.1	Confident	13 Å²	13	39.3 Å²	39.3	5%	0.049	21%	0.205	C	C	.	.	H	α-helix	trans	-61.2	-42.4	-178.7	-66.9	-13.8	0	0	0	113.3	L323 L324 W327 R682 A683 S688 Y689 F690	L323-W686 HydrophobicContact CB-CE3 3.98Å; L323-W686 HydrophobicContact CB-CZ3 4.04Å; L324-W686 HydrophobicContact CD2-CH2 3.38Å; L324-W686 HydrophobicContact CD2-CZ2 4.04Å; L324-W686 HydrophobicContact CD2-CZ3 4.01Å; L324-W686 HydrophobicContact CG-CH2 3.81Å; L324-W686 HydrophobicContact CG-CZ3 4.02Å; W327-W686 AromaticContact CD2-CD1 3.79Å; W327-W686 HydrophobicContact CD2-CD2 4.26Å; W327-W686 AromaticContact CD2-CG 3.97Å; W327-W686 HydrophobicContact CD2-CG 3.97Å; W327-W686 AromaticContact CD2-NE1 3.95Å; W327-W686 AromaticContact CE2-CD1 3.91Å; W327-W686 AromaticContact CE2-NE1 3.81Å; W327-W686 HydrophobicContact CE3-CB 3.68Å; W327-W686 AromaticContact CE3-CD1 3.51Å; W327-W686 HydrophobicContact CE3-CD2 4.26Å; W327-W686 AromaticContact CE3-CG 3.54Å; W327-W686 HydrophobicContact CE3-CG 3.54Å; W327-W686 HydrophobicContact CG-CD2 4.48Å; W327-W686 AromaticContact CH2-CD1 3.54Å; W327-W686 HydrophobicContact CH2-CG 4.35Å; W327-W686 AromaticContact CZ2-CD1 3.81Å; W327-W686 AromaticContact CZ2-NE1 3.91Å; W327-W686 HydrophobicContact CZ3-CB 3.84Å; W327-W686 AromaticContact CZ3-CD1 3.41Å; W327-W686 VanDerWaalsContact CZ3-CD1 3.41Å; W327-W686 AromaticContact CZ3-CG 3.79Å; W327-W686 HydrophobicContact CZ3-CG 3.79Å; R682-W686 VanDerWaalsContact CD-CZ2 3.41Å; R682-W686 HydrophobicContact CG-CD2 4.16Å; R682-W686 HydrophobicContact CG-CH2 4.14Å; R682-W686 HydrophobicContact CG-CZ2 3.56Å; R682-W686 VanDerWaalsContact NE-CH2 3.25Å; R682-W686 VanDerWaalsContact O-CG 3.31Å; R682-W686 PolarHBondContact O-N 3.02Å; A683-W686 PolarHBondContact O-N 3.45Å; W686-S688 PolarHBondContact O-N 3.35Å; W686-Y689 PolarHBondContact O-N 3.32Å; W686-F690 HydrophobicContact CB-CE1 4.28Å; W686-F690 HydrophobicContact CB-CZ 4.15Å; W686-F690 WeakPolarHBondContact O-CD1 3.47Å; W686-F690 PolarHBondContact O-N 2.91Å
687	L	88	Confident	84.8	Confident	13 Å²	13	37.5 Å²	37.5	7%	0.068	19%	0.194	C	C	.	.	H	α-helix	trans	-61.5	-31	-179.8	-84.8	159.2	0	0	0	113.3	L299 V302 K303 I306 A683 L685 Y689 F690	L299-L687 HydrophobicContact CD1-CD2 4.01Å; V302-L687 HydrophobicContact CG1-CD1 4.05Å; K303-L687 HydrophobicContact CG-CD2 4.24Å; I306-L687 HydrophobicContact CD1-CD1 3.04Å; I306-L687 HydrophobicContact CD1-CG 4.48Å; I306-L687 HydrophobicContact CG1-CD1 4.48Å; A683-L687 PolarHBondContact O-N 2.99Å; L685-L687 PolarHBondContact O-N 3.44Å; L687-Y689 PolarHBondContact O-N 3.38Å; L687-F690 HydrophobicContact CD2-CD2 3.55Å; L687-F690 HydrophobicContact CD2-CE2 4.11Å; L687-F690 HydrophobicContact CD2-CG 4.46Å; L687-F690 HydrophobicContact CG-CD2 4.03Å; L687-F690 HydrophobicContact CG-CE2 4.29Å; L687-F690 PolarHBondContact O-N 3.09Å
688	S	84.7	Confident	84.6	Confident	55 Å²	55	37.1 Å²	37.1	39%	0.385	19%	0.194	S	C	.	.	H	α-helix	trans	-62	-22.4	174.4	75.6	0	0	0	0	113.5	K684 L685 W686	K684-S688 PolarHBondContact O-N 3.42Å; L685-S688 WeakPolarHBondContact O-CB 3.49Å; L685-S688 PolarHBondContact O-N 2.98Å; L685-S688 PolarHBondContact O-OG 3.18Å; W686-S688 PolarHBondContact O-N 3.35Å
689	Y	87.4	Confident	84.2	Confident	39 Å²	39	37.8 Å²	37.8	15%	0.153	20%	0.199	C	C	.	.	H	α-helix	trans	-101.2	-10.7	178.4	-65.8	-81.1	0	0	0	113.8	W327 K378 F379 H382 L685 W686 L687	W327-Y689 HydrophobicContact CH2-CD2 4.32Å; W327-Y689 HydrophobicContact CZ3-CD2 4.3Å; W327-Y689 HydrophobicContact CZ3-CG 4.49Å; K378-Y689 HydrophobicContact CB-CD1 3.87Å; K378-Y689 PolarHBondContact NZ-O 3.4Å; K378-Y689 VanDerWaalsContact NZ-O 3.11Å; F379-Y689 HydrophobicContact CB-CD1 4.41Å; F379-Y689 HydrophobicContact CB-CD2 4.35Å; F379-Y689 HydrophobicContact CB-CE1 4.36Å; F379-Y689 HydrophobicContact CB-CE2 4.31Å; F379-Y689 HydrophobicContact CB-CG 4.41Å; F379-Y689 AromaticContact CD2-CE2 3.83Å; F379-Y689 HydrophobicContact CD2-CE2 3.83Å; F379-Y689 AromaticContact CD2-CZ 3.99Å; H382-Y689 HydrophobicContact CB-CE1 4.48Å; H382-Y689 AromaticContact CD2-CE1 3.66Å; L685-Y689 HydrophobicContact CD1-CE2 3.95Å; L685-Y689 HydrophobicContact CG-CE2 4.43Å; L685-Y689 VanDerWaalsContact O-CD2 3.31Å; L685-Y689 WeakPolarHBondContact O-CD2 3.49Å; W686-Y689 PolarHBondContact O-N 3.32Å; L687-Y689 PolarHBondContact O-N 3.38Å
690	F	85.6	Confident	83.8	Confident	14 Å²	14	38.2 Å²	38.2	6%	0.061	20%	0.201	C	C	.	.	H	α-helix	trans	-70.7	-35.8	178.5	-73.3	-4.9	0	0	0	112.6	R296 L299 L323 I326 W327 P375 W686 L687	R296-F690 PolarHBondContact NH1-O 2.85Å; L299-F690 HydrophobicContact CD1-CD2 3.77Å; L299-F690 HydrophobicContact CD1-CE2 3.78Å; L323-F690 HydrophobicContact CD2-CE2 3.82Å; L323-F690 HydrophobicContact CD2-CZ 4.46Å; I326-F690 HydrophobicContact CB-CE1 4.42Å; I326-F690 HydrophobicContact CB-CE2 4.37Å; I326-F690 HydrophobicContact CB-CZ 4.02Å; I326-F690 HydrophobicContact CG2-CD1 4.12Å; I326-F690 HydrophobicContact CG2-CD2 4.2Å; I326-F690 HydrophobicContact CG2-CE1 3.79Å; I326-F690 HydrophobicContact CG2-CE2 3.94Å; I326-F690 HydrophobicContact CG2-CG 4.31Å; I326-F690 HydrophobicContact CG2-CZ 3.73Å; W327-F690 HydrophobicContact CB-CE1 4.29Å; W327-F690 HydrophobicContact CB-CZ 4.5Å; W327-F690 HydrophobicContact CE3-CD1 4.49Å; W327-F690 AromaticContact CE3-CE1 3.8Å; W327-F690 HydrophobicContact CE3-CE1 3.8Å; P375-F690 HydrophobicContact CB-CD1 3.67Å; P375-F690 HydrophobicContact CB-CE1 3.84Å; P375-F690 HydrophobicContact CG-CD1 3.55Å; P375-F690 HydrophobicContact CG-CE1 3.81Å; W686-F690 HydrophobicContact CB-CE1 4.28Å; W686-F690 HydrophobicContact CB-CZ 4.15Å; W686-F690 WeakPolarHBondContact O-CD1 3.47Å; W686-F690 PolarHBondContact O-N 2.91Å; L687-F690 HydrophobicContact CD2-CD2 3.55Å; L687-F690 HydrophobicContact CD2-CE2 4.11Å; L687-F690 HydrophobicContact CD2-CG 4.46Å; L687-F690 HydrophobicContact CG-CD2 4.03Å; L687-F690 HydrophobicContact CG-CE2 4.29Å; L687-F690 PolarHBondContact O-N 3.09Å
691	D	74.7	Confident	83.3	Confident	84 Å²	84	38.2 Å²	38.2	45%	0.449	20%	0.202	S	C	.	.	S	Bend	trans	-65	148.3	177.1	-66.5	-26	0	0	0	110.5	K303 K378 G693	K303-D691 IonicContact NZ-OD1 3.01Å; K303-D691 PolarHBondContact NZ-OD1 3.46Å; K303-D691 IonicContact NZ-OD2 2.76Å; K303-D691 PolarHBondContact NZ-OD2 3.23Å; K378-D691 PolarHBondContact NZ-O 3.23Å; D691-G693 PolarHBondContact O-N 2.92Å
692	E	64.1	Low	82.7	Confident	104 Å²	104	40.3 Å²	40.3	49%	0.486	21%	0.209	S	C	.	.	S	Bend	trans	-67.4	-12.1	-171	-56.1	-159.4	151.9	0	0	114.1	R373	R373-E692 IonicContact CZ-OE1 2.72Å; R373-E692 IonicContact NH2-OE1 3.41Å; R373-E692 PolarHBondContact NH2-OE1 3.32Å; R373-E692 IonicContact NH2-OE2 2.82Å; R373-E692 PolarHBondContact NH2-OE2 3.24Å; R373-E692 VanDerWaalsContact NH2-OE2 3.12Å
693	G	64.6	Low	81.9	Confident	45 Å²	45	42.7 Å²	42.7	46%	0.464	23%	0.227	S	C	.	.			trans	-64.1	167.3	173.9	0	0	0	0	0	114	K378 D691 T695	K378-G693 PolarHBondContact NZ-O 3.38Å; D691-G693 PolarHBondContact O-N 2.92Å; G693-T695 PolarHBondContact O-N 2.98Å
694	R	66.6	Low	80.6	Confident	93 Å²	93	46.1 Å²	46.1	35%	0.351	25%	0.25	S	C	.	.			trans	59.6	38.9	168.3	-52	179	-175.4	-158	-1.9	115.9	H382 E448	H382-R694 PolarHBondContact NE2-O 2.84Å; E448-R694 VanDerWaalsContact CD-NH2 3.34Å; E448-R694 VanDerWaalsContact CG-NH2 3.26Å; E448-R694 IonicContact OE2-CZ 2.73Å; E448-R694 IonicContact OE2-NH1 3.19Å; E448-R694 PolarHBondContact OE2-NH1 3.12Å; E448-R694 IonicContact OE2-NH2 2.83Å; E448-R694 PolarHBondContact OE2-NH2 3.02Å
695	T	76.7	Confident	79.4	Confident	18 Å²	18	44.5 Å²	44.5	11%	0.11	25%	0.249	C	C	.	.			trans	-68.7	-33.5	177.4	53.6	0	0	0	0	113.8	Y360 G693	Y360-T695 WeakPolarHBondContact CE1-OG1 3.47Å; Y360-T695 PolarHBondContact OH-OG1 3.02Å; G693-T695 PolarHBondContact O-N 2.98Å
696	L	82.7	Confident	78.2	Confident	30 Å²	30	47.4 Å²	47.4	16%	0.157	27%	0.27	C	S	.	.	S	Bend	trans	-104.3	131.4	179.9	-66.5	173.9	0	0	0	110.7	A357 Y360 L372 F700	A357-L696 HydrophobicContact CB-CD2 4.08Å; Y360-L696 HydrophobicContact CD1-CD1 4.1Å; Y360-L696 HydrophobicContact CD1-CD2 3.96Å; Y360-L696 HydrophobicContact CD1-CG 4Å; Y360-L696 HydrophobicContact CE1-CG 4.37Å; Y360-L696 HydrophobicContact CG-CD2 4.43Å; L372-L696 HydrophobicContact CD2-CD2 4.29Å; L696-F700 HydrophobicContact CB-CB 4.48Å
697	P	86.9	Confident	76.8	Confident	3 Å²	3	53.4 Å²	53.4	2%	0.019	30%	0.296	C	S	.	.			trans	-77.2	165.8	174.2	33.9	-36.4	0	0	0	112.1	L353 A381 H382 F700 N701	L353-P697 HydrophobicContact CD1-CG 4.07Å; L353-P697 HydrophobicContact CD2-CG 4.28Å; A381-P697 HydrophobicContact CB-CG 4.21Å; H382-P697 VanDerWaalsContact CE1-CA 3.49Å; H382-P697 WeakPolarHBondContact CE1-CA 3.33Å; P697-F700 PolarHBondContact O-N 3.43Å; P697-N701 PolarHBondContact O-N 3.37Å; P697-N701 VanDerWaalsContact O-N 3.11Å
698	A	86	Confident	75.6	Confident	10 Å²	10	55.6 Å²	55.6	8%	0.083	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	146.6	166.1	0	0	0	0	0	109.4	S385 M441 F700	S385-A698 WeakPolarHBondContact CB-O 3.31Å; S385-A698 PolarHBondContact OG-O 2.71Å; M441-A698 HydrophobicContact CG-CB 4.14Å; A698-F700 VanDerWaalsContact C-N 3.35Å
699	P	85.3	Confident	74.4	Confident	22 Å²	22	59 Å²	59	14%	0.143	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	cis	-85.5	-4.1	-3.7	36.4	-32	0	0	0	112.6	K436 W437 N701 L702	K436-P699 HydrophobicContact CB-CB 4.49Å; W437-P699 HydrophobicContact CD2-CB 4.25Å; W437-P699 HydrophobicContact CD2-CG 3.95Å; W437-P699 VanDerWaalsContact CE2-CD 3.49Å; W437-P699 HydrophobicContact CE3-CB 4.34Å; W437-P699 HydrophobicContact CE3-CG 3.92Å; W437-P699 HydrophobicContact CG-CB 4.49Å; W437-P699 HydrophobicContact CH2-CG 4.1Å; W437-P699 HydrophobicContact CZ2-CG 4.12Å; W437-P699 HydrophobicContact CZ3-CG 3.99Å; P699-N701 PolarHBondContact O-N 3.35Å; P699-L702 PolarHBondContact O-N 3Å
700	F	85.9	Confident	73.4	Confident	59 Å²	59	64.2 Å²	64.2	26%	0.259	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-68.6	-14.1	-174.1	-56.1	-66.5	0	0	0	113.6	L353 P354 A357 L696 P697 A698 L702	L353-F700 HydrophobicContact CD2-CE2 4.17Å; L353-F700 HydrophobicContact CG-CE2 4.14Å; P354-F700 HydrophobicContact CB-CZ 4.11Å; A357-F700 HydrophobicContact CB-CB 4.11Å; A357-F700 HydrophobicContact CB-CD1 4.01Å; A357-F700 HydrophobicContact CB-CD2 3.98Å; A357-F700 HydrophobicContact CB-CE1 4.45Å; A357-F700 HydrophobicContact CB-CE2 4.42Å; A357-F700 HydrophobicContact CB-CG 3.76Å; L696-F700 HydrophobicContact CB-CB 4.48Å; P697-F700 PolarHBondContact O-N 3.43Å; A698-F700 VanDerWaalsContact C-N 3.35Å; F700-L702 VanDerWaalsContact C-N 3.25Å; F700-L702 PolarHBondContact O-N 3.09Å
701	N	83.6	Confident	72.5	Confident	22 Å²	22	70.1 Å²	70.1	12%	0.118	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-69.8	-15.1	175.8	71.8	-16.5	0	0	0	114.9	G440 P697 P699	G440-N701 VanDerWaalsContact CA-OD1 3.23Å; G440-N701 WeakPolarHBondContact CA-OD1 3.37Å; G440-N701 PolarHBondContact O-ND2 3.06Å; P697-N701 PolarHBondContact O-N 3.37Å; P697-N701 VanDerWaalsContact O-N 3.11Å; P699-N701 PolarHBondContact O-N 3.35Å
702	L	79.9	Confident	72.1	Confident	71 Å²	71	70.4 Å²	70.4	37%	0.372	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-73.6	-27.5	178.2	-71.2	172.8	0	0	0	112.4	L439 W443 P699 F700 P704	L439-L702 HydrophobicContact CB-CD1 4.12Å; W443-L702 HydrophobicContact CB-CD2 4.06Å; W443-L702 HydrophobicContact CG-CD2 4.37Å; P699-L702 PolarHBondContact O-N 3Å; F700-L702 VanDerWaalsContact C-N 3.25Å; F700-L702 PolarHBondContact O-N 3.09Å; L702-P704 WeakPolarHBondContact O-CD 3.47Å
703	V	74.9	Confident	72.3	Confident	82 Å²	82	68.9 Å²	68.9	50%	0.497	36%	0.363	S	S	.	.	S	Bend	trans	-80	110.7	179.4	-176.5	0	0	0	0	108.4	W361 S705	W361-V703 HydrophobicContact CZ2-CG1 4.28Å; V703-S705 PolarHBondContact O-N 3.3Å
704	P	66.4	Low	72.5	Confident	73 Å²	73	69.3 Å²	69.3	47%	0.474	35%	0.354	S	S	.	.			trans	-65.9	138.4	-179.3	26	-31.9	0	0	0	110.4	L702	L702-P704 WeakPolarHBondContact O-CD 3.47Å
705	S	63.2	Low	72.6	Confident	54 Å²	54	73 Å²	73	38%	0.378	37%	0.368	S	S	.	.			trans	-65.7	151.3	169.2	67.1	0	0	0	0	110	V703 K707 S708 F709	V703-S705 PolarHBondContact O-N 3.3Å; S705-K707 PolarHBondContact O-N 2.94Å; S705-K707 VanDerWaalsContact O-N 3.1Å; S705-S708 WeakPolarHBondContact O-CA 3.43Å; S705-S708 WeakPolarHBondContact O-CB 3.32Å; S705-S708 PolarHBondContact O-N 3Å; S705-S708 PolarHBondContact OG-N 2.92Å; S705-F709 PolarHBondContact O-N 3.37Å; S705-F709 VanDerWaalsContact O-N 3.14Å
706	P	63.5	Low	72.5	Confident	91 Å²	91	76.3 Å²	76.3	59%	0.591	38%	0.384	S	S	*	.	H	α-helix	trans	-53.9	-33.4	177.3	-27.1	34.5	0	0	0	113.1	F709 Y710	P706-F709 PolarHBondContact O-N 3.49Å; P706-Y710 PolarHBondContact O-N 3.37Å; P706-Y710 VanDerWaalsContact O-N 3.14Å
707	K	61.4	Low	72.1	Confident	140 Å²	140	81.1 Å²	81.1	61%	0.609	40%	0.404	S	S	*	.	H	α-helix	trans	-64.1	-43.6	173.1	-65.8	-174.6	179.2	-178.1	0	112.4	S705 F709 Y710 Y711	S705-K707 PolarHBondContact O-N 2.94Å; S705-K707 VanDerWaalsContact O-N 3.1Å; K707-F709 VanDerWaalsContact C-N 3.3Å; K707-F709 PolarHBondContact O-N 3.38Å; K707-Y710 WeakPolarHBondContact O-CB 3.36Å; K707-Y710 PolarHBondContact O-N 2.93Å; K707-Y711 HydrophobicContact CB-CE2 4.3Å; K707-Y711 WeakPolarHBondContact O-CD2 3.23Å; K707-Y711 PolarHBondContact O-N 2.93Å
708	S	62.8	Low	71.3	Confident	58 Å²	58	84.2 Å²	84.2	41%	0.406	43%	0.425	S	S	.	.	H	α-helix	trans	-63.9	-35.7	178.2	-170.3	0	0	0	0	112.1	S705 L712	S705-S708 WeakPolarHBondContact O-CA 3.43Å; S705-S708 WeakPolarHBondContact O-CB 3.32Å; S705-S708 PolarHBondContact O-N 3Å; S705-S708 PolarHBondContact OG-N 2.92Å; S708-L712 VanDerWaalsContact O-CB 3.24Å; S708-L712 WeakPolarHBondContact O-CB 3.48Å; S708-L712 PolarHBondContact O-N 3.03Å
709	F	60.1	Low	70.3	Confident	126 Å²	126	87 Å²	87	55%	0.553	44%	0.444	S	S	*	.	H	α-helix	trans	-67.7	-42.5	175.7	-165.8	-97.9	0	0	0	111.3	S705 P706 K707 L712 V713	S705-F709 PolarHBondContact O-N 3.37Å; S705-F709 VanDerWaalsContact O-N 3.14Å; P706-F709 PolarHBondContact O-N 3.49Å; K707-F709 VanDerWaalsContact C-N 3.3Å; K707-F709 PolarHBondContact O-N 3.38Å; F709-L712 PolarHBondContact O-N 3.22Å; F709-V713 HydrophobicContact CD1-CG2 4.07Å; F709-V713 HydrophobicContact CE1-CG2 3.85Å; F709-V713 HydrophobicContact CZ-CG2 4.31Å; F709-V713 VanDerWaalsContact O-CG2 3.3Å; F709-V713 WeakPolarHBondContact O-CG2 3.18Å; F709-V713 PolarHBondContact O-N 3.1Å
710	Y	66.6	Low	69.5	Low	149 Å²	149	90.7 Å²	90.7	58%	0.584	46%	0.462	S	S	*	.	H	α-helix	trans	-59.2	-46.7	173.8	179.9	-103.8	0	0	0	112.6	P706 K707 V713 L714	P706-Y710 PolarHBondContact O-N 3.37Å; P706-Y710 VanDerWaalsContact O-N 3.14Å; K707-Y710 WeakPolarHBondContact O-CB 3.36Å; K707-Y710 PolarHBondContact O-N 2.93Å; Y710-V713 PolarHBondContact O-N 3.1Å; Y710-L714 HydrophobicContact CD1-CD1 3.72Å; Y710-L714 HydrophobicContact CE1-CD1 3.26Å; Y710-L714 HydrophobicContact CE1-CG 4.44Å; Y710-L714 HydrophobicContact CE2-CD1 4.27Å; Y710-L714 HydrophobicContact CG-CD1 4.4Å; Y710-L714 WeakPolarHBondContact O-CB 3.5Å; Y710-L714 PolarHBondContact O-N 2.96Å
711	Y	65.4	Low	68.7	Low	138 Å²	138	92.1 Å²	92.1	54%	0.541	47%	0.471	S	S	.	.	H	α-helix	trans	-66.5	-36.6	175.9	-70.2	-61.8	0	0	0	112.9	K707 L714 R715	K707-Y711 HydrophobicContact CB-CE2 4.3Å; K707-Y711 WeakPolarHBondContact O-CD2 3.23Å; K707-Y711 PolarHBondContact O-N 2.93Å; Y711-L714 PolarHBondContact O-N 2.61Å; Y711-R715 VanDerWaalsContact O-CB 3.32Å; Y711-R715 WeakPolarHBondContact O-CB 3.49Å; Y711-R715 PolarHBondContact O-N 2.88Å
712	L	67.6	Low	67.7	Low	90 Å²	90	97.1 Å²	97.1	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-63.9	-45.4	175.5	-177.5	69.1	0	0	0	111.1	S708 F709 R715 I716	S708-L712 VanDerWaalsContact O-CB 3.24Å; S708-L712 WeakPolarHBondContact O-CB 3.48Å; S708-L712 PolarHBondContact O-N 3.03Å; F709-L712 PolarHBondContact O-N 3.22Å; L712-R715 PolarHBondContact O-N 3.05Å; L712-I716 HydrophobicContact CD1-CD1 4.19Å; L712-I716 HydrophobicContact CD2-CD1 4.46Å; L712-I716 HydrophobicContact CG-CD1 3.84Å; L712-I716 WeakPolarHBondContact O-CB 3.33Å; L712-I716 VanDerWaalsContact O-CG1 3.26Å; L712-I716 WeakPolarHBondContact O-CG1 3.47Å; L712-I716 PolarHBondContact O-N 2.92Å
713	V	68.4	Low	66.7	Low	72 Å²	72	98.8 Å²	98.8	44%	0.436	51%	0.506	S	S	.	.	H	α-helix	trans	-63	-42.6	176.4	171	0	0	0	0	111.1	F709 Y710 R715 I716 K717	F709-V713 HydrophobicContact CD1-CG2 4.07Å; F709-V713 HydrophobicContact CE1-CG2 3.85Å; F709-V713 HydrophobicContact CZ-CG2 4.31Å; F709-V713 VanDerWaalsContact O-CG2 3.3Å; F709-V713 WeakPolarHBondContact O-CG2 3.18Å; F709-V713 PolarHBondContact O-N 3.1Å; Y710-V713 PolarHBondContact O-N 3.1Å; V713-R715 PolarHBondContact O-N 3.27Å; V713-I716 PolarHBondContact O-N 3.32Å; V713-K717 VanDerWaalsContact O-CB 3.27Å; V713-K717 WeakPolarHBondContact O-CB 3.36Å; V713-K717 PolarHBondContact O-N 3.5Å
714	L	69.2	Low	65.8	Low	54 Å²	54	99.2 Å²	99.2	28%	0.283	51%	0.512	S	S	.	.	H	α-helix	trans	-60.4	-42.8	172.7	-86.3	163.5	0	0	0	112.2	Y710 Y711 K717 S718	Y710-L714 HydrophobicContact CD1-CD1 3.72Å; Y710-L714 HydrophobicContact CE1-CD1 3.26Å; Y710-L714 HydrophobicContact CE1-CG 4.44Å; Y710-L714 HydrophobicContact CE2-CD1 4.27Å; Y710-L714 HydrophobicContact CG-CD1 4.4Å; Y710-L714 WeakPolarHBondContact O-CB 3.5Å; Y710-L714 PolarHBondContact O-N 2.96Å; Y711-L714 PolarHBondContact O-N 2.61Å; L714-K717 PolarHBondContact O-N 3.17Å; L714-S718 WeakPolarHBondContact O-CB 3.48Å; L714-S718 PolarHBondContact O-N 3.34Å; L714-S718 PolarHBondContact O-OG 2.94Å
715	R	67.9	Low	65.3	Low	172 Å²	172	102.3 Å²	102.3	65%	0.649	52%	0.517	S	S	*	.	H	α-helix	trans	-69.6	-39	-179.7	-156.8	176.9	-170	178.1	3.1	111.9	Y711 L712 V713 S718 C719	Y711-R715 VanDerWaalsContact O-CB 3.32Å; Y711-R715 WeakPolarHBondContact O-CB 3.49Å; Y711-R715 PolarHBondContact O-N 2.88Å; L712-R715 PolarHBondContact O-N 3.05Å; V713-R715 PolarHBondContact O-N 3.27Å; R715-S718 PolarHBondContact O-N 3.04Å; R715-C719 VanDerWaalsContact O-CB 3.24Å; R715-C719 WeakPolarHBondContact O-CB 3.46Å; R715-C719 PolarHBondContact O-N 3.07Å
716	I	74.8	Confident	64.5	Low	87 Å²	87	102.5 Å²	102.5	45%	0.446	52%	0.523	S	S	.	.	H	α-helix	trans	-65	-42.8	173	-69.5	167.9	0	0	0	110.1	L712 V713 C719 L720	L712-I716 HydrophobicContact CD1-CD1 4.19Å; L712-I716 HydrophobicContact CD2-CD1 4.46Å; L712-I716 HydrophobicContact CG-CD1 3.84Å; L712-I716 WeakPolarHBondContact O-CB 3.33Å; L712-I716 VanDerWaalsContact O-CG1 3.26Å; L712-I716 WeakPolarHBondContact O-CG1 3.47Å; L712-I716 PolarHBondContact O-N 2.92Å; V713-I716 PolarHBondContact O-N 3.32Å; I716-C719 PolarHBondContact O-N 3.29Å; I716-L720 HydrophobicContact CG2-CD1 3.74Å; I716-L720 HydrophobicContact CG2-CG 4.4Å; I716-L720 WeakPolarHBondContact O-CB 3.48Å; I716-L720 WeakPolarHBondContact O-CG 3.27Å; I716-L720 PolarHBondContact O-N 2.8Å
717	K	73.8	Confident	63.6	Low	131 Å²	131	104.1 Å²	104.1	57%	0.57	53%	0.526	S	S	*	.	H	α-helix	trans	-61.6	-45.6	175	-171	-178	178.7	-177.8	0	111.4	V713 L714 L720 I721	V713-K717 VanDerWaalsContact O-CB 3.27Å; V713-K717 WeakPolarHBondContact O-CB 3.36Å; V713-K717 PolarHBondContact O-N 3.5Å; L714-K717 PolarHBondContact O-N 3.17Å; K717-L720 PolarHBondContact O-N 2.86Å; K717-I721 HydrophobicContact CG-CD1 4.02Å; K717-I721 WeakPolarHBondContact O-CB 3.39Å; K717-I721 WeakPolarHBondContact O-CD1 3.46Å; K717-I721 WeakPolarHBondContact O-CG1 3.26Å; K717-I721 PolarHBondContact O-N 3.48Å
718	S	69.6	Low	62.7	Low	67 Å²	67	100 Å²	100	47%	0.469	52%	0.524	S	S	.	.	H	α-helix	trans	-65.4	-38.6	175.7	-66.1	0	0	0	0	112.7	L714 R715 I721 L722	L714-S718 WeakPolarHBondContact O-CB 3.48Å; L714-S718 PolarHBondContact O-N 3.34Å; L714-S718 PolarHBondContact O-OG 2.94Å; R715-S718 PolarHBondContact O-N 3.04Å; S718-I721 PolarHBondContact O-N 2.87Å; S718-L722 WeakPolarHBondContact O-CB 3.31Å; S718-L722 PolarHBondContact O-N 3.05Å
719	C	65.5	Low	61.6	Low	70 Å²	70	106.4 Å²	106.4	47%	0.473	54%	0.539	S	S	.	.	H	α-helix	trans	-67.2	-41.5	175.8	-166.3	0	0	0	0	111.9	R715 I716 L722 L723	R715-C719 VanDerWaalsContact O-CB 3.24Å; R715-C719 WeakPolarHBondContact O-CB 3.46Å; R715-C719 PolarHBondContact O-N 3.07Å; I716-C719 PolarHBondContact O-N 3.29Å; C719-L722 WeakPolarHBondContact O-CB 3.32Å; C719-L722 PolarHBondContact O-N 3.08Å; C719-L723 WeakPolarHBondContact O-CB 3.2Å; C719-L723 PolarHBondContact O-N 3.15Å
720	L	68.5	Low	60.4	Low	99 Å²	99	111.2 Å²	111.2	52%	0.518	55%	0.553	S	S	.	*	H	α-helix	trans	-63	-41.3	172.5	-79.3	163.5	0	0	0	111.5	I716 K717 L722 L723 C724	I716-L720 HydrophobicContact CG2-CD1 3.74Å; I716-L720 HydrophobicContact CG2-CG 4.4Å; I716-L720 WeakPolarHBondContact O-CB 3.48Å; I716-L720 WeakPolarHBondContact O-CG 3.27Å; I716-L720 PolarHBondContact O-N 2.8Å; K717-L720 PolarHBondContact O-N 2.86Å; L720-L722 VanDerWaalsContact C-N 3.3Å; L720-L722 PolarHBondContact O-N 3.33Å; L720-L723 PolarHBondContact O-N 3.09Å; L720-C724 WeakPolarHBondContact O-CB 3.44Å; L720-C724 PolarHBondContact O-N 3.29Å; L720-C724 PolarHBondContact O-SG 3.46Å
721	I	70.4	Confident	59	Low	88 Å²	88	114.7 Å²	114.7	45%	0.451	57%	0.565	S	S	.	*	H	α-helix	trans	-63.2	-37.7	174.3	-69.7	163.2	0	0	0	111	K717 S718 K725	K717-I721 HydrophobicContact CG-CD1 4.02Å; K717-I721 WeakPolarHBondContact O-CB 3.39Å; K717-I721 WeakPolarHBondContact O-CD1 3.46Å; K717-I721 WeakPolarHBondContact O-CG1 3.26Å; K717-I721 PolarHBondContact O-N 3.48Å; S718-I721 PolarHBondContact O-N 2.87Å; I721-K725 WeakPolarHBondContact O-CB 3.48Å; I721-K725 PolarHBondContact O-N 3.26Å
722	L	62.3	Low	57.5	Low	127 Å²	127	114.6 Å²	114.6	67%	0.665	57%	0.574	S	S	*	*	H	α-helix	trans	-69.5	-41.2	176.5	-120.8	130.7	0	0	0	112.4	S718 C719 L720 K725 A726	S718-L722 WeakPolarHBondContact O-CB 3.31Å; S718-L722 PolarHBondContact O-N 3.05Å; C719-L722 WeakPolarHBondContact O-CB 3.32Å; C719-L722 PolarHBondContact O-N 3.08Å; L720-L722 VanDerWaalsContact C-N 3.3Å; L720-L722 PolarHBondContact O-N 3.33Å; L722-K725 PolarHBondContact O-N 3.04Å; L722-A726 VanDerWaalsContact O-CB 3.29Å; L722-A726 WeakPolarHBondContact O-CB 3.45Å; L722-A726 PolarHBondContact O-N 2.94Å
723	L	57.3	Low	55.9	Low	106 Å²	106	117.1 Å²	117.1	56%	0.555	59%	0.588	S	S	*	*	H	α-helix	trans	-67	-38	174.3	-80.1	159.1	0	0	0	112	C719 L720 A726 N727	C719-L723 WeakPolarHBondContact O-CB 3.2Å; C719-L723 PolarHBondContact O-N 3.15Å; L720-L723 PolarHBondContact O-N 3.09Å; L723-A726 PolarHBondContact O-N 3.26Å; L723-N727 PolarHBondContact O-N 3.17Å
724	C	57.1	Low	54.4	Low	92 Å²	92	122.5 Å²	122.5	62%	0.622	61%	0.609	S	S	*	*	H	α-helix	trans	-68.8	-39.3	173.5	-71.3	0	0	0	0	112.4	L720 N727 G728	L720-C724 WeakPolarHBondContact O-CB 3.44Å; L720-C724 PolarHBondContact O-N 3.29Å; L720-C724 PolarHBondContact O-SG 3.46Å; C724-N727 PolarHBondContact O-N 2.66Å; C724-G728 PolarHBondContact O-N 3.33Å; C724-G728 VanDerWaalsContact O-N 3.12Å
725	K	55.9	Low	53.1	Low	137 Å²	137	126.6 Å²	126.6	60%	0.596	64%	0.636	S	S	*	*	H	α-helix	trans	-68.8	-32.8	173	-90.3	-177	172.6	179.2	0	112.7	I721 L722 G728 R729	I721-K725 WeakPolarHBondContact O-CB 3.48Å; I721-K725 PolarHBondContact O-N 3.26Å; L722-K725 PolarHBondContact O-N 3.04Å; K725-G728 PolarHBondContact O-N 2.99Å; K725-R729 PolarHBondContact O-N 3.5Å
726	A	47.2	Very low	51.3	Low	59 Å²	59	127 Å²	127	49%	0.488	65%	0.645	S	S	.	*	H	α-helix	trans	-68.1	-37.6	174.8	0	0	0	0	0	112.2	L722 L723	L722-A726 VanDerWaalsContact O-CB 3.29Å; L722-A726 WeakPolarHBondContact O-CB 3.45Å; L722-A726 PolarHBondContact O-N 2.94Å; L723-A726 PolarHBondContact O-N 3.26Å
727	N	43.9	Very low	49.4	Very low	125 Å²	125	132.6 Å²	132.6	67%	0.668	67%	0.672	S	S	*	*	H	α-helix	trans	-72.2	-27.6	173.3	-90	-7.8	0	0	0	113.5	L723 C724	L723-N727 PolarHBondContact O-N 3.17Å; C724-N727 PolarHBondContact O-N 2.66Å
728	G	43.3	Very low	47.5	Very low	54 Å²	54	129.3 Å²	129.3	56%	0.557	68%	0.675	S	S	*	*	H	α-helix	trans	-71.9	-27.3	175.1	0	0	0	0	0	114.8	C724 K725	C724-G728 PolarHBondContact O-N 3.33Å; C724-G728 VanDerWaalsContact O-N 3.12Å; K725-G728 PolarHBondContact O-N 2.99Å
729	R	38.5	Very low	45.8	Very low	191 Å²	191	135 Å²	135	72%	0.721	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-82.6	-10.8	178.9	-88.2	-178.1	177.3	174.2	-1.2	114.7	K725 R731	K725-R729 PolarHBondContact O-N 3.5Å; R729-R731 VanDerWaalsContact C-N 3.3Å; R729-R731 PolarHBondContact O-N 3.41Å
730	R	34.6	Very low	44.2	Very low	227 Å²	227	138.1 Å²	138.1	86%	0.857	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-82.4	-3.5	-178.9	-135.7	177.4	-173	-178.6	0.8	114.2
731	R	37	Very low	42.4	Very low	222 Å²	222	141.6 Å²	141.6	84%	0.838	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-105.1	-7.5	-176.1	-157.6	153.7	82	170.4	5.5	115.6	R729	R729-R731 VanDerWaalsContact C-N 3.3Å; R729-R731 PolarHBondContact O-N 3.41Å
732	N	35	Very low	40.5	Very low	136 Å²	136	143.3 Å²	143.3	73%	0.727	74%	0.736	S	S	*	*	S	Bend	trans	-125.3	13.2	-171.5	-85.9	19.4	0	0	0	116.5
733	N	34.8	Very low	39	Very low	144 Å²	144	143.6 Å²	143.6	77%	0.77	73%	0.733	S	S	*	*			trans	-123.2	59.9	-179.2	-73.4	19.6	0	0	0	113
734	E	35.6	Very low	37.8	Very low	184 Å²	184	141.6 Å²	141.6	86%	0.86	73%	0.732	S	S	*	*	S	Bend	trans	-113.3	129.2	144.1	-76.3	-177.8	171.2	0	0	105.7
735	V	42	Very low	36.7	Very low	141 Å²	141	145.3 Å²	145.3	86%	0.855	74%	0.738	S	S	*	*	S	Bend	trans	91.5	78.4	-173.3	-165.1	0	0	0	0	114.5
736	E	31.1	Very low	35.4	Very low	180 Å²	180	145.3 Å²	145.3	84%	0.841	74%	0.74	S	S	*	*			trans	163.8	93.9	131.1	-94.3	-177.7	160.8	0	0	109.1
737	M	35.2	Very low	34.7	Very low	205 Å²	205	147 Å²	147	100%	1.01	74%	0.74	S	S	*	*			trans	-100.8	94.5	172.2	-124.9	-107.9	-76.3	0	0	107.5
738	G	33.8	Very low	34.1	Very low	62 Å²	62	145.5 Å²	145.5	64%	0.639	74%	0.738	S	S	*	*	S	Bend	trans	161.5	118.6	176.5	0	0	0	0	0	110.2
739	M	32.2	Very low	33.5	Very low	187 Å²	187	149.5 Å²	149.5	92%	0.921	74%	0.742	S	S	*	*			trans	83.6	63.1	-176.9	-49.3	-166.8	-166.1	0	0	116.7
740	L	32	Very low	33	Very low	134 Å²	134	146.9 Å²	146.9	70%	0.702	74%	0.743	S	S	*	*			trans	-135.6	76.7	166.2	-97.6	162	0	0	0	110.8
741	H	31.3	Very low	33	Very low	172 Å²	172	141.7 Å²	141.7	80%	0.796	73%	0.731	S	S	*	*	S	Bend	trans	-140.5	-4.7	157	-148.5	-77.2	0	0	0	114
742	T	30.8	Very low	32.9	Very low	124 Å²	124	135 Å²	135	76%	0.761	72%	0.715	S	S	*	*	S	Bend	trans	-108.2	-27.2	-176.1	-9.9	0	0	0	0	113.6
743	Q	31.4	Very low	32.7	Very low	133 Å²	133	135.3 Å²	135.3	62%	0.621	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-9.4	-178	-92	176.2	-17.3	0	0	115.6	K745	Q743-K745 PolarHBondContact O-N 2.94Å
744	A	30.8	Very low	32.6	Very low	64 Å²	64	130.6 Å²	130.6	53%	0.529	70%	0.702	S	S	.	*	H	α-helix	trans	-74.3	-15.5	174.1	0	0	0	0	0	113.2
745	K	34	Very low	32.4	Very low	171 Å²	171	133.1 Å²	133.1	74%	0.743	71%	0.705	S	S	*	*	H	α-helix	trans	-82.6	-31.1	177.9	-98.6	-178.7	174.4	176.9	0	113.4	Q743	Q743-K745 PolarHBondContact O-N 2.94Å
746	E	28.7	Very low	31.7	Very low	136 Å²	136	132.1 Å²	132.1	64%	0.636	69%	0.693	S	S	*	*	H	α-helix	trans	-80.8	-34.2	-179.2	-73.6	179.7	153.8	0	0	112.4	C748 Q749	E746-C748 VanDerWaalsContact C-N 3.34Å; E746-C748 PolarHBondContact O-N 3.42Å; E746-Q749 WeakPolarHBondContact O-CB 3.29Å; E746-Q749 PolarHBondContact O-N 3.24Å; E746-Q749 VanDerWaalsContact O-N 3.15Å
747	I	32.6	Very low	31.6	Very low	96 Å²	96	129 Å²	129	49%	0.492	69%	0.688	S	S	.	*	H	α-helix	trans	-74.1	-23.9	-178.8	-58.9	173.3	0	0	0	112.6	Q749 L751	I747-Q749 VanDerWaalsContact C-N 3.32Å; I747-L751 HydrophobicContact CG2-CD1 4.38Å
748	C	32.6	Very low	31.4	Very low	92 Å²	92	126.1 Å²	126.1	62%	0.622	68%	0.676	S	S	*	*	H	α-helix	trans	-76.5	-18.9	172.1	-85.9	0	0	0	0	113.1	E746	E746-C748 VanDerWaalsContact C-N 3.34Å; E746-C748 PolarHBondContact O-N 3.42Å
749	Q	30.2	Very low	31.1	Very low	138 Å²	138	127.4 Å²	127.4	65%	0.645	68%	0.675	S	S	*	*	H	α-helix	trans	-76.7	-41.3	178.8	-151.4	84.8	12.9	0	0	110.6	E746 I747 L751 V752	E746-Q749 WeakPolarHBondContact O-CB 3.29Å; E746-Q749 PolarHBondContact O-N 3.24Å; E746-Q749 VanDerWaalsContact O-N 3.15Å; I747-Q749 VanDerWaalsContact C-N 3.32Å; Q749-L751 VanDerWaalsContact C-N 3.34Å; Q749-L751 PolarHBondContact O-N 3.42Å; Q749-V752 PolarHBondContact O-N 3.29Å
750	D	26.6	Very low	31	Very low	137 Å²	137	123 Å²	123	73%	0.733	66%	0.663	S	S	*	*	H	α-helix	trans	-77.4	-14.7	-178.5	-72.8	-20.2	0	0	0	114.6
751	L	35.7	Very low	30.8	Very low	118 Å²	118	121.5 Å²	121.5	62%	0.618	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-3	178.3	-104	143.5	0	0	0	113.9	I747 Q749	I747-L751 HydrophobicContact CG2-CD1 4.38Å; Q749-L751 VanDerWaalsContact C-N 3.34Å; Q749-L751 PolarHBondContact O-N 3.42Å
752	V	34.2	Very low	30.5	Very low	81 Å²	81	119.4 Å²	119.4	49%	0.491	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.5	-23.2	178.6	171.4	0	0	0	0	112.7	Q749	Q749-V752 PolarHBondContact O-N 3.29Å
753	D	30.4	Very low	30.7	Very low	142 Å²	142	117.5 Å²	117.5	76%	0.759	63%	0.63	S	S	*	*	S	Bend	trans	-94	-1.5	-170.6	-74.5	-16.2	0	0	0	115.3
754	G	33	Very low	30.6	Very low	45 Å²	45	118 Å²	118	46%	0.464	63%	0.633	S	S	.	*	S	Bend	trans	-117.9	117.7	175.6	0	0	0	0	0	112.6
755	Y	31.1	Very low	30.3	Very low	238 Å²	238	119.7 Å²	119.7	93%	0.933	63%	0.628	S	S	*	*	S	Bend	trans	92.4	77.2	165.6	-56	-84.8	0	0	0	119.3
756	M	27	Very low	30	Very low	120 Å²	120	114.3 Å²	114.3	59%	0.591	61%	0.612	S	S	*	*	S	Bend	trans	-178	147.1	130.4	-164.9	164.5	-69.1	0	0	109.2	L758	M756-L758 PolarHBondContact O-N 2.78Å
757	P	29.5	Very low	30.1	Very low	113 Å²	113	114.2 Å²	114.2	73%	0.734	61%	0.611	S	S	*	*			trans	-61.7	131.3	-179.8	-17	29.8	0	0	0	111.4	S759	P757-S759 PolarHBondContact O-N 2.82Å; P757-S759 VanDerWaalsContact O-N 3.09Å
758	L	30.6	Very low	29.9	Very low	146 Å²	146	116.3 Å²	116.3	76%	0.764	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	101.2	172.8	-79.8	83.5	0	0	0	110.8	M756	M756-L758 PolarHBondContact O-N 2.78Å
759	S	27.4	Very low	29.6	Very low	89 Å²	89	116.1 Å²	116.1	62%	0.622	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.7	-18.3	154.9	57.2	0	0	0	0	115.6	P757	P757-S759 PolarHBondContact O-N 2.82Å; P757-S759 VanDerWaalsContact O-N 3.09Å
760	S	30.2	Very low	29.6	Very low	95 Å²	95	116.6 Å²	116.6	66%	0.664	61%	0.612	S	S	*	*	S	Bend	trans	-126	10.3	-173.7	62.4	0	0	0	0	115.7
761	L	28.3	Very low	29.7	Very low	102 Å²	102	117.7 Å²	117.7	53%	0.534	61%	0.606	S	S	.	*	S	Bend	trans	-126.7	5.1	-178.4	-107	153.7	0	0	0	114.3	K765	L761-K765 WeakPolarHBondContact O-CB 3.08Å
762	Q	26.1	Very low	29.3	Very low	128 Å²	128	119.8 Å²	119.8	60%	0.598	61%	0.61	S	S	*	*	H	α-helix	trans	-82.6	-14.7	174	-120.6	161.2	-27.7	0	0	113.2	S766	Q762-S766 PolarHBondContact O-OG 3.5Å; Q762-S766 VanDerWaalsContact O-OG 3.1Å
763	L	35.2	Very low	28.9	Very low	83 Å²	83	125.4 Å²	125.4	44%	0.435	62%	0.623	S	S	.	*	H	α-helix	trans	-94.4	-30.4	-175.5	-147.7	83.6	0	0	0	114	S766	L763-S766 PolarHBondContact O-OG 3.24Å
764	E	28.9	Very low	28.8	Very low	145 Å²	145	122.7 Å²	122.7	68%	0.678	62%	0.615	S	S	*	*	H	α-helix	trans	-91.5	-29.1	177.1	-104.4	-176.6	156.9	0	0	112.7	Q767 F768	E764-Q767 PolarHBondContact O-N 2.9Å; E764-F768 PolarHBondContact O-N 2.96Å; E764-F768 VanDerWaalsContact O-N 3.11Å
765	K	24.2	Very low	28.6	Very low	98 Å²	98	130.3 Å²	130.3	43%	0.426	63%	0.631	S	S	.	*	H	α-helix	trans	-77.5	-27.2	179	-138.6	174.9	-176	-176.8	0	112.4	L761 D769	L761-K765 WeakPolarHBondContact O-CB 3.08Å; K765-D769 WeakPolarHBondContact O-CB 3.27Å; K765-D769 PolarHBondContact O-N 3.38Å
766	S	28.1	Very low	28.4	Very low	59 Å²	59	122.8 Å²	122.8	41%	0.413	62%	0.618	S	S	.	*	H	α-helix	trans	-68.5	-37.3	169	57.5	0	0	0	0	112.3	Q762 L763 E770	Q762-S766 PolarHBondContact O-OG 3.5Å; Q762-S766 VanDerWaalsContact O-OG 3.1Å; L763-S766 PolarHBondContact O-OG 3.24Å; S766-E770 PolarHBondContact O-N 3.19Å
767	Q	31	Very low	28.3	Very low	133 Å²	133	127.9 Å²	127.9	62%	0.621	63%	0.631	S	S	*	*	H	α-helix	trans	-72.3	-26.7	175.2	-85.4	-173.7	-16.6	0	0	114.2	E764	E764-Q767 PolarHBondContact O-N 2.9Å
768	F	27.8	Very low	28.2	Very low	140 Å²	140	128.8 Å²	128.8	61%	0.614	64%	0.64	S	S	*	*	H	α-helix	trans	-92.5	-36	-179	-154.8	-95.2	0	0	0	113	E764 R771	E764-F768 PolarHBondContact O-N 2.96Å; E764-F768 VanDerWaalsContact O-N 3.11Å; F768-R771 PolarHBondContact O-N 3.05Å
769	D	26.3	Very low	27.9	Very low	89 Å²	89	124.5 Å²	124.5	48%	0.476	63%	0.631	S	S	.	*	H	α-helix	trans	-72.6	-25.7	175.2	-90.9	-22.6	0	0	0	113.2	K765 R771 R773	K765-D769 WeakPolarHBondContact O-CB 3.27Å; K765-D769 PolarHBondContact O-N 3.38Å; D769-R771 VanDerWaalsContact C-N 3.34Å; D769-R773 WeakPolarHBondContact O-CB 3.48Å; D769-R773 PolarHBondContact O-N 2.89Å
770	E	30.4	Very low	28.1	Very low	148 Å²	148	129.5 Å²	129.5	69%	0.692	64%	0.644	S	S	*	*	H	α-helix	trans	-71.1	-28.5	169.6	-86.2	-173.8	153.4	0	0	112.8	S766 F772 S774	S766-E770 PolarHBondContact O-N 3.19Å; E770-F772 PolarHBondContact O-N 3.14Å; E770-S774 PolarHBondContact O-N 3.07Å; E770-S774 PolarHBondContact O-OG 3.26Å; E770-S774 VanDerWaalsContact O-OG 3.09Å
771	R	29.1	Very low	27.8	Very low	159 Å²	159	133.4 Å²	133.4	60%	0.6	65%	0.652	S	S	*	*	H	α-helix	trans	-76.2	-21.7	-178.1	-160.8	-179.3	-84.8	-169.6	1.7	113.1	F768 D769 S774	F768-R771 PolarHBondContact O-N 3.05Å; D769-R771 VanDerWaalsContact C-N 3.34Å; R771-S774 PolarHBondContact O-OG 3.16Å
772	F	26.6	Very low	27.6	Very low	162 Å²	162	138.5 Å²	138.5	71%	0.711	67%	0.67	S	S	*	*	H	α-helix	trans	-103.2	-19.7	177.5	-130.3	-90.3	0	0	0	113.9	E770	E770-F772 PolarHBondContact O-N 3.14Å
773	R	26.6	Very low	27.7	Very low	199 Å²	199	139.3 Å²	139.3	75%	0.751	68%	0.677	S	S	*	*	H	α-helix	trans	-79.2	-19.7	174.8	-154.9	176.5	-68.8	177.7	0.1	112.8	D769	D769-R773 WeakPolarHBondContact O-CB 3.48Å; D769-R773 PolarHBondContact O-N 2.89Å
774	S	27.9	Very low	27.3	Very low	85 Å²	85	143.7 Å²	143.7	59%	0.594	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-10.2	177.6	54.9	0	0	0	0	115.1	E770 R771	E770-S774 PolarHBondContact O-N 3.07Å; E770-S774 PolarHBondContact O-OG 3.26Å; E770-S774 VanDerWaalsContact O-OG 3.09Å; R771-S774 PolarHBondContact O-OG 3.16Å
775	Y	27.8	Very low	27.4	Very low	206 Å²	206	147.9 Å²	147.9	81%	0.808	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	1.9	-177.9	-94.2	-83.1	0	0	0	115.4
776	A	27.1	Very low	27.7	Very low	79 Å²	79	153.1 Å²	153.1	65%	0.653	73%	0.728	S	S	*	*	S	Bend	trans	-134.5	12.3	-171.6	0	0	0	0	0	117.1
777	R	25.2	Very low	28.1	Very low	228 Å²	228	154.7 Å²	154.7	86%	0.86	75%	0.745	S	S	*	*			trans	-143.8	78	168.8	-90.6	-172.3	177.5	169.8	-4.7	112
778	S	27.2	Very low	28.9	Very low	131 Å²	131	157.5 Å²	157.5	92%	0.916	75%	0.75	S	S	*	*			trans	-86.4	104.4	146.9	58.2	0	0	0	0	106.9
779	G	25.7	Very low	30.1	Very low	57 Å²	57	160.3 Å²	160.3	59%	0.588	76%	0.762	S	S	*	*	S	Bend	trans	152	94.5	-177.2	0	0	0	0	0	110
780	E	30.5	Very low	31.7	Very low	193 Å²	193	163.6 Å²	163.6	90%	0.902	77%	0.774	S	S	*	*			trans	28.2	108	156.2	-63.9	177.4	158.8	0	0	117.9
781	E	23.2	Very low	33.8	Very low	178 Å²	178	159.8 Å²	159.8	83%	0.832	76%	0.762	S	S	*	*				178.2	105.7	127.5	-99.5	176.6	-177.5	0	0	109.3	I783	E781-I783 PolarHBondContact O-N 3.06Å
782	F	25.4	Very low	36.4	Very low	208 Å²	208	153 Å²	153	91%	0.912	74%	0.739	S	S	*	*			trans	-74.1	84.5	177.2	-148	-92.9	0	0	0	108.9	Q784	F782-Q784 PolarHBondContact O-N 2.88Å
783	I	28.2	Very low	39.1	Very low	145 Å²	145	152.6 Å²	152.6	74%	0.744	73%	0.732	S	S	*	*			trans	-70.8	104.2	170.2	-62.8	-178	0	0	0	108.2	E781 R785	E781-I783 PolarHBondContact O-N 3.06Å; I783-R785 PolarHBondContact O-N 3.05Å
784	Q	25.9	Very low	41.9	Very low	176 Å²	176	144 Å²	144	82%	0.822	70%	0.7	S	S	*	*			trans	-54.4	98	174.5	-152.4	166.1	15.4	0	0	110.2	F782 K786	F782-Q784 PolarHBondContact O-N 2.88Å; Q784-K786 PolarHBondContact O-N 3.02Å; Q784-K786 VanDerWaalsContact O-N 3.14Å
785	R	32.2	Very low	44.8	Very low	233 Å²	233	143.7 Å²	143.7	88%	0.879	69%	0.689	S	S	*	*			trans	-59.6	117	167.5	-75.6	179.8	176.5	171.2	-1.5	107.2	I783 A787	I783-R785 PolarHBondContact O-N 3.05Å; R785-A787 PolarHBondContact O-N 3.15Å
786	K	29.8	Very low	47.8	Very low	207 Å²	207	139.8 Å²	139.8	90%	0.9	68%	0.676	S	S	*	*			trans	-46.1	113.2	172	-99.6	177.3	175.3	172.2	0	109	Q784 R788	Q784-K786 PolarHBondContact O-N 3.02Å; Q784-K786 VanDerWaalsContact O-N 3.14Å; K786-R788 PolarHBondContact O-N 2.92Å; K786-R788 VanDerWaalsContact O-N 3.08Å
787	A	36.2	Very low	50.8	Low	93 Å²	93	136.3 Å²	136.3	77%	0.769	65%	0.647	S	S	*	*			trans	-54.3	115.4	175.4	0	0	0	0	0	109.1	R785 K789	R785-A787 PolarHBondContact O-N 3.15Å; A787-K789 PolarHBondContact O-N 3.35Å; A787-K789 VanDerWaalsContact O-N 3.12Å
788	R	48.5	Very low	54	Low	191 Å²	191	125.7 Å²	125.7	72%	0.721	61%	0.607	S	S	*	*			trans	-57.4	118.9	165.3	-84.9	-179.7	169.9	177.5	-3.6	106.5	K786 H790	K786-R788 PolarHBondContact O-N 2.92Å; K786-R788 VanDerWaalsContact O-N 3.08Å; R788-H790 PolarHBondContact O-N 3.45Å
789	K	53.2	Low	57.1	Low	199 Å²	199	127.5 Å²	127.5	87%	0.865	60%	0.598	S	S	*	*	S	Bend	trans	-63.8	-10.7	-176.2	-75.8	-175.4	175.3	-176.7	0	114.1	A787	A787-K789 PolarHBondContact O-N 3.35Å; A787-K789 VanDerWaalsContact O-N 3.12Å
790	H	59.5	Low	60.3	Low	158 Å²	158	129.9 Å²	129.9	73%	0.731	59%	0.589	S	S	*	*	S	Bend	trans	-125.6	129.9	177.4	-66.7	-61.3	0	0	0	111.3	R788	R788-H790 PolarHBondContact O-N 3.45Å
791	P	75.2	Confident	63.3	Low	68 Å²	68	120.7 Å²	120.7	44%	0.442	55%	0.547	S	S	.	.			trans	-65.9	139.9	177.3	26	-32.2	0	0	0	110.5	Q795 K796	P791-Q795 VanDerWaalsContact CA-OE1 3.29Å; P791-Q795 HydrophobicContact CB-CB 4.26Å; P791-K796 HydrophobicContact CB-CG 4.4Å; P791-K796 HydrophobicContact CG-CG 4.26Å
792	T	82.3	Confident	66.8	Low	18 Å²	18	113.1 Å²	113.1	11%	0.11	51%	0.512	C	S	.	.			trans	-64.6	162.8	178.5	63.6	0	0	0	0	111	Y794 Q795 K796	T792-Y794 PolarHBondContact O-N 3.28Å; T792-Q795 VanDerWaalsContact N-OE1 3.07Å; T792-Q795 PolarHBondContact O-N 3.5Å; T792-Q795 VanDerWaalsContact OG1-CG 3.31Å; T792-Q795 WeakPolarHBondContact OG1-CG 3.48Å; T792-Q795 PolarHBondContact OG1-N 3.09Å; T792-K796 PolarHBondContact O-N 3.42Å; T792-K796 VanDerWaalsContact O-N 3.12Å
793	R	84.4	Confident	70.1	Confident	153 Å²	153	110 Å²	110	58%	0.577	50%	0.498	S	S	*	.	H	α-helix	trans	-58	-43.1	176.6	-174.5	-179.3	-176.6	178.8	2.7	110.3	E276 K796 I797	E276-R793 IonicContact OE1-CZ 3.13Å; E276-R793 IonicContact OE1-NE 2.67Å; E276-R793 PolarHBondContact OE1-NE 3.5Å; E276-R793 IonicContact OE1-NH2 2.89Å; E276-R793 PolarHBondContact OE1-NH2 3.26Å; E276-R793 IonicContact OE2-CZ 3.76Å; E276-R793 IonicContact OE2-NH2 2.76Å; E276-R793 PolarHBondContact OE2-NH2 3.13Å; R793-K796 PolarHBondContact O-N 3.35Å; R793-I797 HydrophobicContact CG-CD1 4.19Å; R793-I797 WeakPolarHBondContact O-CG1 3.44Å; R793-I797 PolarHBondContact O-N 3.04Å; R793-I797 VanDerWaalsContact O-N 3.08Å
794	Y	85.8	Confident	73.3	Confident	17 Å²	17	105.6 Å²	105.6	7%	0.067	47%	0.472	C	S	.	.	H	α-helix	trans	-56.1	-49.8	174.7	179.2	-100	0	0	0	112.7	D228 A280 D285 R301 T792 K796 I797 M798	D228-Y794 PolarHBondContact OD1-OH 2.9Å; A280-Y794 HydrophobicContact CB-CD2 4.05Å; A280-Y794 HydrophobicContact CB-CE2 4.31Å; A280-Y794 WeakPolarHBondContact O-CE2 3.4Å; D285-Y794 HydrophobicContact CB-CD1 4.02Å; D285-Y794 HydrophobicContact CB-CG 4.07Å; R301-Y794 VanDerWaalsContact CZ-OH 3.23Å; R301-Y794 PolarHBondContact NH1-OH 3.43Å; R301-Y794 VanDerWaalsContact NH2-CZ 3.25Å; R301-Y794 PolarHBondContact NH2-OH 3.06Å; T792-Y794 PolarHBondContact O-N 3.28Å; Y794-K796 VanDerWaalsContact C-N 3.31Å; Y794-K796 PolarHBondContact O-N 3.44Å; Y794-I797 WeakPolarHBondContact O-CB 3.03Å; Y794-I797 PolarHBondContact O-N 2.78Å; Y794-I797 VanDerWaalsContact O-N 3.11Å; Y794-M798 HydrophobicContact CE2-CE 4.32Å; Y794-M798 PolarHBondContact O-N 3.48Å; Y794-M798 WeakPolarHBondContact OH-CE 3.31Å
795	Q	88.1	Confident	76.6	Confident	80 Å²	80	99 Å²	99	37%	0.374	44%	0.439	S	S	.	.	H	α-helix	trans	-61.1	-37.6	179.2	-75.2	173.8	-20.3	0	0	112.8	P791 T792 M798 K799	P791-Q795 VanDerWaalsContact CA-OE1 3.29Å; P791-Q795 HydrophobicContact CB-CB 4.26Å; T792-Q795 VanDerWaalsContact N-OE1 3.07Å; T792-Q795 PolarHBondContact O-N 3.5Å; T792-Q795 VanDerWaalsContact OG1-CG 3.31Å; T792-Q795 WeakPolarHBondContact OG1-CG 3.48Å; T792-Q795 PolarHBondContact OG1-N 3.09Å; Q795-M798 PolarHBondContact O-N 3.44Å; Q795-K799 WeakPolarHBondContact O-CB 3.46Å; Q795-K799 PolarHBondContact O-N 2.81Å
796	K	90	Very high	79.5	Confident	123 Å²	123	88.9 Å²	88.9	54%	0.535	40%	0.404	S	S	.	.	H	α-helix	trans	-65.3	-41.4	175	-67.5	177.6	-175.1	177.6	0	111.8	P791 T792 R793 Y794 R800	P791-K796 HydrophobicContact CB-CG 4.4Å; P791-K796 HydrophobicContact CG-CG 4.26Å; T792-K796 PolarHBondContact O-N 3.42Å; T792-K796 VanDerWaalsContact O-N 3.12Å; R793-K796 PolarHBondContact O-N 3.35Å; Y794-K796 VanDerWaalsContact C-N 3.31Å; Y794-K796 PolarHBondContact O-N 3.44Å; K796-R800 WeakPolarHBondContact O-CG 3.31Å; K796-R800 PolarHBondContact O-N 3.32Å
797	I	91.3	Very high	82.6	Confident	6 Å²	6	83.3 Å²	83.3	3%	0.031	38%	0.383	C	S	.	.	H	α-helix	trans	-62.2	-50.7	175.6	-67.8	163.9	0	0	0	109.9	E276 E277 A280 R793 Y794 K799 R800 L801	E276-I797 HydrophobicContact CG-CD1 4.06Å; E277-I797 HydrophobicContact CB-CG2 4.22Å; E277-I797 HydrophobicContact CG-CG2 4.07Å; A280-I797 HydrophobicContact CB-CD1 3.8Å; A280-I797 HydrophobicContact CB-CG2 4.01Å; R793-I797 HydrophobicContact CG-CD1 4.19Å; R793-I797 WeakPolarHBondContact O-CG1 3.44Å; R793-I797 PolarHBondContact O-N 3.04Å; R793-I797 VanDerWaalsContact O-N 3.08Å; Y794-I797 WeakPolarHBondContact O-CB 3.03Å; Y794-I797 PolarHBondContact O-N 2.78Å; Y794-I797 VanDerWaalsContact O-N 3.11Å; I797-K799 VanDerWaalsContact C-N 3.34Å; I797-K799 PolarHBondContact O-N 3.43Å; I797-R800 WeakPolarHBondContact O-CB 3.2Å; I797-R800 PolarHBondContact O-N 3.48Å; I797-R800 VanDerWaalsContact O-N 3.07Å; I797-L801 HydrophobicContact CG2-CD1 3.83Å; I797-L801 HydrophobicContact CG2-CG 4.4Å; I797-L801 PolarHBondContact O-N 3.1Å
798	M	91.4	Very high	85.3	Confident	5 Å²	5	83.5 Å²	83.5	3%	0.025	37%	0.367	C	S	.	.	H	α-helix	trans	-61	-42.7	-178.5	-169	51.7	71.3	0	0	111.9	P229 V230 Y794 Q795 R800 L801 I802	P229-M798 HydrophobicContact CG-CG 4.22Å; P229-M798 HydrophobicContact CG-SD 3.88Å; V230-M798 HydrophobicContact CG2-CE 3.89Å; Y794-M798 HydrophobicContact CE2-CE 4.32Å; Y794-M798 PolarHBondContact O-N 3.48Å; Y794-M798 WeakPolarHBondContact OH-CE 3.31Å; Q795-M798 PolarHBondContact O-N 3.44Å; M798-R800 VanDerWaalsContact C-N 3.3Å; M798-R800 PolarHBondContact O-N 3.29Å; M798-L801 PolarHBondContact O-N 3.28Å; M798-I802 HydrophobicContact CG-CG1 4.25Å; M798-I802 WeakPolarHBondContact O-CG1 3.46Å; M798-I802 PolarHBondContact O-N 3.26Å; M798-I802 HydrophobicContact SD-CD1 4.22Å; M798-I802 HydrophobicContact SD-CG1 3.93Å
799	K	92	Very high	87.3	Confident	169 Å²	169	75.4 Å²	75.4	74%	0.735	34%	0.341	S	S	*	.	H	α-helix	trans	-59.3	-38.5	174.9	-171.8	173	-176.7	173.5	0	112.8	Q795 I797 K803	Q795-K799 WeakPolarHBondContact O-CB 3.46Å; Q795-K799 PolarHBondContact O-N 2.81Å; I797-K799 VanDerWaalsContact C-N 3.34Å; I797-K799 PolarHBondContact O-N 3.43Å; K799-K803 VanDerWaalsContact O-CB 3.28Å; K799-K803 WeakPolarHBondContact O-CB 3.34Å; K799-K803 PolarHBondContact O-N 3.36Å; K799-K803 VanDerWaalsContact O-N 3.09Å
800	R	93.4	Very high	89	Confident	107 Å²	107	68.4 Å²	68.4	40%	0.404	31%	0.311	S	S	.	.	H	α-helix	trans	-66.8	-44.7	175.8	-72.7	-175	-61.5	168	5.1	111.6	E277 K796 I797 M798 K803 R804	E277-R800 IonicContact OE1-CZ 3.84Å; E277-R800 IonicContact OE1-NH2 3.83Å; K796-R800 WeakPolarHBondContact O-CG 3.31Å; K796-R800 PolarHBondContact O-N 3.32Å; I797-R800 WeakPolarHBondContact O-CB 3.2Å; I797-R800 PolarHBondContact O-N 3.48Å; I797-R800 VanDerWaalsContact O-N 3.07Å; M798-R800 VanDerWaalsContact C-N 3.3Å; M798-R800 PolarHBondContact O-N 3.29Å; R800-K803 PolarHBondContact O-N 3.15Å; R800-R804 WeakPolarHBondContact O-CG 3.26Å; R800-R804 PolarHBondContact O-N 2.98Å
801	L	94.4	Very high	90.4	Very high	1 Å²	1	64.9 Å²	64.9	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-48	-179.4	-71.1	168.9	0	0	0	111.9	V268 E277 I281 I797 M798 K803 R804 Y805	V268-L801 HydrophobicContact CG1-CB 4.42Å; E277-L801 HydrophobicContact CB-CD2 4.43Å; I281-L801 HydrophobicContact CD1-CD1 3.79Å; I281-L801 HydrophobicContact CG1-CD1 3.94Å; I797-L801 HydrophobicContact CG2-CD1 3.83Å; I797-L801 HydrophobicContact CG2-CG 4.4Å; I797-L801 PolarHBondContact O-N 3.1Å; M798-L801 PolarHBondContact O-N 3.28Å; L801-K803 VanDerWaalsContact C-N 3.33Å; L801-K803 PolarHBondContact O-N 3.34Å; L801-R804 WeakPolarHBondContact O-CB 3.49Å; L801-R804 PolarHBondContact O-N 3.39Å; L801-R804 VanDerWaalsContact O-N 3.12Å; L801-Y805 PolarHBondContact O-N 3.29Å
802	I	94.9	Very high	91	Very high	19 Å²	19	65.4 Å²	65.4	10%	0.097	30%	0.299	C	S	.	.	H	α-helix	trans	-64.4	-39	178.2	-62.7	-59.1	0	0	0	111.5	P229 F264 V268 M798 R804 Y805 V806	P229-I802 HydrophobicContact CB-CD1 4.18Å; P229-I802 HydrophobicContact CG-CD1 3.39Å; P229-I802 HydrophobicContact CG-CG1 3.74Å; F264-I802 HydrophobicContact CZ-CD1 4.36Å; V268-I802 HydrophobicContact CG2-CD1 4.13Å; M798-I802 HydrophobicContact CG-CG1 4.25Å; M798-I802 WeakPolarHBondContact O-CG1 3.46Å; M798-I802 PolarHBondContact O-N 3.26Å; M798-I802 HydrophobicContact SD-CD1 4.22Å; M798-I802 HydrophobicContact SD-CG1 3.93Å; I802-R804 VanDerWaalsContact C-N 3.33Å; I802-R804 PolarHBondContact O-N 3.41Å; I802-Y805 PolarHBondContact O-N 2.91Å; I802-Y805 VanDerWaalsContact O-N 3.16Å; I802-V806 HydrophobicContact CG2-CG2 4.26Å; I802-V806 WeakPolarHBondContact O-CG2 3.15Å; I802-V806 PolarHBondContact O-N 3.14Å
803	K	94.7	Very high	91	Very high	143 Å²	143	69 Å²	69	62%	0.622	31%	0.313	S	S	*	.	H	α-helix	trans	-58.8	-44.6	172.4	-175.7	175.8	180	177.9	0	111.8	K799 R800 L801 Y805 L807	K799-K803 VanDerWaalsContact O-CB 3.28Å; K799-K803 WeakPolarHBondContact O-CB 3.34Å; K799-K803 PolarHBondContact O-N 3.36Å; K799-K803 VanDerWaalsContact O-N 3.09Å; R800-K803 PolarHBondContact O-N 3.15Å; L801-K803 VanDerWaalsContact C-N 3.33Å; L801-K803 PolarHBondContact O-N 3.34Å; K803-Y805 VanDerWaalsContact C-N 3.32Å; K803-L807 HydrophobicContact CG-CD1 4.09Å; K803-L807 WeakPolarHBondContact O-CB 3.2Å; K803-L807 VanDerWaalsContact O-CG 3.26Å; K803-L807 WeakPolarHBondContact O-CG 3.45Å; K803-L807 PolarHBondContact O-N 2.96Å; K803-L807 VanDerWaalsContact O-N 3.11Å
804	R	95.5	Very high	90.8	Very high	52 Å²	52	69.4 Å²	69.4	20%	0.196	32%	0.322	C	S	.	.	H	α-helix	trans	-64	-38.5	175.7	-69.6	-178.5	-162.2	150.7	11.3	111.7	L271 E277 R800 L801 I802 K808	L271-R804 HydrophobicContact CD1-CB 4.47Å; L271-R804 PolarHBondContact O-NH1 3.36Å; L271-R804 VanDerWaalsContact O-NH1 3.15Å; E277-R804 IonicContact OE1-CZ 3.36Å; E277-R804 IonicContact OE1-NH1 3.25Å; E277-R804 PolarHBondContact OE1-NH1 3.47Å; E277-R804 IonicContact OE1-NH2 2.85Å; E277-R804 PolarHBondContact OE1-NH2 3.05Å; E277-R804 IonicContact OE2-CZ 2.65Å; E277-R804 IonicContact OE2-NH1 2.82Å; E277-R804 PolarHBondContact OE2-NH1 2.86Å; E277-R804 IonicContact OE2-NH2 3.81Å; R800-R804 WeakPolarHBondContact O-CG 3.26Å; R800-R804 PolarHBondContact O-N 2.98Å; L801-R804 WeakPolarHBondContact O-CB 3.49Å; L801-R804 PolarHBondContact O-N 3.39Å; L801-R804 VanDerWaalsContact O-N 3.12Å; I802-R804 VanDerWaalsContact C-N 3.33Å; I802-R804 PolarHBondContact O-N 3.41Å; R804-K808 WeakPolarHBondContact O-CB 3.41Å; R804-K808 PolarHBondContact O-N 3.16Å
805	Y	95.5	Very high	90.4	Very high	36 Å²	36	72.9 Å²	72.9	14%	0.141	35%	0.349	C	S	.	.	H	α-helix	trans	-63.6	-50.5	179.1	-178.9	-92	0	0	0	111.8	A219 F264 V268 L271 L801 I802 K803 L807 K808 A809	A219-Y805 HydrophobicContact CB-CE1 4.15Å; F264-Y805 AromaticContact CD2-CE1 3.72Å; F264-Y805 HydrophobicContact CD2-CE1 3.72Å; F264-Y805 HydrophobicContact CD2-CE2 4.23Å; F264-Y805 AromaticContact CD2-CZ 3.56Å; F264-Y805 WeakPolarHBondContact CD2-OH 3.36Å; F264-Y805 AromaticContact CE2-CD1 3.94Å; F264-Y805 HydrophobicContact CE2-CD1 3.94Å; F264-Y805 AromaticContact CE2-CE1 3.52Å; F264-Y805 HydrophobicContact CE2-CE1 3.52Å; F264-Y805 HydrophobicContact CE2-CE2 4.45Å; F264-Y805 AromaticContact CE2-CZ 3.82Å; V268-Y805 HydrophobicContact CG2-CD2 3.97Å; V268-Y805 HydrophobicContact CG2-CE2 4.45Å; V268-Y805 HydrophobicContact CG2-CG 4.2Å; L271-Y805 HydrophobicContact CD1-CD2 3.76Å; L271-Y805 HydrophobicContact CD1-CG 4.16Å; L801-Y805 PolarHBondContact O-N 3.29Å; I802-Y805 PolarHBondContact O-N 2.91Å; I802-Y805 VanDerWaalsContact O-N 3.16Å; K803-Y805 VanDerWaalsContact C-N 3.32Å; Y805-L807 PolarHBondContact O-N 3.44Å; Y805-K808 PolarHBondContact O-N 3.26Å; Y805-A809 WeakPolarHBondContact O-CB 3.46Å; Y805-A809 PolarHBondContact O-N 3.38Å
806	V	94.6	Very high	89.8	Confident	21 Å²	21	74.8 Å²	74.8	13%	0.127	36%	0.361	C	S	.	.	H	α-helix	trans	-61	-46.7	178.5	175	0	0	0	0	110.9	Y168 I802 K808 A809 Q810	Y168-V806 HydrophobicContact CD1-CB 4.34Å; Y168-V806 HydrophobicContact CD1-CG1 3.76Å; Y168-V806 HydrophobicContact CD1-CG2 3.84Å; Y168-V806 HydrophobicContact CE1-CB 4.45Å; Y168-V806 HydrophobicContact CE1-CG1 4.29Å; Y168-V806 HydrophobicContact CE1-CG2 3.85Å; Y168-V806 HydrophobicContact CG-CG1 3.98Å; I802-V806 HydrophobicContact CG2-CG2 4.26Å; I802-V806 WeakPolarHBondContact O-CG2 3.15Å; I802-V806 PolarHBondContact O-N 3.14Å; V806-K808 VanDerWaalsContact C-N 3.33Å; V806-K808 PolarHBondContact O-N 2.72Å; V806-A809 PolarHBondContact O-N 3.27Å; V806-Q810 WeakPolarHBondContact O-CG 3.22Å; V806-Q810 PolarHBondContact O-N 2.8Å
807	L	93.4	Very high	88.5	Confident	90 Å²	90	78 Å²	78	47%	0.471	38%	0.378	S	S	.	.	H	α-helix	trans	-61.2	-41.3	177.9	-71.7	172.2	0	0	0	112.1	K803 Y805 V811	K803-L807 HydrophobicContact CG-CD1 4.09Å; K803-L807 WeakPolarHBondContact O-CB 3.2Å; K803-L807 VanDerWaalsContact O-CG 3.26Å; K803-L807 WeakPolarHBondContact O-CG 3.45Å; K803-L807 PolarHBondContact O-N 2.96Å; K803-L807 VanDerWaalsContact O-N 3.11Å; Y805-L807 PolarHBondContact O-N 3.44Å; L807-V811 VanDerWaalsContact O-CG2 3.31Å; L807-V811 WeakPolarHBondContact O-CG2 3.44Å; L807-V811 PolarHBondContact O-N 3.19Å; L807-V811 VanDerWaalsContact O-N 3.1Å
808	K	93.5	Very high	87.5	Confident	97 Å²	97	82.6 Å²	82.6	42%	0.422	41%	0.407	S	S	.	.	H	α-helix	trans	-65.1	-45.6	175.5	-179.3	176.6	175.3	-176.1	0	111.2	L271 R804 Y805 V806 Q810 V811 D812	L271-K808 HydrophobicContact CD2-CD 3.71Å; R804-K808 WeakPolarHBondContact O-CB 3.41Å; R804-K808 PolarHBondContact O-N 3.16Å; Y805-K808 PolarHBondContact O-N 3.26Å; V806-K808 VanDerWaalsContact C-N 3.33Å; V806-K808 PolarHBondContact O-N 2.72Å; K808-Q810 VanDerWaalsContact C-N 3.27Å; K808-Q810 PolarHBondContact O-N 2.8Å; K808-V811 PolarHBondContact O-N 3.35Å; K808-D812 WeakPolarHBondContact CE-OD2 3.31Å; K808-D812 WeakPolarHBondContact CG-OD2 3.26Å; K808-D812 WeakPolarHBondContact O-CB 3.41Å; K808-D812 VanDerWaalsContact O-CG 3.25Å; K808-D812 PolarHBondContact O-N 2.97Å
809	A	90.1	Very high	86.4	Confident	21 Å²	21	87.3 Å²	87.3	17%	0.174	43%	0.432	C	S	.	.	H	α-helix	trans	-62.1	-35.3	179.7	0	0	0	0	0	112.5	Y168 Y805 V806 K813	Y168-A809 HydrophobicContact CE2-CB 3.97Å; Y805-A809 WeakPolarHBondContact O-CB 3.46Å; Y805-A809 PolarHBondContact O-N 3.38Å; V806-A809 PolarHBondContact O-N 3.27Å; A809-K813 WeakPolarHBondContact O-CB 3.45Å; A809-K813 PolarHBondContact O-N 2.85Å
810	Q	88.8	Confident	85.4	Confident	52 Å²	52	85.3 Å²	85.3	24%	0.243	43%	0.425	C	S	.	.	H	α-helix	trans	-65.8	-47.1	172.8	-73.5	177.8	-46.9	0	0	111.6	V806 K808 D812 K813 E814	V806-Q810 WeakPolarHBondContact O-CG 3.22Å; V806-Q810 PolarHBondContact O-N 2.8Å; K808-Q810 VanDerWaalsContact C-N 3.27Å; K808-Q810 PolarHBondContact O-N 2.8Å; Q810-D812 PolarHBondContact O-N 3.44Å; Q810-K813 PolarHBondContact O-N 3.17Å; Q810-E814 WeakPolarHBondContact O-CG 3.36Å; Q810-E814 PolarHBondContact O-N 3.15Å
811	V	89.7	Confident	84.1	Confident	85 Å²	85	81.5 Å²	81.5	52%	0.515	42%	0.419	S	S	.	.	H	α-helix	trans	-63.5	-41.7	177.5	171.8	0	0	0	0	111.9	L807 K808 K813 E814 S815	L807-V811 VanDerWaalsContact O-CG2 3.31Å; L807-V811 WeakPolarHBondContact O-CG2 3.44Å; L807-V811 PolarHBondContact O-N 3.19Å; L807-V811 VanDerWaalsContact O-N 3.1Å; K808-V811 PolarHBondContact O-N 3.35Å; V811-K813 VanDerWaalsContact C-N 3.3Å; V811-K813 PolarHBondContact O-N 3.36Å; V811-E814 PolarHBondContact O-N 2.93Å; V811-S815 PolarHBondContact O-N 2.93Å
812	D	87.1	Confident	83.1	Confident	78 Å²	78	85.8 Å²	85.8	42%	0.417	44%	0.439	S	S	.	.	H	α-helix	trans	-62.6	-40.7	177.4	-68.2	-13.6	0	0	0	109.9	K808 Q810 S815 D816	K808-D812 WeakPolarHBondContact CE-OD2 3.31Å; K808-D812 WeakPolarHBondContact CG-OD2 3.26Å; K808-D812 WeakPolarHBondContact O-CB 3.41Å; K808-D812 VanDerWaalsContact O-CG 3.25Å; K808-D812 PolarHBondContact O-N 2.97Å; Q810-D812 PolarHBondContact O-N 3.44Å; D812-S815 PolarHBondContact O-N 3.33Å; D812-S815 PolarHBondContact O-OG 3Å; D812-D816 PolarHBondContact O-N 2.92Å
813	K	83.4	Confident	82.3	Confident	93 Å²	93	90 Å²	90	40%	0.404	46%	0.462	S	S	.	.	H	α-helix	trans	-65.9	-39.3	174.9	-175.8	179.8	176.5	179	0	113.2	E167 A809 Q810 V811 S815 D816	E167-K813 IonicContact OE1-NZ 2.79Å; E167-K813 PolarHBondContact OE1-NZ 2.95Å; E167-K813 IonicContact OE2-NZ 3.78Å; E167-K813 PolarHBondContact OE2-NZ 3.47Å; A809-K813 WeakPolarHBondContact O-CB 3.45Å; A809-K813 PolarHBondContact O-N 2.85Å; Q810-K813 PolarHBondContact O-N 3.17Å; V811-K813 VanDerWaalsContact C-N 3.3Å; V811-K813 PolarHBondContact O-N 3.36Å; K813-S815 PolarHBondContact O-N 3.14Å; K813-D816 PolarHBondContact O-N 2.86Å
814	E	79.5	Confident	81.3	Confident	163 Å²	163	88.9 Å²	88.9	76%	0.762	46%	0.456	S	S	*	.	H	α-helix	trans	-66.8	-22.8	174.3	-73.7	173.8	-167.8	0	0	112.6	Q810 V811	Q810-E814 WeakPolarHBondContact O-CG 3.36Å; Q810-E814 PolarHBondContact O-N 3.15Å; V811-E814 PolarHBondContact O-N 2.93Å
815	S	77.3	Confident	80.3	Confident	89 Å²	89	89 Å²	89	62%	0.622	46%	0.459	S	S	*	.	H	α-helix	trans	-84.8	-12.1	177.3	73.8	0	0	0	0	114.1	V811 D812 K813	V811-S815 PolarHBondContact O-N 2.93Å; D812-S815 PolarHBondContact O-N 3.33Å; D812-S815 PolarHBondContact O-OG 3Å; K813-S815 PolarHBondContact O-N 3.14Å
816	D	75.9	Confident	79.6	Confident	120 Å²	120	91.9 Å²	91.9	64%	0.642	48%	0.476	S	S	*	.	S	Bend	trans	-73.7	153.2	174.5	-71.3	-29.2	0	0	0	110.8	D812 K813	D812-D816 PolarHBondContact O-N 2.92Å; K813-D816 PolarHBondContact O-N 2.86Å
817	E	61.7	Low	79	Confident	190 Å²	190	97.7 Å²	97.7	89%	0.888	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-55.1	141.2	-166.8	-63.5	179.2	165.1	0	0	115.1	N819	E817-N819 PolarHBondContact O-N 3.41Å
818	V	69.9	Low	78.3	Confident	104 Å²	104	94.6 Å²	94.6	63%	0.63	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-55.6	120.9	175.9	179.8	0	0	0	0	110.6	E822 L823	V818-E822 WeakPolarHBondContact CG1-OE2 3.38Å; V818-L823 HydrophobicContact CG1-CD1 3.81Å
819	N	69.4	Low	77.7	Confident	103 Å²	103	93.6 Å²	93.6	55%	0.551	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-78.4	145.6	-178.3	-169.3	-0.9	0	0	0	111.3	E817 G821 E822	E817-N819 PolarHBondContact O-N 3.41Å; N819-G821 PolarHBondContact O-N 3.4Å; N819-G821 VanDerWaalsContact O-N 3.09Å; N819-G821 PolarHBondContact OD1-N 3.18Å; N819-E822 HydrophobicContact CB-CG 4.29Å; N819-E822 PolarHBondContact O-N 2.98Å
820	E	70.5	Confident	77.4	Confident	128 Å²	128	97.7 Å²	97.7	60%	0.598	50%	0.5	S	S	*	.	H	α-helix	trans	-57.1	-25.6	170.7	-165.7	-164.5	139.6	0	0	111.6	L823 K824	E820-L823 PolarHBondContact O-N 2.98Å; E820-K824 PolarHBondContact O-N 3.28Å; E820-K824 WeakPolarHBondContact OE1-CE 3.2Å; E820-K824 IonicContact OE1-NZ 2.73Å; E820-K824 PolarHBondContact OE1-NZ 3.01Å
821	G	66.5	Low	76.9	Confident	27 Å²	27	96.1 Å²	96.1	28%	0.278	50%	0.495	S	S	.	.	H	α-helix	trans	-58.3	-46.3	171.1	0	0	0	0	0	113.6	N819 L823 K824 E825	N819-G821 PolarHBondContact O-N 3.4Å; N819-G821 VanDerWaalsContact O-N 3.09Å; N819-G821 PolarHBondContact OD1-N 3.18Å; G821-L823 VanDerWaalsContact C-N 3.31Å; G821-L823 PolarHBondContact O-N 3.39Å; G821-K824 WeakPolarHBondContact O-CA 3.32Å; G821-K824 WeakPolarHBondContact O-CB 3.22Å; G821-K824 PolarHBondContact O-N 3.14Å; G821-E825 PolarHBondContact O-N 2.98Å
822	E	72.4	Confident	76.5	Confident	90 Å²	90	93 Å²	93	42%	0.421	48%	0.477	S	S	.	.	H	α-helix	trans	-66.2	-33.9	-179.4	-64.7	170.5	-174.8	0	0	111.2	V818 N819 K824 E825 I826	V818-E822 WeakPolarHBondContact CG1-OE2 3.38Å; N819-E822 HydrophobicContact CB-CG 4.29Å; N819-E822 PolarHBondContact O-N 2.98Å; E822-K824 VanDerWaalsContact C-N 3.34Å; E822-K824 PolarHBondContact O-N 3.02Å; E822-E825 WeakPolarHBondContact O-CB 3.37Å; E822-E825 PolarHBondContact O-N 3.4Å; E822-I826 VanDerWaalsContact O-CG1 3.32Å; E822-I826 WeakPolarHBondContact O-CG1 3.09Å; E822-I826 PolarHBondContact O-N 2.85Å
823	L	78.1	Confident	76.4	Confident	109 Å²	109	93.8 Å²	93.8	57%	0.571	48%	0.48	S	S	*	.	H	α-helix	trans	-66.7	-35.4	171.5	-89.8	96.1	0	0	0	112.8	V818 E820 G821 K827	V818-L823 HydrophobicContact CG1-CD1 3.81Å; E820-L823 PolarHBondContact O-N 2.98Å; G821-L823 VanDerWaalsContact C-N 3.31Å; G821-L823 PolarHBondContact O-N 3.39Å; L823-K827 WeakPolarHBondContact O-CB 3.34Å; L823-K827 PolarHBondContact O-N 3.23Å
824	K	73.9	Confident	76.5	Confident	118 Å²	118	95.4 Å²	95.4	51%	0.513	48%	0.484	S	S	.	.	H	α-helix	trans	-69.7	-40.1	176.5	-75	175.5	-175.1	159.5	0	110.8	E820 G821 E822 K827 Q828	E820-K824 PolarHBondContact O-N 3.28Å; E820-K824 WeakPolarHBondContact OE1-CE 3.2Å; E820-K824 IonicContact OE1-NZ 2.73Å; E820-K824 PolarHBondContact OE1-NZ 3.01Å; G821-K824 WeakPolarHBondContact O-CA 3.32Å; G821-K824 WeakPolarHBondContact O-CB 3.22Å; G821-K824 PolarHBondContact O-N 3.14Å; E822-K824 VanDerWaalsContact C-N 3.34Å; E822-K824 PolarHBondContact O-N 3.02Å; K824-K827 WeakPolarHBondContact O-CB 3.42Å; K824-K827 PolarHBondContact O-N 3.32Å; K824-Q828 VanDerWaalsContact O-CG 3.3Å; K824-Q828 WeakPolarHBondContact O-CG 3.44Å; K824-Q828 PolarHBondContact O-N 3.22Å
825	E	74.4	Confident	76.6	Confident	55 Å²	55	90.5 Å²	90.5	26%	0.257	46%	0.459	S	S	.	.	H	α-helix	trans	-55.4	-57.5	172.5	-177.7	-165	151	0	0	111	E80 G821 E822 K827 Q828 D829	E80-E825 HydrophobicContact CB-CG 4.46Å; E80-E825 VanDerWaalsContact OE2-CG 3.32Å; E80-E825 WeakPolarHBondContact OE2-CG 3.2Å; G821-E825 PolarHBondContact O-N 2.98Å; E822-E825 WeakPolarHBondContact O-CB 3.37Å; E822-E825 PolarHBondContact O-N 3.4Å; E825-K827 PolarHBondContact O-N 3.45Å; E825-K827 VanDerWaalsContact O-N 3.13Å; E825-Q828 CarbonylContact O-C 3.59Å; E825-Q828 WeakPolarHBondContact O-CA 3.42Å; E825-Q828 PolarHBondContact O-N 3.28Å; E825-D829 PolarHBondContact O-N 3.03Å
826	I	81.3	Confident	76.9	Confident	97 Å²	97	90.6 Å²	90.6	50%	0.497	45%	0.449	S	S	.	.	H	α-helix	trans	-55.1	-40.5	179.2	-66.8	165.9	0	0	0	111.6	E822 Q828 D829 I830	E822-I826 VanDerWaalsContact O-CG1 3.32Å; E822-I826 WeakPolarHBondContact O-CG1 3.09Å; E822-I826 PolarHBondContact O-N 2.85Å; I826-Q828 VanDerWaalsContact C-N 3.31Å; I826-Q828 PolarHBondContact O-N 3.02Å; I826-D829 PolarHBondContact O-N 3.43Å; I826-I830 HydrophobicContact CG2-CD1 3.9Å; I826-I830 WeakPolarHBondContact O-CD1 3.23Å; I826-I830 WeakPolarHBondContact O-CG1 3.43Å; I826-I830 PolarHBondContact O-N 2.88Å
827	K	81.8	Confident	77.4	Confident	142 Å²	142	89.5 Å²	89.5	62%	0.617	44%	0.443	S	S	*	.	H	α-helix	trans	-64.1	-37.4	177.7	-179.2	-175.1	172.2	-167.1	0	112	L823 K824 E825 S831	L823-K827 WeakPolarHBondContact O-CB 3.34Å; L823-K827 PolarHBondContact O-N 3.23Å; K824-K827 WeakPolarHBondContact O-CB 3.42Å; K824-K827 PolarHBondContact O-N 3.32Å; E825-K827 PolarHBondContact O-N 3.45Å; E825-K827 VanDerWaalsContact O-N 3.13Å; K827-S831 PolarHBondContact O-N 3.07Å; K827-S831 PolarHBondContact O-OG 2.98Å
828	Q	78.8	Confident	78.6	Confident	25 Å²	25	85 Å²	85	12%	0.117	42%	0.424	C	S	.	.	H	α-helix	trans	-75.6	-39.3	179.1	-67.4	-64	6.8	0	0	111.5	N79 K824 E825 I826 I830 S831 S832	N79-Q828 HydrophobicContact CB-CG 4.45Å; K824-Q828 VanDerWaalsContact O-CG 3.3Å; K824-Q828 WeakPolarHBondContact O-CG 3.44Å; K824-Q828 PolarHBondContact O-N 3.22Å; E825-Q828 CarbonylContact O-C 3.59Å; E825-Q828 WeakPolarHBondContact O-CA 3.42Å; E825-Q828 PolarHBondContact O-N 3.28Å; I826-Q828 VanDerWaalsContact C-N 3.31Å; I826-Q828 PolarHBondContact O-N 3.02Å; Q828-I830 VanDerWaalsContact C-N 3.33Å; Q828-I830 PolarHBondContact O-N 2.94Å; Q828-S831 CarbonylContact O-C 3.42Å; Q828-S831 WeakPolarHBondContact O-CA 3.39Å; Q828-S831 VanDerWaalsContact O-CB 3.31Å; Q828-S831 WeakPolarHBondContact O-CB 3.22Å; Q828-S831 PolarHBondContact O-N 3.18Å; Q828-S832 PolarHBondContact O-N 3.43Å
829	D	80.4	Confident	79.3	Confident	77 Å²	77	83.1 Å²	83.1	41%	0.412	41%	0.409	S	S	.	.	H	α-helix	trans	-58.5	-44.4	172.6	-79.2	-8	0	0	0	112.1	E825 I826 S831 S832 L833	E825-D829 PolarHBondContact O-N 3.03Å; I826-D829 PolarHBondContact O-N 3.43Å; D829-S831 PolarHBondContact O-N 3.46Å; D829-S832 PolarHBondContact O-N 2.89Å; D829-L833 VanDerWaalsContact O-CB 3.3Å; D829-L833 WeakPolarHBondContact O-CB 3.04Å; D829-L833 PolarHBondContact O-N 3.07Å
830	I	85.3	Confident	80.1	Confident	106 Å²	106	84.2 Å²	84.2	54%	0.544	41%	0.411	S	S	.	.	H	α-helix	trans	-59.7	-36.5	173.4	-68.7	165.5	0	0	0	110.9	I826 Q828 R834	I826-I830 HydrophobicContact CG2-CD1 3.9Å; I826-I830 WeakPolarHBondContact O-CD1 3.23Å; I826-I830 WeakPolarHBondContact O-CG1 3.43Å; I826-I830 PolarHBondContact O-N 2.88Å; Q828-I830 VanDerWaalsContact C-N 3.33Å; Q828-I830 PolarHBondContact O-N 2.94Å; I830-R834 WeakPolarHBondContact O-CB 3.22Å; I830-R834 PolarHBondContact O-N 2.85Å; I830-R834 VanDerWaalsContact O-N 3.08Å
831	S	78.6	Confident	80.9	Confident	20 Å²	20	85.4 Å²	85.4	14%	0.14	41%	0.414	C	S	.	.	H	α-helix	trans	-72	-43.5	179.7	-60.2	0	0	0	0	111.6	K827 Q828 D829 R834 Y835	K827-S831 PolarHBondContact O-N 3.07Å; K827-S831 PolarHBondContact O-OG 2.98Å; Q828-S831 CarbonylContact O-C 3.42Å; Q828-S831 WeakPolarHBondContact O-CA 3.39Å; Q828-S831 VanDerWaalsContact O-CB 3.31Å; Q828-S831 WeakPolarHBondContact O-CB 3.22Å; Q828-S831 PolarHBondContact O-N 3.18Å; D829-S831 PolarHBondContact O-N 3.46Å; S831-R834 WeakPolarHBondContact O-CB 3.3Å; S831-R834 PolarHBondContact O-N 3.31Å; S831-Y835 WeakPolarHBondContact O-CD2 3.38Å; S831-Y835 PolarHBondContact O-N 2.81Å
832	S	80.2	Confident	81.8	Confident	18 Å²	18	86.7 Å²	86.7	13%	0.126	42%	0.419	C	S	.	.	H	α-helix	trans	-60.3	-52	174.3	-178.5	0	0	0	0	111.3	G45 Q828 D829 R834 Y835 E836	G45-S832 PolarHBondContact O-OG 3.44Å; Q828-S832 PolarHBondContact O-N 3.43Å; D829-S832 PolarHBondContact O-N 2.89Å; S832-R834 PolarHBondContact O-N 3.49Å; S832-Y835 WeakPolarHBondContact O-CA 3.41Å; S832-Y835 WeakPolarHBondContact O-CB 3.36Å; S832-Y835 PolarHBondContact O-N 3.27Å; S832-E836 PolarHBondContact O-N 3.31Å
833	L	84.4	Confident	82.4	Confident	95 Å²	95	87.7 Å²	87.7	50%	0.497	42%	0.423	S	S	.	.	H	α-helix	trans	-55.9	-39.4	176.7	-178.2	67.8	0	0	0	111.9	D829 Y835 E836 L837	D829-L833 VanDerWaalsContact O-CB 3.3Å; D829-L833 WeakPolarHBondContact O-CB 3.04Å; D829-L833 PolarHBondContact O-N 3.07Å; L833-Y835 VanDerWaalsContact C-N 3.32Å; L833-Y835 PolarHBondContact O-N 3.39Å; L833-E836 PolarHBondContact O-N 3.04Å; L833-L837 HydrophobicContact CD1-CD1 4.44Å; L833-L837 HydrophobicContact CD1-CG 4.42Å; L833-L837 HydrophobicContact CG-CD1 4.13Å; L833-L837 HydrophobicContact CG-CG 4.5Å; L833-L837 WeakPolarHBondContact O-CG 3.45Å; L833-L837 PolarHBondContact O-N 3.35Å
834	R	85.6	Confident	82.8	Confident	128 Å²	128	85.1 Å²	85.1	48%	0.483	42%	0.418	S	S	.	.	H	α-helix	trans	-60.9	-41.8	175.5	-175.6	-171.3	73	-168.1	-1.1	111.6	I830 S831 S832 L838	I830-R834 WeakPolarHBondContact O-CB 3.22Å; I830-R834 PolarHBondContact O-N 2.85Å; I830-R834 VanDerWaalsContact O-N 3.08Å; S831-R834 WeakPolarHBondContact O-CB 3.3Å; S831-R834 PolarHBondContact O-N 3.31Å; S832-R834 PolarHBondContact O-N 3.49Å; R834-L838 HydrophobicContact CG-CD1 4.12Å; R834-L838 WeakPolarHBondContact O-CB 3.5Å; R834-L838 WeakPolarHBondContact O-CD1 3.46Å; R834-L838 WeakPolarHBondContact O-CG 3.17Å; R834-L838 PolarHBondContact O-N 3.11Å; R834-L838 VanDerWaalsContact O-N 3.16Å
835	Y	82.3	Confident	83.3	Confident	59 Å²	59	82.2 Å²	82.2	23%	0.231	42%	0.416	C	S	.	.	H	α-helix	trans	-69	-40.3	179.4	-72	-64.4	0	0	0	111.9	N46 S831 S832 L833 L838 E839	N46-Y835 HydrophobicContact CB-CD2 4.12Å; N46-Y835 HydrophobicContact CB-CE2 4.41Å; N46-Y835 HydrophobicContact CB-CG 4.19Å; S831-Y835 WeakPolarHBondContact O-CD2 3.38Å; S831-Y835 PolarHBondContact O-N 2.81Å; S832-Y835 WeakPolarHBondContact O-CA 3.41Å; S832-Y835 WeakPolarHBondContact O-CB 3.36Å; S832-Y835 PolarHBondContact O-N 3.27Å; L833-Y835 VanDerWaalsContact C-N 3.32Å; L833-Y835 PolarHBondContact O-N 3.39Å; Y835-L838 PolarHBondContact O-N 3.44Å; Y835-E839 PolarHBondContact O-N 3.17Å
836	E	83.2	Confident	83.7	Confident	91 Å²	91	81.1 Å²	81.1	43%	0.425	42%	0.42	S	S	.	.	H	α-helix	trans	-61.6	-49.3	177.6	-164.8	-179.8	-172.8	0	0	111.8	S832 L833 L838 E839 E840	S832-E836 PolarHBondContact O-N 3.31Å; L833-E836 PolarHBondContact O-N 3.04Å; E836-L838 VanDerWaalsContact C-N 3.31Å; E836-L838 PolarHBondContact O-N 3.28Å; E836-E839 PolarHBondContact O-N 3.05Å; E836-E839 VanDerWaalsContact O-N 3.1Å; E836-E840 PolarHBondContact O-N 2.84Å
837	L	86.9	Confident	83.9	Confident	97 Å²	97	82.7 Å²	82.7	51%	0.508	43%	0.425	S	S	.	.	H	α-helix	trans	-63	-35.5	177.6	-69.3	174.1	0	0	0	113.1	L833 E839 K841	L833-L837 HydrophobicContact CD1-CD1 4.44Å; L833-L837 HydrophobicContact CD1-CG 4.42Å; L833-L837 HydrophobicContact CG-CD1 4.13Å; L833-L837 HydrophobicContact CG-CG 4.5Å; L833-L837 WeakPolarHBondContact O-CG 3.45Å; L833-L837 PolarHBondContact O-N 3.35Å; L837-E839 VanDerWaalsContact C-N 3.31Å; L837-K841 WeakPolarHBondContact O-CB 3.41Å; L837-K841 PolarHBondContact O-N 2.83Å; L837-K841 VanDerWaalsContact O-N 3.14Å
838	L	86.7	Confident	84.1	Confident	95 Å²	95	80.9 Å²	80.9	50%	0.497	42%	0.422	S	S	.	.	H	α-helix	trans	-68.1	-34.4	176.1	-76.2	172.9	0	0	0	111.8	R834 Y835 E836 S842	R834-L838 HydrophobicContact CG-CD1 4.12Å; R834-L838 WeakPolarHBondContact O-CB 3.5Å; R834-L838 WeakPolarHBondContact O-CD1 3.46Å; R834-L838 WeakPolarHBondContact O-CG 3.17Å; R834-L838 PolarHBondContact O-N 3.11Å; R834-L838 VanDerWaalsContact O-N 3.16Å; Y835-L838 PolarHBondContact O-N 3.44Å; E836-L838 VanDerWaalsContact C-N 3.31Å; E836-L838 PolarHBondContact O-N 3.28Å; L838-S842 WeakPolarHBondContact O-CB 3.29Å; L838-S842 PolarHBondContact O-N 2.71Å
839	E	83.8	Confident	84.4	Confident	65 Å²	65	82.3 Å²	82.3	30%	0.304	44%	0.437	S	S	.	.	H	α-helix	trans	-75.7	-43	177.4	-177.5	63	-173.1	0	0	112	P48 Y835 E836 L837 K841 S842 Q843	P48-E839 HydrophobicContact CB-CB 4.37Å; P48-E839 HydrophobicContact CB-CG 3.81Å; P48-E839 HydrophobicContact CG-CB 4.03Å; P48-E839 HydrophobicContact CG-CG 4.04Å; Y835-E839 PolarHBondContact O-N 3.17Å; E836-E839 PolarHBondContact O-N 3.05Å; E836-E839 VanDerWaalsContact O-N 3.1Å; L837-E839 VanDerWaalsContact C-N 3.31Å; E839-K841 PolarHBondContact O-N 3Å; E839-S842 VanDerWaalsContact CD-OG 3.31Å; E839-S842 WeakPolarHBondContact O-CA 3.47Å; E839-S842 PolarHBondContact O-N 2.64Å; E839-S842 PolarHBondContact O-OG 3.18Å; E839-S842 PolarHBondContact OE2-OG 3.48Å; E839-Q843 HydrophobicContact CG-CG 4.37Å; E839-Q843 WeakPolarHBondContact O-CG 3.49Å; E839-Q843 PolarHBondContact O-N 3.32Å; E839-Q843 PolarHBondContact OE1-NE2 3.46Å
840	E	86.8	Confident	84.6	Confident	127 Å²	127	83.2 Å²	83.2	59%	0.593	44%	0.442	S	S	*	.	H	α-helix	trans	-57	-42.5	174	-171	-175.6	-177.8	0	0	110.6	E836 S842 Q843 A844	E836-E840 PolarHBondContact O-N 2.84Å; E840-S842 PolarHBondContact O-N 2.82Å; E840-Q843 PolarHBondContact O-N 3.33Å; E840-A844 VanDerWaalsContact O-CB 3.28Å; E840-A844 WeakPolarHBondContact O-CB 3.41Å; E840-A844 PolarHBondContact O-N 2.87Å
841	K	88.6	Confident	84.5	Confident	152 Å²	152	82.7 Å²	82.7	66%	0.661	44%	0.439	S	S	*	.	H	α-helix	trans	-61.9	-41.3	172.2	-179.9	-177	174.9	-179.1	0	112.5	L837 E839 A845	L837-K841 WeakPolarHBondContact O-CB 3.41Å; L837-K841 PolarHBondContact O-N 2.83Å; L837-K841 VanDerWaalsContact O-N 3.14Å; E839-K841 PolarHBondContact O-N 3Å; K841-A845 VanDerWaalsContact O-CB 3.28Å; K841-A845 WeakPolarHBondContact O-CB 3.47Å; K841-A845 PolarHBondContact O-N 3.32Å
842	S	85.1	Confident	84.7	Confident	55 Å²	55	86.6 Å²	86.6	39%	0.385	46%	0.458	S	S	.	.	H	α-helix	trans	-66.7	-42.5	-178.9	86.4	0	0	0	0	110.9	L838 E839 E840 A845 G846	L838-S842 WeakPolarHBondContact O-CB 3.29Å; L838-S842 PolarHBondContact O-N 2.71Å; E839-S842 VanDerWaalsContact CD-OG 3.31Å; E839-S842 WeakPolarHBondContact O-CA 3.47Å; E839-S842 PolarHBondContact O-N 2.64Å; E839-S842 PolarHBondContact O-OG 3.18Å; E839-S842 PolarHBondContact OE2-OG 3.48Å; E840-S842 PolarHBondContact O-N 2.82Å; S842-A845 PolarHBondContact O-N 2.99Å; S842-G846 PolarHBondContact O-N 2.73Å
843	Q	85.1	Confident	84.9	Confident	110 Å²	110	91.5 Å²	91.5	51%	0.514	48%	0.479	S	S	.	.	H	α-helix	trans	-66.1	-48.4	177	-69.7	-180	6.6	0	0	111.2	E839 E840 A845 G846 E847	E839-Q843 HydrophobicContact CG-CG 4.37Å; E839-Q843 WeakPolarHBondContact O-CG 3.49Å; E839-Q843 PolarHBondContact O-N 3.32Å; E839-Q843 PolarHBondContact OE1-NE2 3.46Å; E840-Q843 PolarHBondContact O-N 3.33Å; Q843-A845 VanDerWaalsContact C-N 3.27Å; Q843-A845 PolarHBondContact O-N 3.23Å; Q843-G846 CarbonylContact O-C 3.59Å; Q843-G846 WeakPolarHBondContact O-CA 3.32Å; Q843-G846 PolarHBondContact O-N 2.9Å; Q843-E847 PolarHBondContact O-N 3.46Å
844	A	84.8	Confident	84.7	Confident	56 Å²	56	92.5 Å²	92.5	46%	0.463	48%	0.481	S	S	.	.	H	α-helix	trans	-59.5	-38.3	175.6	0	0	0	0	0	112.1	E840 L848	E840-A844 VanDerWaalsContact O-CB 3.28Å; E840-A844 WeakPolarHBondContact O-CB 3.41Å; E840-A844 PolarHBondContact O-N 2.87Å; A844-L848 WeakPolarHBondContact O-CB 3.19Å; A844-L848 PolarHBondContact O-N 3.12Å
845	A	85.1	Confident	84.4	Confident	56 Å²	56	90.9 Å²	90.9	46%	0.463	48%	0.481	S	S	.	.	H	α-helix	trans	-68.5	-37.2	174.2	0	0	0	0	0	112.5	K841 S842 Q843 A849	K841-A845 VanDerWaalsContact O-CB 3.28Å; K841-A845 WeakPolarHBondContact O-CB 3.47Å; K841-A845 PolarHBondContact O-N 3.32Å; S842-A845 PolarHBondContact O-N 2.99Å; Q843-A845 VanDerWaalsContact C-N 3.27Å; Q843-A845 PolarHBondContact O-N 3.23Å; A845-A849 WeakPolarHBondContact O-CB 3.23Å; A845-A849 PolarHBondContact O-N 3.15Å
846	G	83.4	Confident	84.2	Confident	33 Å²	33	90 Å²	90	34%	0.34	49%	0.49	S	S	.	.	H	α-helix	trans	-66.1	-45.1	174.9	0	0	0	0	0	112.7	S842 Q843 A849 L850	S842-G846 PolarHBondContact O-N 2.73Å; Q843-G846 CarbonylContact O-C 3.59Å; Q843-G846 WeakPolarHBondContact O-CA 3.32Å; Q843-G846 PolarHBondContact O-N 2.9Å; G846-A849 PolarHBondContact O-N 3.12Å; G846-L850 PolarHBondContact O-N 3.16Å
847	E	85.6	Confident	83.9	Confident	130 Å²	130	90.3 Å²	90.3	61%	0.607	50%	0.495	S	S	*	.	H	α-helix	trans	-62	-43.7	173.1	-72.6	-174.1	171.9	0	0	111.4	Q843 A849 L850 L851	Q843-E847 PolarHBondContact O-N 3.46Å; E847-A849 VanDerWaalsContact C-N 3.33Å; E847-A849 PolarHBondContact O-N 3.08Å; E847-L850 PolarHBondContact O-N 3.35Å; E847-L851 WeakPolarHBondContact O-CB 3.48Å; E847-L851 VanDerWaalsContact O-CG 3.28Å; E847-L851 WeakPolarHBondContact O-CG 3.26Å; E847-L851 PolarHBondContact O-N 3.24Å
848	L	86.6	Confident	83.2	Confident	104 Å²	104	93 Å²	93	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-60.4	-43.1	174.8	-176.6	67.4	0	0	0	111.3	A844 L851 I852	A844-L848 WeakPolarHBondContact O-CB 3.19Å; A844-L848 PolarHBondContact O-N 3.12Å; L848-L851 PolarHBondContact O-N 2.99Å; L848-I852 HydrophobicContact CD1-CD1 4.37Å; L848-I852 HydrophobicContact CG-CD1 3.93Å; L848-I852 WeakPolarHBondContact O-CB 3.05Å; L848-I852 WeakPolarHBondContact O-CD1 3.4Å; L848-I852 WeakPolarHBondContact O-CG1 3.43Å; L848-I852 PolarHBondContact O-N 2.89Å
849	A	83.9	Confident	82.2	Confident	54 Å²	54	95.2 Å²	95.2	45%	0.446	51%	0.509	S	S	.	.	H	α-helix	trans	-64.1	-41.6	176.4	0	0	0	0	0	112.1	A845 G846 E847 I852 Q853	A845-A849 WeakPolarHBondContact O-CB 3.23Å; A845-A849 PolarHBondContact O-N 3.15Å; G846-A849 PolarHBondContact O-N 3.12Å; E847-A849 VanDerWaalsContact C-N 3.33Å; E847-A849 PolarHBondContact O-N 3.08Å; A849-I852 PolarHBondContact O-N 3.3Å; A849-Q853 WeakPolarHBondContact O-CB 3.46Å; A849-Q853 PolarHBondContact O-N 3.19Å
850	L	84.1	Confident	81	Confident	97 Å²	97	93.8 Å²	93.8	51%	0.508	51%	0.511	S	S	.	.	H	α-helix	trans	-63.3	-42.3	173.8	-82.8	165.5	0	0	0	112	G846 E847 Q853 Q854	G846-L850 PolarHBondContact O-N 3.16Å; E847-L850 PolarHBondContact O-N 3.35Å; L850-Q853 PolarHBondContact O-N 2.88Å; L850-Q854 WeakPolarHBondContact O-CB 3.24Å; L850-Q854 VanDerWaalsContact O-CG 3.27Å; L850-Q854 WeakPolarHBondContact O-CG 3.19Å; L850-Q854 PolarHBondContact O-N 3.45Å
851	L	84.3	Confident	79.5	Confident	94 Å²	94	95.5 Å²	95.5	49%	0.492	52%	0.517	S	S	.	.	H	α-helix	trans	-65.5	-41.1	175.9	-74.2	169.9	0	0	0	111.6	E847 L848 Q853 Q854 L855	E847-L851 WeakPolarHBondContact O-CB 3.48Å; E847-L851 VanDerWaalsContact O-CG 3.28Å; E847-L851 WeakPolarHBondContact O-CG 3.26Å; E847-L851 PolarHBondContact O-N 3.24Å; L848-L851 PolarHBondContact O-N 2.99Å; L851-Q853 VanDerWaalsContact C-N 3.34Å; L851-Q854 PolarHBondContact O-N 3.48Å; L851-L855 VanDerWaalsContact O-CB 3.32Å; L851-L855 WeakPolarHBondContact O-CB 3.11Å; L851-L855 VanDerWaalsContact O-CG 3.27Å; L851-L855 WeakPolarHBondContact O-CG 3.33Å; L851-L855 PolarHBondContact O-N 3.36Å
852	I	83.3	Confident	77.8	Confident	103 Å²	103	94 Å²	94	53%	0.528	52%	0.516	S	S	.	.	H	α-helix	trans	-62.4	-43.1	173.3	-70.7	165.6	0	0	0	110.3	L848 A849 L855 G856	L848-I852 HydrophobicContact CD1-CD1 4.37Å; L848-I852 HydrophobicContact CG-CD1 3.93Å; L848-I852 WeakPolarHBondContact O-CB 3.05Å; L848-I852 WeakPolarHBondContact O-CD1 3.4Å; L848-I852 WeakPolarHBondContact O-CG1 3.43Å; L848-I852 PolarHBondContact O-N 2.89Å; A849-I852 PolarHBondContact O-N 3.3Å; I852-L855 PolarHBondContact O-N 3.06Å; I852-G856 PolarHBondContact O-N 2.85Å
853	Q	82.5	Confident	76.2	Confident	121 Å²	121	96.9 Å²	96.9	57%	0.565	53%	0.531	S	S	*	.	H	α-helix	trans	-65.6	-43.8	177.3	-170.7	175.8	2.9	0	0	111.6	A849 L850 L851 L855 G856 D857	A849-Q853 WeakPolarHBondContact O-CB 3.46Å; A849-Q853 PolarHBondContact O-N 3.19Å; L850-Q853 PolarHBondContact O-N 2.88Å; L851-Q853 VanDerWaalsContact C-N 3.34Å; Q853-L855 PolarHBondContact O-N 3.3Å; Q853-G856 CarbonylContact O-C 3.58Å; Q853-G856 PolarHBondContact O-N 2.91Å; Q853-D857 WeakPolarHBondContact O-CB 3.36Å; Q853-D857 PolarHBondContact O-N 3.26Å
854	Q	82	Confident	74.5	Confident	115 Å²	115	100 Å²	100	54%	0.537	55%	0.548	S	S	.	.	H	α-helix	trans	-64.8	-37.5	175.6	-75.5	179.1	1.5	0	0	112.8	L850 L851 K858	L850-Q854 WeakPolarHBondContact O-CB 3.24Å; L850-Q854 VanDerWaalsContact O-CG 3.27Å; L850-Q854 WeakPolarHBondContact O-CG 3.19Å; L850-Q854 PolarHBondContact O-N 3.45Å; L851-Q854 PolarHBondContact O-N 3.48Å; Q854-K858 WeakPolarHBondContact O-CB 3.22Å; Q854-K858 WeakPolarHBondContact O-CG 3.17Å; Q854-K858 PolarHBondContact O-N 2.98Å
855	L	79.6	Confident	72.9	Confident	94 Å²	94	107.8 Å²	107.8	49%	0.492	57%	0.565	S	S	.	*	H	α-helix	trans	-65.8	-45.8	171.4	-77.3	164.8	0	0	0	110.3	L851 I852 Q853 D857 K858 F859	L851-L855 VanDerWaalsContact O-CB 3.32Å; L851-L855 WeakPolarHBondContact O-CB 3.11Å; L851-L855 VanDerWaalsContact O-CG 3.27Å; L851-L855 WeakPolarHBondContact O-CG 3.33Å; L851-L855 PolarHBondContact O-N 3.36Å; I852-L855 PolarHBondContact O-N 3.06Å; Q853-L855 PolarHBondContact O-N 3.3Å; L855-D857 PolarHBondContact O-N 3.34Å; L855-K858 PolarHBondContact O-N 2.97Å; L855-F859 HydrophobicContact CD2-CE2 4.26Å; L855-F859 WeakPolarHBondContact O-CD2 3.22Å; L855-F859 PolarHBondContact O-N 2.97Å
856	G	77.9	Confident	71	Confident	41 Å²	41	117.4 Å²	117.4	42%	0.423	60%	0.6	S	S	.	*	H	α-helix	trans	-56	-45.4	174.8	0	0	0	0	0	112.9	I852 Q853 F859 G860	I852-G856 PolarHBondContact O-N 2.85Å; Q853-G856 CarbonylContact O-C 3.58Å; Q853-G856 PolarHBondContact O-N 2.91Å; G856-F859 PolarHBondContact O-N 2.93Å; G856-G860 PolarHBondContact O-N 3.33Å
857	D	76.9	Confident	70.4	Confident	98 Å²	98	121.6 Å²	121.6	52%	0.524	61%	0.613	S	S	.	*	H	α-helix	trans	-68.9	-33.3	176.9	-74.4	-18.4	0	0	0	112.6	Q853 L855 K861	Q853-D857 WeakPolarHBondContact O-CB 3.36Å; Q853-D857 PolarHBondContact O-N 3.26Å; L855-D857 PolarHBondContact O-N 3.34Å; D857-K861 WeakPolarHBondContact O-CB 3.33Å; D857-K861 WeakPolarHBondContact O-CG 3.35Å; D857-K861 PolarHBondContact O-N 3.07Å; D857-K861 VanDerWaalsContact O-N 3.11Å
858	K	72	Confident	69.5	Low	153 Å²	153	121.2 Å²	121.2	67%	0.665	61%	0.613	S	S	*	*	H	α-helix	trans	-69.4	-40.7	172.8	-84.3	-177.2	176.7	178.1	0	112.3	Q854 L855	Q854-K858 WeakPolarHBondContact O-CB 3.22Å; Q854-K858 WeakPolarHBondContact O-CG 3.17Å; Q854-K858 PolarHBondContact O-N 2.98Å; L855-K858 PolarHBondContact O-N 2.97Å
859	F	64.9	Low	68.6	Low	142 Å²	142	122.1 Å²	122.1	62%	0.623	62%	0.617	S	S	*	*	H	α-helix	trans	-74.1	-36.7	176.1	-78.8	-71.9	0	0	0	112.1	L855 G856 K861 N862 T863	L855-F859 HydrophobicContact CD2-CE2 4.26Å; L855-F859 WeakPolarHBondContact O-CD2 3.22Å; L855-F859 PolarHBondContact O-N 2.97Å; G856-F859 PolarHBondContact O-N 2.93Å; F859-K861 VanDerWaalsContact C-N 3.33Å; F859-K861 PolarHBondContact O-N 3.13Å; F859-N862 PolarHBondContact O-N 3.35Å; F859-N862 VanDerWaalsContact O-N 3.13Å; F859-T863 PolarHBondContact O-N 2.8Å; F859-T863 PolarHBondContact O-OG1 3.41Å
860	G	58.6	Low	67.7	Low	35 Å²	35	126.1 Å²	126.1	36%	0.361	63%	0.627	S	S	.	*	H	α-helix	trans	-66.6	-28.5	175.4	0	0	0	0	0	114	G856 T863	G856-G860 PolarHBondContact O-N 3.33Å; G860-T863 PolarHBondContact O-OG1 2.85Å; G860-T863 VanDerWaalsContact O-OG1 3.13Å
861	K	55.1	Low	66.7	Low	162 Å²	162	127.9 Å²	127.9	70%	0.704	64%	0.635	S	S	*	*	H	α-helix	trans	-74.6	-24.6	170.8	-79.3	176.2	178.9	173.6	0	113.5	D857 F859	D857-K861 WeakPolarHBondContact O-CB 3.33Å; D857-K861 WeakPolarHBondContact O-CG 3.35Å; D857-K861 PolarHBondContact O-N 3.07Å; D857-K861 VanDerWaalsContact O-N 3.11Å; F859-K861 VanDerWaalsContact C-N 3.33Å; F859-K861 PolarHBondContact O-N 3.13Å
862	N	52.5	Low	65.5	Low	122 Å²	122	130.2 Å²	130.2	65%	0.652	64%	0.644	S	S	*	*	H	α-helix	trans	-83.5	-17.7	176.7	-79.7	-11.8	0	0	0	113.5	F859	F859-N862 PolarHBondContact O-N 3.35Å; F859-N862 VanDerWaalsContact O-N 3.13Å
863	T	52.8	Low	64.2	Low	115 Å²	115	132.1 Å²	132.1	71%	0.706	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-6	175.2	42.9	0	0	0	0	114.5	F859 G860	F859-T863 PolarHBondContact O-N 2.8Å; F859-T863 PolarHBondContact O-OG1 3.41Å; G860-T863 PolarHBondContact O-OG1 2.85Å; G860-T863 VanDerWaalsContact O-OG1 3.13Å
864	M	48.9	Very low	62.8	Low	175 Å²	175	133 Å²	133	86%	0.862	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	9.9	171.2	-76.2	-129.2	-156.1	0	0	114.2
865	R	51.5	Low	61.2	Low	219 Å²	219	134.5 Å²	134.5	83%	0.826	67%	0.669	S	S	*	*			trans	-121.1	69.5	169.1	-79.9	-174.2	175.3	179.3	-1	110.1
866	H	44	Very low	59.6	Low	258 Å²	258	138.2 Å²	138.2	100%	1.194	69%	0.686	S	S	*	*			trans	-154.8	0	151.8	-96.8	-56.6	0	0	0	110.4

Retrieved 866 of 866 residues in 1637.1 ms (Link to these results)

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