A0A077ZD73_TRITR Loading...

Ubiquitin conjugation factor E4 B

Ubiquitin-protein ligase that probably functions as an E3 ligase in conjunction with specific E1 and E2 ligases. May also function as an E4 ligase mediating the assembly of polyubiquitin chains on substrates ubiquitinated by another E3 ubiquitin ligase. May regulate myosin assembly in striated muscles together with STUB1 and VCP/p97 by targeting myosin chaperone UNC45B for proteasomal degradation.

AlphaFold DB , UniProt , Accession A0A077ZD73, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,065 aa.

						>A0A077ZD73_TRITR|A0A077ZD73
MNNEENTTNSSSPSGCNPFEALKSSSNADKECSTIRVNPEFAHRELSQSELRDVRTAVSSSCEGAVEENVGSVCTAVKESSLDTFVLRSYLEHVMHVSIHDSQESCLPPSLVNEFDQLMISHDCDFDRWLNLSELVIWEIVSNFLQDGMTERNVSLLGTDAASIPSYDVSDKMGDRPGYLSFRSNPQNLGLVKYILTCCRRAHTHGDVGNLDKGVKEKIEDFGKRMCKQIVSLLVHILSACLLPIDTMDIQRALAYCICNENVSAVFLYDFLSQSAELGEEAFDRIFHPLVDVLIFASHVLSLQDEIVTWPLDVFRNLCSIKVNGSRPFCNSILRRPDWFSGPLTEAAGREIAALTPLGSIMTVFCFLDEDPTLDNMCKVDGSHNFVHTVIRLRLQLIRDLSTETLRCMMMNSESREPTMQFLSSVLALNSKKSSLMSNLADLAPDSFLLNILVVLFNLSLKIMLDKVDPLYVFQSSSRVQLQGIARMNMTSENAAMFCKSVEGAMQPRFPSECFFMTVHLAHIALLPLFPRYAKHKRAPIELSDDIRWLERNEKEWIRYPALARRNRLALKLLKRKLEKATKQLAFNEAVMKDENLLSLAAYFSLKQMDVVMKALCGNRSDSIHLTEVPDLFKAFPEFYIEDVLDVFIFLLEYEGPLPGYMSVHRFAQHLLILICNTGIFNNPYLSAKVVELLFYTCPQVRPAGRSFHDSLFQNPSAGEALFKSLVKFYSDVETLGSASEFYDKFNIRFHIQTIFKSMLDEPACRAVMFDYCKNADANFIRFVNMLINDTTYLLDESMEGLLRINSVESQMNDESRWWNLEMEERQRLTVQHAHDERIVRSSLQLARATIDMFVYMTKDVTEPFLTGELGDRLAAMLNYNLKQLCGPTSQRLRVKDPKRYTWEPRSLINELTEIYLNLDCDKFVGCIVADERSYSPAFFRNVIECLIRHNIKSNSKVEQLKLLAQKVHAVWKKRKQEDMVFSDVPSDFMDPVMGTLMRDPVKLPSGSIMDRTVITRHLLNTQTDPFTRQPLNENMLVPAVELKTQIDAWIEEKMHLANKRPHLK
					

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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	26.1	Very low	26.2	Very low	238 Å²	238	156.7 Å²	156.7	100%	1.172	86%	0.856	S	S	*	*				0	105	0	-71.8	-169.1	-161	0	0	107.5
2	N	30.8	Very low	26	Very low	160 Å²	160	152.1 Å²	152.1	86%	0.856	84%	0.844	S	S	*	*			trans	152.8	83.3	157.1	-81.7	3.7	0	0	0	106.8
3	N	27.1	Very low	26	Very low	163 Å²	163	150.7 Å²	150.7	87%	0.872	85%	0.846	S	S	*	*			trans	-77	125.3	159.3	-74.2	-13.1	0	0	0	106.4
4	E	28.5	Very low	25.9	Very low	195 Å²	195	147.7 Å²	147.7	91%	0.911	84%	0.84	S	S	*	*			trans	-126.4	126.5	152.6	-82	-171	169.7	0	0	108.7
5	E	25.9	Very low	26	Very low	175 Å²	175	142.2 Å²	142.2	82%	0.818	83%	0.828	S	S	*	*			trans	-69	138.2	-178.2	-63	166.1	151.2	0	0	110
6	N	28.3	Very low	26	Very low	169 Å²	169	141.4 Å²	141.4	90%	0.904	83%	0.831	S	S	*	*			trans	-138.8	117.8	144.9	-98.8	-33.4	0	0	0	109.7
7	T	24.7	Very low	26	Very low	115 Å²	115	138.9 Å²	138.9	71%	0.706	81%	0.813	S	S	*	*			trans	-70.4	157	177.1	41.9	0	0	0	0	112.8
8	T	23.3	Very low	26.1	Very low	125 Å²	125	136.3 Å²	136.3	77%	0.767	80%	0.802	S	S	*	*			trans	67.9	99.3	158.9	55.4	0	0	0	0	118.6
9	N	25.7	Very low	26.4	Very low	165 Å²	165	133.7 Å²	133.7	88%	0.882	78%	0.779	S	S	*	*				-159	128.3	116.8	-96	-22.7	0	0	0	111.5
10	S	23	Very low	26.5	Very low	105 Å²	105	134.9 Å²	134.9	73%	0.734	78%	0.777	S	S	*	*			trans	-69.4	158.3	172.2	46.8	0	0	0	0	112.4
11	S	24.7	Very low	26.6	Very low	114 Å²	114	131.8 Å²	131.8	80%	0.797	77%	0.768	S	S	*	*			trans	67.3	78.7	162.4	65.4	0	0	0	0	118.2
12	S	24	Very low	26.6	Very low	101 Å²	101	125.3 Å²	125.3	71%	0.706	74%	0.737	S	S	*	*				-169.8	137.1	125.6	42.5	0	0	0	0	107.9	S14	S12-S14 PolarHBondContact O-N 3.03Å
13	P	26	Very low	26.4	Very low	134 Å²	134	126 Å²	126	87%	0.87	73%	0.733	S	S	*	*			trans	-72.7	86.7	172.5	30.8	-28.7	0	0	0	106.2	G15	P13-G15 PolarHBondContact O-N 3.03Å
14	S	24.7	Very low	26.4	Very low	109 Å²	109	121.6 Å²	121.6	76%	0.762	72%	0.715	S	S	*	*			trans	-62.8	92.8	164.4	56.5	0	0	0	0	106	S12 C16	S12-S14 PolarHBondContact O-N 3.03Å; S14-C16 PolarHBondContact O-N 3.06Å
15	G	27.3	Very low	26.4	Very low	65 Å²	65	117.3 Å²	117.3	67%	0.67	71%	0.706	S	S	*	*			trans	-49.1	123.8	175.2	0	0	0	0	0	108.4	P13 N17	P13-G15 PolarHBondContact O-N 3.03Å; G15-N17 PolarHBondContact O-N 3.17Å
16	C	25.1	Very low	26.5	Very low	129 Å²	129	113.8 Å²	113.8	87%	0.872	70%	0.701	S	S	*	*			trans	-45.6	114.2	165.4	-119.9	0	0	0	0	107.1	S14 P18	S14-C16 PolarHBondContact O-N 3.06Å; C16-P18 WeakPolarHBondContact O-CD 3.46Å; C16-P18 VanDerWaalsContact O-N 3.11Å
17	N	26.9	Very low	26.3	Very low	99 Å²	99	112.2 Å²	112.2	53%	0.529	69%	0.692	S	S	.	*			trans	-63.4	112.2	-178.5	-175	-10.3	0	0	0	108.1	G15 F19 E20	G15-N17 PolarHBondContact O-N 3.17Å; N17-F19 PolarHBondContact O-N 3.24Å; N17-F19 WeakPolarHBondContact OD1-CB 3.16Å; N17-F19 VanDerWaalsContact OD1-CD2 3.22Å; N17-F19 WeakPolarHBondContact OD1-CD2 3.37Å; N17-F19 PolarHBondContact OD1-N 2.89Å; N17-E20 PolarHBondContact O-N 3.44Å
18	P	27.1	Very low	26.5	Very low	93 Å²	93	111.3 Å²	111.3	60%	0.604	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-16	-175.6	-21.5	33	0	0	0	113.3	C16 E20 A21	C16-P18 WeakPolarHBondContact O-CD 3.46Å; C16-P18 VanDerWaalsContact O-N 3.11Å; P18-E20 PolarHBondContact O-N 3.11Å; P18-A21 PolarHBondContact O-N 3.27Å
19	F	31.9	Very low	26.6	Very low	86 Å²	86	113.4 Å²	113.4	38%	0.377	70%	0.703	S	S	.	*	H	α-helix	trans	-72.3	-21	-179.2	-74.2	-91.1	0	0	0	114.6	N17 A21 L22 K23	N17-F19 PolarHBondContact O-N 3.24Å; N17-F19 WeakPolarHBondContact OD1-CB 3.16Å; N17-F19 VanDerWaalsContact OD1-CD2 3.22Å; N17-F19 WeakPolarHBondContact OD1-CD2 3.37Å; N17-F19 PolarHBondContact OD1-N 2.89Å; F19-A21 VanDerWaalsContact C-N 3.31Å; F19-L22 PolarHBondContact O-N 3.04Å; F19-K23 PolarHBondContact O-N 3.5Å
20	E	29.1	Very low	26.6	Very low	158 Å²	158	114.8 Å²	114.8	74%	0.738	70%	0.701	S	S	*	*	H	α-helix	trans	-69.9	-30	173.7	-79.8	-164	157.3	0	0	112.2	N17 P18	N17-E20 PolarHBondContact O-N 3.44Å; P18-E20 PolarHBondContact O-N 3.11Å
21	A	28.6	Very low	26.7	Very low	69 Å²	69	119 Å²	119	57%	0.57	71%	0.709	S	S	*	*	H	α-helix	trans	-69.1	-40.8	175.2	0	0	0	0	0	111.7	P18 F19 S24	P18-A21 PolarHBondContact O-N 3.27Å; F19-A21 VanDerWaalsContact C-N 3.31Å; A21-S24 PolarHBondContact O-N 3.41Å; A21-S24 PolarHBondContact O-OG 2.9Å
22	L	25.7	Very low	26.7	Very low	103 Å²	103	119.2 Å²	119.2	54%	0.539	71%	0.709	S	S	.	*	H	α-helix	trans	-72.8	-27.1	-178.7	-77.1	164.1	0	0	0	114.1	F19 S24	F19-L22 PolarHBondContact O-N 3.04Å; L22-S24 PolarHBondContact O-N 2.98Å
23	K	27.1	Very low	26.6	Very low	175 Å²	175	119.6 Å²	119.6	76%	0.761	71%	0.712	S	S	*	*	H	α-helix	trans	-70.2	-18.5	175	-80	-177.5	177.5	178.3	0	113.5	F19	F19-K23 PolarHBondContact O-N 3.5Å
24	S	27.4	Very low	26.4	Very low	70 Å²	70	118.3 Å²	118.3	49%	0.49	70%	0.702	S	S	.	*	G	3₁₀ helix	trans	-88.5	0.5	-170.3	73.5	0	0	0	0	115.5	A21 L22 S26 N27	A21-S24 PolarHBondContact O-N 3.41Å; A21-S24 PolarHBondContact O-OG 2.9Å; L22-S24 PolarHBondContact O-N 2.98Å; S24-S26 PolarHBondContact O-N 3.44Å; S24-N27 PolarHBondContact O-N 2.75Å; S24-N27 VanDerWaalsContact O-N 3.09Å
25	S	27.8	Very low	26.3	Very low	105 Å²	105	120.5 Å²	120.5	73%	0.734	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-66.5	-2	179.8	66.4	0	0	0	0	115.1
26	S	28.4	Very low	26	Very low	100 Å²	100	128.4 Å²	128.4	70%	0.699	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-91.7	-6.5	172.4	61	0	0	0	0	114.8	S24	S24-S26 PolarHBondContact O-N 3.44Å
27	N	24.4	Very low	25.8	Very low	137 Å²	137	128.2 Å²	128.2	73%	0.733	71%	0.707	S	S	*	*			trans	-113.9	80.3	175.2	-80.6	-31.4	0	0	0	110.9	S24 D29	S24-N27 PolarHBondContact O-N 2.75Å; S24-N27 VanDerWaalsContact O-N 3.09Å; N27-D29 VanDerWaalsContact C-N 3.32Å; N27-D29 PolarHBondContact O-N 3.1Å
28	A	29.2	Very low	25.5	Very low	95 Å²	95	128.4 Å²	128.4	79%	0.785	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	89.3	167.1	0	0	0	0	0	109.6
29	D	25.5	Very low	25.5	Very low	169 Å²	169	129.2 Å²	129.2	90%	0.904	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-176.8	17.5	155.9	-94.7	-17.5	0	0	0	114.2	N27	N27-D29 VanDerWaalsContact C-N 3.32Å; N27-D29 PolarHBondContact O-N 3.1Å
30	K	25.6	Very low	25.1	Very low	195 Å²	195	132.5 Å²	132.5	85%	0.848	73%	0.73	S	S	*	*	S	Bend	trans	-119.4	119.5	170	-72	-172.8	178.4	-178.8	0	110.5	C32	K30-C32 PolarHBondContact O-N 3.29Å
31	E	24.8	Very low	24.8	Very low	193 Å²	193	134.6 Å²	134.6	90%	0.902	74%	0.737	S	S	*	*			trans	-39.2	120.2	174	-67.6	173.1	158.2	0	0	110.3	S33	E31-S33 VanDerWaalsContact C-N 3.35Å; E31-S33 PolarHBondContact O-N 3.09Å
32	C	23.4	Very low	24.7	Very low	119 Å²	119	134.6 Å²	134.6	80%	0.804	74%	0.737	S	S	*	*			trans	-63.1	95.5	178.2	-166.6	0	0	0	0	108.1	K30 T34	K30-C32 PolarHBondContact O-N 3.29Å; C32-T34 VanDerWaalsContact C-N 3.28Å; C32-T34 PolarHBondContact O-N 2.56Å
33	S	22.4	Very low	24.8	Very low	108 Å²	108	138.5 Å²	138.5	76%	0.755	75%	0.752	S	S	*	*			trans	-69.9	92.9	169	55.2	0	0	0	0	107.3	E31 I35	E31-S33 VanDerWaalsContact C-N 3.35Å; E31-S33 PolarHBondContact O-N 3.09Å; S33-I35 PolarHBondContact O-N 3.12Å
34	T	23.2	Very low	25	Very low	107 Å²	107	138.6 Å²	138.6	66%	0.656	75%	0.748	S	S	*	*			trans	-44.1	123.6	160.2	33.9	0	0	0	0	108.4	C32 R36	C32-T34 VanDerWaalsContact C-N 3.28Å; C32-T34 PolarHBondContact O-N 2.56Å; T34-R36 VanDerWaalsContact C-N 3.29Å; T34-R36 PolarHBondContact O-N 3.44Å
35	I	21.3	Very low	25.1	Very low	156 Å²	156	144.1 Å²	144.1	80%	0.8	77%	0.766	S	S	*	*			trans	-59.6	98.1	170.1	-65.5	169.5	0	0	0	106	S33 V37	S33-I35 PolarHBondContact O-N 3.12Å; I35-V37 PolarHBondContact O-N 3.08Å; I35-V37 VanDerWaalsContact O-N 3.1Å
36	R	20.8	Very low	25.5	Very low	231 Å²	231	141.4 Å²	141.4	87%	0.872	74%	0.743	S	S	*	*			trans	-71.3	99.1	167.8	-74.8	-174.6	177.9	-175.3	-1.6	106.5	T34 N38	T34-R36 VanDerWaalsContact C-N 3.29Å; T34-R36 PolarHBondContact O-N 3.44Å; R36-N38 PolarHBondContact O-N 3.48Å
37	V	21.4	Very low	26	Very low	124 Å²	124	138.9 Å²	138.9	75%	0.752	73%	0.726	S	S	*	*			trans	-60	118.2	162.2	180	0	0	0	0	106.3	I35 P39	I35-V37 PolarHBondContact O-N 3.08Å; I35-V37 VanDerWaalsContact O-N 3.1Å; V37-P39 WeakPolarHBondContact O-CD 3.28Å
38	N	21.4	Very low	26.6	Very low	104 Å²	104	139.8 Å²	139.8	56%	0.556	73%	0.725	S	S	*	*			trans	-64.2	118.9	177.5	-170	6.3	0	0	0	108.5	R36 E40	R36-N38 PolarHBondContact O-N 3.48Å; N38-E40 PolarHBondContact O-N 3.14Å; N38-E40 VanDerWaalsContact O-N 3.09Å
39	P	26.4	Very low	27	Very low	109 Å²	109	138.7 Å²	138.7	71%	0.708	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	5.1	-173.3	28.2	-33.3	0	0	0	114.6	V37 F41	V37-P39 WeakPolarHBondContact O-CD 3.28Å; P39-F41 VanDerWaalsContact C-N 3.33Å; P39-F41 PolarHBondContact O-N 2.84Å
40	E	23.2	Very low	27.6	Very low	155 Å²	155	132.8 Å²	132.8	72%	0.724	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	5.9	-177.5	-70.7	-167.9	161.1	0	0	115.7	N38	N38-E40 PolarHBondContact O-N 3.14Å; N38-E40 VanDerWaalsContact O-N 3.09Å
41	F	24	Very low	28.2	Very low	202 Å²	202	124.9 Å²	124.9	89%	0.886	65%	0.646	S	S	*	*	S	Bend	trans	-109.9	62.4	172.3	-84.3	-80.8	0	0	0	112	P39	P39-F41 VanDerWaalsContact C-N 3.33Å; P39-F41 PolarHBondContact O-N 2.84Å
42	A	26.4	Very low	29	Very low	70 Å²	70	124.3 Å²	124.3	58%	0.579	64%	0.635	S	S	*	*			trans	-160.3	53.8	166.8	0	0	0	0	0	112.7
43	H	26.1	Very low	29.7	Very low	184 Å²	184	124 Å²	124	85%	0.852	63%	0.625	S	S	*	*			trans	-137.7	99.5	170.2	-66.6	-57.6	0	0	0	110.9
44	R	31.4	Very low	30.6	Very low	177 Å²	177	119 Å²	119	67%	0.668	59%	0.591	S	S	*	*			trans	-124.6	119.6	156.9	-176.6	-178.9	172.7	-149.9	-12.9	107.6	E50	R44-E50 IonicContact CZ-OE1 3.54Å; R44-E50 IonicContact NH2-OE1 3.74Å; R44-E50 PolarHBondContact NH2-OE1 3.36Å; R44-E50 IonicContact NH2-OE2 3.14Å
45	E	30.3	Very low	31.1	Very low	187 Å²	187	121.3 Å²	121.3	87%	0.874	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-73.3	134	170.4	-70.1	176	167.6	0	0	109.7
46	L	36.3	Very low	32.1	Very low	48 Å²	48	118.3 Å²	118.3	25%	0.251	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-80.2	140	176	-72	161.9	0	0	0	110.4	L243 P244 I245	L46-L243 HydrophobicContact CD1-CB 4.38Å; L46-L243 HydrophobicContact CD1-CD1 4.37Å; L46-L243 HydrophobicContact CD1-CD2 4.22Å; L46-L243 HydrophobicContact CD2-CD2 4.45Å; L46-P244 HydrophobicContact CD2-CG 3.99Å; L46-I245 HydrophobicContact CD1-CD1 3.94Å; L46-I245 HydrophobicContact CD1-CG1 3.78Å
47	S	38.6	Very low	32.8	Very low	47 Å²	47	109.3 Å²	109.3	33%	0.329	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-83.5	151.3	179	65.6	0	0	0	0	112.7	S49 E50 L51	S47-S49 PolarHBondContact O-N 3.36Å; S47-S49 VanDerWaalsContact O-N 3.12Å; S47-S49 PolarHBondContact OG-OG 2.85Å; S47-S49 VanDerWaalsContact OG-OG 3.07Å; S47-E50 WeakPolarHBondContact CB-OE2 3.32Å; S47-E50 PolarHBondContact N-OE2 3.4Å; S47-E50 PolarHBondContact O-N 3.1Å; S47-E50 VanDerWaalsContact O-N 3.11Å; S47-E50 VanDerWaalsContact OG-CD 3.23Å; S47-E50 VanDerWaalsContact OG-CG 3.31Å; S47-E50 WeakPolarHBondContact OG-CG 3.45Å; S47-E50 PolarHBondContact OG-N 3.17Å; S47-E50 PolarHBondContact OG-OE2 3.47Å; S47-L51 PolarHBondContact O-N 3.06Å
48	Q	36.6	Very low	33.3	Very low	156 Å²	156	104.3 Å²	104.3	73%	0.729	52%	0.521	S	S	*	.	H	α-helix	trans	-58.4	-23.9	176.2	-75	-173	-8.9	0	0	114.1	R52	Q48-R52 PolarHBondContact O-N 3.25Å
49	S	38.5	Very low	33.8	Very low	72 Å²	72	102.9 Å²	102.9	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-73.4	-43.1	174.9	43.6	0	0	0	0	112.3	S47 L51 R52 D53	S47-S49 PolarHBondContact O-N 3.36Å; S47-S49 VanDerWaalsContact O-N 3.12Å; S47-S49 PolarHBondContact OG-OG 2.85Å; S47-S49 VanDerWaalsContact OG-OG 3.07Å; S49-L51 PolarHBondContact O-N 2.87Å; S49-R52 PolarHBondContact O-N 3.12Å; S49-D53 PolarHBondContact O-N 3.26Å
50	E	37.5	Very low	33.9	Very low	44 Å²	44	101.5 Å²	101.5	21%	0.206	51%	0.512	C	S	.	.	H	α-helix	trans	-60.6	-35.4	177.2	-72.6	161.6	144.2	0	0	110.4	R44 S47 V54	R44-E50 IonicContact CZ-OE1 3.54Å; R44-E50 IonicContact NH2-OE1 3.74Å; R44-E50 PolarHBondContact NH2-OE1 3.36Å; R44-E50 IonicContact NH2-OE2 3.14Å; S47-E50 WeakPolarHBondContact CB-OE2 3.32Å; S47-E50 PolarHBondContact N-OE2 3.4Å; S47-E50 PolarHBondContact O-N 3.1Å; S47-E50 VanDerWaalsContact O-N 3.11Å; S47-E50 VanDerWaalsContact OG-CD 3.23Å; S47-E50 VanDerWaalsContact OG-CG 3.31Å; S47-E50 WeakPolarHBondContact OG-CG 3.45Å; S47-E50 PolarHBondContact OG-N 3.17Å; S47-E50 PolarHBondContact OG-OE2 3.47Å; E50-V54 WeakPolarHBondContact O-CG2 3.48Å; E50-V54 PolarHBondContact O-N 3.36Å
51	L	38.8	Very low	34.1	Very low	30 Å²	30	98.8 Å²	98.8	16%	0.157	51%	0.51	C	S	.	.	H	α-helix	trans	-72.5	-26.9	175.3	-71.9	153.2	0	0	0	114.5	S47 S49 R55 Q146 L243	S47-L51 PolarHBondContact O-N 3.06Å; S49-L51 PolarHBondContact O-N 2.87Å; L51-R55 PolarHBondContact O-N 3.16Å; L51-Q146 HydrophobicContact CD1-CG 4.29Å; L51-L243 HydrophobicContact CD2-CD1 4.21Å; L51-L243 HydrophobicContact CD2-CD2 3.9Å; L51-L243 HydrophobicContact CG-CD2 4.23Å
52	R	40.6	Very low	34.1	Very low	180 Å²	180	92.9 Å²	92.9	68%	0.679	49%	0.493	S	S	*	.	H	α-helix	trans	-74.7	-40.6	175.7	-80.1	-177.5	-176.9	-177.3	2.4	111.8	Q48 S49 V54 R55 T56	Q48-R52 PolarHBondContact O-N 3.25Å; S49-R52 PolarHBondContact O-N 3.12Å; R52-V54 PolarHBondContact O-N 2.89Å; R52-R55 WeakPolarHBondContact O-CB 3.12Å; R52-R55 PolarHBondContact O-N 3.15Å; R52-R55 VanDerWaalsContact O-N 3.1Å; R52-T56 PolarHBondContact O-N 2.86Å; R52-T56 VanDerWaalsContact O-N 3.12Å; R52-T56 PolarHBondContact O-OG1 2.92Å
53	D	38.9	Very low	34	Very low	112 Å²	112	98.2 Å²	98.2	60%	0.599	51%	0.506	S	S	*	.	H	α-helix	trans	-61.6	-36	179.4	-67.6	-21.2	0	0	0	111.1	S49 T56 A57	S49-D53 PolarHBondContact O-N 3.26Å; D53-T56 WeakPolarHBondContact CA-OG1 3.45Å; D53-T56 PolarHBondContact O-N 3.27Å; D53-T56 PolarHBondContact O-OG1 3.45Å; D53-A57 PolarHBondContact O-N 3.43Å
54	V	40.4	Very low	33.8	Very low	5 Å²	5	92.7 Å²	92.7	3%	0.03	50%	0.499	C	S	.	.	H	α-helix	trans	-59.5	-50.8	170.4	168.4	0	0	0	0	113	E50 R52 T56 A57 V58 W138 L242 L243	E50-V54 WeakPolarHBondContact O-CG2 3.48Å; E50-V54 PolarHBondContact O-N 3.36Å; R52-V54 PolarHBondContact O-N 2.89Å; V54-T56 PolarHBondContact O-N 3.48Å; V54-A57 PolarHBondContact O-N 3.33Å; V54-A57 VanDerWaalsContact O-N 3.12Å; V54-V58 WeakPolarHBondContact O-CG2 3.28Å; V54-V58 PolarHBondContact O-N 2.88Å; V54-V58 VanDerWaalsContact O-N 3.12Å; V54-W138 HydrophobicContact CG1-CH2 3.56Å; V54-W138 HydrophobicContact CG1-CZ2 4.23Å; V54-W138 HydrophobicContact CG1-CZ3 3.77Å; V54-L242 HydrophobicContact CB-CB 4.22Å; V54-L242 HydrophobicContact CB-CD2 4.37Å; V54-L242 HydrophobicContact CG1-CB 3.71Å; V54-L242 HydrophobicContact CG1-CD1 3.99Å; V54-L242 HydrophobicContact CG1-CD2 4.01Å; V54-L242 HydrophobicContact CG1-CG 4.09Å; V54-L242 HydrophobicContact CG2-CB 3.63Å; V54-L242 HydrophobicContact CG2-CD2 4.37Å; V54-L242 WeakPolarHBondContact CG2-O 3.38Å; V54-L243 HydrophobicContact CG2-CD2 3.7Å; V54-L243 HydrophobicContact CG2-CG 3.91Å
55	R	35.2	Very low	33.4	Very low	155 Å²	155	88.8 Å²	88.8	59%	0.585	51%	0.505	S	S	*	.	H	α-helix	trans	-58	-39.7	-179.1	-168.9	174.8	-178.8	157.7	1.7	110.8	L51 R52 S59	L51-R55 PolarHBondContact O-N 3.16Å; R52-R55 WeakPolarHBondContact O-CB 3.12Å; R52-R55 PolarHBondContact O-N 3.15Å; R52-R55 VanDerWaalsContact O-N 3.1Å; R55-S59 PolarHBondContact O-N 3.38Å; R55-S59 PolarHBondContact O-OG 2.89Å; R55-S59 VanDerWaalsContact O-OG 3.05Å
56	T	41.4	Very low	33.1	Very low	93 Å²	93	86.3 Å²	86.3	57%	0.571	50%	0.502	S	S	*	.	H	α-helix	trans	-70.9	-37	175.3	30.5	0	0	0	0	114.2	R52 D53 V54 S59 S60	R52-T56 PolarHBondContact O-N 2.86Å; R52-T56 VanDerWaalsContact O-N 3.12Å; R52-T56 PolarHBondContact O-OG1 2.92Å; D53-T56 WeakPolarHBondContact CA-OG1 3.45Å; D53-T56 PolarHBondContact O-N 3.27Å; D53-T56 PolarHBondContact O-OG1 3.45Å; V54-T56 PolarHBondContact O-N 3.48Å; T56-S59 PolarHBondContact O-N 3.19Å; T56-S60 PolarHBondContact O-N 3.46Å
57	A	35.4	Very low	32.4	Very low	42 Å²	42	92 Å²	92	35%	0.347	53%	0.527	S	S	.	.	H	α-helix	trans	-65.8	-38.9	179.3	0	0	0	0	0	112.1	D53 V54 S60 L242	D53-A57 PolarHBondContact O-N 3.43Å; V54-A57 PolarHBondContact O-N 3.33Å; V54-A57 VanDerWaalsContact O-N 3.12Å; A57-S60 PolarHBondContact O-N 3.36Å; A57-S60 PolarHBondContact O-OG 2.98Å; A57-L242 HydrophobicContact CB-CD2 3.83Å
58	V	30.9	Very low	31.6	Very low	18 Å²	18	97.2 Å²	97.2	11%	0.109	55%	0.547	C	S	.	.	H	α-helix	trans	-67.8	-45.7	177.1	178.1	0	0	0	0	111.2	V54 S60 S61 E134 W138 L242	V54-V58 WeakPolarHBondContact O-CG2 3.28Å; V54-V58 PolarHBondContact O-N 2.88Å; V54-V58 VanDerWaalsContact O-N 3.12Å; V58-S60 PolarHBondContact O-N 2.98Å; V58-S61 PolarHBondContact O-N 3.37Å; V58-E134 WeakPolarHBondContact CG1-OE1 3.29Å; V58-W138 HydrophobicContact CG2-CH2 4.33Å; V58-W138 HydrophobicContact CG2-CZ2 3.4Å; V58-W138 VanDerWaalsContact CG2-CZ2 3.4Å; V58-L242 HydrophobicContact CG2-CD1 3.62Å; V58-L242 HydrophobicContact CG2-CD2 4.02Å
59	S	32.3	Very low	31	Very low	75 Å²	75	96.1 Å²	96.1	52%	0.524	55%	0.545	S	S	.	.	H	α-helix	trans	-60.5	-28.2	176.7	-57.5	0	0	0	0	113.1	R55 T56	R55-S59 PolarHBondContact O-N 3.38Å; R55-S59 PolarHBondContact O-OG 2.89Å; R55-S59 VanDerWaalsContact O-OG 3.05Å; T56-S59 PolarHBondContact O-N 3.19Å
60	S	29.8	Very low	30.3	Very low	80 Å²	80	98.9 Å²	98.9	56%	0.559	56%	0.559	S	S	*	*	H	α-helix	trans	-75.6	-18.3	179.5	73.4	0	0	0	0	115	T56 A57 V58 C62	T56-S60 PolarHBondContact O-N 3.46Å; A57-S60 PolarHBondContact O-N 3.36Å; A57-S60 PolarHBondContact O-OG 2.98Å; V58-S60 PolarHBondContact O-N 2.98Å; S60-C62 VanDerWaalsContact C-N 3.29Å; S60-C62 PolarHBondContact O-N 3.01Å
61	S	26	Very low	29.6	Very low	97 Å²	97	99.9 Å²	99.9	68%	0.678	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-5.6	175.9	-74.3	0	0	0	0	113.8	V58	V58-S61 PolarHBondContact O-N 3.37Å
62	C	25.1	Very low	28.9	Very low	78 Å²	78	103.7 Å²	103.7	53%	0.527	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.6	1.6	-178	-66.2	0	0	0	0	114.3	S60 G64	S60-C62 VanDerWaalsContact C-N 3.29Å; S60-C62 PolarHBondContact O-N 3.01Å; C62-G64 VanDerWaalsContact C-N 3.34Å; C62-G64 PolarHBondContact O-N 3.2Å
63	E	23.9	Very low	28.1	Very low	183 Å²	183	101.3 Å²	101.3	86%	0.855	62%	0.616	S	S	*	*			trans	-86.8	74.6	178.3	-70.6	-169.2	169.8	0	0	111.4
64	G	22.9	Very low	27.4	Very low	68 Å²	68	102 Å²	102	70%	0.701	63%	0.628	S	S	*	*			trans	-171.2	61.8	178.1	0	0	0	0	0	114	C62	C62-G64 VanDerWaalsContact C-N 3.34Å; C62-G64 PolarHBondContact O-N 3.2Å
65	A	22.9	Very low	26.7	Very low	95 Å²	95	107.8 Å²	107.8	79%	0.785	66%	0.663	S	S	*	*				172.8	145.8	129.1	0	0	0	0	0	113.3
66	V	22.6	Very low	26.3	Very low	134 Å²	134	105 Å²	105	81%	0.812	67%	0.673	S	S	*	*			trans	92.1	85.2	153.4	-158.5	0	0	0	0	117.7
67	E	21.4	Very low	25.8	Very low	168 Å²	168	106.4 Å²	106.4	79%	0.785	68%	0.682	S	S	*	*			trans	-49.3	147.4	140.3	-71.2	176.2	147.9	0	0	113.5
68	E	22.4	Very low	25.8	Very low	157 Å²	157	114.8 Å²	114.8	73%	0.734	71%	0.71	S	S	*	*			trans	74.1	123.4	145.3	-79	-169.1	178.2	0	0	121.1
69	N	23.5	Very low	26	Very low	132 Å²	132	120.4 Å²	120.4	71%	0.706	74%	0.735	S	S	*	*				108.3	128.3	121.6	-92	-30.8	0	0	0	120.9
70	V	23.7	Very low	26.7	Very low	130 Å²	130	119.8 Å²	119.8	79%	0.788	73%	0.731	S	S	*	*			trans	86.4	106	143.1	-176.9	0	0	0	0	118.9
71	G	23.3	Very low	28.2	Very low	66 Å²	66	120.6 Å²	120.6	68%	0.68	74%	0.737	S	S	*	*				80.5	109.8	97.4	0	0	0	0	0	120.4
72	S	24	Very low	30.3	Very low	110 Å²	110	117.4 Å²	117.4	77%	0.769	71%	0.712	S	S	*	*				59.5	108.4	127.9	-174.9	0	0	0	0	121.9
73	V	23.9	Very low	33	Very low	130 Å²	130	116.8 Å²	116.8	79%	0.788	70%	0.703	S	S	*	*				47.4	111.8	126	-170.1	0	0	0	0	118.9
74	C	24.6	Very low	35.9	Very low	126 Å²	126	108.1 Å²	108.1	85%	0.851	66%	0.663	S	S	*	*			trans	-158.9	129.4	133.6	-99.2	0	0	0	0	113.7
75	T	24.7	Very low	38.7	Very low	126 Å²	126	111 Å²	111	77%	0.773	66%	0.656	S	S	*	*			trans	-13.7	126.7	163.7	47	0	0	0	0	122.8
76	A	27.6	Very low	41.6	Very low	96 Å²	96	107.8 Å²	107.8	79%	0.793	63%	0.627	S	S	*	*				45.4	97	118.4	0	0	0	0	0	120.8
77	V	30.3	Very low	44.6	Very low	123 Å²	123	101.4 Å²	101.4	75%	0.745	59%	0.588	S	S	*	*			trans	-136	136.1	140.2	174.8	0	0	0	0	107.5	E79	V77-E79 HydrophobicContact CG1-CG 4.35Å; V77-E79 PolarHBondContact O-N 3.22Å
78	K	36.4	Very low	47.6	Very low	218 Å²	218	94.6 Å²	94.6	95%	0.948	56%	0.555	S	S	*	*			trans	-69.5	78.4	173.1	-77.3	177.7	171.6	179.1	0	110.1
79	E	34.7	Very low	50.5	Low	137 Å²	137	90 Å²	90	64%	0.64	54%	0.54	S	S	*	.	S	Bend	trans	-101.8	150.6	155.9	-74.4	170.8	173.9	0	0	106.5	V77 S81	V77-E79 HydrophobicContact CG1-CG 4.35Å; V77-E79 PolarHBondContact O-N 3.22Å; E79-S81 PolarHBondContact O-N 3.34Å
80	S	47.3	Very low	53.5	Low	62 Å²	62	83.8 Å²	83.8	43%	0.434	51%	0.507	S	S	.	.			trans	-61.5	89.5	176.8	55.9	0	0	0	0	108.6	D212 V215	S80-D212 VanDerWaalsContact OG-CB 3.23Å; S80-D212 WeakPolarHBondContact OG-CB 3.47Å; S80-V215 VanDerWaalsContact O-CG2 3.24Å; S80-V215 WeakPolarHBondContact O-CG2 3.33Å
81	S	61.1	Low	56.4	Low	97 Å²	97	77.6 Å²	77.6	68%	0.678	47%	0.469	S	S	*	.			trans	-70.8	130.9	-178.3	52.4	0	0	0	0	108.2	E79 D83	E79-S81 PolarHBondContact O-N 3.34Å; S81-D83 PolarHBondContact O-N 3.28Å
82	L	70.8	Confident	59.4	Low	30 Å²	30	76.3 Å²	76.3	16%	0.157	45%	0.446	C	S	.	.			trans	-45.8	123.8	164	-179.7	74.3	0	0	0	108.8	V86 L87 C124 F126 V215 I219	L82-V86 HydrophobicContact CD1-CG1 4.02Å; L82-L87 HydrophobicContact CD1-CD2 3.94Å; L82-L87 HydrophobicContact CD1-CG 4.15Å; L82-L87 HydrophobicContact CD2-CD1 4.48Å; L82-L87 HydrophobicContact CD2-CD2 4.36Å; L82-L87 HydrophobicContact CG-CD2 4.46Å; L82-L87 HydrophobicContact CG-CG 4.39Å; L82-C124 HydrophobicContact CD2-CB 4.37Å; L82-F126 HydrophobicContact CD2-CE1 4.16Å; L82-F126 HydrophobicContact CD2-CE2 4.01Å; L82-F126 HydrophobicContact CD2-CZ 3.46Å; L82-F126 VanDerWaalsContact CD2-CZ 3.46Å; L82-V215 HydrophobicContact CB-CG1 4.11Å; L82-V215 HydrophobicContact CB-CG2 4.45Å; L82-V215 HydrophobicContact CD1-CG1 3.77Å; L82-I219 HydrophobicContact CD1-CD1 4.22Å; L82-I219 HydrophobicContact CD1-CG1 4.11Å
83	D	81.9	Confident	62.2	Low	64 Å²	64	73.6 Å²	73.6	34%	0.342	42%	0.421	S	S	.	.			trans	-120.1	168.1	175.8	72.5	16.5	0	0	0	111.1	S81 F85 V86 L87	S81-D83 PolarHBondContact O-N 3.28Å; D83-F85 PolarHBondContact O-N 3.49Å; D83-F85 WeakPolarHBondContact OD1-CB 3.39Å; D83-F85 PolarHBondContact OD1-N 3.13Å; D83-F85 VanDerWaalsContact OD1-N 3.13Å; D83-V86 PolarHBondContact O-N 3.03Å; D83-V86 VanDerWaalsContact OD1-CG2 3.31Å; D83-V86 WeakPolarHBondContact OD1-CG2 3.48Å; D83-V86 PolarHBondContact OD1-N 3.35Å; D83-L87 PolarHBondContact O-N 3.44Å
84	T	83.3	Confident	65.1	Low	1 Å²	1	67.4 Å²	67.4	1%	0.006	38%	0.383	C	S	.	.	H	α-helix	trans	-65.6	-25.9	-178.6	51.9	0	0	0	0	112.7	L87 R88 M119 H122 D123 W129	T84-L87 PolarHBondContact O-N 3.31Å; T84-R88 WeakPolarHBondContact O-CB 3.38Å; T84-R88 PolarHBondContact O-N 3.39Å; T84-M119 VanDerWaalsContact CB-SD 3.56Å; T84-M119 VanDerWaalsContact O-SD 3.39Å; T84-H122 VanDerWaalsContact CG2-C 3.49Å; T84-D123 WeakPolarHBondContact CG2-O 3.43Å; T84-W129 HydrophobicContact CG2-CZ2 3.92Å
85	F	83.3	Confident	68	Low	130 Å²	130	61.4 Å²	61.4	57%	0.57	34%	0.343	S	S	*	.	H	α-helix	trans	-68.5	-41.8	175.5	-71.1	-81.5	0	0	0	111.8	D83 S89 M119	D83-F85 PolarHBondContact O-N 3.49Å; D83-F85 WeakPolarHBondContact OD1-CB 3.39Å; D83-F85 PolarHBondContact OD1-N 3.13Å; D83-F85 VanDerWaalsContact OD1-N 3.13Å; F85-S89 VanDerWaalsContact O-CB 3.25Å; F85-S89 WeakPolarHBondContact O-CB 3.22Å; F85-S89 PolarHBondContact O-N 3.37Å; F85-M119 HydrophobicContact CD1-CE 3.51Å; F85-M119 HydrophobicContact CD2-CE 4.04Å; F85-M119 HydrophobicContact CE1-CE 3.55Å; F85-M119 HydrophobicContact CE2-CE 4.08Å; F85-M119 HydrophobicContact CG-CE 3.76Å; F85-M119 HydrophobicContact CZ-CE 3.84Å
86	V	82.9	Confident	70.5	Confident	26 Å²	26	58.2 Å²	58.2	16%	0.158	32%	0.319	C	S	.	.	H	α-helix	trans	-62.1	-43.6	174.4	169.4	0	0	0	0	110.7	L82 D83 Y90 V208 L211 I219	L82-V86 HydrophobicContact CD1-CG1 4.02Å; D83-V86 PolarHBondContact O-N 3.03Å; D83-V86 VanDerWaalsContact OD1-CG2 3.31Å; D83-V86 WeakPolarHBondContact OD1-CG2 3.48Å; D83-V86 PolarHBondContact OD1-N 3.35Å; V86-Y90 VanDerWaalsContact O-CB 3.26Å; V86-Y90 WeakPolarHBondContact O-CB 3.46Å; V86-Y90 PolarHBondContact O-N 2.97Å; V86-V208 HydrophobicContact CG1-CG1 3.77Å; V86-L211 HydrophobicContact CG2-CD2 4.49Å; V86-I219 HydrophobicContact CG1-CD1 3.62Å
87	L	84.6	Confident	72.9	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-65.5	-46.4	177.7	-68.8	176.4	0	0	0	112.6	L82 D83 T84 Y90 L91 C124 F126 W129	L82-L87 HydrophobicContact CD1-CD2 3.94Å; L82-L87 HydrophobicContact CD1-CG 4.15Å; L82-L87 HydrophobicContact CD2-CD1 4.48Å; L82-L87 HydrophobicContact CD2-CD2 4.36Å; L82-L87 HydrophobicContact CG-CD2 4.46Å; L82-L87 HydrophobicContact CG-CG 4.39Å; D83-L87 PolarHBondContact O-N 3.44Å; T84-L87 PolarHBondContact O-N 3.31Å; L87-Y90 PolarHBondContact O-N 3.29Å; L87-L91 WeakPolarHBondContact O-CB 3.28Å; L87-L91 WeakPolarHBondContact O-CG 3.45Å; L87-L91 PolarHBondContact O-N 3.1Å; L87-C124 HydrophobicContact CD1-CB 3.93Å; L87-F126 HydrophobicContact CD2-CD1 4.06Å; L87-F126 HydrophobicContact CD2-CE1 3.46Å; L87-F126 VanDerWaalsContact CD2-CE1 3.46Å; L87-F126 HydrophobicContact CD2-CZ 4.32Å; L87-W129 HydrophobicContact CB-CD2 4.1Å; L87-W129 HydrophobicContact CB-CE3 4.31Å; L87-W129 HydrophobicContact CB-CH2 4.21Å; L87-W129 HydrophobicContact CB-CZ2 4.07Å; L87-W129 HydrophobicContact CB-CZ3 4.34Å; L87-W129 HydrophobicContact CD1-CD2 4.24Å; L87-W129 HydrophobicContact CD1-CG 4.18Å; L87-W129 HydrophobicContact CD1-CZ2 4.38Å
88	R	84.9	Confident	75.1	Confident	25 Å²	25	51 Å²	51	9%	0.094	27%	0.268	C	S	.	.	H	α-helix	trans	-59.3	-49.8	174.9	-178.3	176.9	179.6	156.2	-5.2	111.2	T84 Y90 L91 E92 I99 H100 D116 M119 W129	T84-R88 WeakPolarHBondContact O-CB 3.38Å; T84-R88 PolarHBondContact O-N 3.39Å; R88-Y90 VanDerWaalsContact C-N 3.3Å; R88-Y90 PolarHBondContact O-N 2.84Å; R88-L91 WeakPolarHBondContact O-CB 3.16Å; R88-L91 PolarHBondContact O-N 3Å; R88-L91 VanDerWaalsContact O-N 3.15Å; R88-E92 HydrophobicContact CG-CG 4.41Å; R88-E92 IonicContact NE-OE1 2.94Å; R88-E92 VanDerWaalsContact O-CG 3.29Å; R88-E92 WeakPolarHBondContact O-CG 3.33Å; R88-E92 PolarHBondContact O-N 3.14Å; R88-I99 HydrophobicContact CG-CD1 4.46Å; R88-I99 PolarHBondContact NE-O 3.23Å; R88-I99 PolarHBondContact NH2-O 3.02Å; R88-H100 PolarHBondContact NH2-CE1 3.23Å; R88-H100 PolarHBondContact NH2-ND1 3.18Å; R88-D116 IonicContact CZ-OD1 3.69Å; R88-D116 IonicContact NH1-OD1 3.45Å; R88-D116 PolarHBondContact NH1-OD1 3.42Å; R88-D116 IonicContact NH2-OD1 3.13Å; R88-M119 HydrophobicContact CB-SD 4.03Å; R88-W129 HydrophobicContact CB-CH2 3.99Å; R88-W129 HydrophobicContact CB-CZ3 4.07Å
89	S	83.6	Confident	76.8	Confident	60 Å²	60	40.7 Å²	40.7	42%	0.42	22%	0.223	S	C	.	.	H	α-helix	trans	-61.4	-39.2	179.7	-179.6	0	0	0	0	112.1	F85 H93	F85-S89 VanDerWaalsContact O-CB 3.25Å; F85-S89 WeakPolarHBondContact O-CB 3.22Å; F85-S89 PolarHBondContact O-N 3.37Å; S89-H93 WeakPolarHBondContact O-CB 3.35Å; S89-H93 PolarHBondContact O-N 3.27Å
90	Y	85.7	Confident	78.5	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-65.7	-42.8	174.3	-178.9	-102.5	0	0	0	112.1	V86 L87 R88 H93 V94 A202 I219 F222 G223 M226	V86-Y90 VanDerWaalsContact O-CB 3.26Å; V86-Y90 WeakPolarHBondContact O-CB 3.46Å; V86-Y90 PolarHBondContact O-N 2.97Å; L87-Y90 PolarHBondContact O-N 3.29Å; R88-Y90 VanDerWaalsContact C-N 3.3Å; R88-Y90 PolarHBondContact O-N 2.84Å; Y90-H93 WeakPolarHBondContact O-CB 3.37Å; Y90-H93 PolarHBondContact O-N 3.45Å; Y90-V94 HydrophobicContact CD1-CG2 4.22Å; Y90-V94 HydrophobicContact CD2-CG2 4.46Å; Y90-V94 HydrophobicContact CE1-CG2 3.74Å; Y90-V94 HydrophobicContact CE2-CG2 4.01Å; Y90-V94 WeakPolarHBondContact O-CG2 3.37Å; Y90-V94 PolarHBondContact O-N 3.41Å; Y90-A202 PolarHBondContact OH-O 3.07Å; Y90-I219 HydrophobicContact CD1-CG2 4.12Å; Y90-I219 HydrophobicContact CD2-CG2 3.58Å; Y90-I219 HydrophobicContact CE1-CG2 4.04Å; Y90-I219 HydrophobicContact CE2-CG2 3.49Å; Y90-I219 VanDerWaalsContact CE2-CG2 3.49Å; Y90-I219 HydrophobicContact CG-CG2 3.9Å; Y90-F222 AromaticContact CD1-CD1 3.76Å; Y90-F222 HydrophobicContact CD1-CD1 3.76Å; Y90-F222 AromaticContact CD1-CE1 4Å; Y90-F222 HydrophobicContact CD1-CE1 4Å; Y90-F222 AromaticContact CE1-CD1 3.72Å; Y90-F222 HydrophobicContact CE1-CD1 3.72Å; Y90-F222 HydrophobicContact CE1-CE1 4.22Å; Y90-G223 WeakPolarHBondContact OH-CA 3.41Å; Y90-M226 HydrophobicContact CE1-SD 4.17Å
91	L	85.8	Confident	78.9	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-45.6	175.5	-82.6	-177.4	0	0	0	113	L87 R88 H93 V94 M95 I99 F115 W129 F222 M226	L87-L91 WeakPolarHBondContact O-CB 3.28Å; L87-L91 WeakPolarHBondContact O-CG 3.45Å; L87-L91 PolarHBondContact O-N 3.1Å; R88-L91 WeakPolarHBondContact O-CB 3.16Å; R88-L91 PolarHBondContact O-N 3Å; R88-L91 VanDerWaalsContact O-N 3.15Å; L91-H93 VanDerWaalsContact C-N 3.25Å; L91-H93 PolarHBondContact O-N 2.97Å; L91-V94 PolarHBondContact O-N 2.89Å; L91-M95 HydrophobicContact CB-CE 3.92Å; L91-M95 HydrophobicContact CD2-CE 4.24Å; L91-M95 WeakPolarHBondContact O-CB 3.46Å; L91-M95 PolarHBondContact O-N 3.07Å; L91-I99 HydrophobicContact CB-CD1 4.25Å; L91-F115 HydrophobicContact CD1-CE1 3.75Å; L91-F115 HydrophobicContact CD1-CZ 4.33Å; L91-W129 HydrophobicContact CD1-CD2 4.37Å; L91-W129 HydrophobicContact CD1-CE3 3.33Å; L91-W129 HydrophobicContact CD1-CZ3 3.86Å; L91-F222 HydrophobicContact CD2-CE1 3.74Å; L91-F222 HydrophobicContact CD2-CZ 3.86Å; L91-F222 HydrophobicContact CG-CE1 4.06Å; L91-F222 HydrophobicContact CG-CZ 4.31Å; L91-M226 HydrophobicContact CD2-CE 3.28Å; L91-M226 HydrophobicContact CD2-SD 3.41Å; L91-M226 WeakPolarHBondContact CD2-SD 3.27Å
92	E	85.3	Confident	78.5	Confident	40 Å²	40	39.7 Å²	39.7	19%	0.187	21%	0.211	C	C	.	.	H	α-helix	trans	-59.7	-39.2	175.2	-69.6	179.7	159.2	0	0	111.3	R88 H96 V97 I99	R88-E92 HydrophobicContact CG-CG 4.41Å; R88-E92 IonicContact NE-OE1 2.94Å; R88-E92 VanDerWaalsContact O-CG 3.29Å; R88-E92 WeakPolarHBondContact O-CG 3.33Å; R88-E92 PolarHBondContact O-N 3.14Å; E92-H96 VanDerWaalsContact O-CA 3.23Å; E92-H96 WeakPolarHBondContact O-CA 3.38Å; E92-H96 PolarHBondContact O-N 2.67Å; E92-V97 WeakPolarHBondContact CA-O 3.49Å; E92-V97 WeakPolarHBondContact CB-O 3.33Å; E92-V97 VanDerWaalsContact CG-O 3.31Å; E92-V97 WeakPolarHBondContact CG-O 3.28Å; E92-V97 PolarHBondContact O-N 3.24Å; E92-I99 HydrophobicContact CG-CB 4.15Å; E92-I99 HydrophobicContact CG-CD1 3.79Å; E92-I99 HydrophobicContact CG-CG1 3.77Å; E92-I99 WeakPolarHBondContact OE1-CB 3.38Å; E92-I99 PolarHBondContact OE1-N 2.91Å
93	H	84.3	Confident	77.6	Confident	52 Å²	52	48.2 Å²	48.2	24%	0.241	25%	0.25	C	C	.	.	H	α-helix	trans	-61.1	-54.5	172.8	171.5	71	0	0	0	111.4	S89 Y90 L91 H96 R201 T204	S89-H93 WeakPolarHBondContact O-CB 3.35Å; S89-H93 PolarHBondContact O-N 3.27Å; Y90-H93 WeakPolarHBondContact O-CB 3.37Å; Y90-H93 PolarHBondContact O-N 3.45Å; L91-H93 VanDerWaalsContact C-N 3.25Å; L91-H93 PolarHBondContact O-N 2.97Å; H93-H96 PolarHBondContact O-N 3.29Å; H93-R201 WeakPolarHBondContact O-CD 3.35Å; H93-R201 PolarHBondContact O-NH1 2.62Å; H93-T204 PolarHBondContact NE2-OG1 2.72Å
94	V	84.8	Confident	76.1	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.8	-48.3	-176.3	174.7	0	0	0	0	112.2	Y90 L91 H96 C198 A202 M226	Y90-V94 HydrophobicContact CD1-CG2 4.22Å; Y90-V94 HydrophobicContact CD2-CG2 4.46Å; Y90-V94 HydrophobicContact CE1-CG2 3.74Å; Y90-V94 HydrophobicContact CE2-CG2 4.01Å; Y90-V94 WeakPolarHBondContact O-CG2 3.37Å; Y90-V94 PolarHBondContact O-N 3.41Å; L91-V94 PolarHBondContact O-N 2.89Å; V94-H96 VanDerWaalsContact C-N 3.32Å; V94-C198 WeakPolarHBondContact O-CA 3.48Å; V94-C198 PolarHBondContact O-SG 3.47Å; V94-C198 VanDerWaalsContact O-SG 3.37Å; V94-A202 HydrophobicContact CG1-CB 3.88Å; V94-A202 HydrophobicContact CG2-CB 4.39Å; V94-M226 HydrophobicContact CB-CE 3.97Å; V94-M226 HydrophobicContact CB-SD 4.44Å; V94-M226 HydrophobicContact CG1-CE 3.53Å; V94-M226 HydrophobicContact CG1-SD 4.2Å; V94-M226 HydrophobicContact CG2-SD 4.49Å
95	M	84	Confident	74.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-83.8	-9.1	-176.5	-60.9	-176.5	-60	0	0	113.1	L91 V97 I99 V136 I137 Y194 M226	L91-M95 HydrophobicContact CB-CE 3.92Å; L91-M95 HydrophobicContact CD2-CE 4.24Å; L91-M95 WeakPolarHBondContact O-CB 3.46Å; L91-M95 PolarHBondContact O-N 3.07Å; M95-V97 PolarHBondContact O-N 2.93Å; M95-I99 HydrophobicContact CE-CD1 4.07Å; M95-V136 HydrophobicContact CE-CB 4.14Å; M95-V136 HydrophobicContact CE-CG1 3.8Å; M95-V136 HydrophobicContact CE-CG2 4.21Å; M95-V136 HydrophobicContact SD-CB 3.68Å; M95-V136 HydrophobicContact SD-CG1 3.43Å; M95-V136 WeakPolarHBondContact SD-CG1 3.43Å; M95-V136 HydrophobicContact SD-CG2 4.36Å; M95-I137 HydrophobicContact CG-CG1 4.31Å; M95-I137 HydrophobicContact SD-CG1 4.09Å; M95-Y194 WeakPolarHBondContact O-CE2 3.31Å; M95-Y194 PolarHBondContact O-OH 3.18Å; M95-M226 HydrophobicContact CG-CE 4.13Å; M95-M226 HydrophobicContact SD-CE 4.47Å
96	H	78.5	Confident	74.1	Confident	59 Å²	59	50.5 Å²	50.5	27%	0.273	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	29	-174.7	-153.4	0.8	0	0	0	115.2	E92 H93 V94 L156 G158 R201	E92-H96 VanDerWaalsContact O-CA 3.23Å; E92-H96 WeakPolarHBondContact O-CA 3.38Å; E92-H96 PolarHBondContact O-N 2.67Å; H93-H96 PolarHBondContact O-N 3.29Å; V94-H96 VanDerWaalsContact C-N 3.32Å; H96-L156 PolarHBondContact CD2-O 3.45Å; H96-G158 WeakPolarHBondContact NE2-CA 3.35Å; H96-G158 PolarHBondContact NE2-N 3.17Å; H96-R201 PolarHBondContact CD2-NH1 3.15Å; H96-R201 PolarHBondContact CD2-NH2 2.64Å; H96-R201 PolarHBondContact ND1-NH1 3.33Å; H96-R201 PolarHBondContact NE2-NH2 3.1Å
97	V	78.7	Confident	73.7	Confident	8 Å²	8	49.7 Å²	49.7	5%	0.048	26%	0.261	C	S	.	.			trans	-122.3	136	178.7	177.5	0	0	0	0	109.3	E92 M95 I99 L107 I140 L156	E92-V97 WeakPolarHBondContact CA-O 3.49Å; E92-V97 WeakPolarHBondContact CB-O 3.33Å; E92-V97 VanDerWaalsContact CG-O 3.31Å; E92-V97 WeakPolarHBondContact CG-O 3.28Å; E92-V97 PolarHBondContact O-N 3.24Å; M95-V97 PolarHBondContact O-N 2.93Å; V97-I99 PolarHBondContact O-N 3.28Å; V97-L107 HydrophobicContact CG1-CD1 3.84Å; V97-L107 HydrophobicContact CG1-CD2 4.2Å; V97-L107 HydrophobicContact CG1-CG 3.83Å; V97-I140 HydrophobicContact CG2-CD1 3.46Å; V97-I140 VanDerWaalsContact CG2-CD1 3.46Å; V97-I140 HydrophobicContact CG2-CG1 4.44Å; V97-L156 HydrophobicContact CG2-CD2 3.39Å
98	S	75.8	Confident	73.4	Confident	61 Å²	61	51.4 Å²	51.4	43%	0.427	27%	0.273	S	S	.	.			trans	-76.9	119.7	169.5	-174.5	0	0	0	0	109.1	H100	S98-H100 PolarHBondContact O-N 3.43Å; S98-H100 VanDerWaalsContact O-N 3.13Å; S98-H100 PolarHBondContact OG-CD2 2.98Å
99	I	72.4	Confident	73.1	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.294	C	S	.	.			trans	-88.8	64.2	176.4	-55.5	166.1	0	0	0	105.9	R88 L91 E92 M95 V97 L107 F115	R88-I99 HydrophobicContact CG-CD1 4.46Å; R88-I99 PolarHBondContact NE-O 3.23Å; R88-I99 PolarHBondContact NH2-O 3.02Å; L91-I99 HydrophobicContact CB-CD1 4.25Å; E92-I99 HydrophobicContact CG-CB 4.15Å; E92-I99 HydrophobicContact CG-CD1 3.79Å; E92-I99 HydrophobicContact CG-CG1 3.77Å; E92-I99 WeakPolarHBondContact OE1-CB 3.38Å; E92-I99 PolarHBondContact OE1-N 2.91Å; M95-I99 HydrophobicContact CE-CD1 4.07Å; V97-I99 PolarHBondContact O-N 3.28Å; I99-L107 HydrophobicContact CG1-CD1 4.24Å; I99-F115 HydrophobicContact CD1-CD1 4.2Å; I99-F115 HydrophobicContact CD1-CD2 4.49Å; I99-F115 HydrophobicContact CD1-CE1 3.91Å; I99-F115 HydrophobicContact CD1-CE2 4.22Å; I99-F115 HydrophobicContact CD1-CG 4.48Å; I99-F115 HydrophobicContact CD1-CZ 3.92Å; I99-F115 HydrophobicContact CG2-CB 3.69Å; I99-F115 HydrophobicContact CG2-CD1 4.22Å; I99-F115 HydrophobicContact CG2-CD2 3.53Å; I99-F115 HydrophobicContact CG2-CE2 4.19Å; I99-F115 HydrophobicContact CG2-CG 3.55Å
100	H	69.8	Low	73	Confident	93 Å²	93	55 Å²	55	43%	0.431	30%	0.3	S	S	.	.	S	Bend	trans	-129.1	146	175.5	-74.2	-57.9	0	0	0	110.1	R88 S98 S102	R88-H100 PolarHBondContact NH2-CE1 3.23Å; R88-H100 PolarHBondContact NH2-ND1 3.18Å; S98-H100 PolarHBondContact O-N 3.43Å; S98-H100 VanDerWaalsContact O-N 3.13Å; S98-H100 PolarHBondContact OG-CD2 2.98Å; H100-S102 PolarHBondContact O-N 3.17Å; H100-S102 PolarHBondContact O-OG 3.01Å
101	D	55.4	Low	72.8	Confident	129 Å²	129	55.5 Å²	55.5	69%	0.69	30%	0.302	S	S	*	.			trans	-70	76.5	172.6	-152.8	19.9	0	0	0	109.3	V112	D101-V112 HydrophobicContact CB-CG1 4.23Å
102	S	53.6	Low	72.7	Confident	54 Å²	54	55.5 Å²	55.5	38%	0.378	30%	0.303	S	S	.	.			trans	-120	146	175.7	63	0	0	0	0	107.6	H100 E104 S105	H100-S102 PolarHBondContact O-N 3.17Å; H100-S102 PolarHBondContact O-OG 3.01Å; S102-E104 PolarHBondContact O-N 3.21Å; S102-S105 WeakPolarHBondContact O-CB 3.41Å; S102-S105 PolarHBondContact O-N 3.26Å
103	Q	51.6	Low	72.7	Confident	208 Å²	208	57.7 Å²	57.7	97%	0.972	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-7.5	178.6	-68.5	-157	-19.8	0	0	113.8
104	E	50.8	Low	72.7	Confident	181 Å²	181	59.3 Å²	59.3	85%	0.846	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	1.5	177.8	-64.8	-178.3	169.8	0	0	113.4	S102 C106	S102-E104 PolarHBondContact O-N 3.21Å; E104-C106 PolarHBondContact O-N 3.08Å
105	S	58.1	Low	72.7	Confident	31 Å²	31	59.3 Å²	59.3	22%	0.217	32%	0.323	C	S	.	.			trans	-62.4	125.8	177.3	155.4	0	0	0	0	111.9	S102 L107	S102-S105 WeakPolarHBondContact O-CB 3.41Å; S102-S105 PolarHBondContact O-N 3.26Å; S105-L107 PolarHBondContact O-N 3.13Å; S105-L107 PolarHBondContact OG-N 3.49Å; S105-L107 PolarHBondContact OG-O 3.02Å; S105-L107 VanDerWaalsContact OG-O 3.06Å
106	C	65.1	Low	72.8	Confident	32 Å²	32	61.6 Å²	61.6	22%	0.216	34%	0.335	C	S	.	.	S	Bend	trans	-69.4	-9	170.8	-62.8	0	0	0	0	113.4	E104	E104-C106 PolarHBondContact O-N 3.08Å
107	L	74.8	Confident	73	Confident	8 Å²	8	65.3 Å²	65.3	4%	0.042	35%	0.353	C	S	.	.	S	Bend	trans	-99.2	142.9	-173.8	-54.9	177.9	0	0	0	111.5	V97 I99 S105 L111 V112 V136	V97-L107 HydrophobicContact CG1-CD1 3.84Å; V97-L107 HydrophobicContact CG1-CD2 4.2Å; V97-L107 HydrophobicContact CG1-CG 3.83Å; I99-L107 HydrophobicContact CG1-CD1 4.24Å; S105-L107 PolarHBondContact O-N 3.13Å; S105-L107 PolarHBondContact OG-N 3.49Å; S105-L107 PolarHBondContact OG-O 3.02Å; S105-L107 VanDerWaalsContact OG-O 3.06Å; L107-L111 HydrophobicContact CD2-CD2 4.31Å; L107-V112 HydrophobicContact CB-CG2 4.08Å; L107-V136 HydrophobicContact CD1-CG1 4.42Å; L107-V136 HydrophobicContact CD1-CG2 4.1Å; L107-V136 HydrophobicContact CD2-CB 4.32Å; L107-V136 HydrophobicContact CD2-CG1 3.71Å; L107-V136 HydrophobicContact CD2-CG2 4.18Å
108	P	78.6	Confident	73.3	Confident	37 Å²	37	65.7 Å²	65.7	24%	0.24	36%	0.355	C	S	.	.			trans	-63.4	141.6	174.2	24.1	-32	0	0	0	110.5	S110 L111 V112 E139	P108-S110 PolarHBondContact O-N 3.37Å; P108-L111 HydrophobicContact CG-CB 4.04Å; P108-L111 WeakPolarHBondContact O-CB 3.26Å; P108-L111 PolarHBondContact O-N 3.4Å; P108-V112 PolarHBondContact O-N 2.96Å; P108-E139 HydrophobicContact CG-CG 4.46Å
109	P	79	Confident	73.6	Confident	83 Å²	83	63.6 Å²	63.6	54%	0.539	34%	0.338	S	S	.	.	H	α-helix	trans	-55.5	-28.2	-178.7	-27.2	33.7	0	0	0	114.1	L111 V112 N113	P109-L111 VanDerWaalsContact C-N 3.31Å; P109-L111 PolarHBondContact O-N 2.9Å; P109-V112 PolarHBondContact O-N 3.24Å; P109-N113 WeakPolarHBondContact O-CB 3.47Å; P109-N113 VanDerWaalsContact O-CG 3.29Å; P109-N113 PolarHBondContact O-N 3.34Å; P109-N113 PolarHBondContact O-ND2 2.94Å
110	S	81.4	Confident	74.1	Confident	78 Å²	78	70 Å²	70	55%	0.545	37%	0.371	S	S	.	.	H	α-helix	trans	-60.7	-40.1	175.1	54.6	0	0	0	0	112.5	P108 E114	P108-S110 PolarHBondContact O-N 3.37Å; S110-E114 PolarHBondContact O-N 3.4Å
111	L	82.4	Confident	74.8	Confident	11 Å²	11	68.8 Å²	68.8	6%	0.058	37%	0.373	C	S	.	.	H	α-helix	trans	-75.7	-38.5	-178.8	-169.9	63.3	0	0	0	111.2	L107 P108 P109 N113 E114 F115 L132 L135 V136	L107-L111 HydrophobicContact CD2-CD2 4.31Å; P108-L111 HydrophobicContact CG-CB 4.04Å; P108-L111 WeakPolarHBondContact O-CB 3.26Å; P108-L111 PolarHBondContact O-N 3.4Å; P109-L111 VanDerWaalsContact C-N 3.31Å; P109-L111 PolarHBondContact O-N 2.9Å; L111-N113 VanDerWaalsContact C-N 3.3Å; L111-N113 PolarHBondContact O-N 3.14Å; L111-E114 PolarHBondContact O-N 3.33Å; L111-F115 HydrophobicContact CG-CE2 4.26Å; L111-F115 WeakPolarHBondContact O-CD2 3.16Å; L111-F115 PolarHBondContact O-N 3.27Å; L111-L132 HydrophobicContact CD1-CD2 4.11Å; L111-L135 HydrophobicContact CD1-CB 3.92Å; L111-L135 HydrophobicContact CD1-CD1 4.08Å; L111-L135 HydrophobicContact CD2-CB 4.5Å; L111-V136 HydrophobicContact CD2-CB 4.3Å; L111-V136 HydrophobicContact CD2-CG2 3.49Å; L111-V136 VanDerWaalsContact CD2-CG2 3.49Å; L111-V136 HydrophobicContact CG-CG2 4.18Å
112	V	83.4	Confident	76	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.006	37%	0.37	C	S	.	.	H	α-helix	trans	-59.3	-42.6	172.7	-179.1	0	0	0	0	110.8	D101 L107 P108 P109 E114 F115 D116	D101-V112 HydrophobicContact CB-CG1 4.23Å; L107-V112 HydrophobicContact CB-CG2 4.08Å; P108-V112 PolarHBondContact O-N 2.96Å; P109-V112 PolarHBondContact O-N 3.24Å; V112-E114 VanDerWaalsContact C-N 3.33Å; V112-E114 PolarHBondContact O-N 3.05Å; V112-F115 WeakPolarHBondContact O-CB 3.19Å; V112-F115 PolarHBondContact O-N 3.39Å; V112-D116 PolarHBondContact O-N 2.68Å
113	N	84	Confident	77.2	Confident	85 Å²	85	68.6 Å²	68.6	46%	0.455	36%	0.363	S	S	.	.	H	α-helix	trans	-61.4	-37	175.8	-77.7	-49.6	0	0	0	113.1	P109 L111 D116 Q117	P109-N113 WeakPolarHBondContact O-CB 3.47Å; P109-N113 VanDerWaalsContact O-CG 3.29Å; P109-N113 PolarHBondContact O-N 3.34Å; P109-N113 PolarHBondContact O-ND2 2.94Å; L111-N113 VanDerWaalsContact C-N 3.3Å; L111-N113 PolarHBondContact O-N 3.14Å; N113-D116 PolarHBondContact O-N 3.31Å; N113-Q117 WeakPolarHBondContact O-CG 3.43Å; N113-Q117 PolarHBondContact O-N 3.08Å
114	E	85.2	Confident	78.6	Confident	87 Å²	87	60.4 Å²	60.4	41%	0.407	33%	0.329	S	S	.	.	H	α-helix	trans	-65.7	-40.2	176.1	-72.1	179.5	-175.9	0	0	111.8	S110 L111 V112 Q117 L118 L132	S110-E114 PolarHBondContact O-N 3.4Å; L111-E114 PolarHBondContact O-N 3.33Å; V112-E114 VanDerWaalsContact C-N 3.33Å; V112-E114 PolarHBondContact O-N 3.05Å; E114-Q117 PolarHBondContact O-N 3.41Å; E114-L118 PolarHBondContact O-N 2.92Å; E114-L118 VanDerWaalsContact O-N 3.12Å; E114-L132 HydrophobicContact CB-CD1 4.19Å; E114-L132 HydrophobicContact CB-CD2 3.9Å; E114-L132 WeakPolarHBondContact OE2-CD2 3.47Å
115	F	84.8	Confident	80.1	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.9	-45.4	172	-82.2	-73.6	0	0	0	112.1	L91 I99 L111 V112 Q117 L118 M119 W129 L132 V136	L91-F115 HydrophobicContact CD1-CE1 3.75Å; L91-F115 HydrophobicContact CD1-CZ 4.33Å; I99-F115 HydrophobicContact CD1-CD1 4.2Å; I99-F115 HydrophobicContact CD1-CD2 4.49Å; I99-F115 HydrophobicContact CD1-CE1 3.91Å; I99-F115 HydrophobicContact CD1-CE2 4.22Å; I99-F115 HydrophobicContact CD1-CG 4.48Å; I99-F115 HydrophobicContact CD1-CZ 3.92Å; I99-F115 HydrophobicContact CG2-CB 3.69Å; I99-F115 HydrophobicContact CG2-CD1 4.22Å; I99-F115 HydrophobicContact CG2-CD2 3.53Å; I99-F115 HydrophobicContact CG2-CE2 4.19Å; I99-F115 HydrophobicContact CG2-CG 3.55Å; L111-F115 HydrophobicContact CG-CE2 4.26Å; L111-F115 WeakPolarHBondContact O-CD2 3.16Å; L111-F115 PolarHBondContact O-N 3.27Å; V112-F115 WeakPolarHBondContact O-CB 3.19Å; V112-F115 PolarHBondContact O-N 3.39Å; F115-Q117 VanDerWaalsContact C-N 3.29Å; F115-Q117 PolarHBondContact O-N 2.95Å; F115-L118 WeakPolarHBondContact O-CB 3.44Å; F115-L118 PolarHBondContact O-N 3.23Å; F115-M119 VanDerWaalsContact O-CG 3.26Å; F115-M119 WeakPolarHBondContact O-CG 3.17Å; F115-M119 PolarHBondContact O-N 3.42Å; F115-W129 HydrophobicContact CD1-CE3 4.08Å; F115-W129 AromaticContact CD1-CZ3 3.72Å; F115-W129 HydrophobicContact CD1-CZ3 3.72Å; F115-W129 AromaticContact CE1-CE3 3.88Å; F115-W129 HydrophobicContact CE1-CE3 3.88Å; F115-W129 AromaticContact CE1-CZ3 3.89Å; F115-W129 HydrophobicContact CE1-CZ3 3.89Å; F115-L132 HydrophobicContact CD1-CD1 3.67Å; F115-L132 HydrophobicContact CD2-CD1 4.03Å; F115-L132 HydrophobicContact CE1-CB 3.87Å; F115-L132 HydrophobicContact CE1-CD1 3.74Å; F115-L132 HydrophobicContact CE1-CG 4.5Å; F115-L132 HydrophobicContact CE2-CB 3.98Å; F115-L132 HydrophobicContact CE2-CD1 4.09Å; F115-L132 HydrophobicContact CG-CD1 3.83Å; F115-L132 HydrophobicContact CZ-CB 3.51Å; F115-L132 HydrophobicContact CZ-CD1 3.96Å; F115-L132 HydrophobicContact CZ-CG 4.4Å; F115-V136 HydrophobicContact CE2-CG2 3.62Å; F115-V136 HydrophobicContact CZ-CG2 3.97Å
116	D	84.9	Confident	81.3	Confident	48 Å²	48	55.2 Å²	55.2	26%	0.257	30%	0.302	S	S	.	.	H	α-helix	trans	-65.9	-32.2	179.5	-73.5	-26.6	0	0	0	112.1	R88 V112 N113 M119 I120	R88-D116 IonicContact CZ-OD1 3.69Å; R88-D116 IonicContact NH1-OD1 3.45Å; R88-D116 PolarHBondContact NH1-OD1 3.42Å; R88-D116 IonicContact NH2-OD1 3.13Å; V112-D116 PolarHBondContact O-N 2.68Å; N113-D116 PolarHBondContact O-N 3.31Å; D116-M119 WeakPolarHBondContact O-CB 3.36Å; D116-M119 PolarHBondContact O-N 3.25Å; D116-I120 WeakPolarHBondContact O-CD1 3.44Å; D116-I120 VanDerWaalsContact O-CG1 3.23Å; D116-I120 WeakPolarHBondContact O-CG1 3.3Å; D116-I120 PolarHBondContact O-N 3.38Å
117	Q	84.5	Confident	82.2	Confident	137 Å²	137	57.5 Å²	57.5	64%	0.64	31%	0.312	S	S	*	.	H	α-helix	trans	-64.8	-42.8	171.4	-75.7	-176.3	10.4	0	0	112.8	N113 E114 F115 M119 I120 S121	N113-Q117 WeakPolarHBondContact O-CG 3.43Å; N113-Q117 PolarHBondContact O-N 3.08Å; E114-Q117 PolarHBondContact O-N 3.41Å; F115-Q117 VanDerWaalsContact C-N 3.29Å; F115-Q117 PolarHBondContact O-N 2.95Å; Q117-M119 VanDerWaalsContact C-N 3.3Å; Q117-M119 PolarHBondContact O-N 2.93Å; Q117-I120 PolarHBondContact O-N 3.29Å; Q117-S121 PolarHBondContact O-N 2.83Å; Q117-S121 PolarHBondContact O-OG 3.18Å
118	L	83.2	Confident	82.7	Confident	16 Å²	16	63.5 Å²	63.5	8%	0.084	34%	0.335	C	S	.	.	H	α-helix	trans	-63.2	-35.9	173.4	-96	147.8	0	0	0	112.4	E114 F115 S121 H122 D123 R128 W129 L132	E114-L118 PolarHBondContact O-N 2.92Å; E114-L118 VanDerWaalsContact O-N 3.12Å; F115-L118 WeakPolarHBondContact O-CB 3.44Å; F115-L118 PolarHBondContact O-N 3.23Å; L118-S121 WeakPolarHBondContact CA-OG 3.45Å; L118-S121 PolarHBondContact O-OG 2.85Å; L118-H122 PolarHBondContact O-N 3.26Å; L118-D123 HydrophobicContact CD2-CB 4.08Å; L118-D123 PolarHBondContact O-N 2.96Å; L118-R128 HydrophobicContact CD1-CB 4.43Å; L118-R128 HydrophobicContact CD2-CB 4.06Å; L118-W129 HydrophobicContact CB-CZ2 4.4Å; L118-L132 HydrophobicContact CD1-CD1 3.28Å; L118-L132 HydrophobicContact CD1-CG 4.06Å
119	M	83.2	Confident	83.1	Confident	17 Å²	17	61.7 Å²	61.7	8%	0.084	32%	0.323	C	S	.	.	H	α-helix	trans	-66	-45.3	174.8	-69.4	-68.9	-58.5	0	0	111.8	T84 F85 R88 F115 D116 Q117 S121 H122 W129	T84-M119 VanDerWaalsContact CB-SD 3.56Å; T84-M119 VanDerWaalsContact O-SD 3.39Å; F85-M119 HydrophobicContact CD1-CE 3.51Å; F85-M119 HydrophobicContact CD2-CE 4.04Å; F85-M119 HydrophobicContact CE1-CE 3.55Å; F85-M119 HydrophobicContact CE2-CE 4.08Å; F85-M119 HydrophobicContact CG-CE 3.76Å; F85-M119 HydrophobicContact CZ-CE 3.84Å; R88-M119 HydrophobicContact CB-SD 4.03Å; F115-M119 VanDerWaalsContact O-CG 3.26Å; F115-M119 WeakPolarHBondContact O-CG 3.17Å; F115-M119 PolarHBondContact O-N 3.42Å; D116-M119 WeakPolarHBondContact O-CB 3.36Å; D116-M119 PolarHBondContact O-N 3.25Å; Q117-M119 VanDerWaalsContact C-N 3.3Å; Q117-M119 PolarHBondContact O-N 2.93Å; M119-S121 VanDerWaalsContact C-N 3.33Å; M119-S121 PolarHBondContact O-N 3.49Å; M119-H122 PolarHBondContact O-N 3.21Å; M119-W129 HydrophobicContact CG-CH2 4.46Å; M119-W129 HydrophobicContact SD-CH2 3.74Å; M119-W129 HydrophobicContact SD-CZ2 4.28Å
120	I	82.7	Confident	83.3	Confident	135 Å²	135	58.5 Å²	58.5	69%	0.692	30%	0.301	S	S	*	.	H	α-helix	trans	-65.2	-36.7	179	-69.6	163.8	0	0	0	111.4	D116 Q117 H122	D116-I120 WeakPolarHBondContact O-CD1 3.44Å; D116-I120 VanDerWaalsContact O-CG1 3.23Å; D116-I120 WeakPolarHBondContact O-CG1 3.3Å; D116-I120 PolarHBondContact O-N 3.38Å; Q117-I120 PolarHBondContact O-N 3.29Å; I120-H122 PolarHBondContact O-N 2.99Å
121	S	84.1	Confident	83.6	Confident	67 Å²	67	58.9 Å²	58.9	47%	0.469	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-10.2	178.4	65.4	0	0	0	0	113.6	Q117 L118 M119 D123	Q117-S121 PolarHBondContact O-N 2.83Å; Q117-S121 PolarHBondContact O-OG 3.18Å; L118-S121 WeakPolarHBondContact CA-OG 3.45Å; L118-S121 PolarHBondContact O-OG 2.85Å; M119-S121 VanDerWaalsContact C-N 3.33Å; M119-S121 PolarHBondContact O-N 3.49Å; S121-D123 PolarHBondContact O-N 2.77Å; S121-D123 WeakPolarHBondContact OG-CB 3.47Å; S121-D123 PolarHBondContact OG-N 2.85Å
122	H	80.9	Confident	83.7	Confident	136 Å²	136	58.9 Å²	58.9	63%	0.63	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	25.3	-170.6	-65.2	-72.3	0	0	0	113.3	T84 L118 M119 I120 C124	T84-H122 VanDerWaalsContact CG2-C 3.49Å; L118-H122 PolarHBondContact O-N 3.26Å; M119-H122 PolarHBondContact O-N 3.21Å; I120-H122 PolarHBondContact O-N 2.99Å; H122-C124 PolarHBondContact O-N 3.42Å
123	D	78.6	Confident	83.7	Confident	42 Å²	42	58.9 Å²	58.9	23%	0.225	30%	0.297	C	S	.	.			trans	-81	115.1	-175.5	-174	-0.9	0	0	0	110.3	T84 L118 S121 D125 R128 W129	T84-D123 WeakPolarHBondContact CG2-O 3.43Å; L118-D123 HydrophobicContact CD2-CB 4.08Å; L118-D123 PolarHBondContact O-N 2.96Å; S121-D123 PolarHBondContact O-N 2.77Å; S121-D123 WeakPolarHBondContact OG-CB 3.47Å; S121-D123 PolarHBondContact OG-N 2.85Å; D123-D125 WeakPolarHBondContact OD1-CB 3.41Å; D123-D125 PolarHBondContact OD1-N 3.04Å; D123-R128 IonicContact OD2-CZ 2.77Å; D123-R128 IonicContact OD2-NE 3.81Å; D123-R128 IonicContact OD2-NH1 3.87Å; D123-R128 PolarHBondContact OD2-NH1 2.95Å; D123-W129 PolarHBondContact O-NE1 3.08Å
124	C	80.4	Confident	83.6	Confident	37 Å²	37	56.6 Å²	56.6	25%	0.25	28%	0.284	C	S	.	.			trans	-101.5	21.6	179.7	-61.6	0	0	0	0	112.3	L82 L87 H122 F126	L82-C124 HydrophobicContact CD2-CB 4.37Å; L87-C124 HydrophobicContact CD1-CB 3.93Å; H122-C124 PolarHBondContact O-N 3.42Å; C124-F126 PolarHBondContact O-N 3.24Å; C124-F126 VanDerWaalsContact O-N 3.16Å
125	D	83.2	Confident	83.6	Confident	68 Å²	68	55.1 Å²	55.1	36%	0.364	28%	0.278	S	S	.	.			trans	-65.7	108	174.8	178.7	18.8	0	0	0	111.7	D123 D127 R128 W129	D123-D125 WeakPolarHBondContact OD1-CB 3.41Å; D123-D125 PolarHBondContact OD1-N 3.04Å; D125-D127 PolarHBondContact O-N 3.23Å; D125-D127 VanDerWaalsContact O-N 3.11Å; D125-D127 PolarHBondContact OD1-N 3.48Å; D125-R128 PolarHBondContact O-N 3.08Å; D125-W129 VanDerWaalsContact O-CD1 3.22Å; D125-W129 PolarHBondContact O-N 3.28Å
126	F	83.6	Confident	83.5	Confident	34 Å²	34	55.1 Å²	55.1	15%	0.149	28%	0.278	C	S	.	.	H	α-helix	trans	-54.2	-33.7	-176.3	-74.6	-64.7	0	0	0	113.7	L82 L87 C124 R128 W129 L130 K218 F222	L82-F126 HydrophobicContact CD2-CE1 4.16Å; L82-F126 HydrophobicContact CD2-CE2 4.01Å; L82-F126 HydrophobicContact CD2-CZ 3.46Å; L82-F126 VanDerWaalsContact CD2-CZ 3.46Å; L87-F126 HydrophobicContact CD2-CD1 4.06Å; L87-F126 HydrophobicContact CD2-CE1 3.46Å; L87-F126 VanDerWaalsContact CD2-CE1 3.46Å; L87-F126 HydrophobicContact CD2-CZ 4.32Å; C124-F126 PolarHBondContact O-N 3.24Å; C124-F126 VanDerWaalsContact O-N 3.16Å; F126-R128 PolarHBondContact O-N 2.91Å; F126-W129 PolarHBondContact O-N 3.44Å; F126-L130 WeakPolarHBondContact O-CB 3.31Å; F126-L130 PolarHBondContact O-N 3.19Å; F126-K218 HydrophobicContact CE2-CB 4.01Å; F126-K218 HydrophobicContact CE2-CD 4.33Å; F126-K218 HydrophobicContact CE2-CG 4.46Å; F126-K218 HydrophobicContact CZ-CB 3.79Å; F126-F222 HydrophobicContact CB-CD2 4Å; F126-F222 HydrophobicContact CB-CE2 4.39Å; F126-F222 HydrophobicContact CD1-CB 3.65Å; F126-F222 HydrophobicContact CD1-CD1 4.25Å; F126-F222 AromaticContact CD1-CD2 3.3Å; F126-F222 HydrophobicContact CD1-CD2 3.3Å; F126-F222 AromaticContact CD1-CE2 3.95Å; F126-F222 HydrophobicContact CD1-CE2 3.95Å; F126-F222 AromaticContact CD1-CG 3.47Å; F126-F222 HydrophobicContact CD1-CG 3.47Å; F126-F222 VanDerWaalsContact CD1-CG 3.47Å; F126-F222 HydrophobicContact CE1-CB 3.59Å; F126-F222 HydrophobicContact CE1-CD1 4.32Å; F126-F222 HydrophobicContact CE1-CD2 4.08Å; F126-F222 AromaticContact CE1-CG 3.74Å; F126-F222 HydrophobicContact CE1-CG 3.74Å; F126-F222 HydrophobicContact CG-CD2 4.02Å; F126-F222 HydrophobicContact CG-CG 4.48Å; F126-F222 HydrophobicContact CZ-CB 4.46Å; F126-F222 WeakPolarHBondContact O-CE2 3.43Å
127	D	84.2	Confident	83.4	Confident	80 Å²	80	53.1 Å²	53.1	43%	0.428	27%	0.267	S	S	.	.	H	α-helix	trans	-70.7	-35	-174.9	-64.9	-31	0	0	0	111.9	D125 L130 N131 R225	D125-D127 PolarHBondContact O-N 3.23Å; D125-D127 VanDerWaalsContact O-N 3.11Å; D125-D127 PolarHBondContact OD1-N 3.48Å; D127-L130 PolarHBondContact O-N 2.96Å; D127-N131 PolarHBondContact O-N 3.01Å; D127-N131 PolarHBondContact O-ND2 3.46Å; D127-R225 IonicContact OD1-NH1 2.72Å; D127-R225 PolarHBondContact OD1-NH1 2.87Å
128	R	84.7	Confident	83.2	Confident	134 Å²	134	48.5 Å²	48.5	51%	0.506	24%	0.244	S	C	.	.	H	α-helix	trans	-67.8	-43.5	173.1	-71.2	-174	177	174.6	7.2	112.5	L118 D123 D125 F126 L130 N131 L132	L118-R128 HydrophobicContact CD1-CB 4.43Å; L118-R128 HydrophobicContact CD2-CB 4.06Å; D123-R128 IonicContact OD2-CZ 2.77Å; D123-R128 IonicContact OD2-NE 3.81Å; D123-R128 IonicContact OD2-NH1 3.87Å; D123-R128 PolarHBondContact OD2-NH1 2.95Å; D125-R128 PolarHBondContact O-N 3.08Å; F126-R128 PolarHBondContact O-N 2.91Å; R128-L130 VanDerWaalsContact C-N 3.26Å; R128-L130 PolarHBondContact O-N 3.42Å; R128-N131 PolarHBondContact O-N 3.29Å; R128-L132 PolarHBondContact O-N 3.48Å; R128-L132 VanDerWaalsContact O-N 3.11Å
129	W	86.3	Confident	83.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.4	-38.1	175.5	-75.2	96.2	0	0	0	111.5	T84 L87 R88 L91 F115 L118 M119 D123 D125 F126 S133 F222	T84-W129 HydrophobicContact CG2-CZ2 3.92Å; L87-W129 HydrophobicContact CB-CD2 4.1Å; L87-W129 HydrophobicContact CB-CE3 4.31Å; L87-W129 HydrophobicContact CB-CH2 4.21Å; L87-W129 HydrophobicContact CB-CZ2 4.07Å; L87-W129 HydrophobicContact CB-CZ3 4.34Å; L87-W129 HydrophobicContact CD1-CD2 4.24Å; L87-W129 HydrophobicContact CD1-CG 4.18Å; L87-W129 HydrophobicContact CD1-CZ2 4.38Å; R88-W129 HydrophobicContact CB-CH2 3.99Å; R88-W129 HydrophobicContact CB-CZ3 4.07Å; L91-W129 HydrophobicContact CD1-CD2 4.37Å; L91-W129 HydrophobicContact CD1-CE3 3.33Å; L91-W129 HydrophobicContact CD1-CZ3 3.86Å; F115-W129 HydrophobicContact CD1-CE3 4.08Å; F115-W129 AromaticContact CD1-CZ3 3.72Å; F115-W129 HydrophobicContact CD1-CZ3 3.72Å; F115-W129 AromaticContact CE1-CE3 3.88Å; F115-W129 HydrophobicContact CE1-CE3 3.88Å; F115-W129 AromaticContact CE1-CZ3 3.89Å; F115-W129 HydrophobicContact CE1-CZ3 3.89Å; L118-W129 HydrophobicContact CB-CZ2 4.4Å; M119-W129 HydrophobicContact CG-CH2 4.46Å; M119-W129 HydrophobicContact SD-CH2 3.74Å; M119-W129 HydrophobicContact SD-CZ2 4.28Å; D123-W129 PolarHBondContact O-NE1 3.08Å; D125-W129 VanDerWaalsContact O-CD1 3.22Å; D125-W129 PolarHBondContact O-N 3.28Å; F126-W129 PolarHBondContact O-N 3.44Å; W129-S133 WeakPolarHBondContact O-CB 3.4Å; W129-S133 PolarHBondContact O-N 3.21Å; W129-F222 HydrophobicContact CB-CE2 4.08Å; W129-F222 HydrophobicContact CB-CZ 3.83Å
130	L	84.5	Confident	83	Confident	15 Å²	15	49.8 Å²	49.8	8%	0.079	25%	0.25	C	C	.	.	H	α-helix	trans	-64.8	-47.6	177.1	-166.5	68.7	0	0	0	111.3	F126 D127 R128 L132 S133 E134 F222 R225 M226 Q229	F126-L130 WeakPolarHBondContact O-CB 3.31Å; F126-L130 PolarHBondContact O-N 3.19Å; D127-L130 PolarHBondContact O-N 2.96Å; R128-L130 VanDerWaalsContact C-N 3.26Å; R128-L130 PolarHBondContact O-N 3.42Å; L130-L132 PolarHBondContact O-N 2.88Å; L130-S133 WeakPolarHBondContact O-CB 3.18Å; L130-S133 PolarHBondContact O-N 3.07Å; L130-S133 VanDerWaalsContact O-N 3.12Å; L130-S133 PolarHBondContact O-OG 2.84Å; L130-E134 PolarHBondContact O-N 3.21Å; L130-F222 HydrophobicContact CB-CE2 3.99Å; L130-F222 HydrophobicContact CD1-CD2 4.46Å; L130-F222 HydrophobicContact CD1-CE2 4.02Å; L130-R225 HydrophobicContact CD1-CB 3.97Å; L130-R225 HydrophobicContact CD2-CB 4.03Å; L130-M226 HydrophobicContact CD1-CB 4.4Å; L130-M226 HydrophobicContact CD1-CG 3.69Å; L130-Q229 VanDerWaalsContact CG-CD 3.44Å; L130-Q229 VanDerWaalsContact CG-NE2 3.27Å
131	N	86	Confident	82.8	Confident	86 Å²	86	43.4 Å²	43.4	46%	0.46	22%	0.217	S	C	.	.	H	α-helix	trans	-59.2	-42.7	176.5	-70.7	-18.1	0	0	0	112.7	D127 R128 S133 E134 L135	D127-N131 PolarHBondContact O-N 3.01Å; D127-N131 PolarHBondContact O-ND2 3.46Å; R128-N131 PolarHBondContact O-N 3.29Å; N131-S133 VanDerWaalsContact C-N 3.34Å; N131-E134 PolarHBondContact O-N 3.01Å; N131-L135 PolarHBondContact O-N 3.26Å
132	L	84.8	Confident	82.4	Confident	12 Å²	12	41 Å²	41	6%	0.063	20%	0.2	C	C	.	.	H	α-helix	trans	-65.1	-39.4	175.1	-71.1	-167.2	0	0	0	112.1	L111 E114 F115 L118 R128 L130 E134 L135 V136	L111-L132 HydrophobicContact CD1-CD2 4.11Å; E114-L132 HydrophobicContact CB-CD1 4.19Å; E114-L132 HydrophobicContact CB-CD2 3.9Å; E114-L132 WeakPolarHBondContact OE2-CD2 3.47Å; F115-L132 HydrophobicContact CD1-CD1 3.67Å; F115-L132 HydrophobicContact CD2-CD1 4.03Å; F115-L132 HydrophobicContact CE1-CB 3.87Å; F115-L132 HydrophobicContact CE1-CD1 3.74Å; F115-L132 HydrophobicContact CE1-CG 4.5Å; F115-L132 HydrophobicContact CE2-CB 3.98Å; F115-L132 HydrophobicContact CE2-CD1 4.09Å; F115-L132 HydrophobicContact CG-CD1 3.83Å; F115-L132 HydrophobicContact CZ-CB 3.51Å; F115-L132 HydrophobicContact CZ-CD1 3.96Å; F115-L132 HydrophobicContact CZ-CG 4.4Å; L118-L132 HydrophobicContact CD1-CD1 3.28Å; L118-L132 HydrophobicContact CD1-CG 4.06Å; R128-L132 PolarHBondContact O-N 3.48Å; R128-L132 VanDerWaalsContact O-N 3.11Å; L130-L132 PolarHBondContact O-N 2.88Å; L132-E134 VanDerWaalsContact C-N 3.29Å; L132-E134 PolarHBondContact O-N 3.28Å; L132-L135 HydrophobicContact CD2-CD1 4.41Å; L132-L135 PolarHBondContact O-N 2.91Å; L132-V136 WeakPolarHBondContact O-CG2 3.24Å; L132-V136 PolarHBondContact O-N 3.07Å
133	S	84	Confident	82.1	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.2	-38.2	177.6	78.9	0	0	0	0	111.9	W129 L130 N131 L135 V136 I137	W129-S133 WeakPolarHBondContact O-CB 3.4Å; W129-S133 PolarHBondContact O-N 3.21Å; L130-S133 WeakPolarHBondContact O-CB 3.18Å; L130-S133 PolarHBondContact O-N 3.07Å; L130-S133 VanDerWaalsContact O-N 3.12Å; L130-S133 PolarHBondContact O-OG 2.84Å; N131-S133 VanDerWaalsContact C-N 3.34Å; S133-L135 PolarHBondContact O-N 3.29Å; S133-V136 WeakPolarHBondContact O-CB 3.39Å; S133-V136 PolarHBondContact O-N 3.46Å; S133-I137 WeakPolarHBondContact O-CD1 3.48Å; S133-I137 WeakPolarHBondContact O-CG1 3.48Å; S133-I137 PolarHBondContact O-N 2.82Å
134	E	82.6	Confident	81.9	Confident	38 Å²	38	34.1 Å²	34.1	18%	0.178	17%	0.168	C	C	.	.	H	α-helix	trans	-62.5	-42.9	175.6	-178.8	170.6	-174.8	0	0	111.9	V58 L130 N131 L132 V136 I137 W138 Q229	V58-E134 WeakPolarHBondContact CG1-OE1 3.29Å; L130-E134 PolarHBondContact O-N 3.21Å; N131-E134 PolarHBondContact O-N 3.01Å; L132-E134 VanDerWaalsContact C-N 3.29Å; L132-E134 PolarHBondContact O-N 3.28Å; E134-V136 PolarHBondContact O-N 3.33Å; E134-I137 PolarHBondContact O-N 3.11Å; E134-W138 WeakPolarHBondContact O-CB 3.36Å; E134-W138 VanDerWaalsContact O-CD1 3.3Å; E134-W138 PolarHBondContact O-N 3.24Å; E134-Q229 PolarHBondContact OE2-NE2 2.96Å
135	L	83.9	Confident	81.5	Confident	56 Å²	56	33.7 Å²	33.7	29%	0.293	16%	0.163	S	C	.	.	H	α-helix	trans	-63	-40.6	174.8	-67.4	176	0	0	0	112.4	L111 N131 L132 S133 W138 E139	L111-L135 HydrophobicContact CD1-CB 3.92Å; L111-L135 HydrophobicContact CD1-CD1 4.08Å; L111-L135 HydrophobicContact CD2-CB 4.5Å; N131-L135 PolarHBondContact O-N 3.26Å; L132-L135 HydrophobicContact CD2-CD1 4.41Å; L132-L135 PolarHBondContact O-N 2.91Å; S133-L135 PolarHBondContact O-N 3.29Å; L135-W138 PolarHBondContact O-N 2.79Å; L135-E139 PolarHBondContact O-N 2.68Å
136	V	83.5	Confident	80.9	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.6	-50.2	175.2	168.6	0	0	0	0	110.6	M95 L107 L111 F115 L132 S133 E134 W138 E139 I140	M95-V136 HydrophobicContact CE-CB 4.14Å; M95-V136 HydrophobicContact CE-CG1 3.8Å; M95-V136 HydrophobicContact CE-CG2 4.21Å; M95-V136 HydrophobicContact SD-CB 3.68Å; M95-V136 HydrophobicContact SD-CG1 3.43Å; M95-V136 WeakPolarHBondContact SD-CG1 3.43Å; M95-V136 HydrophobicContact SD-CG2 4.36Å; L107-V136 HydrophobicContact CD1-CG1 4.42Å; L107-V136 HydrophobicContact CD1-CG2 4.1Å; L107-V136 HydrophobicContact CD2-CB 4.32Å; L107-V136 HydrophobicContact CD2-CG1 3.71Å; L107-V136 HydrophobicContact CD2-CG2 4.18Å; L111-V136 HydrophobicContact CD2-CB 4.3Å; L111-V136 HydrophobicContact CD2-CG2 3.49Å; L111-V136 VanDerWaalsContact CD2-CG2 3.49Å; L111-V136 HydrophobicContact CG-CG2 4.18Å; F115-V136 HydrophobicContact CE2-CG2 3.62Å; F115-V136 HydrophobicContact CZ-CG2 3.97Å; L132-V136 WeakPolarHBondContact O-CG2 3.24Å; L132-V136 PolarHBondContact O-N 3.07Å; S133-V136 WeakPolarHBondContact O-CB 3.39Å; S133-V136 PolarHBondContact O-N 3.46Å; E134-V136 PolarHBondContact O-N 3.33Å; V136-W138 VanDerWaalsContact C-N 3.31Å; V136-W138 PolarHBondContact O-N 3.02Å; V136-E139 PolarHBondContact O-N 3.49Å; V136-I140 HydrophobicContact CG1-CD1 3.65Å; V136-I140 WeakPolarHBondContact O-CD1 3.24Å; V136-I140 VanDerWaalsContact O-CG1 3.3Å; V136-I140 WeakPolarHBondContact O-CG1 3.35Å; V136-I140 PolarHBondContact O-N 3.35Å
137	I	82.8	Confident	79.6	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.026	19%	0.187	C	C	.	.	H	α-helix	trans	-62.4	-42.8	-178.9	-62.9	157.4	0	0	0	109.7	M95 S133 E134 E139 I140 V141 I230 L233	M95-I137 HydrophobicContact CG-CG1 4.31Å; M95-I137 HydrophobicContact SD-CG1 4.09Å; S133-I137 WeakPolarHBondContact O-CD1 3.48Å; S133-I137 WeakPolarHBondContact O-CG1 3.48Å; S133-I137 PolarHBondContact O-N 2.82Å; E134-I137 PolarHBondContact O-N 3.11Å; I137-E139 PolarHBondContact O-N 3.21Å; I137-I140 PolarHBondContact O-N 2.84Å; I137-V141 HydrophobicContact CG2-CG2 4.23Å; I137-V141 WeakPolarHBondContact O-CB 3.25Å; I137-V141 WeakPolarHBondContact O-CG2 3.4Å; I137-V141 PolarHBondContact O-N 3.43Å; I137-I230 HydrophobicContact CD1-CD1 4.13Å; I137-I230 HydrophobicContact CD1-CG1 3.46Å; I137-I230 VanDerWaalsContact CD1-CG1 3.46Å; I137-I230 HydrophobicContact CG1-CG1 4.42Å; I137-L233 HydrophobicContact CB-CD2 4.37Å; I137-L233 HydrophobicContact CG2-CD2 3.32Å
138	W	80.1	Confident	78.2	Confident	41 Å²	41	35.6 Å²	35.6	16%	0.155	18%	0.176	C	C	.	.	H	α-helix	trans	-57.7	-45.7	175.4	-96.6	110.1	0	0	0	113.3	V54 V58 E134 L135 V136 I140 V141 S142 L233 L242	V54-W138 HydrophobicContact CG1-CH2 3.56Å; V54-W138 HydrophobicContact CG1-CZ2 4.23Å; V54-W138 HydrophobicContact CG1-CZ3 3.77Å; V58-W138 HydrophobicContact CG2-CH2 4.33Å; V58-W138 HydrophobicContact CG2-CZ2 3.4Å; V58-W138 VanDerWaalsContact CG2-CZ2 3.4Å; E134-W138 WeakPolarHBondContact O-CB 3.36Å; E134-W138 VanDerWaalsContact O-CD1 3.3Å; E134-W138 PolarHBondContact O-N 3.24Å; L135-W138 PolarHBondContact O-N 2.79Å; V136-W138 VanDerWaalsContact C-N 3.31Å; V136-W138 PolarHBondContact O-N 3.02Å; W138-I140 VanDerWaalsContact C-N 3.32Å; W138-I140 PolarHBondContact O-N 3.12Å; W138-V141 PolarHBondContact O-N 3.33Å; W138-S142 WeakPolarHBondContact O-CB 3.42Å; W138-S142 PolarHBondContact O-N 2.94Å; W138-L233 HydrophobicContact CD2-CD1 3.72Å; W138-L233 HydrophobicContact CE3-CD1 3.93Å; W138-L233 HydrophobicContact CH2-CD1 3.27Å; W138-L233 HydrophobicContact CZ2-CD1 3.02Å; W138-L233 HydrophobicContact CZ3-CD1 3.73Å; W138-L242 HydrophobicContact CH2-CD1 3.35Å; W138-L242 HydrophobicContact CZ2-CD1 3.46Å; W138-L242 VanDerWaalsContact CZ2-CD1 3.46Å
139	E	81.5	Confident	76.4	Confident	60 Å²	60	31.5 Å²	31.5	28%	0.28	16%	0.163	S	C	.	.	H	α-helix	trans	-61.5	-44.2	178.3	-169.2	69	-170.1	0	0	110.8	P108 L135 V136 I137 S142 N143	P108-E139 HydrophobicContact CG-CG 4.46Å; L135-E139 PolarHBondContact O-N 2.68Å; V136-E139 PolarHBondContact O-N 3.49Å; I137-E139 PolarHBondContact O-N 3.21Å; E139-S142 PolarHBondContact O-N 3.35Å; E139-N143 WeakPolarHBondContact O-CB 3.48Å; E139-N143 PolarHBondContact O-N 3.29Å; E139-N143 PolarHBondContact O-ND2 3.48Å
140	I	79.8	Confident	74.8	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.7	-47.1	178.8	-66.2	164.3	0	0	0	111.2	V97 V136 I137 W138 S142 N143 F144 L156 Y194	V97-I140 HydrophobicContact CG2-CD1 3.46Å; V97-I140 VanDerWaalsContact CG2-CD1 3.46Å; V97-I140 HydrophobicContact CG2-CG1 4.44Å; V136-I140 HydrophobicContact CG1-CD1 3.65Å; V136-I140 WeakPolarHBondContact O-CD1 3.24Å; V136-I140 VanDerWaalsContact O-CG1 3.3Å; V136-I140 WeakPolarHBondContact O-CG1 3.35Å; V136-I140 PolarHBondContact O-N 3.35Å; I137-I140 PolarHBondContact O-N 2.84Å; W138-I140 VanDerWaalsContact C-N 3.32Å; W138-I140 PolarHBondContact O-N 3.12Å; I140-S142 VanDerWaalsContact C-N 3.33Å; I140-S142 PolarHBondContact O-N 3.32Å; I140-N143 WeakPolarHBondContact O-CB 3.08Å; I140-N143 PolarHBondContact O-N 3.5Å; I140-F144 HydrophobicContact CG2-CD2 3.88Å; I140-F144 HydrophobicContact CG2-CE2 3.87Å; I140-F144 WeakPolarHBondContact O-CD2 3.4Å; I140-F144 PolarHBondContact O-N 2.89Å; I140-L156 HydrophobicContact CG2-CD1 3.75Å; I140-Y194 HydrophobicContact CB-CE1 4.27Å; I140-Y194 WeakPolarHBondContact CD1-OH 3.48Å; I140-Y194 HydrophobicContact CG2-CD1 4.04Å; I140-Y194 HydrophobicContact CG2-CE1 3.48Å; I140-Y194 VanDerWaalsContact CG2-CE1 3.48Å; I140-Y194 HydrophobicContact CG2-CE2 4.18Å
141	V	78.9	Confident	73.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-42.9	176.6	165.6	0	0	0	0	111	I137 W138 N143 F144 L145 L191 L233 I237	I137-V141 HydrophobicContact CG2-CG2 4.23Å; I137-V141 WeakPolarHBondContact O-CB 3.25Å; I137-V141 WeakPolarHBondContact O-CG2 3.4Å; I137-V141 PolarHBondContact O-N 3.43Å; W138-V141 PolarHBondContact O-N 3.33Å; V141-N143 VanDerWaalsContact C-N 3.31Å; V141-N143 PolarHBondContact O-N 2.95Å; V141-F144 CarbonylContact O-C 3.6Å; V141-F144 WeakPolarHBondContact O-CB 3.34Å; V141-F144 PolarHBondContact O-N 2.87Å; V141-L145 HydrophobicContact CG1-CD1 4.03Å; V141-L145 HydrophobicContact CG1-CG 4.45Å; V141-L145 VanDerWaalsContact O-CG 3.32Å; V141-L145 WeakPolarHBondContact O-CG 3.48Å; V141-L145 PolarHBondContact O-N 3.19Å; V141-L191 HydrophobicContact CB-CD1 4.2Å; V141-L191 HydrophobicContact CG1-CD1 4.06Å; V141-L191 HydrophobicContact CG2-CD1 3.76Å; V141-L233 HydrophobicContact CB-CD2 4.19Å; V141-L233 HydrophobicContact CG1-CD2 4.48Å; V141-L233 HydrophobicContact CG2-CD2 3.59Å; V141-L233 HydrophobicContact CG2-CG 4.48Å; V141-I237 HydrophobicContact CG1-CD1 3.55Å
142	S	76.8	Confident	71.6	Confident	17 Å²	17	46.5 Å²	46.5	12%	0.119	23%	0.226	C	C	.	.	H	α-helix	trans	-59.3	-42.5	175	180	0	0	0	0	111.3	W138 E139 I140 L145 Q146	W138-S142 WeakPolarHBondContact O-CB 3.42Å; W138-S142 PolarHBondContact O-N 2.94Å; E139-S142 PolarHBondContact O-N 3.35Å; I140-S142 VanDerWaalsContact C-N 3.33Å; I140-S142 PolarHBondContact O-N 3.32Å; S142-L145 CarbonylContact O-C 3.49Å; S142-L145 PolarHBondContact O-N 3.04Å; S142-L145 VanDerWaalsContact O-N 3.1Å; S142-Q146 WeakPolarHBondContact O-CB 3.43Å; S142-Q146 VanDerWaalsContact O-CG 3.31Å; S142-Q146 WeakPolarHBondContact O-CG 3.42Å; S142-Q146 PolarHBondContact O-N 3.04Å; S142-Q146 PolarHBondContact OG-NE2 3.4Å
143	N	75.1	Confident	70.1	Confident	32 Å²	32	46.3 Å²	46.3	17%	0.171	23%	0.225	C	C	.	.	H	α-helix	trans	-63.5	-41.5	174.5	-69.3	-22	0	0	0	112.1	E139 I140 V141 L145 Q146 D147	E139-N143 WeakPolarHBondContact O-CB 3.48Å; E139-N143 PolarHBondContact O-N 3.29Å; E139-N143 PolarHBondContact O-ND2 3.48Å; I140-N143 WeakPolarHBondContact O-CB 3.08Å; I140-N143 PolarHBondContact O-N 3.5Å; V141-N143 VanDerWaalsContact C-N 3.31Å; V141-N143 PolarHBondContact O-N 2.95Å; N143-L145 PolarHBondContact O-N 3.1Å; N143-Q146 PolarHBondContact O-N 2.75Å; N143-D147 PolarHBondContact O-N 3.04Å
144	F	73.9	Confident	68.5	Low	1 Å²	1	49.3 Å²	49.3	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-61	-32.8	172	-91.1	-74.5	0	0	0	112.3	I140 V141 M149 N153 L156 Q187 L191 Y194	I140-F144 HydrophobicContact CG2-CD2 3.88Å; I140-F144 HydrophobicContact CG2-CE2 3.87Å; I140-F144 WeakPolarHBondContact O-CD2 3.4Å; I140-F144 PolarHBondContact O-N 2.89Å; V141-F144 CarbonylContact O-C 3.6Å; V141-F144 WeakPolarHBondContact O-CB 3.34Å; V141-F144 PolarHBondContact O-N 2.87Å; F144-M149 HydrophobicContact CE1-CE 4.35Å; F144-M149 HydrophobicContact CE1-SD 4.47Å; F144-N153 HydrophobicContact CE1-CB 4.14Å; F144-N153 HydrophobicContact CZ-CB 4.27Å; F144-L156 HydrophobicContact CE2-CD1 3.93Å; F144-L156 HydrophobicContact CZ-CD1 4.43Å; F144-Q187 WeakPolarHBondContact O-CG 3.36Å; F144-Q187 PolarHBondContact O-NE2 3.44Å; F144-L191 HydrophobicContact CB-CB 4.11Å; F144-L191 HydrophobicContact CB-CD1 3.86Å; F144-L191 HydrophobicContact CB-CG 4.4Å; F144-L191 HydrophobicContact CD1-CB 4.11Å; F144-L191 HydrophobicContact CD2-CD1 4.24Å; F144-L191 HydrophobicContact CG-CB 4.1Å; F144-L191 HydrophobicContact CG-CD1 4.13Å; F144-Y194 HydrophobicContact CE2-CD1 4.23Å; F144-Y194 HydrophobicContact CE2-CD2 4.46Å; F144-Y194 AromaticContact CE2-CG 3.97Å; F144-Y194 HydrophobicContact CE2-CG 3.97Å
145	L	71.4	Confident	67.3	Low	28 Å²	28	51.1 Å²	51.1	15%	0.147	26%	0.26	C	S	.	.	H	α-helix	trans	-83.3	-30.4	179.5	-67.7	174.5	0	0	0	113.3	V141 S142 N143 L191 L243 I245	V141-L145 HydrophobicContact CG1-CD1 4.03Å; V141-L145 HydrophobicContact CG1-CG 4.45Å; V141-L145 VanDerWaalsContact O-CG 3.32Å; V141-L145 WeakPolarHBondContact O-CG 3.48Å; V141-L145 PolarHBondContact O-N 3.19Å; S142-L145 CarbonylContact O-C 3.49Å; S142-L145 PolarHBondContact O-N 3.04Å; S142-L145 VanDerWaalsContact O-N 3.1Å; N143-L145 PolarHBondContact O-N 3.1Å; L145-L191 HydrophobicContact CD2-CD2 3.88Å; L145-L191 HydrophobicContact CG-CD2 4.38Å; L145-L243 HydrophobicContact CD1-CD1 3.68Å; L145-I245 HydrophobicContact CD1-CD1 4Å; L145-I245 HydrophobicContact CD2-CD1 3.99Å
146	Q	69.8	Low	65.9	Low	97 Å²	97	48.8 Å²	48.8	45%	0.453	25%	0.248	S	C	.	.	H	α-helix	trans	-91.8	-46.3	-175.4	-69.3	179.9	31.3	0	0	114.2	L51 S142 N143	L51-Q146 HydrophobicContact CD1-CG 4.29Å; S142-Q146 WeakPolarHBondContact O-CB 3.43Å; S142-Q146 VanDerWaalsContact O-CG 3.31Å; S142-Q146 WeakPolarHBondContact O-CG 3.42Å; S142-Q146 PolarHBondContact O-N 3.04Å; S142-Q146 PolarHBondContact OG-NE2 3.4Å; N143-Q146 PolarHBondContact O-N 2.75Å
147	D	57.9	Low	64.5	Low	107 Å²	107	48.8 Å²	48.8	57%	0.572	25%	0.248	S	C	*	.	S	Bend	trans	-105.2	3.4	-159.1	-85.8	-9.4	0	0	0	115.7	N143 T150	N143-D147 PolarHBondContact O-N 3.04Å; D147-T150 HydrophobicContact CB-CG2 4.49Å
148	G	53.9	Low	63.2	Low	19 Å²	19	49.8 Å²	49.8	20%	0.196	26%	0.259	C	S	.	.			trans	65.7	-176.2	-175.3	0	0	0	0	0	113.4	T150 N153	G148-T150 PolarHBondContact O-N 3.23Å; G148-N153 PolarHBondContact O-ND2 2.91Å
149	M	47.6	Very low	61.7	Low	47 Å²	47	53.9 Å²	53.9	23%	0.232	29%	0.289	C	S	.	.	S	Bend	trans	-74.1	92.2	176.5	-85.8	-68.9	-164.6	0	0	111.2	F144 N153 V154 L157 I164 P186 Q187	F144-M149 HydrophobicContact CE1-CE 4.35Å; F144-M149 HydrophobicContact CE1-SD 4.47Å; M149-N153 HydrophobicContact SD-CB 4.39Å; M149-V154 HydrophobicContact SD-CG2 4.19Å; M149-L157 HydrophobicContact CE-CD1 4.32Å; M149-I164 HydrophobicContact CE-CD1 3.7Å; M149-I164 HydrophobicContact CE-CG2 4.38Å; M149-P186 WeakPolarHBondContact CE-O 3.5Å; M149-P186 HydrophobicContact CG-CB 4.28Å; M149-Q187 HydrophobicContact CG-CB 4.45Å
150	T	53.2	Low	60.1	Low	50 Å²	50	53.6 Å²	53.6	31%	0.307	29%	0.289	S	S	.	.			trans	-87.3	158.6	168.8	61	0	0	0	0	110.7	D147 G148 R152 N153 V154	D147-T150 HydrophobicContact CB-CG2 4.49Å; G148-T150 PolarHBondContact O-N 3.23Å; T150-R152 PolarHBondContact O-N 3.21Å; T150-R152 VanDerWaalsContact O-N 3.09Å; T150-N153 PolarHBondContact O-N 3.14Å; T150-N153 PolarHBondContact OG1-N 3.23Å; T150-N153 PolarHBondContact OG1-ND2 3.36Å; T150-V154 PolarHBondContact O-N 3.48Å; T150-V154 VanDerWaalsContact O-N 3.17Å
151	E	50.4	Low	58.6	Low	183 Å²	183	54.7 Å²	54.7	86%	0.855	30%	0.298	S	S	*	.	H	α-helix	trans	-51.4	-32.9	171.3	-78.3	-176.4	163.6	0	0	111.8	V154 S155	E151-V154 PolarHBondContact O-N 2.92Å; E151-S155 PolarHBondContact O-N 3.38Å
152	R	52.2	Low	57	Low	184 Å²	184	59.4 Å²	59.4	69%	0.694	34%	0.337	S	S	*	.	H	α-helix	trans	-63.5	-39.4	174.6	-65	179.2	179	174.2	-2.9	113.1	T150 S155	T150-R152 PolarHBondContact O-N 3.21Å; T150-R152 VanDerWaalsContact O-N 3.09Å; R152-S155 PolarHBondContact O-OG 3.4Å
153	N	52.4	Low	55.5	Low	7 Å²	7	61.2 Å²	61.2	4%	0.037	35%	0.349	C	S	.	.	H	α-helix	trans	-74.3	-31.9	178.6	-69.5	-18.9	0	0	0	111.8	F144 G148 M149 T150 L156	F144-N153 HydrophobicContact CE1-CB 4.14Å; F144-N153 HydrophobicContact CZ-CB 4.27Å; G148-N153 PolarHBondContact O-ND2 2.91Å; M149-N153 HydrophobicContact SD-CB 4.39Å; T150-N153 PolarHBondContact O-N 3.14Å; T150-N153 PolarHBondContact OG1-N 3.23Å; T150-N153 PolarHBondContact OG1-ND2 3.36Å; N153-L156 WeakPolarHBondContact O-CB 3.43Å; N153-L156 PolarHBondContact O-N 2.96Å
154	V	51.8	Low	54.2	Low	64 Å²	64	60.7 Å²	60.7	39%	0.388	35%	0.346	S	S	.	.	H	α-helix	trans	-66.1	-37.8	175.7	178.8	0	0	0	0	111.6	M149 T150 E151 L156 L157 A161	M149-V154 HydrophobicContact SD-CG2 4.19Å; T150-V154 PolarHBondContact O-N 3.48Å; T150-V154 VanDerWaalsContact O-N 3.17Å; E151-V154 PolarHBondContact O-N 2.92Å; V154-L156 VanDerWaalsContact C-N 3.26Å; V154-L156 PolarHBondContact O-N 2.61Å; V154-L157 PolarHBondContact O-N 3.46Å; V154-A161 HydrophobicContact CG1-CB 3.89Å
155	S	56.5	Low	52.7	Low	75 Å²	75	63.1 Å²	63.1	52%	0.524	36%	0.362	S	S	.	.	H	α-helix	trans	-63.4	-28.6	177.1	48.1	0	0	0	0	114.1	E151 R152 L157 G158	E151-S155 PolarHBondContact O-N 3.38Å; R152-S155 PolarHBondContact O-OG 3.4Å; S155-L157 PolarHBondContact O-N 3.37Å; S155-G158 PolarHBondContact O-N 3.48Å; S155-G158 VanDerWaalsContact O-N 3.15Å
156	L	55.2	Low	51.1	Low	7 Å²	7	65.1 Å²	65.1	4%	0.037	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.9	177.6	-64.6	171.7	0	0	0	113.2	H96 V97 I140 F144 N153 V154 Y194	H96-L156 PolarHBondContact CD2-O 3.45Å; V97-L156 HydrophobicContact CG2-CD2 3.39Å; I140-L156 HydrophobicContact CG2-CD1 3.75Å; F144-L156 HydrophobicContact CE2-CD1 3.93Å; F144-L156 HydrophobicContact CZ-CD1 4.43Å; N153-L156 WeakPolarHBondContact O-CB 3.43Å; N153-L156 PolarHBondContact O-N 2.96Å; V154-L156 VanDerWaalsContact C-N 3.26Å; V154-L156 PolarHBondContact O-N 2.61Å; L156-Y194 HydrophobicContact CB-CD2 4.21Å; L156-Y194 HydrophobicContact CB-CE2 4.31Å
157	L	53.1	Low	49.5	Very low	1 Å²	1	69.9 Å²	69.9	1%	0.005	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-7.7	-179.7	-67.1	141.1	0	0	0	112.3	M149 V154 S155 D160 A161 I164 K193	M149-L157 HydrophobicContact CE-CD1 4.32Å; V154-L157 PolarHBondContact O-N 3.46Å; S155-L157 PolarHBondContact O-N 3.37Å; L157-D160 WeakPolarHBondContact O-CB 3.27Å; L157-D160 PolarHBondContact O-N 3.1Å; L157-D160 VanDerWaalsContact O-N 3.08Å; L157-A161 HydrophobicContact CB-CB 3.97Å; L157-A161 PolarHBondContact O-N 3.3Å; L157-I164 HydrophobicContact CD1-CD1 3.18Å; L157-I164 HydrophobicContact CD2-CD1 4.07Å; L157-I164 HydrophobicContact CG-CD1 4.11Å; L157-K193 HydrophobicContact CD2-CB 3.91Å
158	G	55	Low	48.2	Very low	25 Å²	25	70.1 Å²	70.1	26%	0.258	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	57.6	-140.3	177	0	0	0	0	0	114.6	H96 S155 D160 A161	H96-G158 WeakPolarHBondContact NE2-CA 3.35Å; H96-G158 PolarHBondContact NE2-N 3.17Å; S155-G158 PolarHBondContact O-N 3.48Å; S155-G158 VanDerWaalsContact O-N 3.15Å; G158-D160 PolarHBondContact O-N 2.87Å; G158-A161 WeakPolarHBondContact O-CB 3.37Å; G158-A161 PolarHBondContact O-N 3.21Å; G158-A161 VanDerWaalsContact O-N 3.13Å
159	T	50.5	Low	47.3	Very low	127 Å²	127	72 Å²	72	78%	0.779	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-60.7	-21.5	173.6	51.3	0	0	0	0	113.3	A161	T159-A161 VanDerWaalsContact C-N 3.26Å; T159-A161 PolarHBondContact O-N 2.95Å
160	D	47.8	Very low	46.6	Very low	55 Å²	55	72.7 Å²	72.7	29%	0.294	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-77.5	-12.1	179	-62.8	-26.8	0	0	0	112.2	L157 G158 A162 S163 R200	L157-D160 WeakPolarHBondContact O-CB 3.27Å; L157-D160 PolarHBondContact O-N 3.1Å; L157-D160 VanDerWaalsContact O-N 3.08Å; G158-D160 PolarHBondContact O-N 2.87Å; D160-A162 PolarHBondContact O-N 3.4Å; D160-S163 WeakPolarHBondContact O-CB 3.24Å; D160-S163 PolarHBondContact O-N 2.85Å; D160-S163 PolarHBondContact O-OG 2.95Å; D160-R200 IonicContact OD2-NH1 2.83Å
161	A	47.6	Very low	45.7	Very low	22 Å²	22	77.9 Å²	77.9	18%	0.182	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-57.2	-30.7	174.3	0	0	0	0	0	113.2	V154 L157 G158 T159 S163 I164	V154-A161 HydrophobicContact CG1-CB 3.89Å; L157-A161 HydrophobicContact CB-CB 3.97Å; L157-A161 PolarHBondContact O-N 3.3Å; G158-A161 WeakPolarHBondContact O-CB 3.37Å; G158-A161 PolarHBondContact O-N 3.21Å; G158-A161 VanDerWaalsContact O-N 3.13Å; T159-A161 VanDerWaalsContact C-N 3.26Å; T159-A161 PolarHBondContact O-N 2.95Å; A161-S163 PolarHBondContact O-N 2.88Å; A161-S163 VanDerWaalsContact O-N 3.11Å; A161-I164 PolarHBondContact O-N 3.45Å; A161-I164 VanDerWaalsContact O-N 3.16Å
162	A	45.1	Very low	44.7	Very low	99 Å²	99	76.9 Å²	76.9	82%	0.818	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-65	-12.7	177.6	0	0	0	0	0	113.8	D160	D160-A162 PolarHBondContact O-N 3.4Å
163	S	45.7	Very low	43.7	Very low	55 Å²	55	77.9 Å²	77.9	39%	0.385	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-98.8	-5.8	178.7	75.4	0	0	0	0	114.2	D160 A161 P165 K193	D160-S163 WeakPolarHBondContact O-CB 3.24Å; D160-S163 PolarHBondContact O-N 2.85Å; D160-S163 PolarHBondContact O-OG 2.95Å; A161-S163 PolarHBondContact O-N 2.88Å; A161-S163 VanDerWaalsContact O-N 3.11Å; S163-P165 WeakPolarHBondContact O-CD 3.38Å; S163-K193 PolarHBondContact O-NZ 3.32Å; S163-K193 VanDerWaalsContact O-NZ 3.17Å; S163-K193 PolarHBondContact OG-NZ 3.35Å
164	I	46.6	Very low	42.9	Very low	21 Å²	21	80.6 Å²	80.6	11%	0.108	48%	0.475	C	S	.	.	S	Bend	trans	-75.8	118.2	165.8	-60.1	-179.7	0	0	0	103.9	M149 L157 A161 S166 P186 K193	M149-I164 HydrophobicContact CE-CD1 3.7Å; M149-I164 HydrophobicContact CE-CG2 4.38Å; L157-I164 HydrophobicContact CD1-CD1 3.18Å; L157-I164 HydrophobicContact CD2-CD1 4.07Å; L157-I164 HydrophobicContact CG-CD1 4.11Å; A161-I164 PolarHBondContact O-N 3.45Å; A161-I164 VanDerWaalsContact O-N 3.16Å; I164-S166 PolarHBondContact O-N 3.27Å; I164-P186 HydrophobicContact CG2-CB 4.43Å; I164-K193 HydrophobicContact CG1-CD 3.9Å
165	P	42.1	Very low	42.3	Very low	52 Å²	52	82.7 Å²	82.7	34%	0.338	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-53.3	122.2	176.6	-14.6	25.2	0	0	0	106.5	S163 V169	S163-P165 WeakPolarHBondContact O-CD 3.38Å; P165-V169 HydrophobicContact CB-CG2 3.38Å; P165-V169 HydrophobicContact CG-CG2 4.19Å
166	S	38.4	Very low	41.8	Very low	70 Å²	70	84.7 Å²	84.7	49%	0.49	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-51.8	164.8	164.7	58.4	0	0	0	0	107.1	I164 D168 V169	I164-S166 PolarHBondContact O-N 3.27Å; S166-D168 PolarHBondContact O-N 2.86Å; S166-D168 VanDerWaalsContact OG-CB 3.28Å; S166-D168 WeakPolarHBondContact OG-CB 3.42Å; S166-D168 PolarHBondContact OG-N 2.91Å; S166-D168 PolarHBondContact OG-OD2 2.9Å; S166-V169 PolarHBondContact O-N 3.14Å
167	Y	37.7	Very low	41.4	Very low	197 Å²	197	88.2 Å²	88.2	77%	0.773	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	-9.2	168.8	-77.1	-92.4	0	0	0	113.4	V169 S170	Y167-V169 PolarHBondContact O-N 2.87Å; Y167-S170 PolarHBondContact O-N 2.69Å
168	D	30.2	Very low	41.2	Very low	112 Å²	112	88.3 Å²	88.3	60%	0.599	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	35.3	171.1	-45.5	-61.3	0	0	0	117.8	S166 S170	S166-D168 PolarHBondContact O-N 2.86Å; S166-D168 VanDerWaalsContact OG-CB 3.28Å; S166-D168 WeakPolarHBondContact OG-CB 3.42Å; S166-D168 PolarHBondContact OG-N 2.91Å; S166-D168 PolarHBondContact OG-OD2 2.9Å; D168-S170 WeakPolarHBondContact CA-OG 3.36Å
169	V	35.1	Very low	41.1	Very low	59 Å²	59	92.2 Å²	92.2	36%	0.358	51%	0.513	S	S	.	.			trans	-86.6	30.3	138.8	-157.6	0	0	0	0	109.6	P165 S166 Y167 R183	P165-V169 HydrophobicContact CB-CG2 3.38Å; P165-V169 HydrophobicContact CG-CG2 4.19Å; S166-V169 PolarHBondContact O-N 3.14Å; Y167-V169 PolarHBondContact O-N 2.87Å; V169-R183 VanDerWaalsContact CG1-NH2 3.29Å
170	S	31.6	Very low	41.3	Very low	61 Å²	61	90.4 Å²	90.4	43%	0.427	50%	0.498	S	S	.	.	S	Bend	trans	-75.9	121.6	154.6	60.8	0	0	0	0	109.4	Y167 D168 K172	Y167-S170 PolarHBondContact O-N 2.69Å; D168-S170 WeakPolarHBondContact CA-OG 3.36Å; S170-K172 VanDerWaalsContact C-N 3.3Å; S170-K172 PolarHBondContact O-N 3.13Å
171	D	34.8	Very low	41.9	Very low	159 Å²	159	87.8 Å²	87.8	85%	0.85	48%	0.484	S	S	*	.			trans	47	33.3	145.1	-73.3	-17.2	0	0	0	119.2	M173	D171-M173 PolarHBondContact O-N 3.36Å
172	K	30.5	Very low	42.8	Very low	163 Å²	163	87 Å²	87	71%	0.709	48%	0.477	S	S	*	.			trans	-65.9	96.7	144.4	-77.8	-169.4	-175.4	173	0	105.8	S170 G174 D175	S170-K172 VanDerWaalsContact C-N 3.3Å; S170-K172 PolarHBondContact O-N 3.13Å; K172-G174 PolarHBondContact O-N 3.15Å; K172-D175 PolarHBondContact O-N 3.49Å
173	M	29.3	Very low	43.8	Very low	204 Å²	204	88.1 Å²	88.1	100%	1.005	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	86	175	-152.1	178.7	-167.9	0	0	108.1	D171	D171-M173 PolarHBondContact O-N 3.36Å
174	G	37.2	Very low	45.1	Very low	64 Å²	64	86.4 Å²	86.4	66%	0.66	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	154.7	-28.8	-168	0	0	0	0	0	116.9	K172 R176	K172-G174 PolarHBondContact O-N 3.15Å; G174-R176 PolarHBondContact O-N 3.18Å
175	D	38.4	Very low	46.5	Very low	109 Å²	109	88.8 Å²	88.8	58%	0.583	46%	0.461	S	S	*	.			trans	-72	116.8	179.2	-82.5	-18.1	0	0	0	110.9	K172	K172-D175 PolarHBondContact O-N 3.49Å
176	R	46.4	Very low	48	Very low	116 Å²	116	88.1 Å²	88.1	44%	0.438	46%	0.457	S	S	.	.			trans	-74.4	158	-166.7	-72	-175.2	-175.3	-168.8	1.2	113.2	G174 G178	G174-R176 PolarHBondContact O-N 3.18Å; R176-G178 PolarHBondContact O-N 3.37Å
177	P	46.6	Very low	49.8	Very low	81 Å²	81	86.4 Å²	86.4	53%	0.526	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-55.7	-24.8	-174.9	-25.3	33.6	0	0	0	116	Y179 L180	P177-Y179 VanDerWaalsContact C-N 3.33Å; P177-Y179 PolarHBondContact O-N 2.77Å; P177-L180 HydrophobicContact CB-CD1 4.03Å; P177-L180 WeakPolarHBondContact O-CA 3.36Å; P177-L180 WeakPolarHBondContact O-CB 3.46Å; P177-L180 VanDerWaalsContact O-CG 3.26Å; P177-L180 WeakPolarHBondContact O-CG 3.48Å; P177-L180 PolarHBondContact O-N 3.49Å
178	G	49.2	Very low	51.9	Low	3 Å²	3	78.1 Å²	78.1	3%	0.031	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-58.2	-37.8	-172.7	0	0	0	0	0	114.7	R176 L180 S181 L301	R176-G178 PolarHBondContact O-N 3.37Å; G178-L180 PolarHBondContact O-N 2.75Å; G178-S181 PolarHBondContact O-N 3.49Å; G178-S181 PolarHBondContact O-OG 3.32Å; G178-L301 VanDerWaalsContact CA-CD2 3.42Å
179	Y	52.3	Low	54.3	Low	108 Å²	108	73.3 Å²	73.3	42%	0.424	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-67.9	-18.2	176.2	-71.5	-81.7	0	0	0	113	P177 S181 F182 R183 I307	P177-Y179 VanDerWaalsContact C-N 3.33Å; P177-Y179 PolarHBondContact O-N 2.77Å; Y179-S181 PolarHBondContact O-N 2.84Å; Y179-F182 PolarHBondContact O-N 2.81Å; Y179-R183 PolarHBondContact O-N 2.86Å; Y179-I307 HydrophobicContact CD1-CD1 4.35Å; Y179-I307 HydrophobicContact CE1-CD1 4.41Å; Y179-I307 HydrophobicContact CE1-CG2 4.41Å
180	L	54.3	Low	56.4	Low	88 Å²	88	70.5 Å²	70.5	46%	0.461	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-62.2	-28.7	175	-60	165.4	0	0	0	111.8	P177 G178 F182 R183	P177-L180 HydrophobicContact CB-CD1 4.03Å; P177-L180 WeakPolarHBondContact O-CA 3.36Å; P177-L180 WeakPolarHBondContact O-CB 3.46Å; P177-L180 VanDerWaalsContact O-CG 3.26Å; P177-L180 WeakPolarHBondContact O-CG 3.48Å; P177-L180 PolarHBondContact O-N 3.49Å; G178-L180 PolarHBondContact O-N 2.75Å; L180-F182 VanDerWaalsContact C-N 3.25Å; L180-F182 PolarHBondContact O-N 2.85Å; L180-R183 VanDerWaalsContact CD2-NE 3.29Å; L180-R183 PolarHBondContact O-N 3.37Å
181	S	60.6	Low	58.9	Low	1 Å²	1	67.7 Å²	67.7	1%	0.007	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-67.8	-27.3	-175.6	66.7	0	0	0	0	113.6	G178 Y179 A297	G178-S181 PolarHBondContact O-N 3.49Å; G178-S181 PolarHBondContact O-OG 3.32Å; Y179-S181 PolarHBondContact O-N 2.84Å; S181-A297 WeakPolarHBondContact OG-CB 3.32Å
182	F	65.8	Low	61.3	Low	6 Å²	6	60.2 Å²	60.2	3%	0.026	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-106.5	8.8	178.7	-63.8	-73	0	0	0	112.6	Y179 L180 S184 A255 Y256 V293 L294 A297 L301 I307 W310 P311	Y179-F182 PolarHBondContact O-N 2.81Å; L180-F182 VanDerWaalsContact C-N 3.25Å; L180-F182 PolarHBondContact O-N 2.85Å; F182-S184 PolarHBondContact O-N 3.19Å; F182-A255 HydrophobicContact CD1-CB 3.9Å; F182-A255 HydrophobicContact CE1-CB 3.87Å; F182-Y256 HydrophobicContact CB-CD2 3.91Å; F182-Y256 HydrophobicContact CB-CG 4.48Å; F182-V293 HydrophobicContact CD1-CG1 4.28Å; F182-V293 HydrophobicContact CE1-CG1 4.37Å; F182-L294 HydrophobicContact CE1-CD2 4.44Å; F182-A297 HydrophobicContact CE1-CB 4.16Å; F182-A297 HydrophobicContact CE2-CB 3.93Å; F182-A297 HydrophobicContact CZ-CB 3.64Å; F182-L301 HydrophobicContact CE2-CD1 4.42Å; F182-I307 HydrophobicContact CD2-CD1 4.45Å; F182-I307 HydrophobicContact CE2-CD1 4.45Å; F182-W310 HydrophobicContact CD2-CE3 4.38Å; F182-W310 HydrophobicContact CE2-CE3 4.1Å; F182-P311 HydrophobicContact CZ-CG 4.16Å
183	R	68.1	Low	63.9	Low	121 Å²	121	52.6 Å²	52.6	46%	0.457	27%	0.274	S	S	.	.			trans	-61.9	124	178.4	-85.2	-169.9	-170.8	-166.6	6.9	110	V169 Y179 L180 R252	V169-R183 VanDerWaalsContact CG1-NH2 3.29Å; Y179-R183 PolarHBondContact O-N 2.86Å; L180-R183 VanDerWaalsContact CD2-NE 3.29Å; L180-R183 PolarHBondContact O-N 3.37Å; R183-R252 WeakPolarHBondContact O-CD 3.39Å
184	S	71.8	Confident	66.5	Low	20 Å²	20	43 Å²	43	14%	0.14	23%	0.226	C	C	.	.			trans	-118.9	155.8	169.8	170.4	0	0	0	0	108.5	F182 N188 D249	F182-S184 PolarHBondContact O-N 3.19Å; S184-N188 WeakPolarHBondContact OG-CB 3.31Å; S184-D249 WeakPolarHBondContact CA-OD1 3.34Å; S184-D249 WeakPolarHBondContact CB-O 3.41Å; S184-D249 PolarHBondContact OG-O 3.25Å; S184-D249 VanDerWaalsContact OG-O 3.07Å; S184-D249 PolarHBondContact OG-OD2 2.98Å
185	N	75.5	Confident	68.9	Low	71 Å²	71	40 Å²	40	38%	0.38	20%	0.195	S	C	.	.			trans	-54.2	133.7	166.6	-179.9	-21.8	0	0	0	109.1	Q187 N188 L189 D249	N185-Q187 PolarHBondContact O-N 3.29Å; N185-Q187 WeakPolarHBondContact OD1-CB 3.36Å; N185-Q187 PolarHBondContact OD1-N 3.03Å; N185-N188 PolarHBondContact O-N 3.18Å; N185-L189 PolarHBondContact O-N 3.11Å; N185-D249 WeakPolarHBondContact CB-OD2 3.35Å; N185-D249 PolarHBondContact N-OD1 3.18Å; N185-D249 PolarHBondContact N-OD2 3.49Å
186	P	73.7	Confident	71.1	Confident	38 Å²	38	35.2 Å²	35.2	25%	0.247	17%	0.17	C	C	.	.	H	α-helix	trans	-43.6	-36.6	173.5	-31.4	34.5	0	0	0	114.3	M149 I164 G190	M149-P186 WeakPolarHBondContact CE-O 3.5Å; M149-P186 HydrophobicContact CG-CB 4.28Å; I164-P186 HydrophobicContact CG2-CB 4.43Å; P186-G190 PolarHBondContact O-N 3.41Å
187	Q	77	Confident	73	Confident	34 Å²	34	29.9 Å²	29.9	16%	0.159	15%	0.15	C	C	.	.	H	α-helix	trans	-59.7	-54.8	176.8	-177.9	-179.4	3.6	0	0	113.1	F144 M149 N185 G190 L191	F144-Q187 WeakPolarHBondContact O-CG 3.36Å; F144-Q187 PolarHBondContact O-NE2 3.44Å; M149-Q187 HydrophobicContact CG-CB 4.45Å; N185-Q187 PolarHBondContact O-N 3.29Å; N185-Q187 WeakPolarHBondContact OD1-CB 3.36Å; N185-Q187 PolarHBondContact OD1-N 3.03Å; Q187-G190 PolarHBondContact O-N 3.21Å; Q187-L191 PolarHBondContact O-N 3.5Å
188	N	80.6	Confident	74.9	Confident	22 Å²	22	26.1 Å²	26.1	12%	0.118	13%	0.126	C	C	.	.	H	α-helix	trans	-70.7	-36.4	-179.1	-71.4	-30.4	0	0	0	111.6	S184 N185 G190 L191 V192 D249 I250	S184-N188 WeakPolarHBondContact OG-CB 3.31Å; N185-N188 PolarHBondContact O-N 3.18Å; N188-G190 VanDerWaalsContact C-N 3.34Å; N188-L191 PolarHBondContact O-N 3.47Å; N188-V192 WeakPolarHBondContact O-CG2 3.32Å; N188-V192 PolarHBondContact O-N 2.99Å; N188-D249 WeakPolarHBondContact CB-OD2 3.4Å; N188-D249 PolarHBondContact ND2-OD2 3.07Å; N188-I250 HydrophobicContact CB-CG1 4.12Å
189	L	81	Confident	76.7	Confident	12 Å²	12	26.1 Å²	26.1	6%	0.063	13%	0.125	C	C	.	.	H	α-helix	trans	-59.7	-46.3	170.8	-179	61.6	0	0	0	111.2	N185 V192 K193 A253 Y256	N185-L189 PolarHBondContact O-N 3.11Å; L189-V192 PolarHBondContact O-N 3.06Å; L189-K193 HydrophobicContact CD1-CG 4.38Å; L189-K193 HydrophobicContact CG-CD 4.32Å; L189-K193 WeakPolarHBondContact O-CB 3.37Å; L189-K193 VanDerWaalsContact O-CG 3.26Å; L189-K193 WeakPolarHBondContact O-CG 3.16Å; L189-K193 PolarHBondContact O-N 3.17Å; L189-A253 HydrophobicContact CB-CB 4.36Å; L189-A253 HydrophobicContact CD1-CB 4.25Å; L189-Y256 HydrophobicContact CD1-CD1 3.62Å; L189-Y256 HydrophobicContact CD1-CE1 4.13Å; L189-Y256 HydrophobicContact CD1-CG 4.44Å
190	G	80.6	Confident	78.2	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.3	-44.2	175.8	0	0	0	0	0	112.7	P186 Q187 N188 K193 Y194	P186-G190 PolarHBondContact O-N 3.41Å; Q187-G190 PolarHBondContact O-N 3.21Å; N188-G190 VanDerWaalsContact C-N 3.34Å; G190-K193 PolarHBondContact O-N 2.68Å; G190-Y194 VanDerWaalsContact O-CB 3.3Å; G190-Y194 WeakPolarHBondContact O-CB 3.31Å; G190-Y194 PolarHBondContact O-N 2.99Å
191	L	83.1	Confident	79.7	Confident	2 Å²	2	23.7 Å²	23.7	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-57.3	-51.5	175.6	172.2	60.8	0	0	0	111.7	V141 F144 L145 Q187 N188 K193 Y194 I195	V141-L191 HydrophobicContact CB-CD1 4.2Å; V141-L191 HydrophobicContact CG1-CD1 4.06Å; V141-L191 HydrophobicContact CG2-CD1 3.76Å; F144-L191 HydrophobicContact CB-CB 4.11Å; F144-L191 HydrophobicContact CB-CD1 3.86Å; F144-L191 HydrophobicContact CB-CG 4.4Å; F144-L191 HydrophobicContact CD1-CB 4.11Å; F144-L191 HydrophobicContact CD2-CD1 4.24Å; F144-L191 HydrophobicContact CG-CB 4.1Å; F144-L191 HydrophobicContact CG-CD1 4.13Å; L145-L191 HydrophobicContact CD2-CD2 3.88Å; L145-L191 HydrophobicContact CG-CD2 4.38Å; Q187-L191 PolarHBondContact O-N 3.5Å; N188-L191 PolarHBondContact O-N 3.47Å; L191-K193 PolarHBondContact O-N 2.93Å; L191-Y194 PolarHBondContact O-N 3.4Å; L191-I195 HydrophobicContact CD1-CD1 3.92Å; L191-I195 HydrophobicContact CD1-CG1 4.34Å; L191-I195 HydrophobicContact CG-CD1 4.18Å; L191-I195 WeakPolarHBondContact O-CG1 3.46Å; L191-I195 PolarHBondContact O-N 3.4Å
192	V	85.2	Confident	80.9	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.006	11%	0.11	C	C	.	.	H	α-helix	trans	-63.5	-43.2	179.8	173.2	0	0	0	0	111.1	N188 L189 Y194 I195 L196 I250 A253 L254 C257	N188-V192 WeakPolarHBondContact O-CG2 3.32Å; N188-V192 PolarHBondContact O-N 2.99Å; L189-V192 PolarHBondContact O-N 3.06Å; V192-Y194 VanDerWaalsContact C-N 3.33Å; V192-Y194 PolarHBondContact O-N 3.03Å; V192-I195 PolarHBondContact O-N 3.01Å; V192-L196 HydrophobicContact CG1-CD1 3.94Å; V192-L196 HydrophobicContact CG1-CG 4.4Å; V192-L196 VanDerWaalsContact O-CG 3.32Å; V192-L196 WeakPolarHBondContact O-CG 3.46Å; V192-L196 PolarHBondContact O-N 2.99Å; V192-I250 HydrophobicContact CG2-CG2 3.83Å; V192-A253 HydrophobicContact CB-CB 4.1Å; V192-A253 HydrophobicContact CG2-CB 3.73Å; V192-L254 HydrophobicContact CG1-CD1 4.26Å; V192-C257 HydrophobicContact CG1-CB 4.03Å
193	K	84.6	Confident	81.6	Confident	3 Å²	3	27 Å²	27	1%	0.013	13%	0.125	C	C	.	.	H	α-helix	trans	-60.3	-42.8	175.5	-76.2	-175.3	-177.8	-115.5	0	112.2	L157 S163 I164 L189 G190 L191 L196 T197 E261	L157-K193 HydrophobicContact CD2-CB 3.91Å; S163-K193 PolarHBondContact O-NZ 3.32Å; S163-K193 VanDerWaalsContact O-NZ 3.17Å; S163-K193 PolarHBondContact OG-NZ 3.35Å; I164-K193 HydrophobicContact CG1-CD 3.9Å; L189-K193 HydrophobicContact CD1-CG 4.38Å; L189-K193 HydrophobicContact CG-CD 4.32Å; L189-K193 WeakPolarHBondContact O-CB 3.37Å; L189-K193 VanDerWaalsContact O-CG 3.26Å; L189-K193 WeakPolarHBondContact O-CG 3.16Å; L189-K193 PolarHBondContact O-N 3.17Å; G190-K193 PolarHBondContact O-N 2.68Å; L191-K193 PolarHBondContact O-N 2.93Å; K193-L196 PolarHBondContact O-N 3.31Å; K193-T197 VanDerWaalsContact O-CB 3.27Å; K193-T197 WeakPolarHBondContact O-CB 3.3Å; K193-T197 PolarHBondContact O-N 3.27Å; K193-T197 PolarHBondContact O-OG1 3.4Å; K193-E261 WeakPolarHBondContact CD-OE1 3.47Å; K193-E261 WeakPolarHBondContact CE-OE1 3.42Å; K193-E261 VanDerWaalsContact CG-OE1 3.31Å; K193-E261 WeakPolarHBondContact CG-OE1 3.35Å; K193-E261 IonicContact NZ-OE1 3.68Å; K193-E261 PolarHBondContact NZ-OE1 3.15Å
194	Y	85.1	Confident	82.1	Confident	2 Å²	2	24.1 Å²	24.1	1%	0.008	12%	0.121	C	C	.	.	H	α-helix	trans	-59.9	-50.6	177.1	172	-99.1	0	0	0	110.6	M95 I140 F144 L156 G190 L191 V192 L196 T197 C198	M95-Y194 WeakPolarHBondContact O-CE2 3.31Å; M95-Y194 PolarHBondContact O-OH 3.18Å; I140-Y194 HydrophobicContact CB-CE1 4.27Å; I140-Y194 WeakPolarHBondContact CD1-OH 3.48Å; I140-Y194 HydrophobicContact CG2-CD1 4.04Å; I140-Y194 HydrophobicContact CG2-CE1 3.48Å; I140-Y194 VanDerWaalsContact CG2-CE1 3.48Å; I140-Y194 HydrophobicContact CG2-CE2 4.18Å; F144-Y194 HydrophobicContact CE2-CD1 4.23Å; F144-Y194 HydrophobicContact CE2-CD2 4.46Å; F144-Y194 AromaticContact CE2-CG 3.97Å; F144-Y194 HydrophobicContact CE2-CG 3.97Å; L156-Y194 HydrophobicContact CB-CD2 4.21Å; L156-Y194 HydrophobicContact CB-CE2 4.31Å; G190-Y194 VanDerWaalsContact O-CB 3.3Å; G190-Y194 WeakPolarHBondContact O-CB 3.31Å; G190-Y194 PolarHBondContact O-N 2.99Å; L191-Y194 PolarHBondContact O-N 3.4Å; V192-Y194 VanDerWaalsContact C-N 3.33Å; V192-Y194 PolarHBondContact O-N 3.03Å; Y194-L196 PolarHBondContact O-N 3.07Å; Y194-T197 WeakPolarHBondContact O-CB 3.33Å; Y194-T197 PolarHBondContact O-N 3.15Å; Y194-T197 VanDerWaalsContact O-N 3.13Å; Y194-C198 PolarHBondContact O-N 3.44Å; Y194-C198 PolarHBondContact O-SG 2.91Å; Y194-C198 VanDerWaalsContact O-SG 3.35Å
195	I	86.3	Confident	81.8	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-55.4	-49.6	176.6	-70.5	172.4	0	0	0	111.2	L191 V192 T197 C198 C199 I230 L234	L191-I195 HydrophobicContact CD1-CD1 3.92Å; L191-I195 HydrophobicContact CD1-CG1 4.34Å; L191-I195 HydrophobicContact CG-CD1 4.18Å; L191-I195 WeakPolarHBondContact O-CG1 3.46Å; L191-I195 PolarHBondContact O-N 3.4Å; V192-I195 PolarHBondContact O-N 3.01Å; I195-T197 VanDerWaalsContact C-N 3.31Å; I195-T197 PolarHBondContact O-N 2.99Å; I195-C198 PolarHBondContact O-N 3.47Å; I195-C199 PolarHBondContact O-N 3.49Å; I195-C199 PolarHBondContact O-SG 3.27Å; I195-C199 VanDerWaalsContact O-SG 3.41Å; I195-I230 HydrophobicContact CB-CG2 4.39Å; I195-I230 HydrophobicContact CG2-CG2 3.66Å; I195-L234 HydrophobicContact CD1-CB 4.34Å; I195-L234 HydrophobicContact CD1-CD1 3.96Å; I195-L234 HydrophobicContact CG2-CB 4.25Å; I195-L234 HydrophobicContact CG2-CD2 4.27Å
196	L	85.7	Confident	81	Confident	9 Å²	9	24.5 Å²	24.5	5%	0.047	13%	0.126	C	C	.	.	H	α-helix	trans	-64.3	-36.3	179.1	-70.4	173.6	0	0	0	112.7	V192 K193 Y194 C199 R200 C257 V263 F267	V192-L196 HydrophobicContact CG1-CD1 3.94Å; V192-L196 HydrophobicContact CG1-CG 4.4Å; V192-L196 VanDerWaalsContact O-CG 3.32Å; V192-L196 WeakPolarHBondContact O-CG 3.46Å; V192-L196 PolarHBondContact O-N 2.99Å; K193-L196 PolarHBondContact O-N 3.31Å; Y194-L196 PolarHBondContact O-N 3.07Å; L196-C199 PolarHBondContact O-N 3.44Å; L196-R200 WeakPolarHBondContact O-CB 3.4Å; L196-R200 PolarHBondContact O-N 3.49Å; L196-C257 HydrophobicContact CD1-CB 3.31Å; L196-V263 HydrophobicContact CD1-CG2 3.93Å; L196-V263 HydrophobicContact CD2-CG1 4.14Å; L196-V263 HydrophobicContact CD2-CG2 4.04Å; L196-F267 HydrophobicContact CD2-CD1 3.97Å; L196-F267 HydrophobicContact CD2-CD2 3.93Å; L196-F267 HydrophobicContact CD2-CE1 3.65Å; L196-F267 HydrophobicContact CD2-CE2 3.62Å; L196-F267 HydrophobicContact CD2-CG 4.09Å; L196-F267 HydrophobicContact CD2-CZ 3.46Å; L196-F267 VanDerWaalsContact CD2-CZ 3.46Å
197	T	85.4	Confident	80	Confident	5 Å²	5	31.2 Å²	31.2	3%	0.031	16%	0.16	C	C	.	.	H	α-helix	trans	-65.3	-44.7	176	-59.9	0	0	0	0	110.4	K193 Y194 I195 C199 R200 R201	K193-T197 VanDerWaalsContact O-CB 3.27Å; K193-T197 WeakPolarHBondContact O-CB 3.3Å; K193-T197 PolarHBondContact O-N 3.27Å; K193-T197 PolarHBondContact O-OG1 3.4Å; Y194-T197 WeakPolarHBondContact O-CB 3.33Å; Y194-T197 PolarHBondContact O-N 3.15Å; Y194-T197 VanDerWaalsContact O-N 3.13Å; I195-T197 VanDerWaalsContact C-N 3.31Å; I195-T197 PolarHBondContact O-N 2.99Å; T197-C199 PolarHBondContact O-N 2.88Å; T197-R200 PolarHBondContact O-N 3.19Å; T197-R201 HydrophobicContact CG2-CG 4.42Å; T197-R201 WeakPolarHBondContact O-CB 3.2Å; T197-R201 WeakPolarHBondContact O-CG 3.3Å; T197-R201 PolarHBondContact O-N 3.45Å
198	C	87.1	Confident	79.1	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.007	16%	0.159	C	C	.	.	H	α-helix	trans	-60.1	-45.7	174.7	-66.3	0	0	0	0	111.5	V94 Y194 I195 R200 R201 A202 I230	V94-C198 WeakPolarHBondContact O-CA 3.48Å; V94-C198 PolarHBondContact O-SG 3.47Å; V94-C198 VanDerWaalsContact O-SG 3.37Å; Y194-C198 PolarHBondContact O-N 3.44Å; Y194-C198 PolarHBondContact O-SG 2.91Å; Y194-C198 VanDerWaalsContact O-SG 3.35Å; I195-C198 PolarHBondContact O-N 3.47Å; C198-R200 VanDerWaalsContact C-N 3.35Å; C198-R200 PolarHBondContact O-N 2.95Å; C198-R201 PolarHBondContact O-N 2.99Å; C198-A202 WeakPolarHBondContact O-CB 3.49Å; C198-A202 PolarHBondContact O-N 2.88Å; C198-I230 HydrophobicContact CB-CD1 3.66Å; C198-I230 HydrophobicContact CB-CG2 4.46Å
199	C	86.7	Confident	78	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.02	18%	0.18	C	C	.	.	H	α-helix	trans	-59	-43.9	174.3	-69.7	0	0	0	0	112.3	I195 L196 T197 A202 H203 C227 I230 F267	I195-C199 PolarHBondContact O-N 3.49Å; I195-C199 PolarHBondContact O-SG 3.27Å; I195-C199 VanDerWaalsContact O-SG 3.41Å; L196-C199 PolarHBondContact O-N 3.44Å; T197-C199 PolarHBondContact O-N 2.88Å; C199-A202 PolarHBondContact O-N 2.85Å; C199-H203 PolarHBondContact O-CD2 3.44Å; C199-H203 PolarHBondContact O-N 3.26Å; C199-C227 VanDerWaalsContact SG-SG 3.69Å; C199-I230 WeakPolarHBondContact SG-CG2 3.45Å; C199-F267 HydrophobicContact CB-CD2 4.17Å
200	R	84.4	Confident	77	Confident	104 Å²	104	39.9 Å²	39.9	39%	0.392	22%	0.221	S	C	.	.	H	α-helix	trans	-62.2	-45.7	177.5	-169.7	-173.3	-61.7	135.8	0.8	111.1	D160 L196 T197 C198 H203 E261	D160-R200 IonicContact OD2-NH1 2.83Å; L196-R200 WeakPolarHBondContact O-CB 3.4Å; L196-R200 PolarHBondContact O-N 3.49Å; T197-R200 PolarHBondContact O-N 3.19Å; C198-R200 VanDerWaalsContact C-N 3.35Å; C198-R200 PolarHBondContact O-N 2.95Å; R200-H203 PolarHBondContact O-N 3.22Å; R200-E261 PolarHBondContact NH2-O 3.43Å
201	R	86.2	Confident	76.4	Confident	42 Å²	42	41.2 Å²	41.2	16%	0.158	23%	0.228	C	C	.	.	H	α-helix	trans	-68.6	-34.4	-179.5	-69.8	-172.9	-173.9	-172.8	2.3	112.7	H93 H96 T197 C198 H203 T204	H93-R201 WeakPolarHBondContact O-CD 3.35Å; H93-R201 PolarHBondContact O-NH1 2.62Å; H96-R201 PolarHBondContact CD2-NH1 3.15Å; H96-R201 PolarHBondContact CD2-NH2 2.64Å; H96-R201 PolarHBondContact ND1-NH1 3.33Å; H96-R201 PolarHBondContact NE2-NH2 3.1Å; T197-R201 HydrophobicContact CG2-CG 4.42Å; T197-R201 WeakPolarHBondContact O-CB 3.2Å; T197-R201 WeakPolarHBondContact O-CG 3.3Å; T197-R201 PolarHBondContact O-N 3.45Å; C198-R201 PolarHBondContact O-N 2.99Å; R201-H203 PolarHBondContact O-N 2.87Å; R201-H203 VanDerWaalsContact O-N 3.17Å; R201-T204 WeakPolarHBondContact CA-OG1 3.46Å; R201-T204 PolarHBondContact O-N 2.88Å; R201-T204 PolarHBondContact O-OG1 3.39Å
202	A	85.4	Confident	76	Confident	2 Å²	2	44.9 Å²	44.9	2%	0.017	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-24.4	173.3	0	0	0	0	0	113	Y90 V94 C198 C199 G223 C227	Y90-A202 PolarHBondContact OH-O 3.07Å; V94-A202 HydrophobicContact CG1-CB 3.88Å; V94-A202 HydrophobicContact CG2-CB 4.39Å; C198-A202 WeakPolarHBondContact O-CB 3.49Å; C198-A202 PolarHBondContact O-N 2.88Å; C199-A202 PolarHBondContact O-N 2.85Å; A202-G223 WeakPolarHBondContact CB-O 3.25Å; A202-C227 HydrophobicContact CB-CB 3.98Å
203	H	79.9	Confident	75.6	Confident	75 Å²	75	52 Å²	52	35%	0.347	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-2.9	173.4	-66.4	-58.1	0	0	0	114.5	C199 R200 R201 C227	C199-H203 PolarHBondContact O-CD2 3.44Å; C199-H203 PolarHBondContact O-N 3.26Å; R200-H203 PolarHBondContact O-N 3.22Å; R201-H203 PolarHBondContact O-N 2.87Å; R201-H203 VanDerWaalsContact O-N 3.17Å; H203-C227 PolarHBondContact NE2-SG 2.83Å
204	T	78.1	Confident	75.2	Confident	60 Å²	60	53.7 Å²	53.7	37%	0.368	30%	0.297	S	S	.	.	S	Bend	trans	-109.1	144.4	178.8	63.1	0	0	0	0	110.8	H93 R201 G206	H93-T204 PolarHBondContact NE2-OG1 2.72Å; R201-T204 WeakPolarHBondContact CA-OG1 3.46Å; R201-T204 PolarHBondContact O-N 2.88Å; R201-T204 PolarHBondContact O-OG1 3.39Å; T204-G206 VanDerWaalsContact C-N 3.28Å; T204-G206 PolarHBondContact O-N 2.9Å
205	H	65.8	Low	74.9	Confident	68 Å²	68	54.3 Å²	54.3	32%	0.315	30%	0.301	S	S	.	.			trans	-77.3	-7.6	-179.5	-65.3	-82.3	0	0	0	114.5	V208 E220	H205-V208 WeakPolarHBondContact O-CB 3.26Å; H205-V208 WeakPolarHBondContact O-CG2 3.47Å; H205-E220 WeakPolarHBondContact CE1-CG 3.35Å; H205-E220 IonicContact CE1-OE1 2.68Å; H205-E220 PolarHBondContact CE1-OE1 3.15Å; H205-E220 IonicContact NE2-OE1 3.87Å; H205-E220 PolarHBondContact NE2-OE1 3.17Å
206	G	58	Low	74.6	Confident	31 Å²	31	57.8 Å²	57.8	32%	0.32	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	-171.6	-168.8	0	0	0	0	0	112.9	T204 V208	T204-G206 VanDerWaalsContact C-N 3.28Å; T204-G206 PolarHBondContact O-N 2.9Å; G206-V208 PolarHBondContact O-N 3.49Å
207	D	54.3	Low	74.4	Confident	178 Å²	178	62.4 Å²	62.4	95%	0.952	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	36.2	171.4	-88.5	-23.6	0	0	0	112.1	G209	D207-G209 PolarHBondContact O-N 3.14Å
208	V	57.4	Low	74.3	Confident	22 Å²	22	67.8 Å²	67.8	13%	0.133	36%	0.361	C	S	.	.			trans	-80.3	64.2	-179.6	-168.2	0	0	0	0	109.3	V86 H205 G206 L211	V86-V208 HydrophobicContact CG1-CG1 3.77Å; H205-V208 WeakPolarHBondContact O-CB 3.26Å; H205-V208 WeakPolarHBondContact O-CG2 3.47Å; G206-V208 PolarHBondContact O-N 3.49Å; V208-L211 HydrophobicContact CB-CD1 4.14Å; V208-L211 HydrophobicContact CG1-CD1 3.44Å; V208-L211 VanDerWaalsContact CG1-CD1 3.44Å; V208-L211 HydrophobicContact CG1-CG 4.09Å; V208-L211 WeakPolarHBondContact O-CD1 3.33Å; V208-L211 WeakPolarHBondContact O-CG 3.49Å
209	G	57	Low	74.1	Confident	56 Å²	56	67.9 Å²	67.9	58%	0.577	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.2	-174.7	162	0	0	0	0	0	119.9	D207 L211	D207-G209 PolarHBondContact O-N 3.14Å; G209-L211 PolarHBondContact O-N 2.81Å
210	N	61.5	Low	74	Confident	172 Å²	172	71.3 Å²	71.3	92%	0.92	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	71.2	168.3	-83.3	-20.8	0	0	0	109.8
211	L	67.6	Low	74	Confident	28 Å²	28	69.5 Å²	69.5	15%	0.147	38%	0.375	C	S	.	.			trans	-70.6	144.3	172.3	-71.8	172.8	0	0	0	111.6	V86 V208 G209 V215 K216 I219	V86-L211 HydrophobicContact CG2-CD2 4.49Å; V208-L211 HydrophobicContact CB-CD1 4.14Å; V208-L211 HydrophobicContact CG1-CD1 3.44Å; V208-L211 VanDerWaalsContact CG1-CD1 3.44Å; V208-L211 HydrophobicContact CG1-CG 4.09Å; V208-L211 WeakPolarHBondContact O-CD1 3.33Å; V208-L211 WeakPolarHBondContact O-CG 3.49Å; G209-L211 PolarHBondContact O-N 2.81Å; L211-V215 HydrophobicContact CD1-CG1 4.18Å; L211-V215 HydrophobicContact CD2-CB 4.46Å; L211-V215 HydrophobicContact CD2-CG1 3.9Å; L211-V215 HydrophobicContact CG-CG1 4.47Å; L211-K216 HydrophobicContact CB-CD 4.5Å; L211-K216 HydrophobicContact CB-CG 3.82Å; L211-K216 HydrophobicContact CD1-CG 4.47Å; L211-K216 VanDerWaalsContact O-CE 3.24Å; L211-K216 WeakPolarHBondContact O-CE 3.45Å; L211-I219 HydrophobicContact CD1-CD1 3.53Å
212	D	74.1	Confident	73.9	Confident	79 Å²	79	67.5 Å²	67.5	42%	0.422	37%	0.367	S	S	.	.			trans	-65.5	152.3	171.3	-162.9	8.5	0	0	0	111.4	S80 G214 V215 K216	S80-D212 VanDerWaalsContact OG-CB 3.23Å; S80-D212 WeakPolarHBondContact OG-CB 3.47Å; D212-G214 VanDerWaalsContact C-N 3.27Å; D212-G214 PolarHBondContact O-N 2.95Å; D212-V215 PolarHBondContact O-N 3.47Å; D212-K216 PolarHBondContact O-N 3.42Å; D212-K216 VanDerWaalsContact O-N 3.11Å
213	K	77.5	Confident	74	Confident	151 Å²	151	67.4 Å²	67.4	66%	0.657	37%	0.367	S	S	*	.	H	α-helix	trans	-56.5	-41.2	-171.1	-172.1	-176.9	174.5	-168.7	0	112.2	V215 K216 E217	K213-V215 VanDerWaalsContact C-N 3.32Å; K213-V215 PolarHBondContact O-N 3.03Å; K213-K216 PolarHBondContact O-N 2.9Å; K213-E217 VanDerWaalsContact CE-OE1 3.32Å; K213-E217 WeakPolarHBondContact CE-OE1 3Å; K213-E217 WeakPolarHBondContact O-CG 3.48Å; K213-E217 PolarHBondContact O-N 3.08Å; K213-E217 VanDerWaalsContact O-N 3.1Å
214	G	76.7	Confident	74.3	Confident	39 Å²	39	68.8 Å²	68.8	40%	0.402	37%	0.372	S	S	.	.	H	α-helix	trans	-67.5	-28.8	179.4	0	0	0	0	0	114	D212 K218	D212-G214 VanDerWaalsContact C-N 3.27Å; D212-G214 PolarHBondContact O-N 2.95Å; G214-K218 WeakPolarHBondContact O-CG 3.06Å; G214-K218 PolarHBondContact O-N 3.47Å
215	V	77.8	Confident	74.7	Confident	15 Å²	15	70.6 Å²	70.6	9%	0.091	37%	0.371	C	S	.	.	H	α-helix	trans	-76.1	-39.3	174.8	-179.5	0	0	0	0	110.7	S80 L82 L211 D212 K213 E217 K218 I219	S80-V215 VanDerWaalsContact O-CG2 3.24Å; S80-V215 WeakPolarHBondContact O-CG2 3.33Å; L82-V215 HydrophobicContact CB-CG1 4.11Å; L82-V215 HydrophobicContact CB-CG2 4.45Å; L82-V215 HydrophobicContact CD1-CG1 3.77Å; L211-V215 HydrophobicContact CD1-CG1 4.18Å; L211-V215 HydrophobicContact CD2-CB 4.46Å; L211-V215 HydrophobicContact CD2-CG1 3.9Å; L211-V215 HydrophobicContact CG-CG1 4.47Å; D212-V215 PolarHBondContact O-N 3.47Å; K213-V215 VanDerWaalsContact C-N 3.32Å; K213-V215 PolarHBondContact O-N 3.03Å; V215-E217 VanDerWaalsContact C-N 3.35Å; V215-E217 PolarHBondContact O-N 2.96Å; V215-K218 PolarHBondContact O-N 3.03Å; V215-I219 HydrophobicContact CG1-CD1 3.92Å; V215-I219 HydrophobicContact CG1-CG1 4.38Å; V215-I219 WeakPolarHBondContact O-CG1 3.14Å; V215-I219 PolarHBondContact O-N 2.85Å
216	K	79.3	Confident	75.7	Confident	74 Å²	74	67.3 Å²	67.3	32%	0.322	36%	0.356	S	S	.	.	H	α-helix	trans	-58	-46	174.4	-71	-178.1	174.9	176	0	111.9	L211 D212 K213 K218 I219 E220	L211-K216 HydrophobicContact CB-CD 4.5Å; L211-K216 HydrophobicContact CB-CG 3.82Å; L211-K216 HydrophobicContact CD1-CG 4.47Å; L211-K216 VanDerWaalsContact O-CE 3.24Å; L211-K216 WeakPolarHBondContact O-CE 3.45Å; D212-K216 PolarHBondContact O-N 3.42Å; D212-K216 VanDerWaalsContact O-N 3.11Å; K213-K216 PolarHBondContact O-N 2.9Å; K216-K218 VanDerWaalsContact C-N 3.32Å; K216-K218 PolarHBondContact O-N 3.03Å; K216-I219 PolarHBondContact O-N 3.34Å; K216-E220 WeakPolarHBondContact O-CG 3.49Å; K216-E220 PolarHBondContact O-N 3.07Å
217	E	81.9	Confident	77	Confident	105 Å²	105	65.9 Å²	65.9	49%	0.491	34%	0.341	S	S	.	.	H	α-helix	trans	-60.5	-39.3	178	-72.7	173.9	-172.9	0	0	112.5	K213 V215 E220 D221	K213-E217 VanDerWaalsContact CE-OE1 3.32Å; K213-E217 WeakPolarHBondContact CE-OE1 3Å; K213-E217 WeakPolarHBondContact O-CG 3.48Å; K213-E217 PolarHBondContact O-N 3.08Å; K213-E217 VanDerWaalsContact O-N 3.1Å; V215-E217 VanDerWaalsContact C-N 3.35Å; V215-E217 PolarHBondContact O-N 2.96Å; E217-E220 PolarHBondContact O-N 3.39Å; E217-D221 PolarHBondContact O-N 2.88Å
218	K	83.1	Confident	78.6	Confident	119 Å²	119	62.7 Å²	62.7	52%	0.517	32%	0.319	S	S	.	.	H	α-helix	trans	-68.4	-41.6	176.3	-71.9	-179.3	178	-174.9	0	112.7	F126 G214 V215 K216 E220 D221 F222	F126-K218 HydrophobicContact CE2-CB 4.01Å; F126-K218 HydrophobicContact CE2-CD 4.33Å; F126-K218 HydrophobicContact CE2-CG 4.46Å; F126-K218 HydrophobicContact CZ-CB 3.79Å; G214-K218 WeakPolarHBondContact O-CG 3.06Å; G214-K218 PolarHBondContact O-N 3.47Å; V215-K218 PolarHBondContact O-N 3.03Å; K216-K218 VanDerWaalsContact C-N 3.32Å; K216-K218 PolarHBondContact O-N 3.03Å; K218-E220 VanDerWaalsContact C-N 3.32Å; K218-D221 PolarHBondContact O-N 3.14Å; K218-F222 WeakPolarHBondContact O-CB 3.36Å; K218-F222 PolarHBondContact O-N 3.21Å
219	I	83.9	Confident	80	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-65.8	-37.6	175.8	-67.7	173.6	0	0	0	110.6	L82 V86 Y90 L211 V215 K216 F222 G223	L82-I219 HydrophobicContact CD1-CD1 4.22Å; L82-I219 HydrophobicContact CD1-CG1 4.11Å; V86-I219 HydrophobicContact CG1-CD1 3.62Å; Y90-I219 HydrophobicContact CD1-CG2 4.12Å; Y90-I219 HydrophobicContact CD2-CG2 3.58Å; Y90-I219 HydrophobicContact CE1-CG2 4.04Å; Y90-I219 HydrophobicContact CE2-CG2 3.49Å; Y90-I219 VanDerWaalsContact CE2-CG2 3.49Å; Y90-I219 HydrophobicContact CG-CG2 3.9Å; L211-I219 HydrophobicContact CD1-CD1 3.53Å; V215-I219 HydrophobicContact CG1-CD1 3.92Å; V215-I219 HydrophobicContact CG1-CG1 4.38Å; V215-I219 WeakPolarHBondContact O-CG1 3.14Å; V215-I219 PolarHBondContact O-N 2.85Å; K216-I219 PolarHBondContact O-N 3.34Å; I219-F222 PolarHBondContact O-N 3.04Å; I219-G223 PolarHBondContact O-N 3.02Å
220	E	83.4	Confident	81.4	Confident	76 Å²	76	60.8 Å²	60.8	36%	0.355	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-41.7	173.4	-75.5	173.3	-151	0	0	112.6	H205 K216 E217 K218 K224	H205-E220 WeakPolarHBondContact CE1-CG 3.35Å; H205-E220 IonicContact CE1-OE1 2.68Å; H205-E220 PolarHBondContact CE1-OE1 3.15Å; H205-E220 IonicContact NE2-OE1 3.87Å; H205-E220 PolarHBondContact NE2-OE1 3.17Å; K216-E220 WeakPolarHBondContact O-CG 3.49Å; K216-E220 PolarHBondContact O-N 3.07Å; E217-E220 PolarHBondContact O-N 3.39Å; K218-E220 VanDerWaalsContact C-N 3.32Å; E220-K224 VanDerWaalsContact O-CG 3.26Å; E220-K224 WeakPolarHBondContact O-CG 3.46Å; E220-K224 PolarHBondContact O-N 3.09Å
221	D	84.5	Confident	82.7	Confident	65 Å²	65	52.6 Å²	52.6	35%	0.348	25%	0.25	S	C	.	.	H	α-helix	trans	-62.9	-45.8	174.8	-171.6	61.1	0	0	0	111	E217 K218 G223 K224 R225	E217-D221 PolarHBondContact O-N 2.88Å; K218-D221 PolarHBondContact O-N 3.14Å; D221-G223 PolarHBondContact O-N 2.9Å; D221-K224 WeakPolarHBondContact O-CB 3.47Å; D221-K224 PolarHBondContact O-N 3.29Å; D221-R225 WeakPolarHBondContact O-CG 3.39Å; D221-R225 PolarHBondContact O-N 2.96Å; D221-R225 IonicContact OD2-CZ 3.22Å; D221-R225 VanDerWaalsContact OD2-CZ 3.24Å; D221-R225 IonicContact OD2-NE 3.47Å; D221-R225 PolarHBondContact OD2-NE 3.18Å; D221-R225 IonicContact OD2-NH2 3.88Å; D221-R225 PolarHBondContact OD2-NH2 3.48Å
222	F	85.6	Confident	83.6	Confident	1 Å²	1	53.1 Å²	53.1	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-59.3	-46.9	175.9	-176.5	-118.1	0	0	0	112.3	Y90 L91 F126 W129 L130 K218 I219 K224 R225 M226	Y90-F222 AromaticContact CD1-CD1 3.76Å; Y90-F222 HydrophobicContact CD1-CD1 3.76Å; Y90-F222 AromaticContact CD1-CE1 4Å; Y90-F222 HydrophobicContact CD1-CE1 4Å; Y90-F222 AromaticContact CE1-CD1 3.72Å; Y90-F222 HydrophobicContact CE1-CD1 3.72Å; Y90-F222 HydrophobicContact CE1-CE1 4.22Å; L91-F222 HydrophobicContact CD2-CE1 3.74Å; L91-F222 HydrophobicContact CD2-CZ 3.86Å; L91-F222 HydrophobicContact CG-CE1 4.06Å; L91-F222 HydrophobicContact CG-CZ 4.31Å; F126-F222 HydrophobicContact CB-CD2 4Å; F126-F222 HydrophobicContact CB-CE2 4.39Å; F126-F222 HydrophobicContact CD1-CB 3.65Å; F126-F222 HydrophobicContact CD1-CD1 4.25Å; F126-F222 AromaticContact CD1-CD2 3.3Å; F126-F222 HydrophobicContact CD1-CD2 3.3Å; F126-F222 AromaticContact CD1-CE2 3.95Å; F126-F222 HydrophobicContact CD1-CE2 3.95Å; F126-F222 AromaticContact CD1-CG 3.47Å; F126-F222 HydrophobicContact CD1-CG 3.47Å; F126-F222 VanDerWaalsContact CD1-CG 3.47Å; F126-F222 HydrophobicContact CE1-CB 3.59Å; F126-F222 HydrophobicContact CE1-CD1 4.32Å; F126-F222 HydrophobicContact CE1-CD2 4.08Å; F126-F222 AromaticContact CE1-CG 3.74Å; F126-F222 HydrophobicContact CE1-CG 3.74Å; F126-F222 HydrophobicContact CG-CD2 4.02Å; F126-F222 HydrophobicContact CG-CG 4.48Å; F126-F222 HydrophobicContact CZ-CB 4.46Å; F126-F222 WeakPolarHBondContact O-CE2 3.43Å; W129-F222 HydrophobicContact CB-CE2 4.08Å; W129-F222 HydrophobicContact CB-CZ 3.83Å; L130-F222 HydrophobicContact CB-CE2 3.99Å; L130-F222 HydrophobicContact CD1-CD2 4.46Å; L130-F222 HydrophobicContact CD1-CE2 4.02Å; K218-F222 WeakPolarHBondContact O-CB 3.36Å; K218-F222 PolarHBondContact O-N 3.21Å; I219-F222 PolarHBondContact O-N 3.04Å; F222-K224 VanDerWaalsContact C-N 3.33Å; F222-K224 PolarHBondContact O-N 3.28Å; F222-R225 WeakPolarHBondContact O-CB 3.47Å; F222-R225 PolarHBondContact O-N 3.06Å; F222-R225 VanDerWaalsContact O-N 3.14Å; F222-M226 HydrophobicContact CD1-SD 4.1Å; F222-M226 HydrophobicContact CE1-CG 4.23Å; F222-M226 HydrophobicContact CE1-SD 3.61Å; F222-M226 HydrophobicContact CE2-CG 4.45Å; F222-M226 HydrophobicContact CZ-CG 4.19Å; F222-M226 HydrophobicContact CZ-SD 4.02Å; F222-M226 WeakPolarHBondContact O-CG 3.36Å; F222-M226 PolarHBondContact O-N 3.26Å
223	G	87.3	Confident	84.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-40.7	174.4	0	0	0	0	0	113.3	Y90 A202 I219 D221 M226 C227	Y90-G223 WeakPolarHBondContact OH-CA 3.41Å; A202-G223 WeakPolarHBondContact CB-O 3.25Å; I219-G223 PolarHBondContact O-N 3.02Å; D221-G223 PolarHBondContact O-N 2.9Å; G223-M226 PolarHBondContact O-N 3.2Å; G223-C227 WeakPolarHBondContact O-CB 3.3Å; G223-C227 PolarHBondContact O-N 3.25Å
224	K	84.9	Confident	84.6	Confident	104 Å²	104	42.7 Å²	42.7	45%	0.452	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-41.7	174.2	-73.3	166.9	-171.2	164.7	0	112	E220 D221 F222 C227 K228	E220-K224 VanDerWaalsContact O-CG 3.26Å; E220-K224 WeakPolarHBondContact O-CG 3.46Å; E220-K224 PolarHBondContact O-N 3.09Å; D221-K224 WeakPolarHBondContact O-CB 3.47Å; D221-K224 PolarHBondContact O-N 3.29Å; F222-K224 VanDerWaalsContact C-N 3.33Å; F222-K224 PolarHBondContact O-N 3.28Å; K224-C227 PolarHBondContact O-N 2.86Å; K224-K228 WeakPolarHBondContact O-CG 3.4Å; K224-K228 PolarHBondContact O-N 2.87Å
225	R	87.5	Confident	85.1	Confident	97 Å²	97	40.9 Å²	40.9	37%	0.366	19%	0.188	S	C	.	.	H	α-helix	trans	-63.6	-45.3	175.9	-66	179.5	-163.1	-159.9	3.9	111.3	D127 L130 D221 F222 C227 K228 Q229	D127-R225 IonicContact OD1-NH1 2.72Å; D127-R225 PolarHBondContact OD1-NH1 2.87Å; L130-R225 HydrophobicContact CD1-CB 3.97Å; L130-R225 HydrophobicContact CD2-CB 4.03Å; D221-R225 WeakPolarHBondContact O-CG 3.39Å; D221-R225 PolarHBondContact O-N 2.96Å; D221-R225 IonicContact OD2-CZ 3.22Å; D221-R225 VanDerWaalsContact OD2-CZ 3.24Å; D221-R225 IonicContact OD2-NE 3.47Å; D221-R225 PolarHBondContact OD2-NE 3.18Å; D221-R225 IonicContact OD2-NH2 3.88Å; D221-R225 PolarHBondContact OD2-NH2 3.48Å; F222-R225 WeakPolarHBondContact O-CB 3.47Å; F222-R225 PolarHBondContact O-N 3.06Å; F222-R225 VanDerWaalsContact O-N 3.14Å; R225-C227 PolarHBondContact O-N 3.48Å; R225-K228 WeakPolarHBondContact O-CB 3.42Å; R225-K228 PolarHBondContact O-N 3.48Å; R225-Q229 PolarHBondContact O-N 2.88Å
226	M	85.7	Confident	85.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.3	-47.3	174.7	-73.3	-174.3	73.9	0	0	112.2	Y90 L91 V94 M95 L130 F222 G223 K228 Q229 I230	Y90-M226 HydrophobicContact CE1-SD 4.17Å; L91-M226 HydrophobicContact CD2-CE 3.28Å; L91-M226 HydrophobicContact CD2-SD 3.41Å; L91-M226 WeakPolarHBondContact CD2-SD 3.27Å; V94-M226 HydrophobicContact CB-CE 3.97Å; V94-M226 HydrophobicContact CB-SD 4.44Å; V94-M226 HydrophobicContact CG1-CE 3.53Å; V94-M226 HydrophobicContact CG1-SD 4.2Å; V94-M226 HydrophobicContact CG2-SD 4.49Å; M95-M226 HydrophobicContact CG-CE 4.13Å; M95-M226 HydrophobicContact SD-CE 4.47Å; L130-M226 HydrophobicContact CD1-CB 4.4Å; L130-M226 HydrophobicContact CD1-CG 3.69Å; F222-M226 HydrophobicContact CD1-SD 4.1Å; F222-M226 HydrophobicContact CE1-CG 4.23Å; F222-M226 HydrophobicContact CE1-SD 3.61Å; F222-M226 HydrophobicContact CE2-CG 4.45Å; F222-M226 HydrophobicContact CZ-CG 4.19Å; F222-M226 HydrophobicContact CZ-SD 4.02Å; F222-M226 WeakPolarHBondContact O-CG 3.36Å; F222-M226 PolarHBondContact O-N 3.26Å; G223-M226 PolarHBondContact O-N 3.2Å; M226-K228 VanDerWaalsContact C-N 3.29Å; M226-K228 PolarHBondContact O-N 2.92Å; M226-Q229 WeakPolarHBondContact O-CB 3.22Å; M226-Q229 PolarHBondContact O-N 3.28Å; M226-Q229 VanDerWaalsContact O-N 3.12Å; M226-I230 WeakPolarHBondContact O-CD1 3.39Å; M226-I230 VanDerWaalsContact O-CG1 3.31Å; M226-I230 WeakPolarHBondContact O-CG1 3.45Å; M226-I230 PolarHBondContact O-N 3.08Å
227	C	87.2	Confident	85.7	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57.6	-44.4	178.4	-170.5	0	0	0	0	110.9	C199 A202 H203 G223 K224 R225 Q229 I230 V231	C199-C227 VanDerWaalsContact SG-SG 3.69Å; A202-C227 HydrophobicContact CB-CB 3.98Å; H203-C227 PolarHBondContact NE2-SG 2.83Å; G223-C227 WeakPolarHBondContact O-CB 3.3Å; G223-C227 PolarHBondContact O-N 3.25Å; K224-C227 PolarHBondContact O-N 2.86Å; R225-C227 PolarHBondContact O-N 3.48Å; C227-Q229 PolarHBondContact O-N 3.38Å; C227-I230 PolarHBondContact O-N 2.94Å; C227-V231 VanDerWaalsContact O-CG2 3.28Å; C227-V231 WeakPolarHBondContact O-CG2 3.47Å; C227-V231 PolarHBondContact O-N 3.39Å
228	K	86.6	Confident	85.8	Confident	112 Å²	112	33.8 Å²	33.8	49%	0.487	16%	0.155	S	C	.	.	H	α-helix	trans	-59.8	-42.5	175.2	-76	-176.2	176.9	-170.9	0	112.7	K224 R225 M226 V231 S232 Q274	K224-K228 WeakPolarHBondContact O-CG 3.4Å; K224-K228 PolarHBondContact O-N 2.87Å; R225-K228 WeakPolarHBondContact O-CB 3.42Å; R225-K228 PolarHBondContact O-N 3.48Å; M226-K228 VanDerWaalsContact C-N 3.29Å; M226-K228 PolarHBondContact O-N 2.92Å; K228-V231 PolarHBondContact O-N 3.47Å; K228-S232 WeakPolarHBondContact O-CB 3.42Å; K228-S232 PolarHBondContact O-N 3.21Å; K228-Q274 PolarHBondContact O-NE2 3.35Å; K228-Q274 PolarHBondContact O-OE1 3.38Å
229	Q	86.8	Confident	85.8	Confident	37 Å²	37	28.1 Å²	28.1	17%	0.173	13%	0.131	C	C	.	.	H	α-helix	trans	-64.8	-42.7	176.1	-72.6	-176	-33.1	0	0	112.8	L130 E134 R225 M226 C227 V231 S232 L233	L130-Q229 VanDerWaalsContact CG-CD 3.44Å; L130-Q229 VanDerWaalsContact CG-NE2 3.27Å; E134-Q229 PolarHBondContact OE2-NE2 2.96Å; R225-Q229 PolarHBondContact O-N 2.88Å; M226-Q229 WeakPolarHBondContact O-CB 3.22Å; M226-Q229 PolarHBondContact O-N 3.28Å; M226-Q229 VanDerWaalsContact O-N 3.12Å; C227-Q229 PolarHBondContact O-N 3.38Å; Q229-V231 VanDerWaalsContact C-N 3.3Å; Q229-V231 PolarHBondContact O-N 3.4Å; Q229-S232 VanDerWaalsContact O-CB 3.31Å; Q229-S232 WeakPolarHBondContact O-CB 3.42Å; Q229-S232 PolarHBondContact O-N 3.15Å; Q229-S232 VanDerWaalsContact O-N 3.16Å; Q229-L233 PolarHBondContact O-N 2.8Å
230	I	87.5	Confident	85.3	Confident	1 Å²	1	30 Å²	30	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-61	-42.3	176.3	-66.8	157.5	0	0	0	110.6	I137 I195 C198 C199 M226 C227 L233 L234	I137-I230 HydrophobicContact CD1-CD1 4.13Å; I137-I230 HydrophobicContact CD1-CG1 3.46Å; I137-I230 VanDerWaalsContact CD1-CG1 3.46Å; I137-I230 HydrophobicContact CG1-CG1 4.42Å; I195-I230 HydrophobicContact CB-CG2 4.39Å; I195-I230 HydrophobicContact CG2-CG2 3.66Å; C198-I230 HydrophobicContact CB-CD1 3.66Å; C198-I230 HydrophobicContact CB-CG2 4.46Å; C199-I230 WeakPolarHBondContact SG-CG2 3.45Å; M226-I230 WeakPolarHBondContact O-CD1 3.39Å; M226-I230 VanDerWaalsContact O-CG1 3.31Å; M226-I230 WeakPolarHBondContact O-CG1 3.45Å; M226-I230 PolarHBondContact O-N 3.08Å; C227-I230 PolarHBondContact O-N 2.94Å; I230-L233 WeakPolarHBondContact O-CB 3.48Å; I230-L233 PolarHBondContact O-N 2.73Å; I230-L234 PolarHBondContact O-N 2.58Å
231	V	87.3	Confident	84.3	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64	-44	174.5	171.8	0	0	0	0	110.8	C227 K228 Q229 L233 L234 V235 F267 D270 F271	C227-V231 VanDerWaalsContact O-CG2 3.28Å; C227-V231 WeakPolarHBondContact O-CG2 3.47Å; C227-V231 PolarHBondContact O-N 3.39Å; K228-V231 PolarHBondContact O-N 3.47Å; Q229-V231 VanDerWaalsContact C-N 3.3Å; Q229-V231 PolarHBondContact O-N 3.4Å; V231-L233 VanDerWaalsContact C-N 3.27Å; V231-L233 PolarHBondContact O-N 3.05Å; V231-L234 WeakPolarHBondContact O-CB 3.46Å; V231-L234 PolarHBondContact O-N 3.39Å; V231-L234 VanDerWaalsContact O-N 3.11Å; V231-V235 HydrophobicContact CG1-CG2 4.31Å; V231-V235 WeakPolarHBondContact O-CG2 3.29Å; V231-V235 PolarHBondContact O-N 3.07Å; V231-F267 HydrophobicContact CG2-CD2 3.62Å; V231-F267 HydrophobicContact CG2-CE2 3.8Å; V231-D270 HydrophobicContact CG1-CB 4.14Å; V231-D270 HydrophobicContact CG2-CB 4.33Å; V231-F271 VanDerWaalsContact CG1-CA 3.45Å; V231-F271 HydrophobicContact CG1-CB 4.03Å; V231-F271 HydrophobicContact CG1-CD2 4.37Å
232	S	88	Confident	83	Confident	38 Å²	38	27.8 Å²	27.8	27%	0.266	14%	0.142	S	C	.	.	H	α-helix	trans	-55.7	-45.4	176.8	-174.9	0	0	0	0	110.8	K228 Q229 L234 V235 H236	K228-S232 WeakPolarHBondContact O-CB 3.42Å; K228-S232 PolarHBondContact O-N 3.21Å; Q229-S232 VanDerWaalsContact O-CB 3.31Å; Q229-S232 WeakPolarHBondContact O-CB 3.42Å; Q229-S232 PolarHBondContact O-N 3.15Å; Q229-S232 VanDerWaalsContact O-N 3.16Å; S232-L234 PolarHBondContact O-N 3.04Å; S232-V235 WeakPolarHBondContact O-CB 3.4Å; S232-V235 PolarHBondContact O-N 2.86Å; S232-H236 PolarHBondContact O-N 2.97Å; S232-H236 PolarHBondContact O-ND1 2.79Å; S232-H236 PolarHBondContact OG-CE1 2.9Å; S232-H236 PolarHBondContact OG-ND1 2.94Å
233	L	85.7	Confident	81.8	Confident	9 Å²	9	28 Å²	28	5%	0.047	14%	0.143	C	C	.	.	H	α-helix	trans	-57.4	-48.3	176.4	177.2	58.7	0	0	0	112	I137 W138 V141 Q229 I230 V231 V235 H236 I237	I137-L233 HydrophobicContact CB-CD2 4.37Å; I137-L233 HydrophobicContact CG2-CD2 3.32Å; W138-L233 HydrophobicContact CD2-CD1 3.72Å; W138-L233 HydrophobicContact CE3-CD1 3.93Å; W138-L233 HydrophobicContact CH2-CD1 3.27Å; W138-L233 HydrophobicContact CZ2-CD1 3.02Å; W138-L233 HydrophobicContact CZ3-CD1 3.73Å; V141-L233 HydrophobicContact CB-CD2 4.19Å; V141-L233 HydrophobicContact CG1-CD2 4.48Å; V141-L233 HydrophobicContact CG2-CD2 3.59Å; V141-L233 HydrophobicContact CG2-CG 4.48Å; Q229-L233 PolarHBondContact O-N 2.8Å; I230-L233 WeakPolarHBondContact O-CB 3.48Å; I230-L233 PolarHBondContact O-N 2.73Å; V231-L233 VanDerWaalsContact C-N 3.27Å; V231-L233 PolarHBondContact O-N 3.05Å; L233-V235 VanDerWaalsContact C-N 3.33Å; L233-V235 PolarHBondContact O-N 3.23Å; L233-H236 PolarHBondContact O-N 3.35Å; L233-I237 HydrophobicContact CD1-CD1 4.1Å; L233-I237 HydrophobicContact CD1-CG1 4.3Å; L233-I237 HydrophobicContact CG-CD1 3.98Å; L233-I237 VanDerWaalsContact O-CG1 3.26Å; L233-I237 WeakPolarHBondContact O-CG1 3.49Å; L233-I237 PolarHBondContact O-N 3.21Å
234	L	86.4	Confident	80.5	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-59.5	-44.2	176.3	179.9	64.9	0	0	0	111.8	I195 I230 V231 S232 H236 I237 L238 L254 F267 F271	I195-L234 HydrophobicContact CD1-CB 4.34Å; I195-L234 HydrophobicContact CD1-CD1 3.96Å; I195-L234 HydrophobicContact CG2-CB 4.25Å; I195-L234 HydrophobicContact CG2-CD2 4.27Å; I230-L234 PolarHBondContact O-N 2.58Å; V231-L234 WeakPolarHBondContact O-CB 3.46Å; V231-L234 PolarHBondContact O-N 3.39Å; V231-L234 VanDerWaalsContact O-N 3.11Å; S232-L234 PolarHBondContact O-N 3.04Å; L234-H236 VanDerWaalsContact C-N 3.31Å; L234-H236 PolarHBondContact O-N 3.46Å; L234-I237 PolarHBondContact O-N 3.13Å; L234-L238 HydrophobicContact CD1-CD1 3.9Å; L234-L238 HydrophobicContact CD1-CG 4.1Å; L234-L238 HydrophobicContact CG-CD1 3.91Å; L234-L238 HydrophobicContact CG-CG 4.43Å; L234-L238 WeakPolarHBondContact O-CB 3.36Å; L234-L238 WeakPolarHBondContact O-CG 3.21Å; L234-L238 PolarHBondContact O-N 3.32Å; L234-L254 HydrophobicContact CD2-CD1 4.3Å; L234-F267 HydrophobicContact CD2-CE2 4.2Å; L234-F267 HydrophobicContact CD2-CZ 3.67Å; L234-F271 HydrophobicContact CD2-CD2 4.26Å; L234-F271 HydrophobicContact CD2-CE2 4.09Å; L234-F271 HydrophobicContact CG-CE2 4.2Å
235	V	88	Confident	79.7	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.006	16%	0.155	C	C	.	.	H	α-helix	trans	-58.1	-45	176.9	172.7	0	0	0	0	110.6	V231 S232 L233 L238 S239 F271 Q274 S275 L278 I286	V231-V235 HydrophobicContact CG1-CG2 4.31Å; V231-V235 WeakPolarHBondContact O-CG2 3.29Å; V231-V235 PolarHBondContact O-N 3.07Å; S232-V235 WeakPolarHBondContact O-CB 3.4Å; S232-V235 PolarHBondContact O-N 2.86Å; L233-V235 VanDerWaalsContact C-N 3.33Å; L233-V235 PolarHBondContact O-N 3.23Å; V235-L238 PolarHBondContact O-N 2.83Å; V235-S239 WeakPolarHBondContact O-CB 3.44Å; V235-S239 PolarHBondContact O-N 3.25Å; V235-S239 PolarHBondContact O-OG 2.84Å; V235-F271 HydrophobicContact CG2-CD2 3.52Å; V235-F271 HydrophobicContact CG2-CE2 3.73Å; V235-Q274 HydrophobicContact CG2-CB 4.27Å; V235-S275 WeakPolarHBondContact CG2-OG 3.36Å; V235-L278 HydrophobicContact CG1-CD1 3.42Å; V235-L278 VanDerWaalsContact CG1-CD1 3.42Å; V235-L278 HydrophobicContact CG1-CG 4.29Å; V235-I286 HydrophobicContact CG1-CD1 3.76Å
236	H	84.8	Confident	78.8	Confident	37 Å²	37	28.9 Å²	28.9	17%	0.171	16%	0.164	C	C	.	.	H	α-helix	trans	-70.5	-32.4	-179.8	-73.8	87	0	0	0	114.1	S232 L233 L234 S239 L242	S232-H236 PolarHBondContact O-N 2.97Å; S232-H236 PolarHBondContact O-ND1 2.79Å; S232-H236 PolarHBondContact OG-CE1 2.9Å; S232-H236 PolarHBondContact OG-ND1 2.94Å; L233-H236 PolarHBondContact O-N 3.35Å; L234-H236 VanDerWaalsContact C-N 3.31Å; L234-H236 PolarHBondContact O-N 3.46Å; H236-S239 WeakPolarHBondContact CA-OG 3.16Å; H236-S239 PolarHBondContact O-OG 2.78Å; H236-S239 VanDerWaalsContact O-OG 3.1Å; H236-L242 HydrophobicContact CB-CD1 3.38Å; H236-L242 HydrophobicContact CB-CG 4.02Å
237	I	82.9	Confident	78.4	Confident	7 Å²	7	29.5 Å²	29.5	4%	0.036	17%	0.168	C	C	.	.	H	α-helix	trans	-65.3	-48.2	171.8	-66.1	162.6	0	0	0	109.6	V141 L233 L234 A240 I250	V141-I237 HydrophobicContact CG1-CD1 3.55Å; L233-I237 HydrophobicContact CD1-CD1 4.1Å; L233-I237 HydrophobicContact CD1-CG1 4.3Å; L233-I237 HydrophobicContact CG-CD1 3.98Å; L233-I237 VanDerWaalsContact O-CG1 3.26Å; L233-I237 WeakPolarHBondContact O-CG1 3.49Å; L233-I237 PolarHBondContact O-N 3.21Å; L234-I237 PolarHBondContact O-N 3.13Å; I237-A240 PolarHBondContact O-N 3.34Å; I237-I250 HydrophobicContact CG2-CD1 3.97Å
238	L	84.7	Confident	78.1	Confident	1 Å²	1	32 Å²	32	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-73.2	-28.2	-175.7	-69.2	177.2	0	0	0	113.6	L234 V235 A240 I250 Q251 L254 F271 I286	L234-L238 HydrophobicContact CD1-CD1 3.9Å; L234-L238 HydrophobicContact CD1-CG 4.1Å; L234-L238 HydrophobicContact CG-CD1 3.91Å; L234-L238 HydrophobicContact CG-CG 4.43Å; L234-L238 WeakPolarHBondContact O-CB 3.36Å; L234-L238 WeakPolarHBondContact O-CG 3.21Å; L234-L238 PolarHBondContact O-N 3.32Å; V235-L238 PolarHBondContact O-N 2.83Å; L238-A240 PolarHBondContact O-N 3.13Å; L238-I250 HydrophobicContact CD2-CB 4Å; L238-I250 HydrophobicContact CD2-CG2 3.57Å; L238-Q251 HydrophobicContact CD2-CG 4.27Å; L238-L254 HydrophobicContact CD1-CD2 3.79Å; L238-F271 HydrophobicContact CD1-CE2 3.91Å; L238-F271 HydrophobicContact CD1-CZ 3.7Å; L238-I286 HydrophobicContact CB-CG1 3.98Å; L238-I286 HydrophobicContact CB-CG2 4.1Å; L238-I286 HydrophobicContact CD1-CG2 4.23Å
239	S	82.9	Confident	77.9	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.007	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-10.9	174.1	67.4	0	0	0	0	113	V235 H236 C241	V235-S239 WeakPolarHBondContact O-CB 3.44Å; V235-S239 PolarHBondContact O-N 3.25Å; V235-S239 PolarHBondContact O-OG 2.84Å; H236-S239 WeakPolarHBondContact CA-OG 3.16Å; H236-S239 PolarHBondContact O-OG 2.78Å; H236-S239 VanDerWaalsContact O-OG 3.1Å; S239-C241 PolarHBondContact O-N 3.17Å; S239-C241 VanDerWaalsContact O-N 3.13Å; S239-C241 WeakPolarHBondContact OG-CB 3.33Å; S239-C241 PolarHBondContact OG-N 2.81Å; S239-C241 PolarHBondContact OG-SG 3.01Å
240	A	73.8	Confident	77.7	Confident	42 Å²	42	26.3 Å²	26.3	35%	0.347	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	21.2	-170	0	0	0	0	0	113.3	I237 L238 L242	I237-A240 PolarHBondContact O-N 3.34Å; L238-A240 PolarHBondContact O-N 3.13Å; A240-L242 PolarHBondContact O-N 3.49Å
241	C	61.8	Low	77.6	Confident	73 Å²	73	26.3 Å²	26.3	49%	0.493	16%	0.156	S	C	.	.	S	Bend	trans	-64.6	-26.7	174.3	-76.5	0	0	0	0	111.9	S239	S239-C241 PolarHBondContact O-N 3.17Å; S239-C241 VanDerWaalsContact O-N 3.13Å; S239-C241 WeakPolarHBondContact OG-CB 3.33Å; S239-C241 PolarHBondContact OG-N 2.81Å; S239-C241 PolarHBondContact OG-SG 3.01Å
242	L	57.8	Low	77.4	Confident	20 Å²	20	30.7 Å²	30.7	11%	0.105	17%	0.173	C	C	.	.	S	Bend	trans	-101.6	-52	-174.9	-64.6	-178.9	0	0	0	111.5	V54 A57 V58 W138 H236 A240	V54-L242 HydrophobicContact CB-CB 4.22Å; V54-L242 HydrophobicContact CB-CD2 4.37Å; V54-L242 HydrophobicContact CG1-CB 3.71Å; V54-L242 HydrophobicContact CG1-CD1 3.99Å; V54-L242 HydrophobicContact CG1-CD2 4.01Å; V54-L242 HydrophobicContact CG1-CG 4.09Å; V54-L242 HydrophobicContact CG2-CB 3.63Å; V54-L242 HydrophobicContact CG2-CD2 4.37Å; V54-L242 WeakPolarHBondContact CG2-O 3.38Å; A57-L242 HydrophobicContact CB-CD2 3.83Å; V58-L242 HydrophobicContact CG2-CD1 3.62Å; V58-L242 HydrophobicContact CG2-CD2 4.02Å; W138-L242 HydrophobicContact CH2-CD1 3.35Å; W138-L242 HydrophobicContact CZ2-CD1 3.46Å; W138-L242 VanDerWaalsContact CZ2-CD1 3.46Å; H236-L242 HydrophobicContact CB-CD1 3.38Å; H236-L242 HydrophobicContact CB-CG 4.02Å; A240-L242 PolarHBondContact O-N 3.49Å
243	L	61.1	Low	77.2	Confident	6 Å²	6	28.9 Å²	28.9	3%	0.031	16%	0.16	C	C	.	.			trans	-126.8	137.3	-175.8	-62.7	163.7	0	0	0	110.9	L46 L51 V54 L145 I245	L46-L243 HydrophobicContact CD1-CB 4.38Å; L46-L243 HydrophobicContact CD1-CD1 4.37Å; L46-L243 HydrophobicContact CD1-CD2 4.22Å; L46-L243 HydrophobicContact CD2-CD2 4.45Å; L51-L243 HydrophobicContact CD2-CD1 4.21Å; L51-L243 HydrophobicContact CD2-CD2 3.9Å; L51-L243 HydrophobicContact CG-CD2 4.23Å; V54-L243 HydrophobicContact CG2-CD2 3.7Å; V54-L243 HydrophobicContact CG2-CG 3.91Å; L145-L243 HydrophobicContact CD1-CD1 3.68Å; L243-I245 HydrophobicContact CB-CD1 3.47Å; L243-I245 VanDerWaalsContact CB-CD1 3.47Å; L243-I245 HydrophobicContact CB-CG1 3.66Å; L243-I245 HydrophobicContact CD1-CD1 3.69Å; L243-I245 HydrophobicContact CG-CD1 4.2Å; L243-I245 PolarHBondContact O-N 2.77Å
244	P	58.5	Low	77.2	Confident	76 Å²	76	28.4 Å²	28.4	49%	0.494	16%	0.158	S	C	.	.			trans	-75.3	69.1	173.3	32.7	-34.4	0	0	0	110.1	L46	L46-P244 HydrophobicContact CD2-CG 3.99Å
245	I	67.8	Low	77.1	Confident	39 Å²	39	28.3 Å²	28.3	20%	0.2	16%	0.157	C	C	.	.			trans	-100.9	142.5	179.1	-62.3	167.5	0	0	0	108.8	L46 L145 L243 T247 I250	L46-I245 HydrophobicContact CD1-CD1 3.94Å; L46-I245 HydrophobicContact CD1-CG1 3.78Å; L145-I245 HydrophobicContact CD1-CD1 4Å; L145-I245 HydrophobicContact CD2-CD1 3.99Å; L243-I245 HydrophobicContact CB-CD1 3.47Å; L243-I245 VanDerWaalsContact CB-CD1 3.47Å; L243-I245 HydrophobicContact CB-CG1 3.66Å; L243-I245 HydrophobicContact CD1-CD1 3.69Å; L243-I245 HydrophobicContact CG-CD1 4.2Å; L243-I245 PolarHBondContact O-N 2.77Å; I245-T247 PolarHBondContact O-N 3.19Å; I245-T247 VanDerWaalsContact O-N 3.08Å; I245-I250 HydrophobicContact CG2-CD1 4.37Å
246	D	69.1	Low	76.9	Confident	105 Å²	105	30.1 Å²	30.1	56%	0.561	16%	0.164	S	C	*	.			trans	-67.5	104.2	163.1	-180	6.4	0	0	0	109.1	M248	D246-M248 PolarHBondContact O-N 2.58Å; D246-M248 WeakPolarHBondContact OD1-CB 3.33Å; D246-M248 VanDerWaalsContact OD1-CG 3.3Å; D246-M248 WeakPolarHBondContact OD1-CG 3.38Å; D246-M248 PolarHBondContact OD1-N 2.86Å
247	T	77.8	Confident	76.8	Confident	13 Å²	13	28.3 Å²	28.3	8%	0.08	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-8.1	-176.8	59.5	0	0	0	0	112.7	I245 D249 I250 Q251	I245-T247 PolarHBondContact O-N 3.19Å; I245-T247 VanDerWaalsContact O-N 3.08Å; T247-D249 VanDerWaalsContact C-N 3.3Å; T247-D249 PolarHBondContact O-N 2.76Å; T247-I250 CarbonylContact O-C 3.59Å; T247-I250 PolarHBondContact O-N 3.03Å; T247-I250 VanDerWaalsContact O-N 3.08Å; T247-Q251 WeakPolarHBondContact O-CG 3.22Å; T247-Q251 PolarHBondContact O-N 3.49Å
248	M	80.6	Confident	76.8	Confident	52 Å²	52	28.8 Å²	28.8	26%	0.256	16%	0.158	S	C	.	.	H	α-helix	trans	-56.6	-42.7	-174.6	-73.3	-41.5	87.4	0	0	112.7	D246 Q251 R252 P289	D246-M248 PolarHBondContact O-N 2.58Å; D246-M248 WeakPolarHBondContact OD1-CB 3.33Å; D246-M248 VanDerWaalsContact OD1-CG 3.3Å; D246-M248 WeakPolarHBondContact OD1-CG 3.38Å; D246-M248 PolarHBondContact OD1-N 2.86Å; M248-Q251 WeakPolarHBondContact O-CB 3.4Å; M248-Q251 PolarHBondContact O-N 3.18Å; M248-R252 WeakPolarHBondContact O-CG 3.25Å; M248-R252 PolarHBondContact O-N 3.36Å; M248-P289 HydrophobicContact CE-CB 3.27Å; M248-P289 HydrophobicContact CE-CG 3.45Å; M248-P289 VanDerWaalsContact CE-CG 3.45Å; M248-P289 HydrophobicContact SD-CB 3.74Å; M248-P289 HydrophobicContact SD-CG 4.32Å
249	D	81.8	Confident	76.4	Confident	30 Å²	30	30 Å²	30	16%	0.16	17%	0.166	C	C	.	.	H	α-helix	trans	-70.8	-34.8	-178.3	-163.6	72	0	0	0	111.9	S184 N185 N188 T247 Q251 R252 A253	S184-D249 WeakPolarHBondContact CA-OD1 3.34Å; S184-D249 WeakPolarHBondContact CB-O 3.41Å; S184-D249 PolarHBondContact OG-O 3.25Å; S184-D249 VanDerWaalsContact OG-O 3.07Å; S184-D249 PolarHBondContact OG-OD2 2.98Å; N185-D249 WeakPolarHBondContact CB-OD2 3.35Å; N185-D249 PolarHBondContact N-OD1 3.18Å; N185-D249 PolarHBondContact N-OD2 3.49Å; N188-D249 WeakPolarHBondContact CB-OD2 3.4Å; N188-D249 PolarHBondContact ND2-OD2 3.07Å; T247-D249 VanDerWaalsContact C-N 3.3Å; T247-D249 PolarHBondContact O-N 2.76Å; D249-Q251 VanDerWaalsContact C-N 3.34Å; D249-R252 PolarHBondContact O-N 2.91Å; D249-R252 IonicContact OD1-NH1 3.58Å; D249-A253 PolarHBondContact O-N 3.21Å
250	I	83.6	Confident	76	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67.6	-37.1	172.3	-53.8	176.2	0	0	0	110.3	N188 V192 I237 L238 I245 T247 A253 L254	N188-I250 HydrophobicContact CB-CG1 4.12Å; V192-I250 HydrophobicContact CG2-CG2 3.83Å; I237-I250 HydrophobicContact CG2-CD1 3.97Å; L238-I250 HydrophobicContact CD2-CB 4Å; L238-I250 HydrophobicContact CD2-CG2 3.57Å; I245-I250 HydrophobicContact CG2-CD1 4.37Å; T247-I250 CarbonylContact O-C 3.59Å; T247-I250 PolarHBondContact O-N 3.03Å; T247-I250 VanDerWaalsContact O-N 3.08Å; I250-A253 WeakPolarHBondContact O-CB 3.3Å; I250-A253 PolarHBondContact O-N 3.39Å; I250-L254 WeakPolarHBondContact O-CB 3.19Å; I250-L254 PolarHBondContact O-N 3.2Å
251	Q	85.1	Confident	75.9	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.6	-36.8	175.5	-66	-75	3.2	0	0	111.8	L238 T247 M248 D249 L254 A255 I286 P289 V293	L238-Q251 HydrophobicContact CD2-CG 4.27Å; T247-Q251 WeakPolarHBondContact O-CG 3.22Å; T247-Q251 PolarHBondContact O-N 3.49Å; M248-Q251 WeakPolarHBondContact O-CB 3.4Å; M248-Q251 PolarHBondContact O-N 3.18Å; D249-Q251 VanDerWaalsContact C-N 3.34Å; Q251-L254 PolarHBondContact O-N 3.39Å; Q251-A255 VanDerWaalsContact O-CB 3.31Å; Q251-A255 WeakPolarHBondContact O-CB 3.37Å; Q251-A255 PolarHBondContact O-N 3.18Å; Q251-I286 PolarHBondContact NE2-O 3.29Å; Q251-P289 HydrophobicContact CG-CB 3.85Å; Q251-V293 HydrophobicContact CB-CG2 4.4Å
252	R	83.1	Confident	76.2	Confident	92 Å²	92	36.5 Å²	36.5	35%	0.347	19%	0.19	S	C	.	.	H	α-helix	trans	-63	-45.8	170.5	-70.9	-178.5	-168.1	134.7	3.4	111.7	R183 M248 D249 L254 A255 Y256 V293	R183-R252 WeakPolarHBondContact O-CD 3.39Å; M248-R252 WeakPolarHBondContact O-CG 3.25Å; M248-R252 PolarHBondContact O-N 3.36Å; D249-R252 PolarHBondContact O-N 2.91Å; D249-R252 IonicContact OD1-NH1 3.58Å; R252-L254 VanDerWaalsContact C-N 3.34Å; R252-L254 PolarHBondContact O-N 3.11Å; R252-A255 PolarHBondContact O-N 3.4Å; R252-Y256 WeakPolarHBondContact O-CB 3.26Å; R252-Y256 PolarHBondContact O-N 2.9Å; R252-V293 HydrophobicContact CG-CG1 3.95Å; R252-V293 HydrophobicContact CG-CG2 3.67Å
253	A	83.2	Confident	77.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.4	-44.4	173.8	0	0	0	0	0	111.8	L189 V192 D249 I250 Y256 C257	L189-A253 HydrophobicContact CB-CB 4.36Å; L189-A253 HydrophobicContact CD1-CB 4.25Å; V192-A253 HydrophobicContact CB-CB 4.1Å; V192-A253 HydrophobicContact CG2-CB 3.73Å; D249-A253 PolarHBondContact O-N 3.21Å; I250-A253 WeakPolarHBondContact O-CB 3.3Å; I250-A253 PolarHBondContact O-N 3.39Å; A253-Y256 WeakPolarHBondContact O-CB 3.28Å; A253-Y256 PolarHBondContact O-N 3.05Å; A253-C257 WeakPolarHBondContact O-CB 3.44Å; A253-C257 PolarHBondContact O-N 3.43Å; A253-C257 PolarHBondContact O-SG 3.1Å
254	L	86	Confident	78.2	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.8	-50.2	177	-177.7	63	0	0	0	111.4	V192 L234 L238 I250 Q251 R252 Y256 C257 I258 F271	V192-L254 HydrophobicContact CG1-CD1 4.26Å; L234-L254 HydrophobicContact CD2-CD1 4.3Å; L238-L254 HydrophobicContact CD1-CD2 3.79Å; I250-L254 WeakPolarHBondContact O-CB 3.19Å; I250-L254 PolarHBondContact O-N 3.2Å; Q251-L254 PolarHBondContact O-N 3.39Å; R252-L254 VanDerWaalsContact C-N 3.34Å; R252-L254 PolarHBondContact O-N 3.11Å; L254-Y256 VanDerWaalsContact C-N 3.31Å; L254-Y256 PolarHBondContact O-N 3.12Å; L254-C257 PolarHBondContact O-N 2.89Å; L254-I258 HydrophobicContact CD1-CD1 4.15Å; L254-I258 HydrophobicContact CD1-CG1 4.24Å; L254-I258 HydrophobicContact CG-CD1 3.88Å; L254-I258 HydrophobicContact CG-CG1 4.4Å; L254-I258 VanDerWaalsContact O-CG1 3.23Å; L254-I258 WeakPolarHBondContact O-CG1 3.38Å; L254-I258 PolarHBondContact O-N 3Å; L254-F271 HydrophobicContact CD2-CE1 3.96Å; L254-F271 HydrophobicContact CD2-CZ 3.84Å
255	A	84.3	Confident	79.3	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-57.2	-44.9	176.7	0	0	0	0	0	111.6	F182 Q251 R252 I258 C259 L290 V293 L294	F182-A255 HydrophobicContact CD1-CB 3.9Å; F182-A255 HydrophobicContact CE1-CB 3.87Å; Q251-A255 VanDerWaalsContact O-CB 3.31Å; Q251-A255 WeakPolarHBondContact O-CB 3.37Å; Q251-A255 PolarHBondContact O-N 3.18Å; R252-A255 PolarHBondContact O-N 3.4Å; A255-I258 PolarHBondContact O-N 3.23Å; A255-C259 PolarHBondContact O-N 2.64Å; A255-C259 PolarHBondContact O-SG 2.83Å; A255-L290 HydrophobicContact CB-CD1 3.7Å; A255-V293 HydrophobicContact CB-CG1 3.95Å; A255-L294 HydrophobicContact CB-CD2 4.41Å
256	Y	83.1	Confident	80.1	Confident	38 Å²	38	40.4 Å²	40.4	15%	0.149	23%	0.225	C	C	.	.	H	α-helix	trans	-57.7	-50.6	175.1	179.1	-96.8	0	0	0	111.5	F182 L189 R252 A253 L254 C259 N260 W310	F182-Y256 HydrophobicContact CB-CD2 3.91Å; F182-Y256 HydrophobicContact CB-CG 4.48Å; L189-Y256 HydrophobicContact CD1-CD1 3.62Å; L189-Y256 HydrophobicContact CD1-CE1 4.13Å; L189-Y256 HydrophobicContact CD1-CG 4.44Å; R252-Y256 WeakPolarHBondContact O-CB 3.26Å; R252-Y256 PolarHBondContact O-N 2.9Å; A253-Y256 WeakPolarHBondContact O-CB 3.28Å; A253-Y256 PolarHBondContact O-N 3.05Å; L254-Y256 VanDerWaalsContact C-N 3.31Å; L254-Y256 PolarHBondContact O-N 3.12Å; Y256-C259 PolarHBondContact O-N 2.79Å; Y256-N260 HydrophobicContact CE1-CB 4.16Å; Y256-N260 HydrophobicContact CE2-CB 4.45Å; Y256-N260 WeakPolarHBondContact O-CB 3.35Å; Y256-N260 PolarHBondContact O-N 3.46Å; Y256-N260 PolarHBondContact OH-ND2 2.98Å; Y256-W310 HydrophobicContact CD2-CZ3 4.5Å
257	C	83.8	Confident	81	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-67.7	-37.9	-176.6	-67.6	0	0	0	0	112.4	V192 L196 A253 L254 C259 N260 E261 V263	V192-C257 HydrophobicContact CG1-CB 4.03Å; L196-C257 HydrophobicContact CD1-CB 3.31Å; A253-C257 WeakPolarHBondContact O-CB 3.44Å; A253-C257 PolarHBondContact O-N 3.43Å; A253-C257 PolarHBondContact O-SG 3.1Å; L254-C257 PolarHBondContact O-N 2.89Å; C257-C259 PolarHBondContact O-N 3.02Å; C257-N260 PolarHBondContact O-N 2.65Å; C257-E261 HydrophobicContact CB-CG 4.33Å; C257-E261 WeakPolarHBondContact O-CB 3.41Å; C257-E261 PolarHBondContact O-N 3.5Å; C257-V263 WeakPolarHBondContact O-CG2 3.4Å
258	I	82.4	Confident	81.5	Confident	16 Å²	16	35.4 Å²	35.4	8%	0.082	20%	0.198	C	C	.	.	H	α-helix	trans	-56.4	-42.7	174	-65.1	166.6	0	0	0	110.5	L254 A255 V263 L268 V314	L254-I258 HydrophobicContact CD1-CD1 4.15Å; L254-I258 HydrophobicContact CD1-CG1 4.24Å; L254-I258 HydrophobicContact CG-CD1 3.88Å; L254-I258 HydrophobicContact CG-CG1 4.4Å; L254-I258 VanDerWaalsContact O-CG1 3.23Å; L254-I258 WeakPolarHBondContact O-CG1 3.38Å; L254-I258 PolarHBondContact O-N 3Å; A255-I258 PolarHBondContact O-N 3.23Å; I258-V263 HydrophobicContact CG1-CG2 4.44Å; I258-L268 HydrophobicContact CD1-CD2 4.23Å; I258-L268 HydrophobicContact CG1-CD2 4.24Å; I258-V314 HydrophobicContact CB-CG2 4.28Å; I258-V314 HydrophobicContact CD1-CG1 4.34Å; I258-V314 HydrophobicContact CG2-CB 4.48Å; I258-V314 HydrophobicContact CG2-CG1 4.16Å; I258-V314 HydrophobicContact CG2-CG2 3.8Å
259	C	76.5	Confident	82.1	Confident	27 Å²	27	37.9 Å²	37.9	18%	0.182	21%	0.205	C	C	.	.	H	α-helix	trans	-73.4	-44.9	180	-57.3	0	0	0	0	113.3	A255 Y256 C257 W310 V314	A255-C259 PolarHBondContact O-N 2.64Å; A255-C259 PolarHBondContact O-SG 2.83Å; Y256-C259 PolarHBondContact O-N 2.79Å; C257-C259 PolarHBondContact O-N 3.02Å; C259-W310 HydrophobicContact CB-CB 4.18Å; C259-W310 HydrophobicContact CB-CD2 3.41Å; C259-W310 VanDerWaalsContact CB-CD2 3.41Å; C259-W310 HydrophobicContact CB-CE3 3.27Å; C259-W310 HydrophobicContact CB-CG 3.85Å; C259-W310 HydrophobicContact CB-CH2 4.27Å; C259-W310 HydrophobicContact CB-CZ2 4.38Å; C259-W310 HydrophobicContact CB-CZ3 3.74Å; C259-V314 WeakPolarHBondContact SG-CG2 3.37Å
260	N	75.3	Confident	82.5	Confident	77 Å²	77	37.1 Å²	37.1	41%	0.412	20%	0.201	S	C	.	.	H	α-helix	trans	-97.4	-27	-163.9	-168.7	64.2	0	0	0	114	Y256 C257 W310	Y256-N260 HydrophobicContact CE1-CB 4.16Å; Y256-N260 HydrophobicContact CE2-CB 4.45Å; Y256-N260 WeakPolarHBondContact O-CB 3.35Å; Y256-N260 PolarHBondContact O-N 3.46Å; Y256-N260 PolarHBondContact OH-ND2 2.98Å; C257-N260 PolarHBondContact O-N 2.65Å; N260-W310 HydrophobicContact CB-CH2 3.82Å; N260-W310 HydrophobicContact CB-CZ3 4.32Å
261	E	71.3	Confident	82.9	Confident	26 Å²	26	37.1 Å²	37.1	12%	0.121	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	15.8	-168.8	-58	-159.2	163.1	0	0	114.7	K193 R200 C257 V263	K193-E261 WeakPolarHBondContact CD-OE1 3.47Å; K193-E261 WeakPolarHBondContact CE-OE1 3.42Å; K193-E261 VanDerWaalsContact CG-OE1 3.31Å; K193-E261 WeakPolarHBondContact CG-OE1 3.35Å; K193-E261 IonicContact NZ-OE1 3.68Å; K193-E261 PolarHBondContact NZ-OE1 3.15Å; R200-E261 PolarHBondContact NH2-O 3.43Å; C257-E261 HydrophobicContact CB-CG 4.33Å; C257-E261 WeakPolarHBondContact O-CB 3.41Å; C257-E261 PolarHBondContact O-N 3.5Å; E261-V263 VanDerWaalsContact C-N 3.32Å; E261-V263 PolarHBondContact O-N 2.91Å
262	N	68.9	Low	83.3	Confident	150 Å²	150	37.1 Å²	37.1	80%	0.802	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	48	55.3	179.1	-164	19.6	0	0	0	111.4	S264	N262-S264 PolarHBondContact O-N 3.03Å
263	V	79.3	Confident	83.8	Confident	21 Å²	21	33.2 Å²	33.2	13%	0.127	19%	0.187	C	C	.	.			trans	-57.3	132.8	-177.9	174.1	0	0	0	0	109.9	L196 C257 I258 E261 F267 L268	L196-V263 HydrophobicContact CD1-CG2 3.93Å; L196-V263 HydrophobicContact CD2-CG1 4.14Å; L196-V263 HydrophobicContact CD2-CG2 4.04Å; C257-V263 WeakPolarHBondContact O-CG2 3.4Å; I258-V263 HydrophobicContact CG1-CG2 4.44Å; E261-V263 VanDerWaalsContact C-N 3.32Å; E261-V263 PolarHBondContact O-N 2.91Å; V263-F267 HydrophobicContact CG1-CB 4.12Å; V263-F267 HydrophobicContact CG1-CD1 3.19Å; V263-F267 HydrophobicContact CG1-CE1 3.84Å; V263-F267 HydrophobicContact CG1-CG 3.9Å; V263-L268 HydrophobicContact CG1-CD2 4.12Å; V263-L268 HydrophobicContact CG1-CG 3.98Å
264	S	81.1	Confident	84.2	Confident	48 Å²	48	34.3 Å²	34.3	34%	0.336	19%	0.193	S	C	.	.			trans	-66.2	143.7	-175	80.2	0	0	0	0	111.3	N262 V266 F267 L268	N262-S264 PolarHBondContact O-N 3.03Å; S264-V266 PolarHBondContact O-N 2.74Å; S264-F267 PolarHBondContact O-N 3.35Å; S264-F267 VanDerWaalsContact O-N 3.13Å; S264-F267 WeakPolarHBondContact OG-CB 3.4Å; S264-F267 PolarHBondContact OG-N 3.41Å; S264-L268 PolarHBondContact O-N 2.7Å; S264-L268 VanDerWaalsContact O-N 3.16Å
265	A	81.6	Confident	84.5	Confident	81 Å²	81	34.3 Å²	34.3	67%	0.669	19%	0.193	S	C	*	.	H	α-helix	trans	-60.2	-27.1	174.3	0	0	0	0	0	112.3	Y269	A265-Y269 WeakPolarHBondContact O-CB 3.43Å; A265-Y269 PolarHBondContact O-N 2.93Å
266	V	84.3	Confident	84.9	Confident	72 Å²	72	35.9 Å²	35.9	44%	0.436	21%	0.206	S	C	.	.	H	α-helix	trans	-66.2	-48.2	175.1	-178.8	0	0	0	0	110.4	S264 L268 Y269 D270	S264-V266 PolarHBondContact O-N 2.74Å; V266-L268 PolarHBondContact O-N 3.25Å; V266-Y269 PolarHBondContact O-N 3.1Å; V266-D270 PolarHBondContact O-N 3.21Å
267	F	88.4	Confident	85.3	Confident	2 Å²	2	41 Å²	41	1%	0.009	23%	0.231	C	C	.	.	H	α-helix	trans	-58.3	-48.2	176.3	168.9	-87.8	0	0	0	111.3	L196 C199 V231 L234 V263 S264 Y269 D270 F271	L196-F267 HydrophobicContact CD2-CD1 3.97Å; L196-F267 HydrophobicContact CD2-CD2 3.93Å; L196-F267 HydrophobicContact CD2-CE1 3.65Å; L196-F267 HydrophobicContact CD2-CE2 3.62Å; L196-F267 HydrophobicContact CD2-CG 4.09Å; L196-F267 HydrophobicContact CD2-CZ 3.46Å; L196-F267 VanDerWaalsContact CD2-CZ 3.46Å; C199-F267 HydrophobicContact CB-CD2 4.17Å; V231-F267 HydrophobicContact CG2-CD2 3.62Å; V231-F267 HydrophobicContact CG2-CE2 3.8Å; L234-F267 HydrophobicContact CD2-CE2 4.2Å; L234-F267 HydrophobicContact CD2-CZ 3.67Å; V263-F267 HydrophobicContact CG1-CB 4.12Å; V263-F267 HydrophobicContact CG1-CD1 3.19Å; V263-F267 HydrophobicContact CG1-CE1 3.84Å; V263-F267 HydrophobicContact CG1-CG 3.9Å; S264-F267 PolarHBondContact O-N 3.35Å; S264-F267 VanDerWaalsContact O-N 3.13Å; S264-F267 WeakPolarHBondContact OG-CB 3.4Å; S264-F267 PolarHBondContact OG-N 3.41Å; F267-Y269 VanDerWaalsContact C-N 3.3Å; F267-Y269 PolarHBondContact O-N 3.34Å; F267-D270 PolarHBondContact O-N 3.19Å; F267-F271 HydrophobicContact CE1-CB 4.36Å; F267-F271 WeakPolarHBondContact O-CB 3.26Å; F267-F271 PolarHBondContact O-N 3.37Å
268	L	88.9	Confident	85.5	Confident	12 Å²	12	44.2 Å²	44.2	6%	0.063	25%	0.248	C	C	.	.	H	α-helix	trans	-63.3	-38.5	-179.8	-69	176	0	0	0	111.8	I258 V263 S264 V266 L272 I321	I258-L268 HydrophobicContact CD1-CD2 4.23Å; I258-L268 HydrophobicContact CG1-CD2 4.24Å; V263-L268 HydrophobicContact CG1-CD2 4.12Å; V263-L268 HydrophobicContact CG1-CG 3.98Å; S264-L268 PolarHBondContact O-N 2.7Å; S264-L268 VanDerWaalsContact O-N 3.16Å; V266-L268 PolarHBondContact O-N 3.25Å; L268-L272 WeakPolarHBondContact O-CD1 3.32Å; L268-L272 PolarHBondContact O-N 3.23Å; L268-I321 HydrophobicContact CB-CD1 3.68Å
269	Y	91.2	Very high	85.9	Confident	103 Å²	103	45 Å²	45	40%	0.404	26%	0.26	S	S	.	.	H	α-helix	trans	-61.3	-52.6	174.7	175.6	-89.1	0	0	0	111.3	A265 V266 F267 F271 L272 S273 I321 K322	A265-Y269 WeakPolarHBondContact O-CB 3.43Å; A265-Y269 PolarHBondContact O-N 2.93Å; V266-Y269 PolarHBondContact O-N 3.1Å; F267-Y269 VanDerWaalsContact C-N 3.3Å; F267-Y269 PolarHBondContact O-N 3.34Å; Y269-F271 VanDerWaalsContact C-N 3.28Å; Y269-F271 PolarHBondContact O-N 3.31Å; Y269-L272 PolarHBondContact O-N 3.02Å; Y269-S273 WeakPolarHBondContact O-CB 3.32Å; Y269-S273 PolarHBondContact O-N 3.06Å; Y269-S273 PolarHBondContact O-OG 3.46Å; Y269-I321 HydrophobicContact CD2-CG2 4.08Å; Y269-K322 WeakPolarHBondContact CE2-O 3.33Å
270	D	90.5	Very high	86.6	Confident	14 Å²	14	49 Å²	49	8%	0.075	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-38.2	-179.7	-73.9	-29	0	0	0	111	V231 V266 F267 S273 Q274	V231-D270 HydrophobicContact CG1-CB 4.14Å; V231-D270 HydrophobicContact CG2-CB 4.33Å; V266-D270 PolarHBondContact O-N 3.21Å; F267-D270 PolarHBondContact O-N 3.19Å; D270-S273 WeakPolarHBondContact CA-OG 3.43Å; D270-S273 PolarHBondContact O-N 2.92Å; D270-S273 PolarHBondContact O-OG 3.36Å; D270-S273 VanDerWaalsContact O-OG 3.13Å; D270-Q274 VanDerWaalsContact O-CB 3.31Å; D270-Q274 WeakPolarHBondContact O-CB 3.22Å; D270-Q274 VanDerWaalsContact O-CG 3.23Å; D270-Q274 WeakPolarHBondContact O-CG 3.47Å; D270-Q274 PolarHBondContact O-N 3.34Å
271	F	92.5	Very high	87.3	Confident	1 Å²	1	51.7 Å²	51.7	0%	0.004	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-46.5	177.3	-179.2	-121.5	0	0	0	111.5	V231 L234 V235 L238 L254 F267 Y269 S275 I286 F287	V231-F271 VanDerWaalsContact CG1-CA 3.45Å; V231-F271 HydrophobicContact CG1-CB 4.03Å; V231-F271 HydrophobicContact CG1-CD2 4.37Å; L234-F271 HydrophobicContact CD2-CD2 4.26Å; L234-F271 HydrophobicContact CD2-CE2 4.09Å; L234-F271 HydrophobicContact CG-CE2 4.2Å; V235-F271 HydrophobicContact CG2-CD2 3.52Å; V235-F271 HydrophobicContact CG2-CE2 3.73Å; L238-F271 HydrophobicContact CD1-CE2 3.91Å; L238-F271 HydrophobicContact CD1-CZ 3.7Å; L254-F271 HydrophobicContact CD2-CE1 3.96Å; L254-F271 HydrophobicContact CD2-CZ 3.84Å; F267-F271 HydrophobicContact CE1-CB 4.36Å; F267-F271 WeakPolarHBondContact O-CB 3.26Å; F267-F271 PolarHBondContact O-N 3.37Å; Y269-F271 VanDerWaalsContact C-N 3.28Å; Y269-F271 PolarHBondContact O-N 3.31Å; F271-S275 VanDerWaalsContact O-CB 3.25Å; F271-S275 WeakPolarHBondContact O-CB 3.21Å; F271-S275 PolarHBondContact O-N 2.97Å; F271-S275 VanDerWaalsContact O-N 3.09Å; F271-S275 PolarHBondContact O-OG 3.17Å; F271-I286 HydrophobicContact CE1-CG2 4.41Å; F271-I286 HydrophobicContact CE2-CG2 4.41Å; F271-I286 HydrophobicContact CZ-CG2 3.67Å; F271-F287 HydrophobicContact CD1-CE1 4.21Å; F271-F287 AromaticContact CD1-CZ 3.85Å; F271-F287 HydrophobicContact CD1-CZ 3.85Å; F271-F287 AromaticContact CE1-CE1 3.68Å; F271-F287 HydrophobicContact CE1-CE1 3.68Å; F271-F287 HydrophobicContact CE1-CE2 4.49Å; F271-F287 AromaticContact CE1-CZ 3.5Å; F271-F287 HydrophobicContact CE1-CZ 3.5Å; F271-F287 VanDerWaalsContact CE1-CZ 3.5Å; F271-F287 HydrophobicContact CZ-CZ 4.19Å
272	L	93.7	Very high	88.2	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-72.2	-37.9	177.5	-90.9	76.6	0	0	0	112.5	L268 Y269 A276 F283 F287 L318 I321 V323 F329	L268-L272 WeakPolarHBondContact O-CD1 3.32Å; L268-L272 PolarHBondContact O-N 3.23Å; Y269-L272 PolarHBondContact O-N 3.02Å; L272-A276 VanDerWaalsContact O-CB 3.3Å; L272-A276 WeakPolarHBondContact O-CB 3.36Å; L272-A276 PolarHBondContact O-N 3.45Å; L272-F283 HydrophobicContact CG-CZ 4.45Å; L272-F287 HydrophobicContact CD1-CE1 3.91Å; L272-F287 HydrophobicContact CD1-CZ 3.67Å; L272-F287 HydrophobicContact CG-CE1 4.27Å; L272-F287 HydrophobicContact CG-CE2 4.48Å; L272-F287 HydrophobicContact CG-CZ 3.76Å; L272-L318 HydrophobicContact CD1-CD2 3.69Å; L272-I321 HydrophobicContact CB-CG2 4.18Å; L272-I321 HydrophobicContact CD1-CD1 4.06Å; L272-I321 HydrophobicContact CD2-CB 3.89Å; L272-I321 HydrophobicContact CD2-CD1 4.02Å; L272-I321 HydrophobicContact CD2-CG2 3.97Å; L272-V323 HydrophobicContact CB-CG2 4.42Å; L272-F329 HydrophobicContact CD2-CB 4.09Å
273	S	93.7	Very high	89.4	Confident	9 Å²	9	44 Å²	44	6%	0.063	25%	0.247	C	C	.	.	H	α-helix	trans	-66.7	-46.5	-178.6	69.1	0	0	0	0	111.3	Y269 D270 A276 E277	Y269-S273 WeakPolarHBondContact O-CB 3.32Å; Y269-S273 PolarHBondContact O-N 3.06Å; Y269-S273 PolarHBondContact O-OG 3.46Å; D270-S273 WeakPolarHBondContact CA-OG 3.43Å; D270-S273 PolarHBondContact O-N 2.92Å; D270-S273 PolarHBondContact O-OG 3.36Å; D270-S273 VanDerWaalsContact O-OG 3.13Å; S273-A276 WeakPolarHBondContact O-CB 3.43Å; S273-A276 PolarHBondContact O-N 3.06Å; S273-E277 WeakPolarHBondContact O-CG 3.2Å; S273-E277 PolarHBondContact O-N 3.48Å; S273-E277 VanDerWaalsContact O-N 3.1Å
274	Q	92.3	Very high	90.1	Very high	23 Å²	23	44 Å²	44	11%	0.107	25%	0.246	C	C	.	.	H	α-helix	trans	-69.6	-37.7	178.7	-66.1	-178.7	40.8	0	0	111.9	K228 V235 D270 A276 E277 L278	K228-Q274 PolarHBondContact O-NE2 3.35Å; K228-Q274 PolarHBondContact O-OE1 3.38Å; V235-Q274 HydrophobicContact CG2-CB 4.27Å; D270-Q274 VanDerWaalsContact O-CB 3.31Å; D270-Q274 WeakPolarHBondContact O-CB 3.22Å; D270-Q274 VanDerWaalsContact O-CG 3.23Å; D270-Q274 WeakPolarHBondContact O-CG 3.47Å; D270-Q274 PolarHBondContact O-N 3.34Å; Q274-A276 PolarHBondContact O-N 3.41Å; Q274-E277 PolarHBondContact O-N 3.31Å; Q274-L278 PolarHBondContact O-N 3.5Å
275	S	92.6	Very high	90.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.2	-37.3	171.7	-60.8	0	0	0	0	111.8	V235 F271 E277 L278	V235-S275 WeakPolarHBondContact CG2-OG 3.36Å; F271-S275 VanDerWaalsContact O-CB 3.25Å; F271-S275 WeakPolarHBondContact O-CB 3.21Å; F271-S275 PolarHBondContact O-N 2.97Å; F271-S275 VanDerWaalsContact O-N 3.09Å; F271-S275 PolarHBondContact O-OG 3.17Å; S275-E277 VanDerWaalsContact C-N 3.34Å; S275-L278 PolarHBondContact O-N 3.42Å
276	A	92	Very high	91	Very high	34 Å²	34	43.5 Å²	43.5	28%	0.281	22%	0.22	S	C	.	.	H	α-helix	trans	-71.8	-29	179.7	0	0	0	0	0	112.5	L272 S273 Q274 L278 G279 F283 V323 P328	L272-A276 VanDerWaalsContact O-CB 3.3Å; L272-A276 WeakPolarHBondContact O-CB 3.36Å; L272-A276 PolarHBondContact O-N 3.45Å; S273-A276 WeakPolarHBondContact O-CB 3.43Å; S273-A276 PolarHBondContact O-N 3.06Å; Q274-A276 PolarHBondContact O-N 3.41Å; A276-L278 VanDerWaalsContact C-N 3.28Å; A276-L278 PolarHBondContact O-N 3.44Å; A276-G279 PolarHBondContact O-N 3.24Å; A276-F283 HydrophobicContact CB-CD2 4.17Å; A276-F283 HydrophobicContact CB-CE2 4.33Å; A276-V323 HydrophobicContact CB-CG1 4.47Å; A276-P328 HydrophobicContact CB-CB 4.27Å; A276-P328 HydrophobicContact CB-CG 4.48Å
277	E	91	Very high	91.4	Very high	146 Å²	146	40.1 Å²	40.1	68%	0.682	20%	0.199	S	C	*	.	H	α-helix	trans	-67	-27.3	175.4	-72.8	168	-170.1	0	0	112.7	S273 Q274 S275 G279	S273-E277 WeakPolarHBondContact O-CG 3.2Å; S273-E277 PolarHBondContact O-N 3.48Å; S273-E277 VanDerWaalsContact O-N 3.1Å; Q274-E277 PolarHBondContact O-N 3.31Å; S275-E277 VanDerWaalsContact C-N 3.34Å; E277-G279 PolarHBondContact O-N 3.18Å
278	L	89	Confident	91.7	Very high	67 Å²	67	41.5 Å²	41.5	35%	0.351	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-7.5	175.4	-61.5	-174.6	0	0	0	114.2	V235 Q274 S275 A276 A282	V235-L278 HydrophobicContact CG1-CD1 3.42Å; V235-L278 VanDerWaalsContact CG1-CD1 3.42Å; V235-L278 HydrophobicContact CG1-CG 4.29Å; Q274-L278 PolarHBondContact O-N 3.5Å; S275-L278 PolarHBondContact O-N 3.42Å; A276-L278 VanDerWaalsContact C-N 3.28Å; A276-L278 PolarHBondContact O-N 3.44Å; L278-A282 HydrophobicContact CB-CB 3.63Å; L278-A282 HydrophobicContact CD1-CB 4.4Å
279	G	89.7	Confident	91.8	Very high	32 Å²	32	41.8 Å²	41.8	33%	0.33	21%	0.208	S	C	.	.			trans	92.7	168.1	-177.6	0	0	0	0	0	114.2	A276 E277 E281 A282 F283	A276-G279 PolarHBondContact O-N 3.24Å; E277-G279 PolarHBondContact O-N 3.18Å; G279-E281 PolarHBondContact O-N 2.88Å; G279-A282 PolarHBondContact O-N 3.37Å; G279-F283 WeakPolarHBondContact O-CB 3.46Å; G279-F283 PolarHBondContact O-N 3.29Å
280	E	92	Very high	91.8	Very high	112 Å²	112	36.9 Å²	36.9	52%	0.523	19%	0.189	S	C	.	.	H	α-helix	trans	-63.9	-40.4	-168.5	-59.2	-162	131.4	0	0	113.8	F283 D284 R335	E280-F283 WeakPolarHBondContact O-CB 3.43Å; E280-F283 PolarHBondContact O-N 2.84Å; E280-D284 WeakPolarHBondContact O-CB 3.37Å; E280-D284 PolarHBondContact O-N 3.5Å; E280-R335 VanDerWaalsContact CD-NH1 3.26Å; E280-R335 IonicContact OE1-CZ 3Å; E280-R335 IonicContact OE1-NH1 3.41Å; E280-R335 PolarHBondContact OE1-NH1 3.17Å; E280-R335 IonicContact OE2-NH1 3.01Å
281	E	90.1	Very high	92	Very high	132 Å²	132	36.2 Å²	36.2	62%	0.617	19%	0.185	S	C	*	.	H	α-helix	trans	-66.8	-42.6	-178.2	-169.4	-175.9	170.5	0	0	111.5	G279 D284 R285	G279-E281 PolarHBondContact O-N 2.88Å; E281-D284 PolarHBondContact O-N 3.32Å; E281-R285 WeakPolarHBondContact O-CG 3.43Å; E281-R285 PolarHBondContact O-N 3.45Å; E281-R285 IonicContact OE1-CZ 2.7Å; E281-R285 IonicContact OE1-NE 2.6Å; E281-R285 IonicContact OE1-NH2 2.65Å; E281-R285 PolarHBondContact OE1-NH2 3.14Å
282	A	89.2	Confident	92	Very high	12 Å²	12	39.6 Å²	39.6	10%	0.099	20%	0.204	C	C	.	.	H	α-helix	trans	-66.1	-41.2	175.7	0	0	0	0	0	111.2	L278 G279 D284 R285 I286	L278-A282 HydrophobicContact CB-CB 3.63Å; L278-A282 HydrophobicContact CD1-CB 4.4Å; G279-A282 PolarHBondContact O-N 3.37Å; A282-D284 PolarHBondContact O-N 2.94Å; A282-R285 PolarHBondContact O-N 3.45Å; A282-I286 WeakPolarHBondContact O-CG1 3.48Å; A282-I286 PolarHBondContact O-N 3.42Å
283	F	94.2	Very high	91.8	Very high	3 Å²	3	40 Å²	40	1%	0.013	21%	0.206	C	C	.	.	H	α-helix	trans	-57.9	-48.2	173.9	-168.9	-79.7	0	0	0	111.2	L272 A276 G279 E280 R285 I286 F287 P328 F329 S332	L272-F283 HydrophobicContact CG-CZ 4.45Å; A276-F283 HydrophobicContact CB-CD2 4.17Å; A276-F283 HydrophobicContact CB-CE2 4.33Å; G279-F283 WeakPolarHBondContact O-CB 3.46Å; G279-F283 PolarHBondContact O-N 3.29Å; E280-F283 WeakPolarHBondContact O-CB 3.43Å; E280-F283 PolarHBondContact O-N 2.84Å; F283-R285 PolarHBondContact O-N 2.83Å; F283-I286 WeakPolarHBondContact O-CB 3.41Å; F283-I286 PolarHBondContact O-N 3.16Å; F283-I286 VanDerWaalsContact O-N 3.12Å; F283-F287 HydrophobicContact CD1-CB 4.42Å; F283-F287 AromaticContact CD1-CD2 3.49Å; F283-F287 HydrophobicContact CD1-CD2 3.49Å; F283-F287 VanDerWaalsContact CD1-CD2 3.49Å; F283-F287 HydrophobicContact CD1-CE2 4.16Å; F283-F287 HydrophobicContact CD1-CG 4.28Å; F283-F287 AromaticContact CD2-CD2 3.98Å; F283-F287 HydrophobicContact CD2-CD2 3.98Å; F283-F287 AromaticContact CD2-CE2 3.82Å; F283-F287 HydrophobicContact CD2-CE2 3.82Å; F283-F287 HydrophobicContact CE1-CB 4.11Å; F283-F287 AromaticContact CE1-CD2 3.2Å; F283-F287 HydrophobicContact CE1-CD2 3.2Å; F283-F287 AromaticContact CE1-CE2 3.75Å; F283-F287 HydrophobicContact CE1-CE2 3.75Å; F283-F287 AromaticContact CE1-CG 3.76Å; F283-F287 HydrophobicContact CE1-CG 3.76Å; F283-F287 AromaticContact CE2-CD2 3.74Å; F283-F287 HydrophobicContact CE2-CD2 3.74Å; F283-F287 AromaticContact CE2-CE2 3.38Å; F283-F287 HydrophobicContact CE2-CE2 3.38Å; F283-F287 HydrophobicContact CE2-CZ 4.25Å; F283-F287 AromaticContact CG-CD2 3.86Å; F283-F287 HydrophobicContact CG-CD2 3.86Å; F283-F287 HydrophobicContact CG-CE2 4.19Å; F283-F287 AromaticContact CZ-CD2 3.34Å; F283-F287 HydrophobicContact CZ-CD2 3.34Å; F283-F287 AromaticContact CZ-CE2 3.34Å; F283-F287 HydrophobicContact CZ-CE2 3.34Å; F283-F287 HydrophobicContact CZ-CG 4.07Å; F283-F287 HydrophobicContact CZ-CZ 4.08Å; F283-F287 VanDerWaalsContact O-CD2 3.31Å; F283-F287 WeakPolarHBondContact O-CD2 3.38Å; F283-F287 PolarHBondContact O-N 3.06Å; F283-P328 HydrophobicContact CE2-CB 3.87Å; F283-P328 HydrophobicContact CE2-CG 4.19Å; F283-P328 HydrophobicContact CZ-CB 3.9Å; F283-P328 HydrophobicContact CZ-CG 4.27Å; F283-F329 HydrophobicContact CZ-CB 4.31Å; F283-S332 VanDerWaalsContact CE1-CB 3.42Å
284	D	93.8	Very high	91.7	Very high	21 Å²	21	39.6 Å²	39.6	11%	0.112	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-39.1	-178.8	-70.8	-5.4	0	0	0	112.1	E280 E281 A282 I286 F287 H288 S332 R335	E280-D284 WeakPolarHBondContact O-CB 3.37Å; E280-D284 PolarHBondContact O-N 3.5Å; E281-D284 PolarHBondContact O-N 3.32Å; A282-D284 PolarHBondContact O-N 2.94Å; D284-I286 PolarHBondContact O-N 3.16Å; D284-F287 PolarHBondContact O-N 2.88Å; D284-H288 VanDerWaalsContact O-CB 3.23Å; D284-H288 WeakPolarHBondContact O-CB 3.4Å; D284-H288 VanDerWaalsContact O-CG 3.32Å; D284-H288 PolarHBondContact O-N 2.86Å; D284-H288 IonicContact OD1-NE2 2.79Å; D284-H288 IonicContact OD2-CE1 2.94Å; D284-H288 IonicContact OD2-NE2 2.84Å; D284-S332 WeakPolarHBondContact OD1-CA 3.43Å; D284-S332 WeakPolarHBondContact OD1-CB 3.41Å; D284-S332 PolarHBondContact OD1-OG 3.03Å; D284-R335 IonicContact OD1-CZ 3.24Å; D284-R335 IonicContact OD1-NE 3.01Å; D284-R335 PolarHBondContact OD1-NE 3.48Å; D284-R335 IonicContact OD1-NH2 2.82Å; D284-R335 PolarHBondContact OD1-NH2 3.36Å; D284-R335 WeakPolarHBondContact OD2-CD 3.31Å; D284-R335 IonicContact OD2-CZ 2.75Å; D284-R335 IonicContact OD2-NE 3.76Å; D284-R335 PolarHBondContact OD2-NE 3.3Å; D284-R335 IonicContact OD2-NH2 3.1Å
285	R	90.2	Very high	91.7	Very high	119 Å²	119	39.4 Å²	39.4	45%	0.449	20%	0.203	S	C	.	.	H	α-helix	trans	-59.9	-29.7	173.6	-72.5	177.8	-164.9	177.2	4.6	113.3	E281 A282 F283 P289	E281-R285 WeakPolarHBondContact O-CG 3.43Å; E281-R285 PolarHBondContact O-N 3.45Å; E281-R285 IonicContact OE1-CZ 2.7Å; E281-R285 IonicContact OE1-NE 2.6Å; E281-R285 IonicContact OE1-NH2 2.65Å; E281-R285 PolarHBondContact OE1-NH2 3.14Å; A282-R285 PolarHBondContact O-N 3.45Å; F283-R285 PolarHBondContact O-N 2.83Å; R285-P289 VanDerWaalsContact O-CD 3.28Å; R285-P289 WeakPolarHBondContact O-CD 3.45Å; R285-P289 WeakPolarHBondContact O-CG 3.13Å
286	I	91.1	Very high	91.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-79.9	-51.1	175.7	-62.9	166.9	0	0	0	110.1	V235 L238 Q251 F271 A282 F283 D284	V235-I286 HydrophobicContact CG1-CD1 3.76Å; L238-I286 HydrophobicContact CB-CG1 3.98Å; L238-I286 HydrophobicContact CB-CG2 4.1Å; L238-I286 HydrophobicContact CD1-CG2 4.23Å; Q251-I286 PolarHBondContact NE2-O 3.29Å; F271-I286 HydrophobicContact CE1-CG2 4.41Å; F271-I286 HydrophobicContact CE2-CG2 4.41Å; F271-I286 HydrophobicContact CZ-CG2 3.67Å; A282-I286 WeakPolarHBondContact O-CG1 3.48Å; A282-I286 PolarHBondContact O-N 3.42Å; F283-I286 WeakPolarHBondContact O-CB 3.41Å; F283-I286 PolarHBondContact O-N 3.16Å; F283-I286 VanDerWaalsContact O-N 3.12Å; D284-I286 PolarHBondContact O-N 3.16Å
287	F	94	Very high	91.5	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-90.5	-24.6	-166	-73.2	-78.9	0	0	0	114.7	F271 L272 F283 D284 L290 V291 L318 F329	F271-F287 HydrophobicContact CD1-CE1 4.21Å; F271-F287 AromaticContact CD1-CZ 3.85Å; F271-F287 HydrophobicContact CD1-CZ 3.85Å; F271-F287 AromaticContact CE1-CE1 3.68Å; F271-F287 HydrophobicContact CE1-CE1 3.68Å; F271-F287 HydrophobicContact CE1-CE2 4.49Å; F271-F287 AromaticContact CE1-CZ 3.5Å; F271-F287 HydrophobicContact CE1-CZ 3.5Å; F271-F287 VanDerWaalsContact CE1-CZ 3.5Å; F271-F287 HydrophobicContact CZ-CZ 4.19Å; L272-F287 HydrophobicContact CD1-CE1 3.91Å; L272-F287 HydrophobicContact CD1-CZ 3.67Å; L272-F287 HydrophobicContact CG-CE1 4.27Å; L272-F287 HydrophobicContact CG-CE2 4.48Å; L272-F287 HydrophobicContact CG-CZ 3.76Å; F283-F287 HydrophobicContact CD1-CB 4.42Å; F283-F287 AromaticContact CD1-CD2 3.49Å; F283-F287 HydrophobicContact CD1-CD2 3.49Å; F283-F287 VanDerWaalsContact CD1-CD2 3.49Å; F283-F287 HydrophobicContact CD1-CE2 4.16Å; F283-F287 HydrophobicContact CD1-CG 4.28Å; F283-F287 AromaticContact CD2-CD2 3.98Å; F283-F287 HydrophobicContact CD2-CD2 3.98Å; F283-F287 AromaticContact CD2-CE2 3.82Å; F283-F287 HydrophobicContact CD2-CE2 3.82Å; F283-F287 HydrophobicContact CE1-CB 4.11Å; F283-F287 AromaticContact CE1-CD2 3.2Å; F283-F287 HydrophobicContact CE1-CD2 3.2Å; F283-F287 AromaticContact CE1-CE2 3.75Å; F283-F287 HydrophobicContact CE1-CE2 3.75Å; F283-F287 AromaticContact CE1-CG 3.76Å; F283-F287 HydrophobicContact CE1-CG 3.76Å; F283-F287 AromaticContact CE2-CD2 3.74Å; F283-F287 HydrophobicContact CE2-CD2 3.74Å; F283-F287 AromaticContact CE2-CE2 3.38Å; F283-F287 HydrophobicContact CE2-CE2 3.38Å; F283-F287 HydrophobicContact CE2-CZ 4.25Å; F283-F287 AromaticContact CG-CD2 3.86Å; F283-F287 HydrophobicContact CG-CD2 3.86Å; F283-F287 HydrophobicContact CG-CE2 4.19Å; F283-F287 AromaticContact CZ-CD2 3.34Å; F283-F287 HydrophobicContact CZ-CD2 3.34Å; F283-F287 AromaticContact CZ-CE2 3.34Å; F283-F287 HydrophobicContact CZ-CE2 3.34Å; F283-F287 HydrophobicContact CZ-CG 4.07Å; F283-F287 HydrophobicContact CZ-CZ 4.08Å; F283-F287 VanDerWaalsContact O-CD2 3.31Å; F283-F287 WeakPolarHBondContact O-CD2 3.38Å; F283-F287 PolarHBondContact O-N 3.06Å; D284-F287 PolarHBondContact O-N 2.88Å; F287-L290 HydrophobicContact CD1-CD2 4.06Å; F287-L290 HydrophobicContact CE1-CD2 4.35Å; F287-L290 WeakPolarHBondContact O-CB 3.22Å; F287-L290 PolarHBondContact O-N 3.09Å; F287-V291 WeakPolarHBondContact O-CG2 3.47Å; F287-V291 PolarHBondContact O-N 3.35Å; F287-L318 HydrophobicContact CD1-CD1 4.47Å; F287-L318 HydrophobicContact CE1-CD2 3.95Å; F287-F329 HydrophobicContact CB-CD2 4.14Å; F287-F329 HydrophobicContact CB-CE2 4.11Å; F287-F329 AromaticContact CD1-CD2 3.74Å; F287-F329 HydrophobicContact CD1-CD2 3.74Å; F287-F329 AromaticContact CD1-CE2 3.88Å; F287-F329 HydrophobicContact CD1-CE2 3.88Å; F287-F329 HydrophobicContact CE1-CD2 4.44Å; F287-F329 HydrophobicContact CG-CD2 4.03Å; F287-F329 HydrophobicContact CG-CE2 4.3Å
288	H	94.1	Very high	91.5	Very high	32 Å²	32	36.8 Å²	36.8	15%	0.148	19%	0.185	C	C	.	.	H	α-helix	trans	-64.3	-48.9	177	-70.1	-170.1	0	0	0	111.8	D284 L290 V291 D292 S332 R336	D284-H288 VanDerWaalsContact O-CB 3.23Å; D284-H288 WeakPolarHBondContact O-CB 3.4Å; D284-H288 VanDerWaalsContact O-CG 3.32Å; D284-H288 PolarHBondContact O-N 2.86Å; D284-H288 IonicContact OD1-NE2 2.79Å; D284-H288 IonicContact OD2-CE1 2.94Å; D284-H288 IonicContact OD2-NE2 2.84Å; H288-L290 VanDerWaalsContact C-N 3.3Å; H288-L290 PolarHBondContact O-N 2.84Å; H288-V291 WeakPolarHBondContact O-CB 3.32Å; H288-V291 PolarHBondContact O-N 3.01Å; H288-V291 VanDerWaalsContact O-N 3.1Å; H288-D292 PolarHBondContact O-N 2.75Å; H288-S332 PolarHBondContact CD2-OG 2.85Å; H288-S332 PolarHBondContact NE2-O 2.96Å; H288-S332 PolarHBondContact NE2-OG 2.64Å; H288-R336 VanDerWaalsContact CD2-CG 3.46Å; H288-R336 WeakPolarHBondContact CD2-CG 3.38Å; H288-R336 WeakPolarHBondContact NE2-CG 3.49Å; H288-R336 PolarHBondContact O-NH1 2.66Å
289	P	91.4	Very high	91.6	Very high	17 Å²	17	38.8 Å²	38.8	11%	0.11	19%	0.192	C	C	.	.	H	α-helix	trans	-52.3	-42.7	169.3	-38.3	44.8	0	0	0	115.8	M248 Q251 R285 V291 D292 V293	M248-P289 HydrophobicContact CE-CB 3.27Å; M248-P289 HydrophobicContact CE-CG 3.45Å; M248-P289 VanDerWaalsContact CE-CG 3.45Å; M248-P289 HydrophobicContact SD-CB 3.74Å; M248-P289 HydrophobicContact SD-CG 4.32Å; Q251-P289 HydrophobicContact CG-CB 3.85Å; R285-P289 VanDerWaalsContact O-CD 3.28Å; R285-P289 WeakPolarHBondContact O-CD 3.45Å; R285-P289 WeakPolarHBondContact O-CG 3.13Å; P289-V291 VanDerWaalsContact C-N 3.28Å; P289-V291 PolarHBondContact O-N 3.41Å; P289-D292 WeakPolarHBondContact O-CB 3.24Å; P289-D292 PolarHBondContact O-N 2.94Å; P289-D292 VanDerWaalsContact O-N 3.17Å; P289-V293 PolarHBondContact O-N 3.37Å
290	L	91.4	Very high	91.5	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.6	-44.2	178	-177.6	57.3	0	0	0	110.1	A255 F287 H288 D292 V293 L294 L318	A255-L290 HydrophobicContact CB-CD1 3.7Å; F287-L290 HydrophobicContact CD1-CD2 4.06Å; F287-L290 HydrophobicContact CE1-CD2 4.35Å; F287-L290 WeakPolarHBondContact O-CB 3.22Å; F287-L290 PolarHBondContact O-N 3.09Å; H288-L290 VanDerWaalsContact C-N 3.3Å; H288-L290 PolarHBondContact O-N 2.84Å; L290-D292 VanDerWaalsContact C-N 3.32Å; L290-D292 PolarHBondContact O-N 3.39Å; L290-V293 WeakPolarHBondContact O-CB 3.17Å; L290-V293 PolarHBondContact O-N 2.98Å; L290-L294 HydrophobicContact CG-CD1 4.48Å; L290-L294 VanDerWaalsContact O-CG 3.3Å; L290-L294 WeakPolarHBondContact O-CG 3.23Å; L290-L294 PolarHBondContact O-N 3.2Å; L290-L318 HydrophobicContact CD2-CD1 3.82Å
291	V	94	Very high	91.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.4	-38.8	176.1	173.4	0	0	0	0	111.4	F287 H288 P289 V293 L294 I295 F315 F329 I333 P357	F287-V291 WeakPolarHBondContact O-CG2 3.47Å; F287-V291 PolarHBondContact O-N 3.35Å; H288-V291 WeakPolarHBondContact O-CB 3.32Å; H288-V291 PolarHBondContact O-N 3.01Å; H288-V291 VanDerWaalsContact O-N 3.1Å; P289-V291 VanDerWaalsContact C-N 3.28Å; P289-V291 PolarHBondContact O-N 3.41Å; V291-V293 VanDerWaalsContact C-N 3.32Å; V291-V293 PolarHBondContact O-N 2.9Å; V291-L294 PolarHBondContact O-N 3.1Å; V291-L294 VanDerWaalsContact O-N 3.16Å; V291-I295 HydrophobicContact CG1-CD1 3.75Å; V291-I295 HydrophobicContact CG1-CG1 4.21Å; V291-I295 WeakPolarHBondContact O-CB 3.31Å; V291-I295 VanDerWaalsContact O-CG1 3.31Å; V291-I295 WeakPolarHBondContact O-CG1 3.32Å; V291-I295 PolarHBondContact O-N 2.85Å; V291-F315 HydrophobicContact CG1-CE2 4.37Å; V291-F315 HydrophobicContact CG2-CE2 4.25Å; V291-F329 HydrophobicContact CG2-CE2 3.94Å; V291-F329 HydrophobicContact CG2-CZ 3.79Å; V291-I333 HydrophobicContact CB-CD1 4.42Å; V291-I333 HydrophobicContact CG1-CD1 4.22Å; V291-I333 HydrophobicContact CG2-CD1 3.44Å; V291-I333 VanDerWaalsContact CG2-CD1 3.44Å; V291-P357 HydrophobicContact CG1-CB 4.18Å
292	D	91.8	Very high	91.4	Very high	73 Å²	73	29.4 Å²	29.4	39%	0.39	15%	0.145	S	C	.	.	H	α-helix	trans	-61	-41.2	176	-61.1	-26.5	0	0	0	111.7	H288 P289 L290 I295 F296 R336	H288-D292 PolarHBondContact O-N 2.75Å; P289-D292 WeakPolarHBondContact O-CB 3.24Å; P289-D292 PolarHBondContact O-N 2.94Å; P289-D292 VanDerWaalsContact O-N 3.17Å; L290-D292 VanDerWaalsContact C-N 3.32Å; L290-D292 PolarHBondContact O-N 3.39Å; D292-I295 PolarHBondContact O-N 3.46Å; D292-F296 WeakPolarHBondContact O-CB 3.35Å; D292-F296 PolarHBondContact O-N 3.11Å; D292-R336 IonicContact OD1-CZ 2.68Å; D292-R336 VanDerWaalsContact OD1-CZ 3.26Å; D292-R336 IonicContact OD1-NH1 2.77Å; D292-R336 PolarHBondContact OD1-NH1 2.83Å; D292-R336 IonicContact OD1-NH2 3.73Å; D292-R336 PolarHBondContact OD1-NH2 3.47Å
293	V	89.9	Confident	91.5	Very high	9 Å²	9	28.9 Å²	28.9	6%	0.055	14%	0.141	C	C	.	.	H	α-helix	trans	-61.6	-44.8	173.6	172.7	0	0	0	0	111.1	F182 Q251 R252 A255 P289 L290 V291 F296 A297	F182-V293 HydrophobicContact CD1-CG1 4.28Å; F182-V293 HydrophobicContact CE1-CG1 4.37Å; Q251-V293 HydrophobicContact CB-CG2 4.4Å; R252-V293 HydrophobicContact CG-CG1 3.95Å; R252-V293 HydrophobicContact CG-CG2 3.67Å; A255-V293 HydrophobicContact CB-CG1 3.95Å; P289-V293 PolarHBondContact O-N 3.37Å; L290-V293 WeakPolarHBondContact O-CB 3.17Å; L290-V293 PolarHBondContact O-N 2.98Å; V291-V293 VanDerWaalsContact C-N 3.32Å; V291-V293 PolarHBondContact O-N 2.9Å; V293-F296 PolarHBondContact O-N 3.02Å; V293-A297 WeakPolarHBondContact O-CB 3.49Å; V293-A297 PolarHBondContact O-N 2.68Å
294	L	92.5	Very high	91.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-66.5	-39.9	179.7	-61	173.6	0	0	0	112	F182 A255 L290 V291 A297 S298 P311 V314 F315 I361	F182-L294 HydrophobicContact CE1-CD2 4.44Å; A255-L294 HydrophobicContact CB-CD2 4.41Å; L290-L294 HydrophobicContact CG-CD1 4.48Å; L290-L294 VanDerWaalsContact O-CG 3.3Å; L290-L294 WeakPolarHBondContact O-CG 3.23Å; L290-L294 PolarHBondContact O-N 3.2Å; V291-L294 PolarHBondContact O-N 3.1Å; V291-L294 VanDerWaalsContact O-N 3.16Å; L294-A297 PolarHBondContact O-N 2.78Å; L294-S298 WeakPolarHBondContact O-CB 3.43Å; L294-S298 PolarHBondContact O-N 3.4Å; L294-S298 PolarHBondContact O-OG 3.1Å; L294-P311 HydrophobicContact CB-CB 4.23Å; L294-P311 HydrophobicContact CD2-CB 4.28Å; L294-P311 WeakPolarHBondContact O-CB 3.36Å; L294-V314 HydrophobicContact CD1-CB 4.24Å; L294-V314 HydrophobicContact CD1-CG1 3.88Å; L294-V314 HydrophobicContact CD2-CB 3.92Å; L294-V314 HydrophobicContact CD2-CG1 4Å; L294-V314 HydrophobicContact CD2-CG2 4.33Å; L294-F315 HydrophobicContact CD1-CB 4.35Å; L294-F315 HydrophobicContact CD1-CD2 4.37Å; L294-I361 HydrophobicContact CB-CD1 4.29Å
295	I	92.9	Very high	90.8	Very high	19 Å²	19	29.7 Å²	29.7	10%	0.097	14%	0.144	C	C	.	.	H	α-helix	trans	-62.6	-50.1	175	-72	170.7	0	0	0	109.9	V291 D292 A297 S298 H299 P357 I361	V291-I295 HydrophobicContact CG1-CD1 3.75Å; V291-I295 HydrophobicContact CG1-CG1 4.21Å; V291-I295 WeakPolarHBondContact O-CB 3.31Å; V291-I295 VanDerWaalsContact O-CG1 3.31Å; V291-I295 WeakPolarHBondContact O-CG1 3.32Å; V291-I295 PolarHBondContact O-N 2.85Å; D292-I295 PolarHBondContact O-N 3.46Å; I295-A297 VanDerWaalsContact C-N 3.31Å; I295-A297 PolarHBondContact O-N 2.6Å; I295-S298 WeakPolarHBondContact O-CB 3.37Å; I295-S298 PolarHBondContact O-N 3.03Å; I295-S298 VanDerWaalsContact O-N 3.08Å; I295-H299 PolarHBondContact O-N 3Å; I295-P357 HydrophobicContact CD1-CB 4.17Å; I295-P357 HydrophobicContact CD1-CG 4.36Å; I295-I361 HydrophobicContact CG1-CD1 4.16Å; I295-I361 HydrophobicContact CG1-CG1 4.07Å
296	F	90.1	Very high	90.4	Very high	109 Å²	109	31.3 Å²	31.3	48%	0.478	16%	0.157	S	C	.	.	H	α-helix	trans	-57.6	-45.3	177.8	177.7	-104.2	0	0	0	111.7	D292 V293 S298 H299 V300	D292-F296 WeakPolarHBondContact O-CB 3.35Å; D292-F296 PolarHBondContact O-N 3.11Å; V293-F296 PolarHBondContact O-N 3.02Å; F296-S298 VanDerWaalsContact C-N 3.33Å; F296-S298 PolarHBondContact O-N 2.92Å; F296-H299 PolarHBondContact O-N 2.81Å; F296-V300 HydrophobicContact CD2-CG2 4.45Å; F296-V300 HydrophobicContact CE1-CG2 4.11Å; F296-V300 HydrophobicContact CE2-CG2 4.03Å; F296-V300 HydrophobicContact CZ-CG2 3.85Å; F296-V300 WeakPolarHBondContact O-CG2 3.39Å; F296-V300 PolarHBondContact O-N 3.42Å; F296-V300 VanDerWaalsContact O-N 3.16Å
297	A	89	Confident	90.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.2	-42.6	175.3	0	0	0	0	0	112	S181 F182 V293 L294 I295 H299 V300 L301 P311	S181-A297 WeakPolarHBondContact OG-CB 3.32Å; F182-A297 HydrophobicContact CE1-CB 4.16Å; F182-A297 HydrophobicContact CE2-CB 3.93Å; F182-A297 HydrophobicContact CZ-CB 3.64Å; V293-A297 WeakPolarHBondContact O-CB 3.49Å; V293-A297 PolarHBondContact O-N 2.68Å; L294-A297 PolarHBondContact O-N 2.78Å; I295-A297 VanDerWaalsContact C-N 3.31Å; I295-A297 PolarHBondContact O-N 2.6Å; A297-H299 VanDerWaalsContact C-N 3.29Å; A297-H299 PolarHBondContact O-N 2.93Å; A297-V300 PolarHBondContact O-N 3.31Å; A297-L301 HydrophobicContact CB-CD1 4.34Å; A297-L301 WeakPolarHBondContact O-CB 3.43Å; A297-L301 WeakPolarHBondContact O-CD1 3.36Å; A297-L301 WeakPolarHBondContact O-CG 3.37Å; A297-L301 PolarHBondContact O-N 2.87Å; A297-P311 HydrophobicContact CB-CB 4.47Å; A297-P311 HydrophobicContact CB-CG 3.74Å
298	S	91.5	Very high	90	Very high	16 Å²	16	32.1 Å²	32.1	11%	0.112	16%	0.162	C	C	.	.	H	α-helix	trans	-62.3	-34.5	177.9	-54.8	0	0	0	0	112.6	L294 I295 F296 P311	L294-S298 WeakPolarHBondContact O-CB 3.43Å; L294-S298 PolarHBondContact O-N 3.4Å; L294-S298 PolarHBondContact O-OG 3.1Å; I295-S298 WeakPolarHBondContact O-CB 3.37Å; I295-S298 PolarHBondContact O-N 3.03Å; I295-S298 VanDerWaalsContact O-N 3.08Å; F296-S298 VanDerWaalsContact C-N 3.33Å; F296-S298 PolarHBondContact O-N 2.92Å; S298-P311 VanDerWaalsContact OG-CB 3.27Å; S298-P311 WeakPolarHBondContact OG-CB 2.92Å
299	H	90.4	Very high	89.9	Confident	108 Å²	108	31.5 Å²	31.5	50%	0.5	16%	0.16	S	C	.	.	H	α-helix	trans	-76.4	-26.1	177.5	-66.5	165	0	0	0	113.9	I295 F296 A297 A354 S360	I295-H299 PolarHBondContact O-N 3Å; F296-H299 PolarHBondContact O-N 2.81Å; A297-H299 VanDerWaalsContact C-N 3.29Å; A297-H299 PolarHBondContact O-N 2.93Å; H299-A354 PolarHBondContact CE1-O 3.28Å; H299-A354 PolarHBondContact NE2-O 3.39Å; H299-S360 WeakPolarHBondContact NE2-CB 3.48Å; H299-S360 PolarHBondContact NE2-OG 3.04Å
300	V	88.4	Confident	89.9	Confident	57 Å²	57	32.8 Å²	32.8	35%	0.345	16%	0.163	S	C	.	.	H	α-helix	trans	-88.9	-34.5	-178.6	173.7	0	0	0	0	112	F296 A297	F296-V300 HydrophobicContact CD2-CG2 4.45Å; F296-V300 HydrophobicContact CE1-CG2 4.11Å; F296-V300 HydrophobicContact CE2-CG2 4.03Å; F296-V300 HydrophobicContact CZ-CG2 3.85Å; F296-V300 WeakPolarHBondContact O-CG2 3.39Å; F296-V300 PolarHBondContact O-N 3.42Å; F296-V300 VanDerWaalsContact O-N 3.16Å; A297-V300 PolarHBondContact O-N 3.31Å
301	L	90	Very high	89.9	Confident	13 Å²	13	32.8 Å²	32.8	7%	0.068	16%	0.163	C	C	.	.			trans	-76.2	138.5	-177.1	-67.7	169.1	0	0	0	111.7	G178 F182 A297 D305 I307 V308 P311	G178-L301 VanDerWaalsContact CA-CD2 3.42Å; F182-L301 HydrophobicContact CE2-CD1 4.42Å; A297-L301 HydrophobicContact CB-CD1 4.34Å; A297-L301 WeakPolarHBondContact O-CB 3.43Å; A297-L301 WeakPolarHBondContact O-CD1 3.36Å; A297-L301 WeakPolarHBondContact O-CG 3.37Å; A297-L301 PolarHBondContact O-N 2.87Å; L301-D305 HydrophobicContact CD2-CB 4.04Å; L301-I307 HydrophobicContact CD1-CD1 4.44Å; L301-I307 HydrophobicContact CD1-CG1 4.33Å; L301-I307 HydrophobicContact CD2-CD1 3.79Å; L301-I307 HydrophobicContact CD2-CG1 3.68Å; L301-V308 HydrophobicContact CB-CG2 4.28Å; L301-P311 HydrophobicContact CD1-CG 3.9Å
302	S	89.9	Confident	89.9	Confident	10 Å²	10	33 Å²	33	7%	0.07	16%	0.164	C	C	.	.			trans	-108.5	158.3	175.4	172.7	0	0	0	0	110.1	Q304 D305 V308 D371 T373 L374	S302-Q304 PolarHBondContact O-N 2.89Å; S302-Q304 PolarHBondContact OG-NE2 3.35Å; S302-D305 PolarHBondContact N-OD2 3.39Å; S302-D305 WeakPolarHBondContact O-CB 3.4Å; S302-D305 PolarHBondContact O-N 2.98Å; S302-V308 WeakPolarHBondContact O-CB 3.29Å; S302-V308 WeakPolarHBondContact O-CG2 3.41Å; S302-D371 WeakPolarHBondContact CB-OD2 3.33Å; S302-D371 PolarHBondContact OG-OD2 3.23Å; S302-T373 PolarHBondContact OG-OG1 2.9Å; S302-L374 WeakPolarHBondContact OG-CD2 3.34Å
303	L	90.7	Very high	89.9	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-19.3	177.4	-173.7	65.7	0	0	0	113	V364 F365 C366 L374 I391 R394 I398	L303-V364 HydrophobicContact CB-CG1 4.09Å; L303-V364 HydrophobicContact CD1-CG1 3.91Å; L303-F365 WeakPolarHBondContact CB-O 3.42Å; L303-C366 HydrophobicContact CD2-CB 3.81Å; L303-L374 HydrophobicContact CB-CD2 3.79Å; L303-I391 HydrophobicContact CD2-CB 4.4Å; L303-I391 HydrophobicContact CD2-CG1 3.98Å; L303-I391 HydrophobicContact CD2-CG2 4.06Å; L303-R394 HydrophobicContact CD1-CB 3.76Å; L303-R394 WeakPolarHBondContact O-CD 3.42Å; L303-R394 PolarHBondContact O-NH1 3Å; L303-I398 HydrophobicContact CD1-CD1 3.93Å
304	Q	85.9	Confident	90	Very high	22 Å²	22	31.6 Å²	31.6	10%	0.103	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-21.1	174.1	72	-172.6	-58.4	0	0	114.2	S302 T373 M377 R394	S302-Q304 PolarHBondContact O-N 2.89Å; S302-Q304 PolarHBondContact OG-NE2 3.35Å; Q304-T373 PolarHBondContact NE2-O 3.22Å; Q304-T373 VanDerWaalsContact NE2-O 3.08Å; Q304-T373 PolarHBondContact NE2-OG1 2.95Å; Q304-M377 HydrophobicContact CB-CE 4.43Å; Q304-M377 HydrophobicContact CB-CG 3.53Å; Q304-M377 HydrophobicContact CB-SD 3.66Å; Q304-R394 PolarHBondContact O-NH1 2.76Å
305	D	86.8	Confident	90.2	Very high	19 Å²	19	31.6 Å²	31.6	10%	0.102	16%	0.156	C	C	.	.	S	Bend	trans	-78	136.2	180	-59.6	-49.5	0	0	0	110.6	L301 S302 I307 V308 R394	L301-D305 HydrophobicContact CD2-CB 4.04Å; S302-D305 PolarHBondContact N-OD2 3.39Å; S302-D305 WeakPolarHBondContact O-CB 3.4Å; S302-D305 PolarHBondContact O-N 2.98Å; D305-I307 PolarHBondContact O-N 2.81Å; D305-V308 WeakPolarHBondContact O-CB 3.38Å; D305-V308 WeakPolarHBondContact O-CG1 3.49Å; D305-V308 PolarHBondContact O-N 2.86Å; D305-R394 PolarHBondContact O-NH1 3.16Å
306	E	83.6	Confident	90.3	Very high	153 Å²	153	34 Å²	34	72%	0.715	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-29.2	-178.1	-67.1	-178.1	176.5	0	0	112.7
307	I	86.4	Confident	90.4	Very high	8 Å²	8	30.6 Å²	30.6	4%	0.041	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	9.1	-177.3	63	163.5	0	0	0	113.4	Y179 F182 L301 D305 T309 W310	Y179-I307 HydrophobicContact CD1-CD1 4.35Å; Y179-I307 HydrophobicContact CE1-CD1 4.41Å; Y179-I307 HydrophobicContact CE1-CG2 4.41Å; F182-I307 HydrophobicContact CD2-CD1 4.45Å; F182-I307 HydrophobicContact CE2-CD1 4.45Å; L301-I307 HydrophobicContact CD1-CD1 4.44Å; L301-I307 HydrophobicContact CD1-CG1 4.33Å; L301-I307 HydrophobicContact CD2-CD1 3.79Å; L301-I307 HydrophobicContact CD2-CG1 3.68Å; D305-I307 PolarHBondContact O-N 2.81Å; I307-T309 PolarHBondContact O-N 3.29Å; I307-W310 HydrophobicContact CB-CD2 3.59Å; I307-W310 HydrophobicContact CB-CE3 3.94Å; I307-W310 HydrophobicContact CB-CG 3.9Å; I307-W310 HydrophobicContact CB-CZ2 4.3Å; I307-W310 HydrophobicContact CB-CZ3 4.43Å; I307-W310 HydrophobicContact CD1-CE3 4.36Å; I307-W310 HydrophobicContact CG2-CD2 3.75Å; I307-W310 VanDerWaalsContact CG2-CE2 3.45Å; I307-W310 HydrophobicContact CG2-CE3 4.03Å; I307-W310 HydrophobicContact CG2-CG 4.45Å; I307-W310 HydrophobicContact CG2-CH2 3.8Å; I307-W310 HydrophobicContact CG2-CZ2 3.49Å; I307-W310 VanDerWaalsContact CG2-CZ2 3.49Å; I307-W310 HydrophobicContact CG2-CZ3 4.06Å; I307-W310 VanDerWaalsContact O-CB 3.24Å; I307-W310 WeakPolarHBondContact O-CB 3.49Å; I307-W310 PolarHBondContact O-N 3.08Å
308	V	90.1	Very high	90.7	Very high	9 Å²	9	30.7 Å²	30.7	6%	0.055	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-28.1	-175	67.8	0	0	0	0	113.9	L301 S302 D305 V364	L301-V308 HydrophobicContact CB-CG2 4.28Å; S302-V308 WeakPolarHBondContact O-CB 3.29Å; S302-V308 WeakPolarHBondContact O-CG2 3.41Å; D305-V308 WeakPolarHBondContact O-CB 3.38Å; D305-V308 WeakPolarHBondContact O-CG1 3.49Å; D305-V308 PolarHBondContact O-N 2.86Å; V308-V364 HydrophobicContact CG2-CG1 3.66Å; V308-V364 HydrophobicContact CG2-CG2 4.21Å
309	T	91.4	Very high	90.9	Very high	18 Å²	18	29.9 Å²	29.9	11%	0.11	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-11.2	-178.8	62.1	0	0	0	0	113.9	I307 L312 D313 L397 I398	I307-T309 PolarHBondContact O-N 3.29Å; T309-L312 PolarHBondContact O-N 3.08Å; T309-D313 WeakPolarHBondContact O-CB 3.38Å; T309-D313 PolarHBondContact O-N 2.7Å; T309-L397 HydrophobicContact CG2-CB 4.48Å; T309-L397 HydrophobicContact CG2-CD2 3.8Å; T309-L397 HydrophobicContact CG2-CG 4.06Å; T309-I398 HydrophobicContact CG2-CD1 4.36Å; T309-I398 HydrophobicContact CG2-CG1 3.69Å
310	W	90.7	Very high	91.1	Very high	44 Å²	44	27 Å²	27	17%	0.167	14%	0.137	C	C	.	.	H	α-helix	trans	-56.9	-49.4	-174.9	-77.1	13.5	0	0	0	113.5	F182 Y256 C259 N260 I307 L312 D313 V314	F182-W310 HydrophobicContact CD2-CE3 4.38Å; F182-W310 HydrophobicContact CE2-CE3 4.1Å; Y256-W310 HydrophobicContact CD2-CZ3 4.5Å; C259-W310 HydrophobicContact CB-CB 4.18Å; C259-W310 HydrophobicContact CB-CD2 3.41Å; C259-W310 VanDerWaalsContact CB-CD2 3.41Å; C259-W310 HydrophobicContact CB-CE3 3.27Å; C259-W310 HydrophobicContact CB-CG 3.85Å; C259-W310 HydrophobicContact CB-CH2 4.27Å; C259-W310 HydrophobicContact CB-CZ2 4.38Å; C259-W310 HydrophobicContact CB-CZ3 3.74Å; N260-W310 HydrophobicContact CB-CH2 3.82Å; N260-W310 HydrophobicContact CB-CZ3 4.32Å; I307-W310 HydrophobicContact CB-CD2 3.59Å; I307-W310 HydrophobicContact CB-CE3 3.94Å; I307-W310 HydrophobicContact CB-CG 3.9Å; I307-W310 HydrophobicContact CB-CZ2 4.3Å; I307-W310 HydrophobicContact CB-CZ3 4.43Å; I307-W310 HydrophobicContact CD1-CE3 4.36Å; I307-W310 HydrophobicContact CG2-CD2 3.75Å; I307-W310 VanDerWaalsContact CG2-CE2 3.45Å; I307-W310 HydrophobicContact CG2-CE3 4.03Å; I307-W310 HydrophobicContact CG2-CG 4.45Å; I307-W310 HydrophobicContact CG2-CH2 3.8Å; I307-W310 HydrophobicContact CG2-CZ2 3.49Å; I307-W310 VanDerWaalsContact CG2-CZ2 3.49Å; I307-W310 HydrophobicContact CG2-CZ3 4.06Å; I307-W310 VanDerWaalsContact O-CB 3.24Å; I307-W310 WeakPolarHBondContact O-CB 3.49Å; I307-W310 PolarHBondContact O-N 3.08Å; W310-L312 VanDerWaalsContact C-N 3.3Å; W310-L312 PolarHBondContact O-N 2.71Å; W310-D313 PolarHBondContact O-N 3.24Å; W310-D313 VanDerWaalsContact O-N 3.15Å; W310-V314 WeakPolarHBondContact O-CG2 3.4Å; W310-V314 PolarHBondContact O-N 2.79Å
311	P	92.1	Very high	91.4	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.006	13%	0.126	C	C	.	.	H	α-helix	trans	-60.2	-42.2	-177.6	-22	33	0	0	0	112.7	F182 L294 A297 S298 L301 F315	F182-P311 HydrophobicContact CZ-CG 4.16Å; L294-P311 HydrophobicContact CB-CB 4.23Å; L294-P311 HydrophobicContact CD2-CB 4.28Å; L294-P311 WeakPolarHBondContact O-CB 3.36Å; A297-P311 HydrophobicContact CB-CB 4.47Å; A297-P311 HydrophobicContact CB-CG 3.74Å; S298-P311 VanDerWaalsContact OG-CB 3.27Å; S298-P311 WeakPolarHBondContact OG-CB 2.92Å; L301-P311 HydrophobicContact CD1-CG 3.9Å; P311-F315 WeakPolarHBondContact O-CB 3.31Å; P311-F315 PolarHBondContact O-N 2.75Å
312	L	94.6	Very high	91.6	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-69	-35.8	178.7	-178.1	60.6	0	0	0	112.1	T309 W310 F315 R316 I361 M362 I398 L401 S402	T309-L312 PolarHBondContact O-N 3.08Å; W310-L312 VanDerWaalsContact C-N 3.3Å; W310-L312 PolarHBondContact O-N 2.71Å; L312-F315 PolarHBondContact O-N 3.49Å; L312-R316 WeakPolarHBondContact O-CB 3.32Å; L312-R316 PolarHBondContact O-N 2.96Å; L312-I361 HydrophobicContact CB-CG2 3.87Å; L312-I361 HydrophobicContact CD1-CG2 3.5Å; L312-I361 VanDerWaalsContact CD1-CG2 3.5Å; L312-I361 HydrophobicContact CG-CG2 4.27Å; L312-M362 HydrophobicContact CD1-CG 4.26Å; L312-I398 HydrophobicContact CD2-CG2 3.99Å; L312-I398 WeakPolarHBondContact CD2-O 3.43Å; L312-L401 HydrophobicContact CD2-CB 3.7Å; L312-L401 HydrophobicContact CD2-CD1 4.39Å; L312-L401 HydrophobicContact CG-CB 3.75Å; L312-L401 HydrophobicContact CG-CD1 4.34Å; L312-S402 WeakPolarHBondContact CD2-OG 3.38Å
313	D	92.2	Very high	91.7	Very high	49 Å²	49	29.6 Å²	29.6	26%	0.262	14%	0.144	S	C	.	.	H	α-helix	trans	-67.7	-44.1	177.7	-168.6	40.1	0	0	0	112.3	T309 W310 R316 N317 L401	T309-D313 WeakPolarHBondContact O-CB 3.38Å; T309-D313 PolarHBondContact O-N 2.7Å; W310-D313 PolarHBondContact O-N 3.24Å; W310-D313 VanDerWaalsContact O-N 3.15Å; D313-R316 PolarHBondContact O-N 3.47Å; D313-R316 IonicContact OD1-CZ 3.68Å; D313-R316 IonicContact OD1-NE 2.8Å; D313-R316 PolarHBondContact OD1-NE 3.36Å; D313-R316 IonicContact OD1-NH2 3.89Å; D313-R316 PolarHBondContact OD1-NH2 3.31Å; D313-N317 WeakPolarHBondContact O-CB 3.32Å; D313-N317 VanDerWaalsContact O-CG 3.3Å; D313-N317 PolarHBondContact O-N 2.91Å; D313-N317 PolarHBondContact O-ND2 3.17Å; D313-L401 HydrophobicContact CB-CD1 3.99Å; D313-L401 HydrophobicContact CB-CD2 4.29Å; D313-L401 WeakPolarHBondContact OD1-CD2 3.5Å
314	V	91.5	Very high	91.7	Very high	3 Å²	3	37 Å²	37	2%	0.018	18%	0.184	C	C	.	.	H	α-helix	trans	-58.6	-51.1	172.9	176.4	0	0	0	0	110.2	I258 C259 L294 W310 R316 N317 L318	I258-V314 HydrophobicContact CB-CG2 4.28Å; I258-V314 HydrophobicContact CD1-CG1 4.34Å; I258-V314 HydrophobicContact CG2-CB 4.48Å; I258-V314 HydrophobicContact CG2-CG1 4.16Å; I258-V314 HydrophobicContact CG2-CG2 3.8Å; C259-V314 WeakPolarHBondContact SG-CG2 3.37Å; L294-V314 HydrophobicContact CD1-CB 4.24Å; L294-V314 HydrophobicContact CD1-CG1 3.88Å; L294-V314 HydrophobicContact CD2-CB 3.92Å; L294-V314 HydrophobicContact CD2-CG1 4Å; L294-V314 HydrophobicContact CD2-CG2 4.33Å; W310-V314 WeakPolarHBondContact O-CG2 3.4Å; W310-V314 PolarHBondContact O-N 2.79Å; V314-R316 VanDerWaalsContact C-N 3.29Å; V314-R316 PolarHBondContact O-N 3.47Å; V314-N317 PolarHBondContact O-N 3.01Å; V314-N317 VanDerWaalsContact O-N 3.16Å; V314-L318 HydrophobicContact CG1-CD1 3.94Å; V314-L318 HydrophobicContact CG1-CG 4.37Å; V314-L318 VanDerWaalsContact O-CG 3.3Å; V314-L318 WeakPolarHBondContact O-CG 3.19Å; V314-L318 PolarHBondContact O-N 3.45Å
315	F	95.4	Very high	91.8	Very high	1 Å²	1	39.3 Å²	39.3	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-57.5	-44.3	179.7	-165.8	-86.4	0	0	0	111.7	V291 L294 P311 L312 L318 C319 F329 I333 L358 I361 T405	V291-F315 HydrophobicContact CG1-CE2 4.37Å; V291-F315 HydrophobicContact CG2-CE2 4.25Å; L294-F315 HydrophobicContact CD1-CB 4.35Å; L294-F315 HydrophobicContact CD1-CD2 4.37Å; P311-F315 WeakPolarHBondContact O-CB 3.31Å; P311-F315 PolarHBondContact O-N 2.75Å; L312-F315 PolarHBondContact O-N 3.49Å; F315-L318 PolarHBondContact O-N 3.42Å; F315-C319 PolarHBondContact O-N 2.86Å; F315-C319 PolarHBondContact O-SG 3.2Å; F315-C319 VanDerWaalsContact O-SG 3.42Å; F315-F329 HydrophobicContact CD1-CE1 4.38Å; F315-F329 AromaticContact CD2-CE1 3.93Å; F315-F329 HydrophobicContact CD2-CE1 3.93Å; F315-F329 AromaticContact CD2-CZ 3.86Å; F315-F329 HydrophobicContact CD2-CZ 3.86Å; F315-F329 HydrophobicContact CE1-CE1 4.29Å; F315-F329 AromaticContact CE2-CE1 3.86Å; F315-F329 HydrophobicContact CE2-CE1 3.86Å; F315-F329 AromaticContact CE2-CZ 3.85Å; F315-F329 HydrophobicContact CE2-CZ 3.85Å; F315-F329 HydrophobicContact CG-CE1 4.23Å; F315-F329 HydrophobicContact CZ-CE1 4.05Å; F315-F329 HydrophobicContact CZ-CZ 4.47Å; F315-I333 HydrophobicContact CE2-CD1 3.65Å; F315-I333 HydrophobicContact CE2-CG1 4.15Å; F315-I333 HydrophobicContact CZ-CD1 3.9Å; F315-I333 HydrophobicContact CZ-CG1 3.91Å; F315-I333 HydrophobicContact CZ-CG2 4.34Å; F315-L358 HydrophobicContact CE1-CD2 3.73Å; F315-L358 HydrophobicContact CZ-CD2 4.07Å; F315-I361 HydrophobicContact CB-CD1 4.22Å; F315-I361 HydrophobicContact CB-CG2 4.06Å; F315-I361 HydrophobicContact CD2-CD1 3.17Å; F315-I361 HydrophobicContact CE2-CD1 3.51Å; F315-I361 HydrophobicContact CG-CD1 3.75Å; F315-I361 HydrophobicContact CG-CG2 4.26Å; F315-I361 HydrophobicContact CZ-CD1 4.35Å; F315-T405 HydrophobicContact CD1-CG2 3.64Å; F315-T405 HydrophobicContact CE1-CG2 3.69Å
316	R	95.3	Very high	92.2	Very high	68 Å²	68	39.8 Å²	39.8	26%	0.257	22%	0.218	S	C	.	.	H	α-helix	trans	-60.1	-46.7	175.9	-175.8	-86.8	-63.2	-165.7	-5.1	112	L312 D313 V314 L318 C319 S320 L401 E404 T405	L312-R316 WeakPolarHBondContact O-CB 3.32Å; L312-R316 PolarHBondContact O-N 2.96Å; D313-R316 PolarHBondContact O-N 3.47Å; D313-R316 IonicContact OD1-CZ 3.68Å; D313-R316 IonicContact OD1-NE 2.8Å; D313-R316 PolarHBondContact OD1-NE 3.36Å; D313-R316 IonicContact OD1-NH2 3.89Å; D313-R316 PolarHBondContact OD1-NH2 3.31Å; V314-R316 VanDerWaalsContact C-N 3.29Å; V314-R316 PolarHBondContact O-N 3.47Å; R316-L318 VanDerWaalsContact C-N 3.34Å; R316-L318 PolarHBondContact O-N 2.86Å; R316-C319 PolarHBondContact O-N 3.07Å; R316-S320 WeakPolarHBondContact O-CB 3.06Å; R316-S320 PolarHBondContact O-N 3.4Å; R316-L401 HydrophobicContact CB-CD2 4.43Å; R316-L401 HydrophobicContact CG-CD2 4.26Å; R316-E404 HydrophobicContact CG-CB 4.03Å; R316-E404 HydrophobicContact CG-CG 4.2Å; R316-T405 WeakPolarHBondContact CA-OG1 3.4Å; R316-T405 WeakPolarHBondContact CB-OG1 3.42Å; R316-T405 WeakPolarHBondContact CG-OG1 3.5Å
317	N	92.7	Very high	92.8	Very high	38 Å²	38	33.6 Å²	33.6	20%	0.203	19%	0.188	C	C	.	.	H	α-helix	trans	-61.3	-43.8	179.3	-74.7	-28.9	0	0	0	111.2	D313 V314 S320	D313-N317 WeakPolarHBondContact O-CB 3.32Å; D313-N317 VanDerWaalsContact O-CG 3.3Å; D313-N317 PolarHBondContact O-N 2.91Å; D313-N317 PolarHBondContact O-ND2 3.17Å; V314-N317 PolarHBondContact O-N 3.01Å; V314-N317 VanDerWaalsContact O-N 3.16Å; N317-S320 WeakPolarHBondContact O-CB 3.18Å; N317-S320 PolarHBondContact O-N 2.99Å; N317-S320 VanDerWaalsContact O-N 3.08Å; N317-S320 PolarHBondContact O-OG 3.46Å
318	L	94.7	Very high	93.3	Very high	2 Å²	2	34 Å²	34	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-62.9	-42.8	176.5	-63.9	173.1	0	0	0	111.9	L272 F287 L290 V314 F315 R316 S320 F329	L272-L318 HydrophobicContact CD1-CD2 3.69Å; F287-L318 HydrophobicContact CD1-CD1 4.47Å; F287-L318 HydrophobicContact CE1-CD2 3.95Å; L290-L318 HydrophobicContact CD2-CD1 3.82Å; V314-L318 HydrophobicContact CG1-CD1 3.94Å; V314-L318 HydrophobicContact CG1-CG 4.37Å; V314-L318 VanDerWaalsContact O-CG 3.3Å; V314-L318 WeakPolarHBondContact O-CG 3.19Å; V314-L318 PolarHBondContact O-N 3.45Å; F315-L318 PolarHBondContact O-N 3.42Å; R316-L318 VanDerWaalsContact C-N 3.34Å; R316-L318 PolarHBondContact O-N 2.86Å; L318-S320 PolarHBondContact O-N 3.23Å; L318-F329 HydrophobicContact CB-CB 4.3Å; L318-F329 HydrophobicContact CB-CD1 3.47Å; L318-F329 VanDerWaalsContact CB-CD1 3.47Å; L318-F329 HydrophobicContact CB-CD2 3.88Å; L318-F329 HydrophobicContact CB-CE1 3.59Å; L318-F329 HydrophobicContact CB-CE2 3.99Å; L318-F329 HydrophobicContact CB-CG 3.61Å; L318-F329 HydrophobicContact CB-CZ 3.84Å; L318-F329 HydrophobicContact CD1-CD2 4.17Å; L318-F329 HydrophobicContact CD1-CE1 4.27Å; L318-F329 HydrophobicContact CD1-CE2 3.61Å; L318-F329 HydrophobicContact CD1-CZ 3.66Å; L318-F329 HydrophobicContact CG-CE2 4.39Å; L318-F329 HydrophobicContact CG-CZ 4.41Å; L318-F329 WeakPolarHBondContact O-CB 3.42Å
319	C	96.5	Very high	93.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.5	-30.6	172.8	-73.3	0	0	0	0	113.1	F315 R316 I321 R327 F329 C408	F315-C319 PolarHBondContact O-N 2.86Å; F315-C319 PolarHBondContact O-SG 3.2Å; F315-C319 VanDerWaalsContact O-SG 3.42Å; R316-C319 PolarHBondContact O-N 3.07Å; C319-I321 VanDerWaalsContact C-N 3.35Å; C319-I321 PolarHBondContact O-N 3.1Å; C319-R327 VanDerWaalsContact O-CD 3.28Å; C319-R327 WeakPolarHBondContact O-CD 3.47Å; C319-R327 PolarHBondContact O-NH1 3.32Å; C319-F329 HydrophobicContact CB-CD1 4.48Å; C319-C408 HydrophobicContact CB-CB 3.95Å
320	S	94.2	Very high	93.9	Very high	46 Å²	46	32.8 Å²	32.8	32%	0.322	18%	0.184	S	C	.	.	H	α-helix	trans	-76.8	-17	-172.8	80.7	0	0	0	0	114.9	R316 N317 L318 R327	R316-S320 WeakPolarHBondContact O-CB 3.06Å; R316-S320 PolarHBondContact O-N 3.4Å; N317-S320 WeakPolarHBondContact O-CB 3.18Å; N317-S320 PolarHBondContact O-N 2.99Å; N317-S320 VanDerWaalsContact O-N 3.08Å; N317-S320 PolarHBondContact O-OG 3.46Å; L318-S320 PolarHBondContact O-N 3.23Å; S320-R327 PolarHBondContact O-NH1 3.22Å
321	I	94.8	Very high	94.2	Very high	19 Å²	19	31.2 Å²	31.2	10%	0.097	18%	0.179	C	C	.	.			trans	-81.3	136.6	-176.8	-65.4	165.8	0	0	0	110.4	L268 Y269 L272 C319 V323	L268-I321 HydrophobicContact CB-CD1 3.68Å; Y269-I321 HydrophobicContact CD2-CG2 4.08Å; L272-I321 HydrophobicContact CB-CG2 4.18Å; L272-I321 HydrophobicContact CD1-CD1 4.06Å; L272-I321 HydrophobicContact CD2-CB 3.89Å; L272-I321 HydrophobicContact CD2-CD1 4.02Å; L272-I321 HydrophobicContact CD2-CG2 3.97Å; C319-I321 VanDerWaalsContact C-N 3.35Å; C319-I321 PolarHBondContact O-N 3.1Å; I321-V323 HydrophobicContact CG2-CG2 4.27Å
322	K	95	Very high	94.5	Very high	107 Å²	107	31.1 Å²	31.1	47%	0.465	18%	0.178	S	C	.	.			trans	-113.7	130.8	174.7	-68.5	-175.3	178	-174	0	109.9	Y269 S326 R327	Y269-K322 WeakPolarHBondContact CE2-O 3.33Å; K322-S326 CarbonylContact C-O 3.26Å; K322-S326 WeakPolarHBondContact CA-O 3.43Å; K322-R327 HydrophobicContact CG-CG 4.03Å
323	V	92.3	Very high	94.6	Very high	10 Å²	10	31 Å²	31	6%	0.061	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-121.7	123	173.7	-178	0	0	0	0	107	L272 A276 I321 G325 S326 P328	L272-V323 HydrophobicContact CB-CG2 4.42Å; A276-V323 HydrophobicContact CB-CG1 4.47Å; I321-V323 HydrophobicContact CG2-CG2 4.27Å; V323-G325 PolarHBondContact O-N 3.4Å; V323-G325 VanDerWaalsContact O-N 3.1Å; V323-S326 PolarHBondContact N-O 3.47Å; V323-S326 PolarHBondContact O-N 3.49Å; V323-P328 HydrophobicContact CB-CG 4.03Å; V323-P328 HydrophobicContact CG2-CG 3.83Å
324	N	89	Confident	94.7	Very high	156 Å²	156	30.5 Å²	30.5	83%	0.834	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	36.7	179.5	-59.5	-29.8	0	0	0	114.3	S326	N324-S326 VanDerWaalsContact C-N 3.29Å; N324-S326 PolarHBondContact O-N 2.95Å
325	G	89.9	Confident	94.9	Very high	70 Å²	70	34.1 Å²	34.1	72%	0.722	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.6	-11.9	179	0	0	0	0	0	115.6	V323	V323-G325 PolarHBondContact O-N 3.4Å; V323-G325 VanDerWaalsContact O-N 3.1Å
326	S	93.7	Very high	94.9	Very high	30 Å²	30	34.8 Å²	34.8	21%	0.21	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-104.2	166	176.3	-171.5	0	0	0	0	111.9	K322 V323 N324 P328 N331 N412	K322-S326 CarbonylContact C-O 3.26Å; K322-S326 WeakPolarHBondContact CA-O 3.43Å; V323-S326 PolarHBondContact N-O 3.47Å; V323-S326 PolarHBondContact O-N 3.49Å; N324-S326 VanDerWaalsContact C-N 3.29Å; N324-S326 PolarHBondContact O-N 2.95Å; S326-P328 WeakPolarHBondContact O-CD 3.4Å; S326-N331 PolarHBondContact OG-ND2 3.26Å; S326-N412 PolarHBondContact OG-OD1 2.92Å
327	R	96.4	Very high	94.7	Very high	23 Å²	23	36.9 Å²	36.9	9%	0.087	21%	0.213	C	C	.	.			trans	-108.1	89.1	172.9	-62.1	-174.2	179.6	-75.2	6.6	109.4	C319 S320 K322 F329 C330 N331 C408 N412	C319-R327 VanDerWaalsContact O-CD 3.28Å; C319-R327 WeakPolarHBondContact O-CD 3.47Å; C319-R327 PolarHBondContact O-NH1 3.32Å; S320-R327 PolarHBondContact O-NH1 3.22Å; K322-R327 HydrophobicContact CG-CG 4.03Å; R327-F329 VanDerWaalsContact C-N 3.31Å; R327-F329 PolarHBondContact O-N 3.19Å; R327-C330 HydrophobicContact CB-CB 3.85Å; R327-C330 WeakPolarHBondContact O-CB 3.14Å; R327-C330 PolarHBondContact O-N 3.42Å; R327-N331 PolarHBondContact O-N 2.92Å; R327-C408 WeakPolarHBondContact CD-O 3.47Å; R327-C408 PolarHBondContact NE-O 3.22Å; R327-N412 HydrophobicContact CB-CB 4.06Å; R327-N412 HydrophobicContact CG-CB 3.96Å; R327-N412 PolarHBondContact N-OD1 2.8Å; R327-N412 VanDerWaalsContact N-OD1 3.17Å
328	P	96.3	Very high	94.7	Very high	17 Å²	17	37 Å²	37	11%	0.11	21%	0.213	C	C	.	.	H	α-helix	trans	-61.9	-36.1	-170.1	24.6	-34.8	0	0	0	113.1	A276 F283 V323 S326 N331 S332	A276-P328 HydrophobicContact CB-CB 4.27Å; A276-P328 HydrophobicContact CB-CG 4.48Å; F283-P328 HydrophobicContact CE2-CB 3.87Å; F283-P328 HydrophobicContact CE2-CG 4.19Å; F283-P328 HydrophobicContact CZ-CB 3.9Å; F283-P328 HydrophobicContact CZ-CG 4.27Å; V323-P328 HydrophobicContact CB-CG 4.03Å; V323-P328 HydrophobicContact CG2-CG 3.83Å; S326-P328 WeakPolarHBondContact O-CD 3.4Å; P328-N331 WeakPolarHBondContact O-CB 3.08Å; P328-N331 PolarHBondContact O-N 3.1Å; P328-S332 WeakPolarHBondContact O-CB 3.27Å; P328-S332 PolarHBondContact O-N 3.32Å
329	F	97.6	Very high	94.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-43.7	174.9	-175.9	-103.7	0	0	0	112	L272 F283 F287 V291 F315 L318 C319 R327 N331 S332 I333	L272-F329 HydrophobicContact CD2-CB 4.09Å; F283-F329 HydrophobicContact CZ-CB 4.31Å; F287-F329 HydrophobicContact CB-CD2 4.14Å; F287-F329 HydrophobicContact CB-CE2 4.11Å; F287-F329 AromaticContact CD1-CD2 3.74Å; F287-F329 HydrophobicContact CD1-CD2 3.74Å; F287-F329 AromaticContact CD1-CE2 3.88Å; F287-F329 HydrophobicContact CD1-CE2 3.88Å; F287-F329 HydrophobicContact CE1-CD2 4.44Å; F287-F329 HydrophobicContact CG-CD2 4.03Å; F287-F329 HydrophobicContact CG-CE2 4.3Å; V291-F329 HydrophobicContact CG2-CE2 3.94Å; V291-F329 HydrophobicContact CG2-CZ 3.79Å; F315-F329 HydrophobicContact CD1-CE1 4.38Å; F315-F329 AromaticContact CD2-CE1 3.93Å; F315-F329 HydrophobicContact CD2-CE1 3.93Å; F315-F329 AromaticContact CD2-CZ 3.86Å; F315-F329 HydrophobicContact CD2-CZ 3.86Å; F315-F329 HydrophobicContact CE1-CE1 4.29Å; F315-F329 AromaticContact CE2-CE1 3.86Å; F315-F329 HydrophobicContact CE2-CE1 3.86Å; F315-F329 AromaticContact CE2-CZ 3.85Å; F315-F329 HydrophobicContact CE2-CZ 3.85Å; F315-F329 HydrophobicContact CG-CE1 4.23Å; F315-F329 HydrophobicContact CZ-CE1 4.05Å; F315-F329 HydrophobicContact CZ-CZ 4.47Å; L318-F329 HydrophobicContact CB-CB 4.3Å; L318-F329 HydrophobicContact CB-CD1 3.47Å; L318-F329 VanDerWaalsContact CB-CD1 3.47Å; L318-F329 HydrophobicContact CB-CD2 3.88Å; L318-F329 HydrophobicContact CB-CE1 3.59Å; L318-F329 HydrophobicContact CB-CE2 3.99Å; L318-F329 HydrophobicContact CB-CG 3.61Å; L318-F329 HydrophobicContact CB-CZ 3.84Å; L318-F329 HydrophobicContact CD1-CD2 4.17Å; L318-F329 HydrophobicContact CD1-CE1 4.27Å; L318-F329 HydrophobicContact CD1-CE2 3.61Å; L318-F329 HydrophobicContact CD1-CZ 3.66Å; L318-F329 HydrophobicContact CG-CE2 4.39Å; L318-F329 HydrophobicContact CG-CZ 4.41Å; L318-F329 WeakPolarHBondContact O-CB 3.42Å; C319-F329 HydrophobicContact CB-CD1 4.48Å; R327-F329 VanDerWaalsContact C-N 3.31Å; R327-F329 PolarHBondContact O-N 3.19Å; F329-N331 PolarHBondContact O-N 3Å; F329-S332 WeakPolarHBondContact O-CB 3.3Å; F329-S332 PolarHBondContact O-N 3.3Å; F329-I333 HydrophobicContact CD1-CG1 4.16Å; F329-I333 HydrophobicContact CE1-CD1 4.06Å; F329-I333 HydrophobicContact CE1-CG1 3.84Å; F329-I333 HydrophobicContact CE2-CD1 4.12Å; F329-I333 HydrophobicContact CE2-CG1 4.43Å; F329-I333 HydrophobicContact CZ-CD1 3.71Å; F329-I333 HydrophobicContact CZ-CG1 4Å; F329-I333 WeakPolarHBondContact O-CG1 3.44Å; F329-I333 PolarHBondContact O-N 3.46Å
330	C	97.6	Very high	93.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.2	-37.9	175.5	-62.1	0	0	0	0	111.9	R327 L334 M409	R327-C330 HydrophobicContact CB-CB 3.85Å; R327-C330 WeakPolarHBondContact O-CB 3.14Å; R327-C330 PolarHBondContact O-N 3.42Å; C330-L334 WeakPolarHBondContact O-CG 3.24Å; C330-M409 HydrophobicContact CB-CG 4.36Å
331	N	97.1	Very high	92.7	Very high	11 Å²	11	43.8 Å²	43.8	6%	0.059	25%	0.246	C	C	.	.	H	α-helix	trans	-68.8	-42.9	176.4	-64.6	-0.9	0	0	0	111.6	S326 R327 P328 F329 I333 L334 N412 E414	S326-N331 PolarHBondContact OG-ND2 3.26Å; R327-N331 PolarHBondContact O-N 2.92Å; P328-N331 WeakPolarHBondContact O-CB 3.08Å; P328-N331 PolarHBondContact O-N 3.1Å; F329-N331 PolarHBondContact O-N 3Å; N331-I333 VanDerWaalsContact C-N 3.32Å; N331-I333 PolarHBondContact O-N 3.12Å; N331-L334 WeakPolarHBondContact O-CB 3.27Å; N331-L334 PolarHBondContact O-N 3.07Å; N331-L334 VanDerWaalsContact O-N 3.12Å; N331-N412 PolarHBondContact OD1-ND2 3.13Å; N331-E414 PolarHBondContact ND2-OE1 3.41Å; N331-E414 PolarHBondContact ND2-OE2 2.89Å
332	S	97.1	Very high	91.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.7	-40.4	177.9	-179.4	0	0	0	0	112.9	F283 D284 H288 P328 F329 L334 R335	F283-S332 VanDerWaalsContact CE1-CB 3.42Å; D284-S332 WeakPolarHBondContact OD1-CA 3.43Å; D284-S332 WeakPolarHBondContact OD1-CB 3.41Å; D284-S332 PolarHBondContact OD1-OG 3.03Å; H288-S332 PolarHBondContact CD2-OG 2.85Å; H288-S332 PolarHBondContact NE2-O 2.96Å; H288-S332 PolarHBondContact NE2-OG 2.64Å; P328-S332 WeakPolarHBondContact O-CB 3.27Å; P328-S332 PolarHBondContact O-N 3.32Å; F329-S332 WeakPolarHBondContact O-CB 3.3Å; F329-S332 PolarHBondContact O-N 3.3Å; S332-L334 PolarHBondContact O-N 3.45Å; S332-R335 PolarHBondContact O-N 3.32Å
333	I	96.6	Very high	91.5	Very high	0 Å²	0	43 Å²	43	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59.3	-34.6	176.5	-67.4	-59.2	0	0	0	112	V291 F315 F329 N331 R335 R336 W339 P357 M409	V291-I333 HydrophobicContact CB-CD1 4.42Å; V291-I333 HydrophobicContact CG1-CD1 4.22Å; V291-I333 HydrophobicContact CG2-CD1 3.44Å; V291-I333 VanDerWaalsContact CG2-CD1 3.44Å; F315-I333 HydrophobicContact CE2-CD1 3.65Å; F315-I333 HydrophobicContact CE2-CG1 4.15Å; F315-I333 HydrophobicContact CZ-CD1 3.9Å; F315-I333 HydrophobicContact CZ-CG1 3.91Å; F315-I333 HydrophobicContact CZ-CG2 4.34Å; F329-I333 HydrophobicContact CD1-CG1 4.16Å; F329-I333 HydrophobicContact CE1-CD1 4.06Å; F329-I333 HydrophobicContact CE1-CG1 3.84Å; F329-I333 HydrophobicContact CE2-CD1 4.12Å; F329-I333 HydrophobicContact CE2-CG1 4.43Å; F329-I333 HydrophobicContact CZ-CD1 3.71Å; F329-I333 HydrophobicContact CZ-CG1 4Å; F329-I333 WeakPolarHBondContact O-CG1 3.44Å; F329-I333 PolarHBondContact O-N 3.46Å; N331-I333 VanDerWaalsContact C-N 3.32Å; N331-I333 PolarHBondContact O-N 3.12Å; I333-R335 VanDerWaalsContact C-N 3.26Å; I333-R335 PolarHBondContact O-N 2.91Å; I333-R336 WeakPolarHBondContact O-CB 3.39Å; I333-R336 PolarHBondContact O-N 3.37Å; I333-W339 HydrophobicContact CG2-CE3 3.53Å; I333-W339 HydrophobicContact CG2-CZ3 3.59Å; I333-P357 HydrophobicContact CG2-CB 4.48Å; I333-M409 HydrophobicContact CG2-CE 4.43Å
334	L	96.1	Very high	91.4	Very high	40 Å²	40	47.9 Å²	47.9	21%	0.209	28%	0.284	C	S	.	.	H	α-helix	trans	-69	-24.8	178	-54.9	176	0	0	0	113.2	C330 N331 S332 R336 W339 M409 P418	C330-L334 WeakPolarHBondContact O-CG 3.24Å; N331-L334 WeakPolarHBondContact O-CB 3.27Å; N331-L334 PolarHBondContact O-N 3.07Å; N331-L334 VanDerWaalsContact O-N 3.12Å; S332-L334 PolarHBondContact O-N 3.45Å; L334-R336 VanDerWaalsContact C-N 3.33Å; L334-W339 HydrophobicContact CD2-CD2 3.92Å; L334-W339 VanDerWaalsContact CD2-CE2 3.46Å; L334-W339 HydrophobicContact CD2-CE3 4.29Å; L334-W339 HydrophobicContact CD2-CH2 3.84Å; L334-W339 HydrophobicContact CD2-CZ2 3.43Å; L334-W339 VanDerWaalsContact CD2-CZ2 3.43Å; L334-W339 HydrophobicContact CD2-CZ3 4.25Å; L334-M409 HydrophobicContact CD2-CE 4.46Å; L334-P418 HydrophobicContact CD1-CG 4.11Å; L334-P418 HydrophobicContact CD2-CB 3.63Å; L334-P418 HydrophobicContact CD2-CG 4.14Å
335	R	95.4	Very high	91.5	Very high	79 Å²	79	43.3 Å²	43.3	30%	0.298	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-6.7	-179.7	-66.8	-173.8	-65.7	-101.5	5.4	112.9	E280 D284 S332 I333	E280-R335 VanDerWaalsContact CD-NH1 3.26Å; E280-R335 IonicContact OE1-CZ 3Å; E280-R335 IonicContact OE1-NH1 3.41Å; E280-R335 PolarHBondContact OE1-NH1 3.17Å; E280-R335 IonicContact OE2-NH1 3.01Å; D284-R335 IonicContact OD1-CZ 3.24Å; D284-R335 IonicContact OD1-NE 3.01Å; D284-R335 PolarHBondContact OD1-NE 3.48Å; D284-R335 IonicContact OD1-NH2 2.82Å; D284-R335 PolarHBondContact OD1-NH2 3.36Å; D284-R335 WeakPolarHBondContact OD2-CD 3.31Å; D284-R335 IonicContact OD2-CZ 2.75Å; D284-R335 IonicContact OD2-NE 3.76Å; D284-R335 PolarHBondContact OD2-NE 3.3Å; D284-R335 IonicContact OD2-NH2 3.1Å; S332-R335 PolarHBondContact O-N 3.32Å; I333-R335 VanDerWaalsContact C-N 3.26Å; I333-R335 PolarHBondContact O-N 2.91Å
336	R	94.8	Very high	91.5	Very high	14 Å²	14	48.7 Å²	48.7	5%	0.053	27%	0.268	C	S	.	.	S	Bend	trans	-66.6	142.9	174.3	-69.1	-178.6	53.9	93	-4.3	111.1	H288 D292 I333 L334 D338 W339	H288-R336 VanDerWaalsContact CD2-CG 3.46Å; H288-R336 WeakPolarHBondContact CD2-CG 3.38Å; H288-R336 WeakPolarHBondContact NE2-CG 3.49Å; H288-R336 PolarHBondContact O-NH1 2.66Å; D292-R336 IonicContact OD1-CZ 2.68Å; D292-R336 VanDerWaalsContact OD1-CZ 3.26Å; D292-R336 IonicContact OD1-NH1 2.77Å; D292-R336 PolarHBondContact OD1-NH1 2.83Å; D292-R336 IonicContact OD1-NH2 3.73Å; D292-R336 PolarHBondContact OD1-NH2 3.47Å; I333-R336 WeakPolarHBondContact O-CB 3.39Å; I333-R336 PolarHBondContact O-N 3.37Å; L334-R336 VanDerWaalsContact C-N 3.33Å; R336-D338 WeakPolarHBondContact CB-OD1 3.46Å; R336-D338 IonicContact CZ-OD1 3.31Å; R336-D338 IonicContact CZ-OD2 2.81Å; R336-D338 IonicContact NE-OD1 3.71Å; R336-D338 PolarHBondContact NE-OD1 3.11Å; R336-D338 IonicContact NE-OD2 3.5Å; R336-D338 IonicContact NH2-OD1 3.54Å; R336-D338 PolarHBondContact NH2-OD1 2.97Å; R336-D338 IonicContact NH2-OD2 3.5Å; R336-D338 PolarHBondContact NH2-OD2 3.39Å; R336-D338 PolarHBondContact O-N 3.34Å; R336-W339 WeakPolarHBondContact O-CB 3.37Å; R336-W339 PolarHBondContact O-N 2.92Å
337	P	91.9	Very high	91.5	Very high	113 Å²	113	48.1 Å²	48.1	73%	0.734	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.7	179.8	26.8	-35	0	0	0	113.5
338	D	92.8	Very high	91.4	Very high	39 Å²	39	47.7 Å²	47.7	21%	0.209	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	1.8	-179.1	66.8	-18.1	0	0	0	113.8	R336 F340 P357	R336-D338 WeakPolarHBondContact CB-OD1 3.46Å; R336-D338 IonicContact CZ-OD1 3.31Å; R336-D338 IonicContact CZ-OD2 2.81Å; R336-D338 IonicContact NE-OD1 3.71Å; R336-D338 PolarHBondContact NE-OD1 3.11Å; R336-D338 IonicContact NE-OD2 3.5Å; R336-D338 IonicContact NH2-OD1 3.54Å; R336-D338 PolarHBondContact NH2-OD1 2.97Å; R336-D338 IonicContact NH2-OD2 3.5Å; R336-D338 PolarHBondContact NH2-OD2 3.39Å; R336-D338 PolarHBondContact O-N 3.34Å; D338-F340 VanDerWaalsContact C-N 3.31Å; D338-F340 PolarHBondContact O-N 3.41Å; D338-P357 WeakPolarHBondContact O-CD 3.2Å; D338-P357 WeakPolarHBondContact OD1-CG 3.32Å
339	W	91.1	Very high	91.3	Very high	27 Å²	27	46.9 Å²	46.9	10%	0.102	26%	0.262	C	S	.	.	S	Bend	trans	-52.2	-50.9	177.9	168.9	-108.3	0	0	0	111.5	I333 L334 R336 T356 L358 M409 P418 F422	I333-W339 HydrophobicContact CG2-CE3 3.53Å; I333-W339 HydrophobicContact CG2-CZ3 3.59Å; L334-W339 HydrophobicContact CD2-CD2 3.92Å; L334-W339 VanDerWaalsContact CD2-CE2 3.46Å; L334-W339 HydrophobicContact CD2-CE3 4.29Å; L334-W339 HydrophobicContact CD2-CH2 3.84Å; L334-W339 HydrophobicContact CD2-CZ2 3.43Å; L334-W339 VanDerWaalsContact CD2-CZ2 3.43Å; L334-W339 HydrophobicContact CD2-CZ3 4.25Å; R336-W339 WeakPolarHBondContact O-CB 3.37Å; R336-W339 PolarHBondContact O-N 2.92Å; W339-T356 WeakPolarHBondContact O-CG2 3.35Å; W339-L358 HydrophobicContact CH2-CD1 3.51Å; W339-L358 HydrophobicContact CH2-CG 4.31Å; W339-L358 HydrophobicContact CZ3-CD1 3.55Å; W339-L358 HydrophobicContact CZ3-CG 3.82Å; W339-M409 HydrophobicContact CH2-CE 3.5Å; W339-M409 HydrophobicContact CZ3-CE 3.71Å; W339-P418 HydrophobicContact CZ2-CB 3.88Å; W339-F422 HydrophobicContact CZ2-CB 4.44Å
340	F	78.2	Confident	91.1	Very high	85 Å²	85	52 Å²	52	37%	0.373	28%	0.281	S	S	.	.			trans	-165.7	92.4	174.6	-167.6	-107.9	0	0	0	111.1	D338 G342 I352 S425	D338-F340 VanDerWaalsContact C-N 3.31Å; D338-F340 PolarHBondContact O-N 3.41Å; F340-G342 VanDerWaalsContact C-N 3.34Å; F340-I352 HydrophobicContact CE2-CD1 3.99Å; F340-S425 WeakPolarHBondContact CZ-OG 3.42Å
341	S	73.1	Confident	91	Very high	79 Å²	79	52.7 Å²	52.7	55%	0.552	28%	0.284	S	S	*	.			trans	-89.1	5.6	179.8	57.7	0	0	0	0	114.4
342	G	78.1	Confident	90.9	Very high	27 Å²	27	52.4 Å²	52.4	28%	0.278	28%	0.283	S	S	.	.			trans	71.8	174.4	-165.3	0	0	0	0	0	112.6	F340	F340-G342 VanDerWaalsContact C-N 3.34Å
343	P	87.6	Confident	90.8	Very high	84 Å²	84	52.5 Å²	52.5	55%	0.545	28%	0.283	S	S	.	.			trans	-68.5	132.6	-178.9	29.1	-34.6	0	0	0	111.4	A348	P343-A348 HydrophobicContact CB-CB 3.55Å
344	L	89.5	Confident	90.7	Very high	111 Å²	111	54.4 Å²	54.4	58%	0.581	30%	0.299	S	S	*	.	S	Bend	trans	-92.5	-29.3	177	-59.2	178.5	0	0	0	111.5	E351 L355	L344-E351 PolarHBondContact N-OE2 3.25Å; L344-L355 HydrophobicContact CD1-CD1 3.76Å
345	T	91.6	Very high	90.6	Very high	61 Å²	61	55.9 Å²	55.9	37%	0.374	31%	0.307	S	S	.	.	S	Bend	trans	-136.3	-177.3	177.7	77.5	0	0	0	0	111.3	A347 E351	T345-A347 PolarHBondContact O-N 3.24Å; T345-A347 PolarHBondContact OG1-N 3.44Å; T345-A347 VanDerWaalsContact OG1-N 3.11Å; T345-E351 WeakPolarHBondContact CA-OE1 3.44Å; T345-E351 WeakPolarHBondContact CB-OE1 3.45Å; T345-E351 WeakPolarHBondContact CG2-OE1 3.35Å; T345-E351 PolarHBondContact N-OE1 3.48Å; T345-E351 PolarHBondContact N-OE2 2.95Å; T345-E351 PolarHBondContact OG1-OE1 3.02Å
346	E	89.4	Confident	90.6	Very high	182 Å²	182	52.5 Å²	52.5	85%	0.85	30%	0.295	S	S	*	.	S	Bend	trans	-67	-20	172.9	-61.8	-175.2	166.7	0	0	112.6	A348	E346-A348 PolarHBondContact O-N 3.06Å
347	A	93.2	Very high	90.6	Very high	19 Å²	19	51.8 Å²	51.8	16%	0.157	29%	0.292	C	S	.	.			trans	-83.1	39.4	178.4	0	0	0	0	0	113	T345 G349 R350 E351 D442	T345-A347 PolarHBondContact O-N 3.24Å; T345-A347 PolarHBondContact OG1-N 3.44Å; T345-A347 VanDerWaalsContact OG1-N 3.11Å; A347-G349 VanDerWaalsContact C-N 3.25Å; A347-G349 PolarHBondContact O-N 2.61Å; A347-R350 HydrophobicContact CB-CB 4.4Å; A347-R350 WeakPolarHBondContact O-CB 3.3Å; A347-R350 PolarHBondContact O-N 3.26Å; A347-E351 WeakPolarHBondContact O-CG 3.46Å; A347-E351 PolarHBondContact O-N 3.22Å; A347-D442 CarbonylContact C-O 3.6Å; A347-D442 VanDerWaalsContact C-O 3.26Å; A347-D442 WeakPolarHBondContact CA-O 3.45Å; A347-D442 HydrophobicContact CB-CB 4.33Å
348	A	93.4	Very high	90.8	Very high	13 Å²	13	46.5 Å²	46.5	11%	0.107	26%	0.257	C	S	.	.	H	α-helix	trans	-56.9	-34.6	-171.8	0	0	0	0	0	114	P343 E346 R350 E351 I352 L429	P343-A348 HydrophobicContact CB-CB 3.55Å; E346-A348 PolarHBondContact O-N 3.06Å; A348-R350 VanDerWaalsContact C-N 3.34Å; A348-E351 PolarHBondContact O-N 3.05Å; A348-I352 PolarHBondContact O-N 3.45Å; A348-L429 HydrophobicContact CB-CD1 4.29Å; A348-L429 HydrophobicContact CB-CD2 3.76Å; A348-L429 HydrophobicContact CB-CG 4.43Å
349	G	94.2	Very high	90.9	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-66.9	-37.4	176.9	0	0	0	0	0	111.9	A347 I352 D442 A444	A347-G349 VanDerWaalsContact C-N 3.25Å; A347-G349 PolarHBondContact O-N 2.61Å; G349-I352 WeakPolarHBondContact O-CG2 3.46Å; G349-D442 PolarHBondContact N-O 3.13Å; G349-A444 VanDerWaalsContact C-N 3.29Å; G349-A444 WeakPolarHBondContact O-CA 3.49Å; G349-A444 VanDerWaalsContact O-CB 3.25Å; G349-A444 WeakPolarHBondContact O-CB 3.25Å; G349-A444 PolarHBondContact O-N 3.04Å
350	R	94.6	Very high	91.1	Very high	108 Å²	108	43.4 Å²	43.4	41%	0.408	24%	0.243	S	C	.	.	H	α-helix	trans	-71.6	-39.5	174.4	-169.7	169.7	-177.6	167.2	1.7	111.9	A347 A348 A353 A354 A441 D442	A347-R350 HydrophobicContact CB-CB 4.4Å; A347-R350 WeakPolarHBondContact O-CB 3.3Å; A347-R350 PolarHBondContact O-N 3.26Å; A348-R350 VanDerWaalsContact C-N 3.34Å; R350-A353 PolarHBondContact O-N 2.65Å; R350-A354 WeakPolarHBondContact O-CB 3.32Å; R350-A354 PolarHBondContact O-N 3.37Å; R350-A441 WeakPolarHBondContact CD-O 3.37Å; R350-D442 PolarHBondContact N-O 3.38Å
351	E	94.8	Very high	91.9	Very high	13 Å²	13	39.5 Å²	39.5	6%	0.061	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-45.4	179.5	-72.4	173.7	174.2	0	0	112.8	L344 T345 A347 A348 A353 A354 L355	L344-E351 PolarHBondContact N-OE2 3.25Å; T345-E351 WeakPolarHBondContact CA-OE1 3.44Å; T345-E351 WeakPolarHBondContact CB-OE1 3.45Å; T345-E351 WeakPolarHBondContact CG2-OE1 3.35Å; T345-E351 PolarHBondContact N-OE1 3.48Å; T345-E351 PolarHBondContact N-OE2 2.95Å; T345-E351 PolarHBondContact OG1-OE1 3.02Å; A347-E351 WeakPolarHBondContact O-CG 3.46Å; A347-E351 PolarHBondContact O-N 3.22Å; A348-E351 PolarHBondContact O-N 3.05Å; E351-A353 PolarHBondContact O-N 2.98Å; E351-A354 PolarHBondContact O-N 3Å; E351-A354 VanDerWaalsContact O-N 3.07Å; E351-L355 HydrophobicContact CB-CD1 4Å; E351-L355 HydrophobicContact CB-CG 4.46Å; E351-L355 HydrophobicContact CG-CD1 4.02Å; E351-L355 VanDerWaalsContact O-CB 3.3Å; E351-L355 WeakPolarHBondContact O-CB 3.38Å; E351-L355 PolarHBondContact O-N 3.46Å
352	I	95.5	Very high	93	Very high	6 Å²	6	35.8 Å²	35.8	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-60.7	-34.6	179.8	-169.5	168.8	0	0	0	111.7	F340 A348 G349 T356 F422 V426 L429	F340-I352 HydrophobicContact CE2-CD1 3.99Å; A348-I352 PolarHBondContact O-N 3.45Å; G349-I352 WeakPolarHBondContact O-CG2 3.46Å; I352-T356 HydrophobicContact CG1-CG2 4.04Å; I352-T356 WeakPolarHBondContact O-CG2 3.36Å; I352-T356 PolarHBondContact O-OG1 3.06Å; I352-F422 HydrophobicContact CD1-CD2 4.1Å; I352-F422 HydrophobicContact CD1-CE2 3.99Å; I352-F422 HydrophobicContact CG1-CD2 4.25Å; I352-F422 HydrophobicContact CG1-CE2 3.72Å; I352-V426 HydrophobicContact CD1-CB 4.48Å; I352-V426 HydrophobicContact CD1-CG2 3.65Å; I352-V426 HydrophobicContact CG1-CG2 4.2Å; I352-L429 HydrophobicContact CB-CD1 4.04Å; I352-L429 HydrophobicContact CD1-CD1 3.98Å; I352-L429 HydrophobicContact CG2-CD1 4.08Å
353	A	95.5	Very high	93.8	Very high	2 Å²	2	35.2 Å²	35.2	2%	0.017	19%	0.191	C	C	.	.	H	α-helix	trans	-76	-31.7	175.7	0	0	0	0	0	113	R350 E351 G359 S360 T363 A444 P445 F448	R350-A353 PolarHBondContact O-N 2.65Å; E351-A353 PolarHBondContact O-N 2.98Å; A353-G359 CarbonylContact O-C 3.19Å; A353-G359 VanDerWaalsContact O-CA 3.3Å; A353-G359 WeakPolarHBondContact O-CA 3.26Å; A353-G359 VanDerWaalsContact O-O 3.09Å; A353-S360 PolarHBondContact O-N 3.35Å; A353-T363 PolarHBondContact O-OG1 3.33Å; A353-A444 HydrophobicContact CB-CB 4.2Å; A353-P445 HydrophobicContact CB-CG 4.48Å; A353-F448 HydrophobicContact CB-CB 4.39Å; A353-F448 HydrophobicContact CB-CD1 3.69Å; A353-F448 HydrophobicContact CB-CD2 4.38Å; A353-F448 HydrophobicContact CB-CE1 3.96Å; A353-F448 HydrophobicContact CB-CG 3.89Å; A353-F448 HydrophobicContact CB-CZ 4.44Å
354	A	93.6	Very high	94.1	Very high	40 Å²	40	32 Å²	32	33%	0.331	17%	0.17	S	C	.	.	H	α-helix	trans	-98.5	-23.6	-172.3	0	0	0	0	0	115.1	H299 R350 E351 S360	H299-A354 PolarHBondContact CE1-O 3.28Å; H299-A354 PolarHBondContact NE2-O 3.39Å; R350-A354 WeakPolarHBondContact O-CB 3.32Å; R350-A354 PolarHBondContact O-N 3.37Å; E351-A354 PolarHBondContact O-N 3Å; E351-A354 VanDerWaalsContact O-N 3.07Å; A354-S360 PolarHBondContact O-OG 3.33Å
355	L	93.7	Very high	94.4	Very high	71 Å²	71	30.4 Å²	30.4	37%	0.372	16%	0.158	S	C	.	.	H	α-helix	trans	-112.2	-24.4	-169.8	-58.3	-177.5	0	0	0	113.4	L344 E351	L344-L355 HydrophobicContact CD1-CD1 3.76Å; E351-L355 HydrophobicContact CB-CD1 4Å; E351-L355 HydrophobicContact CB-CG 4.46Å; E351-L355 HydrophobicContact CG-CD1 4.02Å; E351-L355 VanDerWaalsContact O-CB 3.3Å; E351-L355 WeakPolarHBondContact O-CB 3.38Å; E351-L355 PolarHBondContact O-N 3.46Å
356	T	95.5	Very high	94.5	Very high	7 Å²	7	27.5 Å²	27.5	4%	0.043	14%	0.141	C	C	.	.	S	Bend	trans	-80.1	150	175.9	69.7	0	0	0	0	110.5	W339 I352 L358 G359 S360 F422	W339-T356 WeakPolarHBondContact O-CG2 3.35Å; I352-T356 HydrophobicContact CG1-CG2 4.04Å; I352-T356 WeakPolarHBondContact O-CG2 3.36Å; I352-T356 PolarHBondContact O-OG1 3.06Å; T356-L358 VanDerWaalsContact C-N 3.33Å; T356-L358 PolarHBondContact O-N 3.42Å; T356-G359 PolarHBondContact O-N 3.04Å; T356-G359 WeakPolarHBondContact OG1-CA 3.38Å; T356-G359 PolarHBondContact OG1-N 2.89Å; T356-S360 WeakPolarHBondContact O-CB 3.38Å; T356-S360 PolarHBondContact O-N 3.14Å; T356-S360 PolarHBondContact O-OG 3.24Å; T356-F422 HydrophobicContact CG2-CE2 4.26Å; T356-F422 WeakPolarHBondContact OG1-CE2 3.24Å
357	P	95.5	Very high	94.8	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-57.5	-44.5	176	-27.6	34.9	0	0	0	112.8	V291 I295 I333 D338 I361	V291-P357 HydrophobicContact CG1-CB 4.18Å; I295-P357 HydrophobicContact CD1-CB 4.17Å; I295-P357 HydrophobicContact CD1-CG 4.36Å; I333-P357 HydrophobicContact CG2-CB 4.48Å; D338-P357 WeakPolarHBondContact O-CD 3.2Å; D338-P357 WeakPolarHBondContact OD1-CG 3.32Å; P357-I361 WeakPolarHBondContact O-CB 3.27Å; P357-I361 VanDerWaalsContact O-CG1 3.29Å; P357-I361 WeakPolarHBondContact O-CG1 3.38Å; P357-I361 PolarHBondContact O-N 3.04Å; P357-I361 VanDerWaalsContact O-N 3.13Å
358	L	95.4	Very high	94.8	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-68.7	-42.9	177.8	-70.2	-179.1	0	0	0	112.3	F315 W339 T356 M362 T405 L406 M409 F422	F315-L358 HydrophobicContact CE1-CD2 3.73Å; F315-L358 HydrophobicContact CZ-CD2 4.07Å; W339-L358 HydrophobicContact CH2-CD1 3.51Å; W339-L358 HydrophobicContact CH2-CG 4.31Å; W339-L358 HydrophobicContact CZ3-CD1 3.55Å; W339-L358 HydrophobicContact CZ3-CG 3.82Å; T356-L358 VanDerWaalsContact C-N 3.33Å; T356-L358 PolarHBondContact O-N 3.42Å; L358-M362 HydrophobicContact CD2-CE 3.83Å; L358-M362 VanDerWaalsContact O-CB 3.25Å; L358-M362 WeakPolarHBondContact O-CB 3.3Å; L358-M362 VanDerWaalsContact O-CG 3.25Å; L358-M362 WeakPolarHBondContact O-CG 3.16Å; L358-M362 PolarHBondContact O-N 2.72Å; L358-M362 VanDerWaalsContact O-N 3.09Å; L358-T405 HydrophobicContact CD2-CG2 4.2Å; L358-L406 HydrophobicContact CD1-CD2 3.98Å; L358-M409 HydrophobicContact CD1-CE 4.36Å; L358-M409 HydrophobicContact CD1-SD 3.92Å; L358-M409 HydrophobicContact CD2-SD 3.78Å; L358-M409 HydrophobicContact CG-SD 4.33Å; L358-F422 HydrophobicContact CB-CE1 3.97Å; L358-F422 HydrophobicContact CB-CE2 4.33Å; L358-F422 HydrophobicContact CB-CZ 3.82Å; L358-F422 HydrophobicContact CD1-CD1 3.99Å; L358-F422 HydrophobicContact CD1-CE1 4.13Å; L358-F422 HydrophobicContact CD1-CG 4.37Å
359	G	95.7	Very high	94.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-55.6	-53.6	175.2	0	0	0	0	0	111.3	A353 T356 I361 M362 T363	A353-G359 CarbonylContact O-C 3.19Å; A353-G359 VanDerWaalsContact O-CA 3.3Å; A353-G359 WeakPolarHBondContact O-CA 3.26Å; A353-G359 VanDerWaalsContact O-O 3.09Å; T356-G359 PolarHBondContact O-N 3.04Å; T356-G359 WeakPolarHBondContact OG1-CA 3.38Å; T356-G359 PolarHBondContact OG1-N 2.89Å; G359-I361 PolarHBondContact O-N 2.75Å; G359-M362 PolarHBondContact O-N 3.34Å; G359-T363 WeakPolarHBondContact O-CB 3.37Å; G359-T363 PolarHBondContact O-N 2.97Å; G359-T363 VanDerWaalsContact O-N 3.07Å; G359-T363 PolarHBondContact O-OG1 3.31Å
360	S	95.1	Very high	94.6	Very high	2 Å²	2	25 Å²	25	1%	0.014	13%	0.127	C	C	.	.	H	α-helix	trans	-63	-46.6	-173.8	-61.8	0	0	0	0	112.2	H299 A353 A354 T356 M362 T363	H299-S360 WeakPolarHBondContact NE2-CB 3.48Å; H299-S360 PolarHBondContact NE2-OG 3.04Å; A353-S360 PolarHBondContact O-N 3.35Å; A354-S360 PolarHBondContact O-OG 3.33Å; T356-S360 WeakPolarHBondContact O-CB 3.38Å; T356-S360 PolarHBondContact O-N 3.14Å; T356-S360 PolarHBondContact O-OG 3.24Å; S360-M362 VanDerWaalsContact C-N 3.35Å; S360-M362 PolarHBondContact O-N 2.99Å; S360-T363 PolarHBondContact O-N 3.43Å
361	I	94.6	Very high	94.5	Very high	3 Å²	3	20.7 Å²	20.7	2%	0.015	11%	0.112	C	C	.	.	H	α-helix	trans	-75.6	-25.2	-175.2	-63.8	171.1	0	0	0	111.5	L294 I295 L312 F315 P357 G359	L294-I361 HydrophobicContact CB-CD1 4.29Å; I295-I361 HydrophobicContact CG1-CD1 4.16Å; I295-I361 HydrophobicContact CG1-CG1 4.07Å; L312-I361 HydrophobicContact CB-CG2 3.87Å; L312-I361 HydrophobicContact CD1-CG2 3.5Å; L312-I361 VanDerWaalsContact CD1-CG2 3.5Å; L312-I361 HydrophobicContact CG-CG2 4.27Å; F315-I361 HydrophobicContact CB-CD1 4.22Å; F315-I361 HydrophobicContact CB-CG2 4.06Å; F315-I361 HydrophobicContact CD2-CD1 3.17Å; F315-I361 HydrophobicContact CE2-CD1 3.51Å; F315-I361 HydrophobicContact CG-CD1 3.75Å; F315-I361 HydrophobicContact CG-CG2 4.26Å; F315-I361 HydrophobicContact CZ-CD1 4.35Å; P357-I361 WeakPolarHBondContact O-CB 3.27Å; P357-I361 VanDerWaalsContact O-CG1 3.29Å; P357-I361 WeakPolarHBondContact O-CG1 3.38Å; P357-I361 PolarHBondContact O-N 3.04Å; P357-I361 VanDerWaalsContact O-N 3.13Å; G359-I361 PolarHBondContact O-N 2.75Å
362	M	95.7	Very high	94.4	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-91.6	-7	177.3	-64.6	176.6	-179.5	0	0	114	L312 L358 G359 S360 V364 T405 L406 F448 N451 I452	L312-M362 HydrophobicContact CD1-CG 4.26Å; L358-M362 HydrophobicContact CD2-CE 3.83Å; L358-M362 VanDerWaalsContact O-CB 3.25Å; L358-M362 WeakPolarHBondContact O-CB 3.3Å; L358-M362 VanDerWaalsContact O-CG 3.25Å; L358-M362 WeakPolarHBondContact O-CG 3.16Å; L358-M362 PolarHBondContact O-N 2.72Å; L358-M362 VanDerWaalsContact O-N 3.09Å; G359-M362 PolarHBondContact O-N 3.34Å; S360-M362 VanDerWaalsContact C-N 3.35Å; S360-M362 PolarHBondContact O-N 2.99Å; M362-V364 PolarHBondContact O-N 3.14Å; M362-T405 HydrophobicContact CE-CG2 3.69Å; M362-L406 HydrophobicContact CE-CD1 4.18Å; M362-L406 HydrophobicContact CE-CD2 3.97Å; M362-L406 HydrophobicContact CE-CG 3.64Å; M362-L406 HydrophobicContact SD-CD1 4.14Å; M362-L406 HydrophobicContact SD-CG 4.25Å; M362-F448 HydrophobicContact CB-CD2 4.39Å; M362-F448 HydrophobicContact CB-CE2 4.3Å; M362-N451 PolarHBondContact O-ND2 3.12Å; M362-I452 HydrophobicContact SD-CD1 3.74Å
363	T	95.5	Very high	94	Very high	15 Å²	15	27.2 Å²	27.2	9%	0.092	16%	0.155	C	C	.	.			trans	-89.9	101.7	179.3	-60.5	0	0	0	0	110.5	A353 G359 S360 F365 P445 F448	A353-T363 PolarHBondContact O-OG1 3.33Å; G359-T363 WeakPolarHBondContact O-CB 3.37Å; G359-T363 PolarHBondContact O-N 2.97Å; G359-T363 VanDerWaalsContact O-N 3.07Å; G359-T363 PolarHBondContact O-OG1 3.31Å; S360-T363 PolarHBondContact O-N 3.43Å; T363-F365 HydrophobicContact CG2-CD1 4.22Å; T363-F365 HydrophobicContact CG2-CE1 3.74Å; T363-F365 HydrophobicContact CG2-CZ 3.93Å; T363-P445 HydrophobicContact CG2-CG 3.96Å; T363-F448 HydrophobicContact CG2-CB 4.21Å; T363-F448 WeakPolarHBondContact OG1-CB 3.46Å; T363-F448 WeakPolarHBondContact OG1-CD2 3.41Å
364	V	94.3	Very high	93.7	Very high	15 Å²	15	27.1 Å²	27.1	9%	0.091	15%	0.154	C	C	.	.			trans	-121.1	112.2	168.2	-179.8	0	0	0	0	108.5	L303 V308 M362 C366 I398 S447	L303-V364 HydrophobicContact CB-CG1 4.09Å; L303-V364 HydrophobicContact CD1-CG1 3.91Å; V308-V364 HydrophobicContact CG2-CG1 3.66Å; V308-V364 HydrophobicContact CG2-CG2 4.21Å; M362-V364 PolarHBondContact O-N 3.14Å; V364-C366 PolarHBondContact O-N 2.85Å; V364-I398 HydrophobicContact CB-CD1 3.85Å; V364-I398 HydrophobicContact CG1-CD1 3.74Å; V364-I398 HydrophobicContact CG2-CD1 3.9Å; V364-I398 HydrophobicContact CG2-CG1 4.38Å; V364-I398 HydrophobicContact CG2-CG2 4.29Å; V364-S447 VanDerWaalsContact O-CB 3.28Å; V364-S447 WeakPolarHBondContact O-CB 3.4Å
365	F	95.1	Very high	93.4	Very high	78 Å²	78	26.8 Å²	26.8	34%	0.342	15%	0.147	S	C	.	.			trans	-65.6	128.9	-175.8	-59.9	-59.7	0	0	0	112.2	L303 T363 E370 D371 P445 S447	L303-F365 WeakPolarHBondContact CB-O 3.42Å; T363-F365 HydrophobicContact CG2-CD1 4.22Å; T363-F365 HydrophobicContact CG2-CE1 3.74Å; T363-F365 HydrophobicContact CG2-CZ 3.93Å; F365-E370 HydrophobicContact CB-CB 4.15Å; F365-E370 HydrophobicContact CD1-CB 3.64Å; F365-E370 HydrophobicContact CD1-CG 4.38Å; F365-E370 HydrophobicContact CE1-CB 4.29Å; F365-E370 HydrophobicContact CG-CB 4.05Å; F365-D371 HydrophobicContact CB-CB 3.67Å; F365-D371 HydrophobicContact CD2-CB 4.31Å; F365-D371 HydrophobicContact CG-CB 4.3Å; F365-P445 HydrophobicContact CD1-CB 4.13Å; F365-P445 HydrophobicContact CD1-CG 4.49Å; F365-P445 HydrophobicContact CE1-CB 3.64Å; F365-P445 HydrophobicContact CE1-CG 3.72Å; F365-S447 WeakPolarHBondContact CA-OG 3.43Å
366	C	94.5	Very high	93.1	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.007	15%	0.145	C	C	.	.			trans	-123.1	-1	179.5	67.3	0	0	0	0	113.9	L303 V364 L395 S447 V591	L303-C366 HydrophobicContact CD2-CB 3.81Å; V364-C366 PolarHBondContact O-N 2.85Å; C366-L395 HydrophobicContact CB-CD1 4.09Å; C366-L395 HydrophobicContact CB-CD2 3.96Å; C366-L395 HydrophobicContact CB-CG 4.47Å; C366-S447 PolarHBondContact N-OG 2.53Å; C366-S447 PolarHBondContact SG-OG 2.99Å; C366-V591 HydrophobicContact CB-CG2 3.92Å; C366-V591 VanDerWaalsContact SG-CG2 3.56Å
367	F	94.8	Very high	92.5	Very high	2 Å²	2	27 Å²	27	1%	0.009	15%	0.148	C	C	.	.	S	Bend	trans	-107.2	138.3	173	-63.9	-73.7	0	0	0	111.3	D369 E370 D371 D446 L450 L529 N588 V591	F367-D369 PolarHBondContact O-N 3.08Å; F367-E370 HydrophobicContact CB-CG 4.14Å; F367-E370 WeakPolarHBondContact O-CB 3.49Å; F367-E370 PolarHBondContact O-N 3.2Å; F367-D371 PolarHBondContact O-N 3.11Å; F367-D446 HydrophobicContact CD2-CB 3.79Å; F367-D446 HydrophobicContact CE2-CB 3.48Å; F367-D446 VanDerWaalsContact CE2-CB 3.48Å; F367-D446 HydrophobicContact CZ-CB 4.44Å; F367-L450 HydrophobicContact CE2-CD1 3.88Å; F367-L450 HydrophobicContact CZ-CD1 3.9Å; F367-L529 HydrophobicContact CZ-CD1 4.25Å; F367-N588 WeakPolarHBondContact CD1-OD1 3.22Å; F367-V591 HydrophobicContact CE1-CB 4.12Å; F367-V591 HydrophobicContact CE1-CG1 4.26Å; F367-V591 HydrophobicContact CE1-CG2 4.26Å; F367-V591 HydrophobicContact CE2-CG1 4.4Å; F367-V591 HydrophobicContact CZ-CB 4.12Å; F367-V591 HydrophobicContact CZ-CG1 3.75Å; F367-V591 HydrophobicContact CZ-CG2 4.39Å
368	L	92.7	Very high	91.8	Very high	17 Å²	17	27.8 Å²	27.8	9%	0.089	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-23.2	-178.6	-177.2	71.8	0	0	0	113.6	E370 D371 P372 L374 D375 K583 F587	L368-E370 VanDerWaalsContact C-N 3.28Å; L368-D371 CarbonylContact O-C 3.57Å; L368-P372 WeakPolarHBondContact O-CA 3.48Å; L368-L374 HydrophobicContact CD1-CB 4.15Å; L368-D375 HydrophobicContact CD1-CB 3.96Å; L368-K583 HydrophobicContact CD2-CB 4.27Å; L368-F587 HydrophobicContact CB-CD2 4.2Å; L368-F587 HydrophobicContact CB-CG 4.33Å
369	D	91.2	Very high	90.9	Very high	95 Å²	95	34 Å²	34	51%	0.508	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-21	173.1	-69.9	-41.8	0	0	0	112.5	F367 H536 Q584	F367-D369 PolarHBondContact O-N 3.08Å; D369-H536 IonicContact OD2-CE1 3.76Å; D369-Q584 PolarHBondContact OD1-OE1 3.22Å; D369-Q584 PolarHBondContact OD2-NE2 3.17Å; D369-Q584 PolarHBondContact OD2-OE1 3.02Å
370	E	93.7	Very high	89.4	Confident	47 Å²	47	38.5 Å²	38.5	22%	0.22	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-41.2	177.6	-60.2	178.1	157.2	0	0	111.4	F365 F367 L368 P445 D446 S447	F365-E370 HydrophobicContact CB-CB 4.15Å; F365-E370 HydrophobicContact CD1-CB 3.64Å; F365-E370 HydrophobicContact CD1-CG 4.38Å; F365-E370 HydrophobicContact CE1-CB 4.29Å; F365-E370 HydrophobicContact CG-CB 4.05Å; F367-E370 HydrophobicContact CB-CG 4.14Å; F367-E370 WeakPolarHBondContact O-CB 3.49Å; F367-E370 PolarHBondContact O-N 3.2Å; L368-E370 VanDerWaalsContact C-N 3.28Å; E370-P445 WeakPolarHBondContact OE1-CA 3.48Å; E370-P445 VanDerWaalsContact OE1-CB 3.29Å; E370-P445 WeakPolarHBondContact OE1-CB 3.4Å; E370-D446 WeakPolarHBondContact OE1-CB 3.4Å; E370-D446 PolarHBondContact OE1-N 3.04Å; E370-S447 VanDerWaalsContact OE2-CB 3.28Å; E370-S447 WeakPolarHBondContact OE2-CB 3.3Å; E370-S447 PolarHBondContact OE2-OG 3.45Å
371	D	92.7	Very high	87.6	Confident	18 Å²	18	43 Å²	43	10%	0.096	23%	0.23	C	C	.	.			trans	-129.2	96.5	174.2	179.9	7.4	0	0	0	111	S302 F365 F367 L368 T373 L374	S302-D371 WeakPolarHBondContact CB-OD2 3.33Å; S302-D371 PolarHBondContact OG-OD2 3.23Å; F365-D371 HydrophobicContact CB-CB 3.67Å; F365-D371 HydrophobicContact CD2-CB 4.31Å; F365-D371 HydrophobicContact CG-CB 4.3Å; F367-D371 PolarHBondContact O-N 3.11Å; L368-D371 CarbonylContact O-C 3.57Å; D371-T373 PolarHBondContact O-N 3.25Å; D371-T373 VanDerWaalsContact OD1-CB 3.24Å; D371-T373 WeakPolarHBondContact OD1-CB 3.43Å; D371-T373 WeakPolarHBondContact OD1-CG2 3.26Å; D371-T373 PolarHBondContact OD1-N 3.31Å; D371-T373 PolarHBondContact OD1-OG1 2.81Å; D371-T373 PolarHBondContact OD2-OG1 3.32Å; D371-T373 VanDerWaalsContact OD2-OG1 3.1Å; D371-L374 HydrophobicContact CB-CD1 4.01Å; D371-L374 HydrophobicContact CB-CG 3.94Å; D371-L374 WeakPolarHBondContact O-CB 3.33Å; D371-L374 VanDerWaalsContact O-CG 3.29Å; D371-L374 WeakPolarHBondContact O-CG 3.46Å; D371-L374 PolarHBondContact O-N 3.41Å
372	P	90.9	Very high	86.1	Confident	92 Å²	92	45.9 Å²	45.9	60%	0.597	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-62.6	-19.3	176.8	-25	35.3	0	0	0	114.2	L368 L374 D375	L368-P372 WeakPolarHBondContact O-CA 3.48Å; P372-L374 PolarHBondContact O-N 3.02Å; P372-D375 WeakPolarHBondContact O-CB 3.39Å; P372-D375 PolarHBondContact O-N 3.35Å
373	T	88.4	Confident	85	Confident	65 Å²	65	48.5 Å²	48.5	40%	0.399	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-70	-18	-178.5	75.9	0	0	0	0	112.2	S302 Q304 D371 D375 N376	S302-T373 PolarHBondContact OG-OG1 2.9Å; Q304-T373 PolarHBondContact NE2-O 3.22Å; Q304-T373 VanDerWaalsContact NE2-O 3.08Å; Q304-T373 PolarHBondContact NE2-OG1 2.95Å; D371-T373 PolarHBondContact O-N 3.25Å; D371-T373 VanDerWaalsContact OD1-CB 3.24Å; D371-T373 WeakPolarHBondContact OD1-CB 3.43Å; D371-T373 WeakPolarHBondContact OD1-CG2 3.26Å; D371-T373 PolarHBondContact OD1-N 3.31Å; D371-T373 PolarHBondContact OD1-OG1 2.81Å; D371-T373 PolarHBondContact OD2-OG1 3.32Å; D371-T373 VanDerWaalsContact OD2-OG1 3.1Å; T373-D375 PolarHBondContact O-N 3.27Å; T373-N376 WeakPolarHBondContact O-CB 3.33Å; T373-N376 PolarHBondContact O-N 3.42Å; T373-N376 VanDerWaalsContact O-N 3.14Å; T373-N376 PolarHBondContact O-ND2 3.4Å
374	L	89.5	Confident	84.4	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-60.4	-23.6	175.3	-61.6	176.4	0	0	0	112.8	S302 L303 L368 D371 P372 N376 M377 F587	S302-L374 WeakPolarHBondContact OG-CD2 3.34Å; L303-L374 HydrophobicContact CB-CD2 3.79Å; L368-L374 HydrophobicContact CD1-CB 4.15Å; D371-L374 HydrophobicContact CB-CD1 4.01Å; D371-L374 HydrophobicContact CB-CG 3.94Å; D371-L374 WeakPolarHBondContact O-CB 3.33Å; D371-L374 VanDerWaalsContact O-CG 3.29Å; D371-L374 WeakPolarHBondContact O-CG 3.46Å; D371-L374 PolarHBondContact O-N 3.41Å; P372-L374 PolarHBondContact O-N 3.02Å; L374-N376 PolarHBondContact O-N 3.32Å; L374-M377 HydrophobicContact CB-CE 4.05Å; L374-M377 HydrophobicContact CD2-CE 3.63Å; L374-M377 HydrophobicContact CG-CE 4.37Å; L374-M377 WeakPolarHBondContact O-CB 3.31Å; L374-M377 PolarHBondContact O-N 3.19Å; L374-F587 HydrophobicContact CB-CD1 4.4Å; L374-F587 HydrophobicContact CB-CE1 3.58Å; L374-F587 HydrophobicContact CB-CE2 4.44Å; L374-F587 HydrophobicContact CB-CZ 3.63Å; L374-F587 HydrophobicContact CD1-CD1 4.22Å; L374-F587 HydrophobicContact CD1-CE1 4.01Å; L374-F587 HydrophobicContact CG-CE1 4.29Å; L374-F587 VanDerWaalsContact O-CZ 3.29Å; L374-F587 WeakPolarHBondContact O-CZ 3.31Å
375	D	87.7	Confident	83.9	Confident	33 Å²	33	55.8 Å²	55.8	18%	0.176	32%	0.315	C	S	.	.	H	α-helix	trans	-52.1	-26.9	173.5	175.7	61.8	0	0	0	112.6	L368 P372 T373 M377 C378 K379 K583	L368-D375 HydrophobicContact CD1-CB 3.96Å; P372-D375 WeakPolarHBondContact O-CB 3.39Å; P372-D375 PolarHBondContact O-N 3.35Å; T373-D375 PolarHBondContact O-N 3.27Å; D375-M377 VanDerWaalsContact C-N 3.27Å; D375-M377 PolarHBondContact O-N 3.21Å; D375-C378 WeakPolarHBondContact O-CB 3.28Å; D375-C378 PolarHBondContact O-N 2.92Å; D375-C378 VanDerWaalsContact O-N 3.16Å; D375-K379 WeakPolarHBondContact OD2-CE 3.4Å; D375-K379 IonicContact OD2-NZ 2.7Å; D375-K379 PolarHBondContact OD2-NZ 3.44Å; D375-K583 WeakPolarHBondContact OD1-CD 3.29Å; D375-K583 WeakPolarHBondContact OD1-CE 3.46Å; D375-K583 IonicContact OD1-NZ 3.31Å; D375-K583 PolarHBondContact OD1-NZ 2.88Å; D375-K583 IonicContact OD2-NZ 2.65Å
376	N	85.8	Confident	83.3	Confident	63 Å²	63	56.6 Å²	56.6	34%	0.337	32%	0.319	S	S	.	.	H	α-helix	trans	-63.5	-30.3	177	-66.8	-25.3	0	0	0	113	T373 L374 C378 K379	T373-N376 WeakPolarHBondContact O-CB 3.33Å; T373-N376 PolarHBondContact O-N 3.42Å; T373-N376 VanDerWaalsContact O-N 3.14Å; T373-N376 PolarHBondContact O-ND2 3.4Å; L374-N376 PolarHBondContact O-N 3.32Å; N376-C378 PolarHBondContact O-N 2.79Å; N376-K379 PolarHBondContact O-N 3.48Å; N376-K379 VanDerWaalsContact O-N 3.13Å; N376-K379 PolarHBondContact OD1-NZ 3.02Å
377	M	83.2	Confident	82.9	Confident	20 Å²	20	56.7 Å²	56.7	10%	0.099	32%	0.319	C	S	.	.	H	α-helix	trans	-64.1	-31.6	175.6	-67.3	-167.9	-69.7	0	0	112.1	Q304 L374 D375 K379 I391 F587	Q304-M377 HydrophobicContact CB-CE 4.43Å; Q304-M377 HydrophobicContact CB-CG 3.53Å; Q304-M377 HydrophobicContact CB-SD 3.66Å; L374-M377 HydrophobicContact CB-CE 4.05Å; L374-M377 HydrophobicContact CD2-CE 3.63Å; L374-M377 HydrophobicContact CG-CE 4.37Å; L374-M377 WeakPolarHBondContact O-CB 3.31Å; L374-M377 PolarHBondContact O-N 3.19Å; D375-M377 VanDerWaalsContact C-N 3.27Å; D375-M377 PolarHBondContact O-N 3.21Å; M377-K379 VanDerWaalsContact C-N 3.31Å; M377-K379 PolarHBondContact O-N 2.94Å; M377-I391 HydrophobicContact CE-CD1 4.13Å; M377-I391 HydrophobicContact CE-CG1 4.17Å; M377-F587 HydrophobicContact CE-CE1 3.41Å; M377-F587 VanDerWaalsContact CE-CE1 3.41Å; M377-F587 HydrophobicContact CE-CZ 3.7Å
378	C	80.2	Confident	82.7	Confident	15 Å²	15	57.8 Å²	57.8	10%	0.101	33%	0.325	C	S	.	.	H	α-helix	trans	-71.9	-24.4	176.2	-65	0	0	0	0	113	D375 N376 G382 K583	D375-C378 WeakPolarHBondContact O-CB 3.28Å; D375-C378 PolarHBondContact O-N 2.92Å; D375-C378 VanDerWaalsContact O-N 3.16Å; N376-C378 PolarHBondContact O-N 2.79Å; C378-G382 WeakPolarHBondContact O-CA 3.46Å; C378-G382 PolarHBondContact O-N 2.93Å; C378-K583 HydrophobicContact CB-CD 4.48Å
379	K	77.3	Confident	82.6	Confident	133 Å²	133	61 Å²	61	58%	0.578	35%	0.345	S	S	*	.	H	α-helix	trans	-77.1	-25.7	-177.2	-65.6	175	-171.9	147.9	0	113.4	D375 N376 M377	D375-K379 WeakPolarHBondContact OD2-CE 3.4Å; D375-K379 IonicContact OD2-NZ 2.7Å; D375-K379 PolarHBondContact OD2-NZ 3.44Å; N376-K379 PolarHBondContact O-N 3.48Å; N376-K379 VanDerWaalsContact O-N 3.13Å; N376-K379 PolarHBondContact OD1-NZ 3.02Å; M377-K379 VanDerWaalsContact C-N 3.31Å; M377-K379 PolarHBondContact O-N 2.94Å
380	V	64.2	Low	82.4	Confident	94 Å²	94	57.9 Å²	57.9	57%	0.57	33%	0.329	S	S	*	.	H	α-helix	trans	-75	-48.6	-172.1	179.4	0	0	0	0	111.6
381	D	57.8	Low	82.3	Confident	95 Å²	95	55.7 Å²	55.7	51%	0.508	32%	0.319	S	S	.	.	H	α-helix	trans	-123.5	-2.4	-174.1	-78.6	-43.2	0	0	0	115.2	S383 F386	D381-S383 PolarHBondContact O-N 3.21Å; D381-F386 HydrophobicContact CB-CD1 4.01Å; D381-F386 HydrophobicContact CB-CE1 4.46Å; D381-F386 HydrophobicContact CB-CG 4.39Å; D381-F386 WeakPolarHBondContact OD2-CE1 3.17Å
382	G	61.8	Low	82.4	Confident	64 Å²	64	57.6 Å²	57.6	66%	0.66	33%	0.325	S	S	*	.			trans	62.5	-10.7	173.3	0	0	0	0	0	117.1	C378	C378-G382 WeakPolarHBondContact O-CA 3.46Å; C378-G382 PolarHBondContact O-N 2.93Å
383	S	73	Confident	82.4	Confident	56 Å²	56	58.4 Å²	58.4	39%	0.392	32%	0.323	S	S	.	.			trans	-100.9	121.5	-177.7	179	0	0	0	0	111.4	D381 N385 F386	D381-S383 PolarHBondContact O-N 3.21Å; S383-N385 PolarHBondContact O-N 2.96Å; S383-F386 PolarHBondContact O-N 3.3Å
384	H	83.3	Confident	82.6	Confident	68 Å²	68	57.7 Å²	57.7	32%	0.315	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-27.8	176.4	-61	165.1	0	0	0	112.9	F386 V387 H388 A586	H384-F386 VanDerWaalsContact C-N 3.34Å; H384-F386 PolarHBondContact O-N 2.89Å; H384-V387 WeakPolarHBondContact O-CB 3.45Å; H384-V387 PolarHBondContact O-N 3.22Å; H384-H388 PolarHBondContact O-CD2 3.36Å; H384-H388 PolarHBondContact O-N 2.92Å; H384-A586 HydrophobicContact CB-CB 4.16Å
385	N	83.8	Confident	82.8	Confident	116 Å²	116	57.7 Å²	57.7	62%	0.62	31%	0.314	S	S	*	.	H	α-helix	trans	-63.1	-40.7	178.7	-70.6	-12.2	0	0	0	111.9	S383 H388 T389	S383-N385 PolarHBondContact O-N 2.96Å; N385-H388 PolarHBondContact O-N 3.43Å; N385-T389 PolarHBondContact O-N 3.43Å; N385-T389 PolarHBondContact O-OG1 3.4Å
386	F	83	Confident	83.2	Confident	95 Å²	95	60.2 Å²	60.2	42%	0.417	32%	0.324	S	S	.	.	H	α-helix	trans	-63.2	-45.8	176	174	-102.4	0	0	0	111.1	D381 S383 H384 H388 T389 V390	D381-F386 HydrophobicContact CB-CD1 4.01Å; D381-F386 HydrophobicContact CB-CE1 4.46Å; D381-F386 HydrophobicContact CB-CG 4.39Å; D381-F386 WeakPolarHBondContact OD2-CE1 3.17Å; S383-F386 PolarHBondContact O-N 3.3Å; H384-F386 VanDerWaalsContact C-N 3.34Å; H384-F386 PolarHBondContact O-N 2.89Å; F386-H388 VanDerWaalsContact C-N 3.29Å; F386-H388 PolarHBondContact O-N 3.48Å; F386-T389 PolarHBondContact O-N 2.91Å; F386-V390 HydrophobicContact CD1-CG2 4.42Å; F386-V390 HydrophobicContact CD2-CG2 4.19Å; F386-V390 HydrophobicContact CE1-CG2 3.97Å; F386-V390 HydrophobicContact CE2-CG2 3.71Å; F386-V390 HydrophobicContact CZ-CG2 3.6Å; F386-V390 WeakPolarHBondContact O-CG2 3.37Å; F386-V390 PolarHBondContact O-N 3.29Å
387	V	85.8	Confident	83.6	Confident	3 Å²	3	61 Å²	61	2%	0.018	33%	0.328	C	S	.	.	H	α-helix	trans	-56.4	-45	175.7	176.3	0	0	0	0	110.7	H384 I391 F587	H384-V387 WeakPolarHBondContact O-CB 3.45Å; H384-V387 PolarHBondContact O-N 3.22Å; V387-I391 HydrophobicContact CG1-CD1 3.49Å; V387-I391 VanDerWaalsContact CG1-CD1 3.49Å; V387-I391 HydrophobicContact CG1-CG1 4.32Å; V387-I391 VanDerWaalsContact O-CB 3.31Å; V387-I391 WeakPolarHBondContact O-CB 3.26Å; V387-I391 VanDerWaalsContact O-CG1 3.24Å; V387-I391 WeakPolarHBondContact O-CG1 3.44Å; V387-I391 PolarHBondContact O-N 3.35Å; V387-F587 HydrophobicContact CG1-CE1 4.36Å; V387-F587 HydrophobicContact CG1-CZ 4.2Å
388	H	91.2	Very high	84.2	Confident	25 Å²	25	60.1 Å²	60.1	12%	0.116	32%	0.324	C	S	.	.	H	α-helix	trans	-60.7	-47.4	177.5	-64.1	-178.8	0	0	0	111.9	H384 N385 F386 R392 A586 A590	H384-H388 PolarHBondContact O-CD2 3.36Å; H384-H388 PolarHBondContact O-N 2.92Å; N385-H388 PolarHBondContact O-N 3.43Å; F386-H388 VanDerWaalsContact C-N 3.29Å; F386-H388 PolarHBondContact O-N 3.48Å; H388-R392 WeakPolarHBondContact O-CB 3.49Å; H388-R392 WeakPolarHBondContact O-CD 3.39Å; H388-R392 WeakPolarHBondContact O-CG 3.4Å; H388-R392 PolarHBondContact O-N 3.44Å; H388-A586 PolarHBondContact CD2-O 3.29Å; H388-A586 PolarHBondContact NE2-O 3.42Å; H388-A586 VanDerWaalsContact NE2-O 3.16Å; H388-A590 HydrophobicContact CB-CB 4.45Å
389	T	89.5	Confident	85	Confident	83 Å²	83	59.4 Å²	59.4	51%	0.509	32%	0.319	S	S	.	.	H	α-helix	trans	-61.3	-49.3	-179.3	-58.9	0	0	0	0	111.9	N385 F386 R392 L393	N385-T389 PolarHBondContact O-N 3.43Å; N385-T389 PolarHBondContact O-OG1 3.4Å; F386-T389 PolarHBondContact O-N 2.91Å; T389-R392 PolarHBondContact O-N 3.42Å; T389-L393 HydrophobicContact CG2-CD1 3.96Å; T389-L393 WeakPolarHBondContact O-CB 3.32Å; T389-L393 WeakPolarHBondContact O-CG 3.43Å; T389-L393 PolarHBondContact O-N 3.18Å
390	V	88.1	Confident	85.9	Confident	31 Å²	31	56.6 Å²	56.6	19%	0.188	31%	0.31	C	S	.	.	H	α-helix	trans	-64.8	-46.1	-177.9	174.9	0	0	0	0	111.3	F386 R392 L393 R394	F386-V390 HydrophobicContact CD1-CG2 4.42Å; F386-V390 HydrophobicContact CD2-CG2 4.19Å; F386-V390 HydrophobicContact CE1-CG2 3.97Å; F386-V390 HydrophobicContact CE2-CG2 3.71Å; F386-V390 HydrophobicContact CZ-CG2 3.6Å; F386-V390 WeakPolarHBondContact O-CG2 3.37Å; F386-V390 PolarHBondContact O-N 3.29Å; V390-R392 PolarHBondContact O-N 2.89Å; V390-L393 PolarHBondContact O-N 3.43Å; V390-R394 WeakPolarHBondContact O-CG 3.47Å; V390-R394 PolarHBondContact O-N 3.47Å; V390-R394 VanDerWaalsContact O-N 3.09Å
391	I	91.6	Very high	87.5	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-60.3	-47.4	179	-72.8	175.3	0	0	0	110.7	L303 M377 V387 R394 L395 F587 A590 V591	L303-I391 HydrophobicContact CD2-CB 4.4Å; L303-I391 HydrophobicContact CD2-CG1 3.98Å; L303-I391 HydrophobicContact CD2-CG2 4.06Å; M377-I391 HydrophobicContact CE-CD1 4.13Å; M377-I391 HydrophobicContact CE-CG1 4.17Å; V387-I391 HydrophobicContact CG1-CD1 3.49Å; V387-I391 VanDerWaalsContact CG1-CD1 3.49Å; V387-I391 HydrophobicContact CG1-CG1 4.32Å; V387-I391 VanDerWaalsContact O-CB 3.31Å; V387-I391 WeakPolarHBondContact O-CB 3.26Å; V387-I391 VanDerWaalsContact O-CG1 3.24Å; V387-I391 WeakPolarHBondContact O-CG1 3.44Å; V387-I391 PolarHBondContact O-N 3.35Å; I391-R394 PolarHBondContact O-N 3.16Å; I391-L395 HydrophobicContact CG2-CD1 3.58Å; I391-L395 HydrophobicContact CG2-CG 4.15Å; I391-L395 VanDerWaalsContact O-CB 3.31Å; I391-L395 WeakPolarHBondContact O-CB 3.38Å; I391-L395 VanDerWaalsContact O-CG 3.29Å; I391-L395 WeakPolarHBondContact O-CG 3.28Å; I391-L395 PolarHBondContact O-N 3.28Å; I391-F587 HydrophobicContact CD1-CD1 3.52Å; I391-F587 HydrophobicContact CD1-CE1 3.43Å; I391-F587 VanDerWaalsContact CD1-CE1 3.43Å; I391-F587 HydrophobicContact CD1-CZ 4.4Å; I391-A590 HydrophobicContact CB-CB 4.06Å; I391-A590 HydrophobicContact CD1-CB 3.85Å; I391-A590 HydrophobicContact CG2-CB 3.81Å; I391-V591 HydrophobicContact CG2-CG2 4.43Å
392	R	93.6	Very high	89.4	Confident	57 Å²	57	48 Å²	48	22%	0.215	26%	0.261	C	S	.	.	H	α-helix	trans	-64.8	-43.4	-177.8	-71.7	172.1	-174.1	-175.4	0.3	112.4	H388 T389 V390 R394 L395 Q396 E589 A590 K593 D594	H388-R392 WeakPolarHBondContact O-CB 3.49Å; H388-R392 WeakPolarHBondContact O-CD 3.39Å; H388-R392 WeakPolarHBondContact O-CG 3.4Å; H388-R392 PolarHBondContact O-N 3.44Å; T389-R392 PolarHBondContact O-N 3.42Å; V390-R392 PolarHBondContact O-N 2.89Å; R392-R394 PolarHBondContact O-N 3.42Å; R392-L395 PolarHBondContact O-N 2.85Å; R392-Q396 VanDerWaalsContact O-CB 3.31Å; R392-Q396 WeakPolarHBondContact O-CB 3.46Å; R392-Q396 PolarHBondContact O-N 2.99Å; R392-E589 PolarHBondContact NH2-O 2.91Å; R392-A590 VanDerWaalsContact CG-O 3.3Å; R392-A590 WeakPolarHBondContact CG-O 3.27Å; R392-A590 PolarHBondContact NE-O 3.45Å; R392-K593 PolarHBondContact NH1-O 2.62Å; R392-K593 VanDerWaalsContact NH2-C 3.35Å; R392-K593 PolarHBondContact NH2-O 3.46Å; R392-D594 HydrophobicContact CG-CB 4.31Å
393	L	92.3	Very high	91	Very high	109 Å²	109	45.9 Å²	45.9	57%	0.571	24%	0.235	S	C	*	.	H	α-helix	trans	-60	-45.5	176.2	-74.2	171.3	0	0	0	111.9	T389 V390 Q396 L397	T389-L393 HydrophobicContact CG2-CD1 3.96Å; T389-L393 WeakPolarHBondContact O-CB 3.32Å; T389-L393 WeakPolarHBondContact O-CG 3.43Å; T389-L393 PolarHBondContact O-N 3.18Å; V390-L393 PolarHBondContact O-N 3.43Å; L393-Q396 PolarHBondContact O-N 2.96Å; L393-L397 PolarHBondContact O-N 2.65Å
394	R	93.1	Very high	92.2	Very high	51 Å²	51	46.2 Å²	46.2	19%	0.192	23%	0.231	C	C	.	.	H	α-helix	trans	-68.5	-44	179.2	-71	-178.2	178.7	175.8	-0.8	111.9	L303 Q304 D305 V390 I391 R392 Q396 L397 I398	L303-R394 HydrophobicContact CD1-CB 3.76Å; L303-R394 WeakPolarHBondContact O-CD 3.42Å; L303-R394 PolarHBondContact O-NH1 3Å; Q304-R394 PolarHBondContact O-NH1 2.76Å; D305-R394 PolarHBondContact O-NH1 3.16Å; V390-R394 WeakPolarHBondContact O-CG 3.47Å; V390-R394 PolarHBondContact O-N 3.47Å; V390-R394 VanDerWaalsContact O-N 3.09Å; I391-R394 PolarHBondContact O-N 3.16Å; R392-R394 PolarHBondContact O-N 3.42Å; R394-Q396 VanDerWaalsContact C-N 3.32Å; R394-Q396 PolarHBondContact O-N 3.39Å; R394-L397 PolarHBondContact O-N 3.03Å; R394-I398 WeakPolarHBondContact O-CD1 3.43Å; R394-I398 VanDerWaalsContact O-CG1 3.26Å; R394-I398 WeakPolarHBondContact O-CG1 3.43Å; R394-I398 PolarHBondContact O-N 3.18Å
395	L	93.7	Very high	92.8	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-40.3	176.2	-76.4	178	0	0	0	112.1	C366 I391 R392 I398 R399 V591	C366-L395 HydrophobicContact CB-CD1 4.09Å; C366-L395 HydrophobicContact CB-CD2 3.96Å; C366-L395 HydrophobicContact CB-CG 4.47Å; I391-L395 HydrophobicContact CG2-CD1 3.58Å; I391-L395 HydrophobicContact CG2-CG 4.15Å; I391-L395 VanDerWaalsContact O-CB 3.31Å; I391-L395 WeakPolarHBondContact O-CB 3.38Å; I391-L395 VanDerWaalsContact O-CG 3.29Å; I391-L395 WeakPolarHBondContact O-CG 3.28Å; I391-L395 PolarHBondContact O-N 3.28Å; R392-L395 PolarHBondContact O-N 2.85Å; L395-I398 PolarHBondContact O-N 3.39Å; L395-R399 WeakPolarHBondContact O-CB 3.02Å; L395-R399 VanDerWaalsContact O-CD 3.28Å; L395-R399 WeakPolarHBondContact O-CD 3.22Å; L395-R399 WeakPolarHBondContact O-CG 3.01Å; L395-R399 PolarHBondContact O-N 3.16Å; L395-V591 HydrophobicContact CD1-CG2 4.03Å
396	Q	94.5	Very high	93.4	Very high	86 Å²	86	37.4 Å²	37.4	40%	0.402	19%	0.186	S	C	.	.	H	α-helix	trans	-57.8	-50.6	174.9	-177.4	175.3	2.9	0	0	110.6	R392 L393 R394 I398 R399 D400	R392-Q396 VanDerWaalsContact O-CB 3.31Å; R392-Q396 WeakPolarHBondContact O-CB 3.46Å; R392-Q396 PolarHBondContact O-N 2.99Å; L393-Q396 PolarHBondContact O-N 2.96Å; R394-Q396 VanDerWaalsContact C-N 3.32Å; R394-Q396 PolarHBondContact O-N 3.39Å; Q396-I398 PolarHBondContact O-N 2.89Å; Q396-R399 PolarHBondContact O-N 2.86Å; Q396-D400 WeakPolarHBondContact O-CB 3.42Å; Q396-D400 VanDerWaalsContact O-CG 3.24Å; Q396-D400 PolarHBondContact O-N 3.45Å
397	L	95.1	Very high	94	Very high	80 Å²	80	38.5 Å²	38.5	42%	0.419	19%	0.187	S	C	.	.	H	α-helix	trans	-59.6	-45.9	177.5	-178.9	58	0	0	0	112.2	T309 L393 R394 R399 D400 L401	T309-L397 HydrophobicContact CG2-CB 4.48Å; T309-L397 HydrophobicContact CG2-CD2 3.8Å; T309-L397 HydrophobicContact CG2-CG 4.06Å; L393-L397 PolarHBondContact O-N 2.65Å; R394-L397 PolarHBondContact O-N 3.03Å; L397-R399 VanDerWaalsContact C-N 3.31Å; L397-R399 PolarHBondContact O-N 3.24Å; L397-D400 PolarHBondContact O-N 3.11Å; L397-L401 HydrophobicContact CD1-CD1 4.12Å; L397-L401 HydrophobicContact CD1-CG 4.11Å; L397-L401 HydrophobicContact CG-CD1 4.05Å; L397-L401 HydrophobicContact CG-CG 4.47Å; L397-L401 WeakPolarHBondContact O-CB 2.96Å; L397-L401 VanDerWaalsContact O-CG 3.25Å; L397-L401 WeakPolarHBondContact O-CG 3.31Å; L397-L401 PolarHBondContact O-N 2.69Å
398	I	96.1	Very high	94.5	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-58.8	-43.3	177.9	-68.9	159.6	0	0	0	111.2	L303 T309 L312 V364 R394 L395 Q396 S402	L303-I398 HydrophobicContact CD1-CD1 3.93Å; T309-I398 HydrophobicContact CG2-CD1 4.36Å; T309-I398 HydrophobicContact CG2-CG1 3.69Å; L312-I398 HydrophobicContact CD2-CG2 3.99Å; L312-I398 WeakPolarHBondContact CD2-O 3.43Å; V364-I398 HydrophobicContact CB-CD1 3.85Å; V364-I398 HydrophobicContact CG1-CD1 3.74Å; V364-I398 HydrophobicContact CG2-CD1 3.9Å; V364-I398 HydrophobicContact CG2-CG1 4.38Å; V364-I398 HydrophobicContact CG2-CG2 4.29Å; R394-I398 WeakPolarHBondContact O-CD1 3.43Å; R394-I398 VanDerWaalsContact O-CG1 3.26Å; R394-I398 WeakPolarHBondContact O-CG1 3.43Å; R394-I398 PolarHBondContact O-N 3.18Å; L395-I398 PolarHBondContact O-N 3.39Å; Q396-I398 PolarHBondContact O-N 2.89Å; I398-S402 VanDerWaalsContact O-CB 3.31Å; I398-S402 WeakPolarHBondContact O-CB 3.28Å; I398-S402 PolarHBondContact O-N 3.34Å; I398-S402 PolarHBondContact O-OG 3.09Å
399	R	96.5	Very high	94.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-71.2	-36.3	-179.6	-70.9	161.8	177.6	178	2.7	112.2	L395 Q396 L397 S402 T403 N451 V454 D594	L395-R399 WeakPolarHBondContact O-CB 3.02Å; L395-R399 VanDerWaalsContact O-CD 3.28Å; L395-R399 WeakPolarHBondContact O-CD 3.22Å; L395-R399 WeakPolarHBondContact O-CG 3.01Å; L395-R399 PolarHBondContact O-N 3.16Å; Q396-R399 PolarHBondContact O-N 2.86Å; L397-R399 VanDerWaalsContact C-N 3.31Å; L397-R399 PolarHBondContact O-N 3.24Å; R399-S402 PolarHBondContact O-N 3.44Å; R399-T403 WeakPolarHBondContact O-CB 3.32Å; R399-T403 PolarHBondContact O-N 2.77Å; R399-T403 PolarHBondContact O-OG1 2.68Å; R399-N451 PolarHBondContact NE-OD1 3.44Å; R399-V454 HydrophobicContact CB-CB 4.41Å; R399-V454 HydrophobicContact CB-CG1 3.85Å; R399-V454 HydrophobicContact CG-CB 4.16Å; R399-V454 HydrophobicContact CG-CG1 4.1Å; R399-V454 HydrophobicContact CG-CG2 4.47Å; R399-D594 IonicContact CZ-OD2 3.76Å; R399-D594 IonicContact NH1-OD2 3.27Å; R399-D594 PolarHBondContact NH1-OD2 3.44Å
400	D	96.1	Very high	95	Very high	74 Å²	74	33.7 Å²	33.7	40%	0.396	16%	0.159	S	C	.	.	H	α-helix	trans	-65	-46.2	175	-71.2	-18.3	0	0	0	110.8	Q396 L397 T403 E404	Q396-D400 WeakPolarHBondContact O-CB 3.42Å; Q396-D400 VanDerWaalsContact O-CG 3.24Å; Q396-D400 PolarHBondContact O-N 3.45Å; L397-D400 PolarHBondContact O-N 3.11Å; D400-T403 PolarHBondContact O-N 3.26Å; D400-E404 PolarHBondContact O-N 3.4Å
401	L	97.3	Very high	95.2	Very high	8 Å²	8	38.1 Å²	38.1	4%	0.042	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-44.3	175.5	-66.4	172.1	0	0	0	111.7	L312 D313 R316 L397 T403 E404 T405	L312-L401 HydrophobicContact CD2-CB 3.7Å; L312-L401 HydrophobicContact CD2-CD1 4.39Å; L312-L401 HydrophobicContact CG-CB 3.75Å; L312-L401 HydrophobicContact CG-CD1 4.34Å; D313-L401 HydrophobicContact CB-CD1 3.99Å; D313-L401 HydrophobicContact CB-CD2 4.29Å; D313-L401 WeakPolarHBondContact OD1-CD2 3.5Å; R316-L401 HydrophobicContact CB-CD2 4.43Å; R316-L401 HydrophobicContact CG-CD2 4.26Å; L397-L401 HydrophobicContact CD1-CD1 4.12Å; L397-L401 HydrophobicContact CD1-CG 4.11Å; L397-L401 HydrophobicContact CG-CD1 4.05Å; L397-L401 HydrophobicContact CG-CG 4.47Å; L397-L401 WeakPolarHBondContact O-CB 2.96Å; L397-L401 VanDerWaalsContact O-CG 3.25Å; L397-L401 WeakPolarHBondContact O-CG 3.31Å; L397-L401 PolarHBondContact O-N 2.69Å; L401-T403 VanDerWaalsContact C-N 3.3Å; L401-T403 PolarHBondContact O-N 3.45Å; L401-E404 PolarHBondContact O-N 3.31Å; L401-T405 WeakPolarHBondContact O-CB 3.47Å; L401-T405 PolarHBondContact O-N 3.37Å; L401-T405 PolarHBondContact O-OG1 3.14Å
402	S	97.5	Very high	95.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.5	-40.7	176.4	-60.7	0	0	0	0	111.7	L312 I398 R399 L406	L312-S402 WeakPolarHBondContact CD2-OG 3.38Å; I398-S402 VanDerWaalsContact O-CB 3.31Å; I398-S402 WeakPolarHBondContact O-CB 3.28Å; I398-S402 PolarHBondContact O-N 3.34Å; I398-S402 PolarHBondContact O-OG 3.09Å; R399-S402 PolarHBondContact O-N 3.44Å; S402-L406 PolarHBondContact O-N 3.32Å
403	T	96.9	Very high	95.4	Very high	19 Å²	19	40.5 Å²	40.5	12%	0.117	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-46.8	177.9	-59.9	0	0	0	0	110.6	R399 D400 L401 R407 N458	R399-T403 WeakPolarHBondContact O-CB 3.32Å; R399-T403 PolarHBondContact O-N 2.77Å; R399-T403 PolarHBondContact O-OG1 2.68Å; D400-T403 PolarHBondContact O-N 3.26Å; L401-T403 VanDerWaalsContact C-N 3.3Å; L401-T403 PolarHBondContact O-N 3.45Å; T403-R407 WeakPolarHBondContact O-CB 3.18Å; T403-R407 PolarHBondContact O-N 3.08Å; T403-N458 HydrophobicContact CG2-CB 3.76Å; T403-N458 PolarHBondContact OG1-ND2 3.04Å; T403-N458 VanDerWaalsContact OG1-ND2 3.09Å
404	E	96.4	Very high	95.6	Very high	63 Å²	63	40 Å²	40	29%	0.294	20%	0.199	S	C	.	.	H	α-helix	trans	-70	-37.6	-179	-170.6	55.6	-150.2	0	0	112.4	R316 D400 L401 R407 C408	R316-E404 HydrophobicContact CG-CB 4.03Å; R316-E404 HydrophobicContact CG-CG 4.2Å; D400-E404 PolarHBondContact O-N 3.4Å; L401-E404 PolarHBondContact O-N 3.31Å; E404-R407 PolarHBondContact O-N 3.38Å; E404-R407 IonicContact OE2-NH1 3.28Å; E404-C408 WeakPolarHBondContact O-CB 3.23Å; E404-C408 PolarHBondContact O-N 2.99Å; E404-C408 PolarHBondContact O-SG 3.38Å; E404-C408 PolarHBondContact OE1-SG 3.42Å; E404-C408 VanDerWaalsContact OE1-SG 3.38Å
405	T	97.5	Very high	95.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-56.7	-56.2	173.1	-64.9	0	0	0	0	111.2	F315 R316 L358 M362 L401 R407 C408 M409	F315-T405 HydrophobicContact CD1-CG2 3.64Å; F315-T405 HydrophobicContact CE1-CG2 3.69Å; R316-T405 WeakPolarHBondContact CA-OG1 3.4Å; R316-T405 WeakPolarHBondContact CB-OG1 3.42Å; R316-T405 WeakPolarHBondContact CG-OG1 3.5Å; L358-T405 HydrophobicContact CD2-CG2 4.2Å; M362-T405 HydrophobicContact CE-CG2 3.69Å; L401-T405 WeakPolarHBondContact O-CB 3.47Å; L401-T405 PolarHBondContact O-N 3.37Å; L401-T405 PolarHBondContact O-OG1 3.14Å; T405-R407 VanDerWaalsContact C-N 3.31Å; T405-R407 PolarHBondContact O-N 3Å; T405-C408 WeakPolarHBondContact O-CB 3.19Å; T405-C408 PolarHBondContact O-N 3.44Å; T405-C408 VanDerWaalsContact O-N 3.17Å; T405-M409 PolarHBondContact O-N 3.02Å; T405-M409 VanDerWaalsContact O-N 3.11Å
406	L	96.4	Very high	95.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.8	-36.7	-179.9	-73.6	177.9	0	0	0	111.7	L358 M362 S402 C408 M409 M410 T419 L423 I452 V455	L358-L406 HydrophobicContact CD1-CD2 3.98Å; M362-L406 HydrophobicContact CE-CD1 4.18Å; M362-L406 HydrophobicContact CE-CD2 3.97Å; M362-L406 HydrophobicContact CE-CG 3.64Å; M362-L406 HydrophobicContact SD-CD1 4.14Å; M362-L406 HydrophobicContact SD-CG 4.25Å; S402-L406 PolarHBondContact O-N 3.32Å; L406-C408 VanDerWaalsContact C-N 3.34Å; L406-C408 PolarHBondContact O-N 3.3Å; L406-M409 PolarHBondContact O-N 2.81Å; L406-M410 VanDerWaalsContact O-CB 3.26Å; L406-M410 WeakPolarHBondContact O-CB 3.48Å; L406-M410 WeakPolarHBondContact O-CG 3.36Å; L406-M410 PolarHBondContact O-N 3.18Å; L406-T419 HydrophobicContact CD2-CG2 3.76Å; L406-L423 HydrophobicContact CD1-CD2 4.21Å; L406-I452 HydrophobicContact CD1-CD1 4.3Å; L406-V455 HydrophobicContact CB-CG1 4.04Å; L406-V455 HydrophobicContact CD1-CB 4.16Å; L406-V455 HydrophobicContact CD1-CG1 3.66Å; L406-V455 HydrophobicContact CD1-CG2 4.21Å; L406-V455 HydrophobicContact CG-CG1 4.43Å
407	R	95.3	Very high	95.8	Very high	117 Å²	117	43.5 Å²	43.5	44%	0.442	21%	0.213	S	C	.	.	H	α-helix	trans	-60.9	-43.2	174.1	-174.6	-177.4	-178.2	-172	-3.7	111.7	T403 E404 T405 M410 M411	T403-R407 WeakPolarHBondContact O-CB 3.18Å; T403-R407 PolarHBondContact O-N 3.08Å; E404-R407 PolarHBondContact O-N 3.38Å; E404-R407 IonicContact OE2-NH1 3.28Å; T405-R407 VanDerWaalsContact C-N 3.31Å; T405-R407 PolarHBondContact O-N 3Å; R407-M410 PolarHBondContact O-N 3.01Å; R407-M411 HydrophobicContact CG-CG 4.33Å; R407-M411 WeakPolarHBondContact O-CB 3.39Å; R407-M411 WeakPolarHBondContact O-CG 3.38Å; R407-M411 PolarHBondContact O-N 2.9Å
408	C	96.3	Very high	95.8	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.007	20%	0.204	C	C	.	.	H	α-helix	trans	-60.8	-46.2	177.3	-77	0	0	0	0	111.7	C319 R327 E404 T405 L406 M411 N412	C319-C408 HydrophobicContact CB-CB 3.95Å; R327-C408 WeakPolarHBondContact CD-O 3.47Å; R327-C408 PolarHBondContact NE-O 3.22Å; E404-C408 WeakPolarHBondContact O-CB 3.23Å; E404-C408 PolarHBondContact O-N 2.99Å; E404-C408 PolarHBondContact O-SG 3.38Å; E404-C408 PolarHBondContact OE1-SG 3.42Å; E404-C408 VanDerWaalsContact OE1-SG 3.38Å; T405-C408 WeakPolarHBondContact O-CB 3.19Å; T405-C408 PolarHBondContact O-N 3.44Å; T405-C408 VanDerWaalsContact O-N 3.17Å; L406-C408 VanDerWaalsContact C-N 3.34Å; L406-C408 PolarHBondContact O-N 3.3Å; C408-M411 PolarHBondContact O-N 3.39Å; C408-N412 PolarHBondContact O-N 3.29Å
409	M	96.4	Very high	95.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-38.3	176.8	-62.9	-171.1	74.4	0	0	112.7	C330 I333 L334 W339 L358 T405 L406 M411 N412 S415 R416 T419	C330-M409 HydrophobicContact CB-CG 4.36Å; I333-M409 HydrophobicContact CG2-CE 4.43Å; L334-M409 HydrophobicContact CD2-CE 4.46Å; W339-M409 HydrophobicContact CH2-CE 3.5Å; W339-M409 HydrophobicContact CZ3-CE 3.71Å; L358-M409 HydrophobicContact CD1-CE 4.36Å; L358-M409 HydrophobicContact CD1-SD 3.92Å; L358-M409 HydrophobicContact CD2-SD 3.78Å; L358-M409 HydrophobicContact CG-SD 4.33Å; T405-M409 PolarHBondContact O-N 3.02Å; T405-M409 VanDerWaalsContact O-N 3.11Å; L406-M409 PolarHBondContact O-N 2.81Å; M409-M411 VanDerWaalsContact C-N 3.33Å; M409-M411 PolarHBondContact O-N 3.35Å; M409-N412 PolarHBondContact O-N 3.4Å; M409-S415 WeakPolarHBondContact CA-OG 3.43Å; M409-S415 CarbonylContact O-C 3.4Å; M409-S415 PolarHBondContact O-OG 2.86Å; M409-R416 PolarHBondContact O-N 3.09Å; M409-T419 HydrophobicContact CB-CG2 4.27Å; M409-T419 WeakPolarHBondContact CB-OG1 3.34Å
410	M	93.3	Very high	95.7	Very high	10 Å²	10	41.6 Å²	41.6	5%	0.049	21%	0.205	C	C	.	.	H	α-helix	trans	-70.3	-27.1	177.8	-76.5	-63.4	-57.7	0	0	114.1	L406 R407 N412 R416 T419 M420 F510	L406-M410 VanDerWaalsContact O-CB 3.26Å; L406-M410 WeakPolarHBondContact O-CB 3.48Å; L406-M410 WeakPolarHBondContact O-CG 3.36Å; L406-M410 PolarHBondContact O-N 3.18Å; R407-M410 PolarHBondContact O-N 3.01Å; M410-N412 VanDerWaalsContact C-N 3.34Å; M410-R416 HydrophobicContact CE-CG 4.01Å; M410-R416 WeakPolarHBondContact O-CG 3.41Å; M410-R416 HydrophobicContact SD-CG 4.38Å; M410-T419 HydrophobicContact CG-CG2 4.02Å; M410-T419 HydrophobicContact SD-CG2 3.88Å; M410-M420 HydrophobicContact CE-CG 3.56Å; M410-M420 HydrophobicContact CE-SD 3.34Å; M410-M420 WeakPolarHBondContact CE-SD 3.39Å; M410-M420 HydrophobicContact SD-CG 3.62Å; M410-M420 HydrophobicContact SD-SD 3.71Å; M410-F510 HydrophobicContact CE-CD2 3.81Å; M410-F510 HydrophobicContact CE-CE2 3.43Å; M410-F510 VanDerWaalsContact CE-CE2 3.43Å; M410-F510 HydrophobicContact CE-CZ 4.31Å
411	M	93.2	Very high	95.6	Very high	124 Å²	124	42.2 Å²	42.2	61%	0.611	21%	0.205	S	C	*	.	H	α-helix	trans	-82.9	-11.8	177.2	-71.9	-64.1	-59.5	0	0	113.2	R407 C408 M409	R407-M411 HydrophobicContact CG-CG 4.33Å; R407-M411 WeakPolarHBondContact O-CB 3.39Å; R407-M411 WeakPolarHBondContact O-CG 3.38Å; R407-M411 PolarHBondContact O-N 2.9Å; C408-M411 PolarHBondContact O-N 3.39Å; M409-M411 VanDerWaalsContact C-N 3.33Å; M409-M411 PolarHBondContact O-N 3.35Å
412	N	95.9	Very high	95.6	Very high	7 Å²	7	42 Å²	42	4%	0.037	20%	0.204	C	C	.	.	S	Bend	trans	-96.3	133.3	178.8	176	64.5	0	0	0	110.6	S326 R327 N331 C408 M409 M410 E414 S415 R416	S326-N412 PolarHBondContact OG-OD1 2.92Å; R327-N412 HydrophobicContact CB-CB 4.06Å; R327-N412 HydrophobicContact CG-CB 3.96Å; R327-N412 PolarHBondContact N-OD1 2.8Å; R327-N412 VanDerWaalsContact N-OD1 3.17Å; N331-N412 PolarHBondContact OD1-ND2 3.13Å; C408-N412 PolarHBondContact O-N 3.29Å; M409-N412 PolarHBondContact O-N 3.4Å; M410-N412 VanDerWaalsContact C-N 3.34Å; N412-E414 PolarHBondContact O-N 3.21Å; N412-S415 WeakPolarHBondContact CB-OG 3.34Å; N412-S415 PolarHBondContact ND2-N 3.43Å; N412-S415 PolarHBondContact ND2-OG 3.18Å; N412-S415 PolarHBondContact O-N 3.41Å; N412-R416 VanDerWaalsContact O-CB 3.29Å; N412-R416 WeakPolarHBondContact O-CB 3.31Å; N412-R416 PolarHBondContact O-N 3.05Å
413	S	94	Very high	95.5	Very high	100 Å²	100	42.3 Å²	42.3	70%	0.699	21%	0.206	S	C	*	.	H	α-helix	trans	-60.2	-42.4	-168.7	41.8	0	0	0	0	113.2
414	E	95.2	Very high	95.5	Very high	99 Å²	99	41.8 Å²	41.8	46%	0.463	20%	0.203	S	C	.	.	H	α-helix	trans	-78.7	-35.6	-175.3	-67	172.6	-109.4	0	0	112.5	N331 N412 P418	N331-E414 PolarHBondContact ND2-OE1 3.41Å; N331-E414 PolarHBondContact ND2-OE2 2.89Å; N412-E414 PolarHBondContact O-N 3.21Å; E414-P418 VanDerWaalsContact O-CD 3.24Å; E414-P418 WeakPolarHBondContact O-CD 3.31Å; E414-P418 WeakPolarHBondContact O-CG 3.48Å
415	S	96.2	Very high	95.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-88.5	-13.1	-178.7	55.9	0	0	0	0	114.5	M409 N412 T419	M409-S415 WeakPolarHBondContact CA-OG 3.43Å; M409-S415 CarbonylContact O-C 3.4Å; M409-S415 PolarHBondContact O-OG 2.86Å; N412-S415 WeakPolarHBondContact CB-OG 3.34Å; N412-S415 PolarHBondContact ND2-N 3.43Å; N412-S415 PolarHBondContact ND2-OG 3.18Å; N412-S415 PolarHBondContact O-N 3.41Å; S415-T419 WeakPolarHBondContact O-CB 3.22Å; S415-T419 PolarHBondContact O-N 2.98Å; S415-T419 PolarHBondContact O-OG1 2.89Å
416	R	95.4	Very high	95.4	Very high	110 Å²	110	39.3 Å²	39.3	42%	0.415	19%	0.193	S	C	.	.	H	α-helix	trans	-57.5	-56	-177.1	177.8	178.7	178.7	130.8	-0.8	113.1	M409 M410 N412 T419 M420	M409-R416 PolarHBondContact O-N 3.09Å; M410-R416 HydrophobicContact CE-CG 4.01Å; M410-R416 WeakPolarHBondContact O-CG 3.41Å; M410-R416 HydrophobicContact SD-CG 4.38Å; N412-R416 VanDerWaalsContact O-CB 3.29Å; N412-R416 WeakPolarHBondContact O-CB 3.31Å; N412-R416 PolarHBondContact O-N 3.05Å; R416-T419 PolarHBondContact O-N 3.43Å; R416-M420 WeakPolarHBondContact O-CG 3.45Å; R416-M420 PolarHBondContact O-N 3.21Å
417	E	94.6	Very high	95.4	Very high	101 Å²	101	39.8 Å²	39.8	47%	0.472	20%	0.195	S	C	.	.	H	α-helix	trans	-67	-46.3	-177.3	179.7	57.8	-145.2	0	0	112.1	T419 M420 Q421 R479	E417-T419 VanDerWaalsContact C-N 3.28Å; E417-T419 PolarHBondContact O-N 3.42Å; E417-M420 PolarHBondContact O-N 3.11Å; E417-Q421 WeakPolarHBondContact O-CB 3.49Å; E417-Q421 PolarHBondContact O-N 3.15Å; E417-R479 IonicContact OE1-CZ 2.85Å; E417-R479 IonicContact OE1-NH1 2.75Å; E417-R479 PolarHBondContact OE1-NH1 3.42Å; E417-R479 IonicContact OE1-NH2 2.62Å; E417-R479 PolarHBondContact OE1-NH2 3.07Å; E417-R479 IonicContact OE2-CZ 2.77Å; E417-R479 IonicContact OE2-NH2 3.78Å; E417-R479 PolarHBondContact OE2-NH2 2.62Å
418	P	95.7	Very high	95.3	Very high	37 Å²	37	36.1 Å²	36.1	24%	0.24	19%	0.189	C	C	.	.	H	α-helix	trans	-57.2	-37.9	172.7	-27.9	36.3	0	0	0	113.8	L334 W339 E414 Q421 F422	L334-P418 HydrophobicContact CD1-CG 4.11Å; L334-P418 HydrophobicContact CD2-CB 3.63Å; L334-P418 HydrophobicContact CD2-CG 4.14Å; W339-P418 HydrophobicContact CZ2-CB 3.88Å; E414-P418 VanDerWaalsContact O-CD 3.24Å; E414-P418 WeakPolarHBondContact O-CD 3.31Å; E414-P418 WeakPolarHBondContact O-CG 3.48Å; P418-Q421 PolarHBondContact O-N 2.97Å; P418-F422 PolarHBondContact O-N 2.95Å
419	T	95.6	Very high	95.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.4	-41.9	177.2	-56.1	0	0	0	0	111.2	L406 M409 M410 S415 R416 E417 Q421 F422 L423	L406-T419 HydrophobicContact CD2-CG2 3.76Å; M409-T419 HydrophobicContact CB-CG2 4.27Å; M409-T419 WeakPolarHBondContact CB-OG1 3.34Å; M410-T419 HydrophobicContact CG-CG2 4.02Å; M410-T419 HydrophobicContact SD-CG2 3.88Å; S415-T419 WeakPolarHBondContact O-CB 3.22Å; S415-T419 PolarHBondContact O-N 2.98Å; S415-T419 PolarHBondContact O-OG1 2.89Å; R416-T419 PolarHBondContact O-N 3.43Å; E417-T419 VanDerWaalsContact C-N 3.28Å; E417-T419 PolarHBondContact O-N 3.42Å; T419-Q421 VanDerWaalsContact C-N 3.27Å; T419-Q421 PolarHBondContact O-N 3.44Å; T419-F422 WeakPolarHBondContact O-CB 3.34Å; T419-F422 PolarHBondContact O-N 3.25Å; T419-L423 WeakPolarHBondContact O-CG 2.99Å; T419-L423 PolarHBondContact O-N 2.92Å
420	M	94.7	Very high	95.3	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.02	20%	0.202	C	C	.	.	H	α-helix	trans	-62.6	-37	173.1	-71.5	-66.3	-72.6	0	0	111.9	M410 R416 E417 L423 S424 F510 E513 M517	M410-M420 HydrophobicContact CE-CG 3.56Å; M410-M420 HydrophobicContact CE-SD 3.34Å; M410-M420 WeakPolarHBondContact CE-SD 3.39Å; M410-M420 HydrophobicContact SD-CG 3.62Å; M410-M420 HydrophobicContact SD-SD 3.71Å; R416-M420 WeakPolarHBondContact O-CG 3.45Å; R416-M420 PolarHBondContact O-N 3.21Å; E417-M420 PolarHBondContact O-N 3.11Å; M420-L423 PolarHBondContact O-N 3.44Å; M420-S424 PolarHBondContact O-N 3.41Å; M420-S424 PolarHBondContact O-OG 2.94Å; M420-F510 HydrophobicContact CE-CD2 4.11Å; M420-F510 HydrophobicContact CE-CE2 4.36Å; M420-F510 HydrophobicContact SD-CD2 4.14Å; M420-F510 HydrophobicContact SD-CE2 3.97Å; M420-E513 HydrophobicContact CE-CB 3.73Å; M420-E513 HydrophobicContact CE-CG 4.48Å; M420-M517 HydrophobicContact CE-CE 3.29Å; M420-M517 HydrophobicContact CE-SD 4.32Å; M420-M517 HydrophobicContact SD-CE 3.87Å
421	Q	94.6	Very high	95.3	Very high	87 Å²	87	40.9 Å²	40.9	41%	0.407	22%	0.22	S	C	.	.	H	α-helix	trans	-69.5	-35.4	176.2	-174.3	58	24.4	0	0	112.7	E417 P418 T419 S424 S425	E417-Q421 WeakPolarHBondContact O-CB 3.49Å; E417-Q421 PolarHBondContact O-N 3.15Å; P418-Q421 PolarHBondContact O-N 2.97Å; T419-Q421 VanDerWaalsContact C-N 3.27Å; T419-Q421 PolarHBondContact O-N 3.44Å; Q421-S424 WeakPolarHBondContact CA-OG 3.27Å; Q421-S424 PolarHBondContact O-OG 3.36Å; Q421-S424 PolarHBondContact OE1-OG 3.48Å; Q421-S425 VanDerWaalsContact O-CB 3.31Å; Q421-S425 WeakPolarHBondContact O-CB 3.35Å; Q421-S425 PolarHBondContact O-N 3.33Å; Q421-S425 PolarHBondContact O-OG 3.24Å
422	F	95.9	Very high	95.2	Very high	4 Å²	4	42 Å²	42	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-60.8	-49.9	171.1	169.5	-100.3	0	0	0	110.7	W339 I352 T356 L358 P418 T419 S424 S425 V426 F448	W339-F422 HydrophobicContact CZ2-CB 4.44Å; I352-F422 HydrophobicContact CD1-CD2 4.1Å; I352-F422 HydrophobicContact CD1-CE2 3.99Å; I352-F422 HydrophobicContact CG1-CD2 4.25Å; I352-F422 HydrophobicContact CG1-CE2 3.72Å; T356-F422 HydrophobicContact CG2-CE2 4.26Å; T356-F422 WeakPolarHBondContact OG1-CE2 3.24Å; L358-F422 HydrophobicContact CB-CE1 3.97Å; L358-F422 HydrophobicContact CB-CE2 4.33Å; L358-F422 HydrophobicContact CB-CZ 3.82Å; L358-F422 HydrophobicContact CD1-CD1 3.99Å; L358-F422 HydrophobicContact CD1-CE1 4.13Å; L358-F422 HydrophobicContact CD1-CG 4.37Å; P418-F422 PolarHBondContact O-N 2.95Å; T419-F422 WeakPolarHBondContact O-CB 3.34Å; T419-F422 PolarHBondContact O-N 3.25Å; F422-S424 PolarHBondContact O-N 3.02Å; F422-S425 WeakPolarHBondContact O-CB 3.15Å; F422-S425 PolarHBondContact O-N 3.49Å; F422-S425 VanDerWaalsContact O-N 3.13Å; F422-V426 HydrophobicContact CD1-CG2 4.46Å; F422-V426 HydrophobicContact CE1-CG2 4.04Å; F422-V426 HydrophobicContact CE2-CG2 4.18Å; F422-V426 HydrophobicContact CZ-CG2 3.89Å; F422-V426 WeakPolarHBondContact O-CG2 3.37Å; F422-V426 PolarHBondContact O-N 3.24Å; F422-F448 HydrophobicContact CZ-CZ 4.15Å
423	L	96.5	Very high	95.1	Very high	5 Å²	5	42 Å²	42	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-40.5	179.4	-66.2	172	0	0	0	112.7	L406 T419 M420 S425 V426 L427 I452 L456 M517	L406-L423 HydrophobicContact CD1-CD2 4.21Å; T419-L423 WeakPolarHBondContact O-CG 2.99Å; T419-L423 PolarHBondContact O-N 2.92Å; M420-L423 PolarHBondContact O-N 3.44Å; L423-S425 VanDerWaalsContact C-N 3.3Å; L423-S425 PolarHBondContact O-N 3.4Å; L423-V426 PolarHBondContact O-N 3.43Å; L423-L427 PolarHBondContact O-N 3.09Å; L423-L427 VanDerWaalsContact O-N 3.16Å; L423-I452 HydrophobicContact CD2-CG2 3.66Å; L423-L456 HydrophobicContact CD1-CD2 4.2Å; L423-M517 HydrophobicContact CB-SD 4.48Å
424	S	95.7	Very high	94.9	Very high	9 Å²	9	39.6 Å²	39.6	6%	0.063	20%	0.204	C	C	.	.	H	α-helix	trans	-66.4	-33.6	174.5	68.4	0	0	0	0	112.4	M420 Q421 F422 L427 A428	M420-S424 PolarHBondContact O-N 3.41Å; M420-S424 PolarHBondContact O-OG 2.94Å; Q421-S424 WeakPolarHBondContact CA-OG 3.27Å; Q421-S424 PolarHBondContact O-OG 3.36Å; Q421-S424 PolarHBondContact OE1-OG 3.48Å; F422-S424 PolarHBondContact O-N 3.02Å; S424-L427 WeakPolarHBondContact O-CB 3.34Å; S424-L427 PolarHBondContact O-N 3.34Å; S424-A428 WeakPolarHBondContact O-CB 3.44Å; S424-A428 PolarHBondContact O-N 3.19Å
425	S	95.8	Very high	94.5	Very high	10 Å²	10	38 Å²	38	7%	0.07	20%	0.203	C	C	.	.	H	α-helix	trans	-70.2	-40	175	-58.3	0	0	0	0	111.6	F340 Q421 F422 L423 L427 A428 L429	F340-S425 WeakPolarHBondContact CZ-OG 3.42Å; Q421-S425 VanDerWaalsContact O-CB 3.31Å; Q421-S425 WeakPolarHBondContact O-CB 3.35Å; Q421-S425 PolarHBondContact O-N 3.33Å; Q421-S425 PolarHBondContact O-OG 3.24Å; F422-S425 WeakPolarHBondContact O-CB 3.15Å; F422-S425 PolarHBondContact O-N 3.49Å; F422-S425 VanDerWaalsContact O-N 3.13Å; L423-S425 VanDerWaalsContact C-N 3.3Å; L423-S425 PolarHBondContact O-N 3.4Å; S425-L427 VanDerWaalsContact C-N 3.26Å; S425-L427 PolarHBondContact O-N 3.08Å; S425-A428 PolarHBondContact O-N 2.87Å; S425-L429 WeakPolarHBondContact O-CB 3.41Å; S425-L429 VanDerWaalsContact O-CG 3.23Å; S425-L429 WeakPolarHBondContact O-CG 3.44Å; S425-L429 PolarHBondContact O-N 3.06Å
426	V	96.7	Very high	93.6	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	25%	0.25	C	C	.	.	H	α-helix	trans	-55.3	-44.4	171.9	170.6	0	0	0	0	110.4	I352 F422 L423 N430 F448 L449	I352-V426 HydrophobicContact CD1-CB 4.48Å; I352-V426 HydrophobicContact CD1-CG2 3.65Å; I352-V426 HydrophobicContact CG1-CG2 4.2Å; F422-V426 HydrophobicContact CD1-CG2 4.46Å; F422-V426 HydrophobicContact CE1-CG2 4.04Å; F422-V426 HydrophobicContact CE2-CG2 4.18Å; F422-V426 HydrophobicContact CZ-CG2 3.89Å; F422-V426 WeakPolarHBondContact O-CG2 3.37Å; F422-V426 PolarHBondContact O-N 3.24Å; L423-V426 PolarHBondContact O-N 3.43Å; V426-N430 WeakPolarHBondContact O-CB 3.4Å; V426-N430 PolarHBondContact O-N 2.93Å; V426-N430 PolarHBondContact O-ND2 2.85Å; V426-F448 HydrophobicContact CG1-CE1 3.94Å; V426-F448 HydrophobicContact CG2-CE1 4.12Å; V426-F448 HydrophobicContact CG2-CZ 4.08Å; V426-L449 HydrophobicContact CG1-CD2 3.81Å
427	L	96.3	Very high	92.8	Very high	10 Å²	10	50.6 Å²	50.6	5%	0.052	27%	0.274	C	S	.	.	H	α-helix	trans	-61.7	-54.1	174.9	-78.1	168.2	0	0	0	112.4	L423 S424 S425 L429 N430 S431 V480 M517 H520 L521 I524	L423-L427 PolarHBondContact O-N 3.09Å; L423-L427 VanDerWaalsContact O-N 3.16Å; S424-L427 WeakPolarHBondContact O-CB 3.34Å; S424-L427 PolarHBondContact O-N 3.34Å; S425-L427 VanDerWaalsContact C-N 3.26Å; S425-L427 PolarHBondContact O-N 3.08Å; L427-L429 PolarHBondContact O-N 3.49Å; L427-N430 PolarHBondContact O-N 3.14Å; L427-S431 PolarHBondContact O-N 3.05Å; L427-V480 HydrophobicContact CD1-CG1 4.37Å; L427-M517 HydrophobicContact CD1-CB 3.72Å; L427-M517 HydrophobicContact CD1-CG 3.63Å; L427-M517 HydrophobicContact CD1-SD 4.27Å; L427-H520 HydrophobicContact CD2-CB 3.96Å; L427-L521 HydrophobicContact CD2-CB 3.67Å; L427-L521 HydrophobicContact CD2-CD1 3.88Å; L427-L521 HydrophobicContact CD2-CG 4.34Å; L427-I524 HydrophobicContact CD2-CD1 4.08Å
428	A	94.4	Very high	92.3	Very high	39 Å²	39	47.6 Å²	47.6	32%	0.322	26%	0.264	S	S	.	.	H	α-helix	trans	-61.1	-45.4	-175	0	0	0	0	0	112.2	S424 S425 N430 S431	S424-A428 WeakPolarHBondContact O-CB 3.44Å; S424-A428 PolarHBondContact O-N 3.19Å; S425-A428 PolarHBondContact O-N 2.87Å; A428-N430 VanDerWaalsContact C-N 3.26Å; A428-N430 PolarHBondContact O-N 2.82Å; A428-S431 WeakPolarHBondContact O-CB 3.35Å; A428-S431 PolarHBondContact O-N 3.31Å; A428-S431 PolarHBondContact O-OG 2.89Å
429	L	95.3	Very high	91.9	Very high	52 Å²	52	50 Å²	50	27%	0.272	28%	0.276	S	S	.	.	H	α-helix	trans	-70.7	-20.8	-178.2	-63.7	178.7	0	0	0	113.3	A348 I352 S425 L427	A348-L429 HydrophobicContact CB-CD1 4.29Å; A348-L429 HydrophobicContact CB-CD2 3.76Å; A348-L429 HydrophobicContact CB-CG 4.43Å; I352-L429 HydrophobicContact CB-CD1 4.04Å; I352-L429 HydrophobicContact CD1-CD1 3.98Å; I352-L429 HydrophobicContact CG2-CD1 4.08Å; S425-L429 WeakPolarHBondContact O-CB 3.41Å; S425-L429 VanDerWaalsContact O-CG 3.23Å; S425-L429 WeakPolarHBondContact O-CG 3.44Å; S425-L429 PolarHBondContact O-N 3.06Å; L427-L429 PolarHBondContact O-N 3.49Å
430	N	96	Very high	91.6	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-108.8	5.5	-179.9	-66.3	-73.4	0	0	0	114.1	V426 L427 A428 K432 K433 A444 L449 I524	V426-N430 WeakPolarHBondContact O-CB 3.4Å; V426-N430 PolarHBondContact O-N 2.93Å; V426-N430 PolarHBondContact O-ND2 2.85Å; L427-N430 PolarHBondContact O-N 3.14Å; A428-N430 VanDerWaalsContact C-N 3.26Å; A428-N430 PolarHBondContact O-N 2.82Å; N430-K432 PolarHBondContact O-N 3.28Å; N430-K432 VanDerWaalsContact O-N 3.07Å; N430-K433 VanDerWaalsContact O-CB 3.24Å; N430-K433 WeakPolarHBondContact O-CB 3.43Å; N430-K433 PolarHBondContact O-N 3.17Å; N430-A444 VanDerWaalsContact OD1-CB 3.22Å; N430-A444 WeakPolarHBondContact OD1-CB 3.32Å; N430-A444 PolarHBondContact OD1-N 3.38Å; N430-L449 HydrophobicContact CB-CD2 4.39Å; N430-I524 HydrophobicContact CB-CG2 3.98Å; N430-I524 VanDerWaalsContact O-CG2 3.3Å; N430-I524 WeakPolarHBondContact O-CG2 3.42Å
431	S	93	Very high	91.4	Very high	60 Å²	60	56.8 Å²	56.8	42%	0.42	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-51.1	-34.4	-178.8	54.7	0	0	0	0	114.4	L427 A428 K433 S434	L427-S431 PolarHBondContact O-N 3.05Å; A428-S431 WeakPolarHBondContact O-CB 3.35Å; A428-S431 PolarHBondContact O-N 3.31Å; A428-S431 PolarHBondContact O-OG 2.89Å; S431-K433 PolarHBondContact O-N 3.13Å; S431-S434 PolarHBondContact O-OG 3.46Å
432	K	92.4	Very high	91.3	Very high	146 Å²	146	55.2 Å²	55.2	64%	0.635	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-69.7	-10.5	179.4	-67.1	-176.7	-178.7	175	0	114.2	N430 S434 S435 S438 L443	N430-K432 PolarHBondContact O-N 3.28Å; N430-K432 VanDerWaalsContact O-N 3.07Å; K432-S434 PolarHBondContact O-N 3.24Å; K432-S435 WeakPolarHBondContact O-CB 3.37Å; K432-S435 PolarHBondContact O-N 2.75Å; K432-S435 PolarHBondContact O-OG 2.85Å; K432-S438 WeakPolarHBondContact O-CB 3.43Å; K432-L443 HydrophobicContact CB-CD2 4.48Å
433	K	92.9	Very high	91.3	Very high	8 Å²	8	55.7 Å²	55.7	4%	0.035	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-65.6	-27	-176	-161.1	166.8	170	-70	0	113.5	N430 S431 S435 L443 D446 L449 I524	N430-K433 VanDerWaalsContact O-CB 3.24Å; N430-K433 WeakPolarHBondContact O-CB 3.43Å; N430-K433 PolarHBondContact O-N 3.17Å; S431-K433 PolarHBondContact O-N 3.13Å; K433-S435 VanDerWaalsContact C-N 3.28Å; K433-L443 HydrophobicContact CB-CD1 3.89Å; K433-L443 HydrophobicContact CG-CD1 4.08Å; K433-D446 WeakPolarHBondContact CE-OD1 3.07Å; K433-D446 IonicContact NZ-OD1 2.82Å; K433-D446 PolarHBondContact NZ-OD1 3.09Å; K433-L449 HydrophobicContact CD-CD1 3.43Å; K433-L449 VanDerWaalsContact CD-CD1 3.43Å; K433-I524 HydrophobicContact CB-CG2 3.89Å; K433-I524 HydrophobicContact CD-CG2 4.34Å; K433-I524 PolarHBondContact NZ-O 3.38Å; K433-I524 VanDerWaalsContact NZ-O 3.11Å
434	S	89.4	Confident	91.3	Very high	50 Å²	50	55.7 Å²	55.7	35%	0.35	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-79.3	-7.3	173.3	61.4	0	0	0	0	113.7	S431 K432 H523	S431-S434 PolarHBondContact O-OG 3.46Å; K432-S434 PolarHBondContact O-N 3.24Å; S434-H523 VanDerWaalsContact CB-NE2 3.3Å; S434-H523 WeakPolarHBondContact CB-NE2 3.39Å; S434-H523 PolarHBondContact OG-NE2 3.41Å
435	S	87.4	Confident	91.4	Very high	64 Å²	64	56.3 Å²	56.3	45%	0.448	32%	0.319	S	S	.	.	S	Bend	trans	-74.7	145.2	177.3	-58.7	0	0	0	0	112.1	K432 K433 M437 S438	K432-S435 WeakPolarHBondContact O-CB 3.37Å; K432-S435 PolarHBondContact O-N 2.75Å; K432-S435 PolarHBondContact O-OG 2.85Å; K433-S435 VanDerWaalsContact C-N 3.28Å; S435-M437 VanDerWaalsContact C-N 3.26Å; S435-M437 PolarHBondContact O-N 2.85Å; S435-S438 PolarHBondContact O-N 2.78Å
436	L	76.6	Confident	91.4	Very high	187 Å²	187	56.1 Å²	56.1	98%	0.979	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-32.8	-179.2	-92.6	142.7	0	0	0	115.1
437	M	78.8	Confident	91.4	Very high	189 Å²	189	56.1 Å²	56.1	93%	0.931	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123	55	-178.8	-68.6	-170	164.2	0	0	111.1	S435	S435-M437 VanDerWaalsContact C-N 3.26Å; S435-M437 PolarHBondContact O-N 2.85Å
438	S	84.4	Confident	91.5	Very high	37 Å²	37	55.6 Å²	55.6	26%	0.259	32%	0.315	S	S	.	.			trans	-76.4	135.7	177.1	60.2	0	0	0	0	111.8	K432 S435 L440	K432-S438 WeakPolarHBondContact O-CB 3.43Å; S435-S438 PolarHBondContact O-N 2.78Å; S438-L440 PolarHBondContact O-N 3.38Å
439	N	88.5	Confident	91.6	Very high	89 Å²	89	53.8 Å²	53.8	48%	0.476	30%	0.299	S	S	.	.			trans	-83.9	100.1	170.4	-176.3	12.5	0	0	0	109.2	A441 D442 L443	N439-A441 PolarHBondContact O-N 3.27Å; N439-A441 VanDerWaalsContact O-N 3.11Å; N439-A441 WeakPolarHBondContact OD1-CB 3.42Å; N439-A441 PolarHBondContact OD1-N 2.92Å; N439-D442 PolarHBondContact ND2-OD1 3.1Å; N439-D442 PolarHBondContact ND2-OD2 3.41Å; N439-D442 PolarHBondContact O-N 3.49Å; N439-D442 VanDerWaalsContact O-N 3.16Å; N439-L443 WeakPolarHBondContact O-CG 3.42Å
440	L	88.6	Confident	91.8	Very high	98 Å²	98	51.3 Å²	51.3	51%	0.513	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-62	-19.7	-178.9	-59.7	-179.8	0	0	0	113.3	S438 D442 L443	S438-L440 PolarHBondContact O-N 3.38Å; L440-D442 VanDerWaalsContact C-N 3.27Å; L440-D442 PolarHBondContact O-N 3.07Å; L440-L443 PolarHBondContact O-N 3.39Å
441	A	89.9	Confident	91.8	Very high	48 Å²	48	51.3 Å²	51.3	40%	0.397	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-69	-25.9	178.3	0	0	0	0	0	113.4	R350 N439	R350-A441 WeakPolarHBondContact CD-O 3.37Å; N439-A441 PolarHBondContact O-N 3.27Å; N439-A441 VanDerWaalsContact O-N 3.11Å; N439-A441 WeakPolarHBondContact OD1-CB 3.42Å; N439-A441 PolarHBondContact OD1-N 2.92Å
442	D	93	Very high	92.1	Very high	54 Å²	54	48.5 Å²	48.5	29%	0.289	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-92	-10	-177.2	-57.5	-22.7	0	0	0	112.5	A347 G349 R350 N439 L440	A347-D442 CarbonylContact C-O 3.6Å; A347-D442 VanDerWaalsContact C-O 3.26Å; A347-D442 WeakPolarHBondContact CA-O 3.45Å; A347-D442 HydrophobicContact CB-CB 4.33Å; G349-D442 PolarHBondContact N-O 3.13Å; R350-D442 PolarHBondContact N-O 3.38Å; N439-D442 PolarHBondContact ND2-OD1 3.1Å; N439-D442 PolarHBondContact ND2-OD2 3.41Å; N439-D442 PolarHBondContact O-N 3.49Å; N439-D442 VanDerWaalsContact O-N 3.16Å; L440-D442 VanDerWaalsContact C-N 3.27Å; L440-D442 PolarHBondContact O-N 3.07Å
443	L	96	Very high	92.4	Very high	14 Å²	14	41.6 Å²	41.6	7%	0.073	24%	0.237	C	C	.	.	S	Bend	trans	-108.6	161.5	-170.3	-59.2	173.6	0	0	0	111.1	K432 K433 N439 L440	K432-L443 HydrophobicContact CB-CD2 4.48Å; K433-L443 HydrophobicContact CB-CD1 3.89Å; K433-L443 HydrophobicContact CG-CD1 4.08Å; N439-L443 WeakPolarHBondContact O-CG 3.42Å; L440-L443 PolarHBondContact O-N 3.39Å
444	A	96.7	Very high	92.6	Very high	4 Å²	4	41.2 Å²	41.2	3%	0.033	24%	0.235	C	C	.	.			trans	-63.4	145.7	175.3	0	0	0	0	0	110.9	G349 A353 N430 F448 L449	G349-A444 VanDerWaalsContact C-N 3.29Å; G349-A444 WeakPolarHBondContact O-CA 3.49Å; G349-A444 VanDerWaalsContact O-CB 3.25Å; G349-A444 WeakPolarHBondContact O-CB 3.25Å; G349-A444 PolarHBondContact O-N 3.04Å; A353-A444 HydrophobicContact CB-CB 4.2Å; N430-A444 VanDerWaalsContact OD1-CB 3.22Å; N430-A444 WeakPolarHBondContact OD1-CB 3.32Å; N430-A444 PolarHBondContact OD1-N 3.38Å; A444-F448 HydrophobicContact CB-CD1 3.89Å; A444-F448 HydrophobicContact CB-CE1 4.44Å; A444-L449 HydrophobicContact CB-CD1 4.12Å; A444-L449 HydrophobicContact CB-CD2 3.94Å; A444-L449 HydrophobicContact CB-CG 3.86Å
445	P	96.6	Very high	93	Very high	22 Å²	22	38.9 Å²	38.9	14%	0.143	22%	0.219	C	C	.	.			trans	-61.8	147.5	174	26.8	-33.1	0	0	0	111	A353 T363 F365 E370 S447 F448 L449	A353-P445 HydrophobicContact CB-CG 4.48Å; T363-P445 HydrophobicContact CG2-CG 3.96Å; F365-P445 HydrophobicContact CD1-CB 4.13Å; F365-P445 HydrophobicContact CD1-CG 4.49Å; F365-P445 HydrophobicContact CE1-CB 3.64Å; F365-P445 HydrophobicContact CE1-CG 3.72Å; E370-P445 WeakPolarHBondContact OE1-CA 3.48Å; E370-P445 VanDerWaalsContact OE1-CB 3.29Å; E370-P445 WeakPolarHBondContact OE1-CB 3.4Å; P445-S447 PolarHBondContact O-N 2.92Å; P445-F448 HydrophobicContact CG-CB 3.82Å; P445-F448 PolarHBondContact O-N 3.47Å; P445-L449 PolarHBondContact O-N 3.04Å; P445-L449 VanDerWaalsContact O-N 3.16Å
446	D	97	Very high	93.5	Very high	7 Å²	7	36 Å²	36	4%	0.037	20%	0.198	C	C	.	.	H	α-helix	trans	-59.4	-38	178.1	-66.1	-58.3	0	0	0	111.5	F367 E370 K433 F448 L449 L450 L529 R532	F367-D446 HydrophobicContact CD2-CB 3.79Å; F367-D446 HydrophobicContact CE2-CB 3.48Å; F367-D446 VanDerWaalsContact CE2-CB 3.48Å; F367-D446 HydrophobicContact CZ-CB 4.44Å; E370-D446 WeakPolarHBondContact OE1-CB 3.4Å; E370-D446 PolarHBondContact OE1-N 3.04Å; K433-D446 WeakPolarHBondContact CE-OD1 3.07Å; K433-D446 IonicContact NZ-OD1 2.82Å; K433-D446 PolarHBondContact NZ-OD1 3.09Å; D446-F448 VanDerWaalsContact C-N 3.3Å; D446-F448 PolarHBondContact O-N 3.34Å; D446-L449 PolarHBondContact O-N 3.35Å; D446-L450 WeakPolarHBondContact O-CB 3.36Å; D446-L450 VanDerWaalsContact O-CG 3.28Å; D446-L450 WeakPolarHBondContact O-CG 3.41Å; D446-L450 PolarHBondContact O-N 2.9Å; D446-L529 HydrophobicContact CB-CD2 4.32Å; D446-R532 IonicContact OD2-CZ 3.32Å; D446-R532 IonicContact OD2-NH1 3.96Å; D446-R532 PolarHBondContact OD2-NH1 3.16Å; D446-R532 IonicContact OD2-NH2 2.71Å; D446-R532 PolarHBondContact OD2-NH2 3.2Å
447	S	96.3	Very high	94.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.8	-42.4	179	-61.5	0	0	0	0	112.5	V364 F365 C366 E370 P445 N451	V364-S447 VanDerWaalsContact O-CB 3.28Å; V364-S447 WeakPolarHBondContact O-CB 3.4Å; F365-S447 WeakPolarHBondContact CA-OG 3.43Å; C366-S447 PolarHBondContact N-OG 2.53Å; C366-S447 PolarHBondContact SG-OG 2.99Å; E370-S447 VanDerWaalsContact OE2-CB 3.28Å; E370-S447 WeakPolarHBondContact OE2-CB 3.3Å; E370-S447 PolarHBondContact OE2-OG 3.45Å; P445-S447 PolarHBondContact O-N 2.92Å; S447-N451 PolarHBondContact O-N 3.38Å; S447-N451 PolarHBondContact O-ND2 3.03Å
448	F	97.7	Very high	95.3	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.8	-51	174.9	170.9	-108.8	0	0	0	111.2	A353 M362 T363 F422 V426 A444 P445 D446 L450 N451 I452	A353-F448 HydrophobicContact CB-CB 4.39Å; A353-F448 HydrophobicContact CB-CD1 3.69Å; A353-F448 HydrophobicContact CB-CD2 4.38Å; A353-F448 HydrophobicContact CB-CE1 3.96Å; A353-F448 HydrophobicContact CB-CG 3.89Å; A353-F448 HydrophobicContact CB-CZ 4.44Å; M362-F448 HydrophobicContact CB-CD2 4.39Å; M362-F448 HydrophobicContact CB-CE2 4.3Å; T363-F448 HydrophobicContact CG2-CB 4.21Å; T363-F448 WeakPolarHBondContact OG1-CB 3.46Å; T363-F448 WeakPolarHBondContact OG1-CD2 3.41Å; F422-F448 HydrophobicContact CZ-CZ 4.15Å; V426-F448 HydrophobicContact CG1-CE1 3.94Å; V426-F448 HydrophobicContact CG2-CE1 4.12Å; V426-F448 HydrophobicContact CG2-CZ 4.08Å; A444-F448 HydrophobicContact CB-CD1 3.89Å; A444-F448 HydrophobicContact CB-CE1 4.44Å; P445-F448 HydrophobicContact CG-CB 3.82Å; P445-F448 PolarHBondContact O-N 3.47Å; D446-F448 VanDerWaalsContact C-N 3.3Å; D446-F448 PolarHBondContact O-N 3.34Å; F448-L450 VanDerWaalsContact C-N 3.31Å; F448-L450 PolarHBondContact O-N 3.23Å; F448-N451 WeakPolarHBondContact O-CB 3.45Å; F448-N451 PolarHBondContact O-N 3.44Å; F448-N451 VanDerWaalsContact O-N 3.09Å; F448-I452 HydrophobicContact CD2-CG1 4.18Å; F448-I452 HydrophobicContact CE1-CG1 4.13Å; F448-I452 HydrophobicContact CE2-CD1 3.8Å; F448-I452 HydrophobicContact CE2-CG1 3.68Å; F448-I452 HydrophobicContact CZ-CD1 4.07Å; F448-I452 HydrophobicContact CZ-CG1 3.68Å; F448-I452 WeakPolarHBondContact O-CG1 3.36Å; F448-I452 PolarHBondContact O-N 3.48Å
449	L	98.2	Very high	95.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.6	-37.6	-176.5	-67.8	175.1	0	0	0	112.5	V426 N430 K433 A444 P445 D446 I452 L453 L521 I524 A525	V426-L449 HydrophobicContact CG1-CD2 3.81Å; N430-L449 HydrophobicContact CB-CD2 4.39Å; K433-L449 HydrophobicContact CD-CD1 3.43Å; K433-L449 VanDerWaalsContact CD-CD1 3.43Å; A444-L449 HydrophobicContact CB-CD1 4.12Å; A444-L449 HydrophobicContact CB-CD2 3.94Å; A444-L449 HydrophobicContact CB-CG 3.86Å; P445-L449 PolarHBondContact O-N 3.04Å; P445-L449 VanDerWaalsContact O-N 3.16Å; D446-L449 PolarHBondContact O-N 3.35Å; L449-I452 PolarHBondContact O-N 2.92Å; L449-L453 VanDerWaalsContact O-CB 3.29Å; L449-L453 WeakPolarHBondContact O-CB 3.16Å; L449-L453 PolarHBondContact O-N 2.89Å; L449-L521 HydrophobicContact CD2-CD1 4.22Å; L449-I524 HydrophobicContact CD1-CG2 4.49Å; L449-A525 HydrophobicContact CB-CB 3.67Å
450	L	98	Very high	96.1	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.2	-37.9	174.6	-73.1	178.4	0	0	0	112.1	F367 D446 F448 L453 V454 L526 L529 V591	F367-L450 HydrophobicContact CE2-CD1 3.88Å; F367-L450 HydrophobicContact CZ-CD1 3.9Å; D446-L450 WeakPolarHBondContact O-CB 3.36Å; D446-L450 VanDerWaalsContact O-CG 3.28Å; D446-L450 WeakPolarHBondContact O-CG 3.41Å; D446-L450 PolarHBondContact O-N 2.9Å; F448-L450 VanDerWaalsContact C-N 3.31Å; F448-L450 PolarHBondContact O-N 3.23Å; L450-L453 HydrophobicContact CD2-CD2 4.42Å; L450-L453 PolarHBondContact O-N 3.39Å; L450-V454 WeakPolarHBondContact O-CG2 2.97Å; L450-V454 PolarHBondContact O-N 3.38Å; L450-L526 HydrophobicContact CD2-CB 4.43Å; L450-L526 HydrophobicContact CD2-CD1 4.17Å; L450-L529 HydrophobicContact CD1-CD1 3.77Å; L450-L529 HydrophobicContact CD2-CD1 3.91Å; L450-L529 HydrophobicContact CG-CD1 4.09Å; L450-V591 HydrophobicContact CD1-CG1 3.71Å
451	N	97.2	Very high	96.2	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-63.3	-47.8	175.2	-70.4	-15.3	0	0	0	110.6	M362 R399 S447 F448 L453 V454 V455	M362-N451 PolarHBondContact O-ND2 3.12Å; R399-N451 PolarHBondContact NE-OD1 3.44Å; S447-N451 PolarHBondContact O-N 3.38Å; S447-N451 PolarHBondContact O-ND2 3.03Å; F448-N451 WeakPolarHBondContact O-CB 3.45Å; F448-N451 PolarHBondContact O-N 3.44Å; F448-N451 VanDerWaalsContact O-N 3.09Å; N451-L453 VanDerWaalsContact C-N 3.31Å; N451-L453 PolarHBondContact O-N 3.29Å; N451-V454 PolarHBondContact O-N 2.99Å; N451-V455 WeakPolarHBondContact O-CG2 3.46Å; N451-V455 PolarHBondContact O-N 3.34Å; N451-V455 VanDerWaalsContact O-N 3.12Å
452	I	98	Very high	96.1	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-62.6	-39	175.7	-57.1	-57.5	0	0	0	111.4	M362 L406 L423 F448 L449 V454 V455 L456 L521	M362-I452 HydrophobicContact SD-CD1 3.74Å; L406-I452 HydrophobicContact CD1-CD1 4.3Å; L423-I452 HydrophobicContact CD2-CG2 3.66Å; F448-I452 HydrophobicContact CD2-CG1 4.18Å; F448-I452 HydrophobicContact CE1-CG1 4.13Å; F448-I452 HydrophobicContact CE2-CD1 3.8Å; F448-I452 HydrophobicContact CE2-CG1 3.68Å; F448-I452 HydrophobicContact CZ-CD1 4.07Å; F448-I452 HydrophobicContact CZ-CG1 3.68Å; F448-I452 WeakPolarHBondContact O-CG1 3.36Å; F448-I452 PolarHBondContact O-N 3.48Å; L449-I452 PolarHBondContact O-N 2.92Å; I452-V454 PolarHBondContact O-N 2.92Å; I452-V455 WeakPolarHBondContact O-CB 3.22Å; I452-V455 PolarHBondContact O-N 3.3Å; I452-L456 PolarHBondContact O-N 3.09Å; I452-L521 HydrophobicContact CB-CD2 3.98Å; I452-L521 HydrophobicContact CG2-CD2 3.52Å
453	L	98.4	Very high	96.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.8	-44.5	176.4	178.7	61.4	0	0	0	112.1	L449 L450 N451 V455 L456 F457 T518 L521 A522 A525 L526	L449-L453 VanDerWaalsContact O-CB 3.29Å; L449-L453 WeakPolarHBondContact O-CB 3.16Å; L449-L453 PolarHBondContact O-N 2.89Å; L450-L453 HydrophobicContact CD2-CD2 4.42Å; L450-L453 PolarHBondContact O-N 3.39Å; N451-L453 VanDerWaalsContact C-N 3.31Å; N451-L453 PolarHBondContact O-N 3.29Å; L453-V455 VanDerWaalsContact C-N 3.3Å; L453-V455 PolarHBondContact O-N 3.08Å; L453-L456 PolarHBondContact O-N 2.94Å; L453-L456 VanDerWaalsContact O-N 3.17Å; L453-F457 HydrophobicContact CD1-CD1 4.37Å; L453-F457 HydrophobicContact CD1-CD2 4.39Å; L453-F457 HydrophobicContact CD1-CE1 3.91Å; L453-F457 HydrophobicContact CD1-CE2 3.96Å; L453-F457 HydrophobicContact CD1-CZ 3.69Å; L453-F457 HydrophobicContact CD2-CE2 3.76Å; L453-F457 HydrophobicContact CD2-CZ 3.87Å; L453-F457 HydrophobicContact CG-CD2 3.99Å; L453-F457 HydrophobicContact CG-CE1 4.41Å; L453-F457 HydrophobicContact CG-CE2 3.53Å; L453-F457 HydrophobicContact CG-CZ 3.76Å; L453-F457 WeakPolarHBondContact O-CG 3.28Å; L453-F457 PolarHBondContact O-N 3.37Å; L453-T518 HydrophobicContact CD1-CG2 4.48Å; L453-L521 HydrophobicContact CB-CD2 4.09Å; L453-L521 HydrophobicContact CB-CG 4.22Å; L453-L521 HydrophobicContact CD1-CB 4.13Å; L453-L521 HydrophobicContact CD1-CD2 4.48Å; L453-L521 HydrophobicContact CD1-CG 4.2Å; L453-A522 HydrophobicContact CD1-CB 3.93Å; L453-A522 HydrophobicContact CD2-CB 4.46Å; L453-A525 HydrophobicContact CB-CB 4.35Å; L453-A525 HydrophobicContact CD2-CB 4.18Å; L453-L526 HydrophobicContact CD2-CB 3.63Å; L453-L526 HydrophobicContact CD2-CD2 4.37Å
454	V	97.7	Very high	96	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63	-38.8	176.6	170.3	0	0	0	0	111.2	R399 L450 N451 I452 L456 F457 N458 L597 L600	R399-V454 HydrophobicContact CB-CB 4.41Å; R399-V454 HydrophobicContact CB-CG1 3.85Å; R399-V454 HydrophobicContact CG-CB 4.16Å; R399-V454 HydrophobicContact CG-CG1 4.1Å; R399-V454 HydrophobicContact CG-CG2 4.47Å; L450-V454 WeakPolarHBondContact O-CG2 2.97Å; L450-V454 PolarHBondContact O-N 3.38Å; N451-V454 PolarHBondContact O-N 2.99Å; I452-V454 PolarHBondContact O-N 2.92Å; V454-L456 PolarHBondContact O-N 3.28Å; V454-F457 PolarHBondContact O-N 3.08Å; V454-N458 WeakPolarHBondContact O-CB 3.38Å; V454-N458 PolarHBondContact O-N 3.48Å; V454-N458 PolarHBondContact O-ND2 2.8Å; V454-L597 HydrophobicContact CG2-CD1 3.77Å; V454-L600 HydrophobicContact CG1-CD1 3.85Å
455	V	97.1	Very high	95.7	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-59.5	-47.7	172.8	178.5	0	0	0	0	110.9	L406 N451 I452 L453 F457 N458 L459	L406-V455 HydrophobicContact CB-CG1 4.04Å; L406-V455 HydrophobicContact CD1-CB 4.16Å; L406-V455 HydrophobicContact CD1-CG1 3.66Å; L406-V455 HydrophobicContact CD1-CG2 4.21Å; L406-V455 HydrophobicContact CG-CG1 4.43Å; N451-V455 WeakPolarHBondContact O-CG2 3.46Å; N451-V455 PolarHBondContact O-N 3.34Å; N451-V455 VanDerWaalsContact O-N 3.12Å; I452-V455 WeakPolarHBondContact O-CB 3.22Å; I452-V455 PolarHBondContact O-N 3.3Å; L453-V455 VanDerWaalsContact C-N 3.3Å; L453-V455 PolarHBondContact O-N 3.08Å; V455-F457 PolarHBondContact O-N 3.38Å; V455-N458 WeakPolarHBondContact O-CB 3.39Å; V455-N458 PolarHBondContact O-N 2.98Å; V455-L459 HydrophobicContact CG1-CD1 3.99Å; V455-L459 HydrophobicContact CG1-CG 4.23Å; V455-L459 WeakPolarHBondContact O-CG 3.44Å; V455-L459 PolarHBondContact O-N 2.96Å
456	L	97.8	Very high	95.5	Very high	3 Å²	3	28.5 Å²	28.5	2%	0.016	14%	0.14	C	C	.	.	H	α-helix	trans	-64.1	-37.1	178.6	-74.8	-167.5	0	0	0	112.9	L423 I452 L453 V454 L459 S460 M517 T518 L521	L423-L456 HydrophobicContact CD1-CD2 4.2Å; I452-L456 PolarHBondContact O-N 3.09Å; L453-L456 PolarHBondContact O-N 2.94Å; L453-L456 VanDerWaalsContact O-N 3.17Å; V454-L456 PolarHBondContact O-N 3.28Å; L456-L459 HydrophobicContact CD2-CD1 4.35Å; L456-L459 PolarHBondContact O-N 3.24Å; L456-S460 VanDerWaalsContact O-CB 3.25Å; L456-S460 WeakPolarHBondContact O-CB 3.49Å; L456-S460 PolarHBondContact O-N 3.26Å; L456-S460 PolarHBondContact O-OG 3.45Å; L456-M517 HydrophobicContact CD1-CB 4.23Å; L456-T518 HydrophobicContact CB-CG2 4.04Å; L456-T518 WeakPolarHBondContact CB-OG1 3.23Å; L456-T518 PolarHBondContact O-OG1 2.82Å; L456-L521 HydrophobicContact CD1-CB 3.96Å; L456-L521 HydrophobicContact CD1-CD2 3.55Å; L456-L521 HydrophobicContact CD1-CG 4.41Å; L456-L521 HydrophobicContact CG-CD2 4.24Å
457	F	97.9	Very high	95.3	Very high	5 Å²	5	32.5 Å²	32.5	2%	0.022	16%	0.158	C	C	.	.	H	α-helix	trans	-59.4	-49.1	170.3	-73.1	-35.5	0	0	0	111.2	L453 V454 V455 L459 S460 L461 T518 A522 L597 L600 A601 F604	L453-F457 HydrophobicContact CD1-CD1 4.37Å; L453-F457 HydrophobicContact CD1-CD2 4.39Å; L453-F457 HydrophobicContact CD1-CE1 3.91Å; L453-F457 HydrophobicContact CD1-CE2 3.96Å; L453-F457 HydrophobicContact CD1-CZ 3.69Å; L453-F457 HydrophobicContact CD2-CE2 3.76Å; L453-F457 HydrophobicContact CD2-CZ 3.87Å; L453-F457 HydrophobicContact CG-CD2 3.99Å; L453-F457 HydrophobicContact CG-CE1 4.41Å; L453-F457 HydrophobicContact CG-CE2 3.53Å; L453-F457 HydrophobicContact CG-CZ 3.76Å; L453-F457 WeakPolarHBondContact O-CG 3.28Å; L453-F457 PolarHBondContact O-N 3.37Å; V454-F457 PolarHBondContact O-N 3.08Å; V455-F457 PolarHBondContact O-N 3.38Å; F457-L459 PolarHBondContact O-N 3.28Å; F457-S460 CarbonylContact O-C 3.52Å; F457-S460 WeakPolarHBondContact O-CA 3.46Å; F457-S460 WeakPolarHBondContact O-CB 3.43Å; F457-S460 PolarHBondContact O-N 3.37Å; F457-L461 PolarHBondContact O-N 2.89Å; F457-T518 HydrophobicContact CD1-CG2 3.45Å; F457-T518 VanDerWaalsContact CD1-CG2 3.45Å; F457-T518 HydrophobicContact CE1-CG2 3.77Å; F457-T518 HydrophobicContact CG-CG2 4.43Å; F457-A522 HydrophobicContact CZ-CB 4.39Å; F457-L597 HydrophobicContact CE2-CD1 4.36Å; F457-L600 HydrophobicContact CB-CB 3.96Å; F457-L600 HydrophobicContact CB-CD1 4.24Å; F457-L600 HydrophobicContact CB-CD2 4.28Å; F457-L600 HydrophobicContact CB-CG 4.4Å; F457-L600 HydrophobicContact CD2-CB 3.7Å; F457-L600 HydrophobicContact CE2-CB 4.43Å; F457-L600 HydrophobicContact CG-CB 4.02Å; F457-A601 HydrophobicContact CE2-CB 4.08Å; F457-A601 HydrophobicContact CZ-CB 4.03Å; F457-F604 HydrophobicContact CD1-CB 3.64Å; F457-F604 HydrophobicContact CD1-CD1 4.15Å; F457-F604 HydrophobicContact CD1-CD2 4.12Å; F457-F604 AromaticContact CD1-CG 3.69Å; F457-F604 HydrophobicContact CD1-CG 3.69Å; F457-F604 HydrophobicContact CE1-CB 3.67Å; F457-F604 AromaticContact CE1-CD1 3.71Å; F457-F604 HydrophobicContact CE1-CD1 3.71Å; F457-F604 AromaticContact CE1-CG 3.69Å; F457-F604 HydrophobicContact CE1-CG 3.69Å
458	N	96.2	Very high	95.2	Very high	36 Å²	36	32.8 Å²	32.8	19%	0.193	16%	0.16	C	C	.	.	H	α-helix	trans	-60.9	-43	179.4	-76.6	-27	0	0	0	112.5	T403 V454 V455 S460 L461	T403-N458 HydrophobicContact CG2-CB 3.76Å; T403-N458 PolarHBondContact OG1-ND2 3.04Å; T403-N458 VanDerWaalsContact OG1-ND2 3.09Å; V454-N458 WeakPolarHBondContact O-CB 3.38Å; V454-N458 PolarHBondContact O-N 3.48Å; V454-N458 PolarHBondContact O-ND2 2.8Å; V455-N458 WeakPolarHBondContact O-CB 3.39Å; V455-N458 PolarHBondContact O-N 2.98Å; N458-S460 PolarHBondContact O-N 3.14Å; N458-L461 WeakPolarHBondContact O-CB 3.49Å; N458-L461 PolarHBondContact O-N 3.29Å
459	L	94.5	Very high	95	Very high	31 Å²	31	34.6 Å²	34.6	16%	0.162	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-33.2	174.5	-67.3	177.1	0	0	0	111.8	V455 L456 F457	V455-L459 HydrophobicContact CG1-CD1 3.99Å; V455-L459 HydrophobicContact CG1-CG 4.23Å; V455-L459 WeakPolarHBondContact O-CG 3.44Å; V455-L459 PolarHBondContact O-N 2.96Å; L456-L459 HydrophobicContact CD2-CD1 4.35Å; L456-L459 PolarHBondContact O-N 3.24Å; F457-L459 PolarHBondContact O-N 3.28Å
460	S	95.1	Very high	94.8	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.007	18%	0.177	C	C	.	.	H	α-helix	trans	-79.6	-13.9	179	-65.9	0	0	0	0	114.9	L456 F457 N458 K462 I463 C514 T518 K607	L456-S460 VanDerWaalsContact O-CB 3.25Å; L456-S460 WeakPolarHBondContact O-CB 3.49Å; L456-S460 PolarHBondContact O-N 3.26Å; L456-S460 PolarHBondContact O-OG 3.45Å; F457-S460 CarbonylContact O-C 3.52Å; F457-S460 WeakPolarHBondContact O-CA 3.46Å; F457-S460 WeakPolarHBondContact O-CB 3.43Å; F457-S460 PolarHBondContact O-N 3.37Å; N458-S460 PolarHBondContact O-N 3.14Å; S460-K462 VanDerWaalsContact C-N 3.29Å; S460-K462 PolarHBondContact O-N 3.29Å; S460-I463 PolarHBondContact O-N 3.47Å; S460-C514 PolarHBondContact OG-SG 3.01Å; S460-T518 PolarHBondContact OG-OG1 3.17Å; S460-K607 PolarHBondContact O-NZ 3.25Å; S460-K607 VanDerWaalsContact O-NZ 3.11Å
461	L	90.9	Very high	94.6	Very high	70 Å²	70	38.4 Å²	38.4	37%	0.366	19%	0.19	S	C	.	.	H	α-helix	trans	-56	-43.2	179.9	-72.9	176.8	0	0	0	112.3	F457 N458 L600 Y603 K607	F457-L461 PolarHBondContact O-N 2.89Å; N458-L461 WeakPolarHBondContact O-CB 3.49Å; N458-L461 PolarHBondContact O-N 3.29Å; L461-L600 HydrophobicContact CD1-CD2 4.15Å; L461-L600 HydrophobicContact CD2-CD2 3.93Å; L461-L600 HydrophobicContact CG-CD2 4.31Å; L461-Y603 HydrophobicContact CD2-CD1 3.64Å; L461-Y603 HydrophobicContact CD2-CE1 3.66Å; L461-K607 PolarHBondContact O-NZ 3.16Å
462	K	87.5	Confident	94.5	Very high	178 Å²	178	38.4 Å²	38.4	77%	0.774	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-3	-176.8	-64	-173.6	179.6	-178.8	0	114.4	S460 M464	S460-K462 VanDerWaalsContact C-N 3.29Å; S460-K462 PolarHBondContact O-N 3.29Å; K462-M464 PolarHBondContact O-N 2.93Å
463	I	93	Very high	94.3	Very high	14 Å²	14	38.7 Å²	38.7	7%	0.072	19%	0.192	C	C	.	.			trans	-70.1	121.1	178.1	-65	175.7	0	0	0	109	S460 V468 P511 C514 F515 K607	S460-I463 PolarHBondContact O-N 3.47Å; I463-V468 HydrophobicContact CG2-CG2 3.47Å; I463-V468 VanDerWaalsContact CG2-CG2 3.47Å; I463-P511 HydrophobicContact CG2-CB 3.99Å; I463-C514 HydrophobicContact CD1-CB 3.79Å; I463-F515 HydrophobicContact CD1-CB 4.42Å; I463-K607 PolarHBondContact O-NZ 3.45Å
464	M	93.3	Very high	94.1	Very high	113 Å²	113	39.1 Å²	39.1	56%	0.557	19%	0.194	S	C	*	.			trans	-82.8	132.1	170	-56.1	-176.3	-65.9	0	0	109.3	K462 D466 K467	K462-M464 PolarHBondContact O-N 2.93Å; M464-D466 WeakPolarHBondContact CB-OD1 3.38Å; M464-D466 PolarHBondContact O-N 3.41Å; M464-K467 HydrophobicContact CB-CG 4.38Å; M464-K467 HydrophobicContact CE-CG 4.09Å; M464-K467 WeakPolarHBondContact O-CB 3.39Å; M464-K467 PolarHBondContact O-N 3.35Å
465	L	92.3	Very high	93.7	Very high	44 Å²	44	39.8 Å²	39.8	23%	0.23	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-66.7	-19.9	-171.9	-59.2	-175.7	0	0	0	113.9	K467 V468 F515 K607 D610 V611	L465-K467 PolarHBondContact O-N 2.99Å; L465-V468 PolarHBondContact O-N 2.94Å; L465-F515 HydrophobicContact CD2-CE2 4.21Å; L465-K607 HydrophobicContact CD2-CB 4Å; L465-K607 HydrophobicContact CD2-CD 4.11Å; L465-K607 HydrophobicContact CD2-CG 4.11Å; L465-D610 HydrophobicContact CD1-CB 3.55Å; L465-V611 HydrophobicContact CD2-CG2 3.98Å
466	D	91.3	Very high	93.3	Very high	93 Å²	93	44.8 Å²	44.8	50%	0.497	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-70.4	-19	172.5	69.6	-60.2	0	0	0	112.9	M464	M464-D466 WeakPolarHBondContact CB-OD1 3.38Å; M464-D466 PolarHBondContact O-N 3.41Å
467	K	93.4	Very high	92.9	Very high	91 Å²	91	47 Å²	47	40%	0.396	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-91.2	-8.6	176.2	-56	-54.6	-176.5	-133.6	0	113.4	M464 L465 P511	M464-K467 HydrophobicContact CB-CG 4.38Å; M464-K467 HydrophobicContact CE-CG 4.09Å; M464-K467 WeakPolarHBondContact O-CB 3.39Å; M464-K467 PolarHBondContact O-N 3.35Å; L465-K467 PolarHBondContact O-N 2.99Å; K467-P511 HydrophobicContact CB-CB 3.97Å; K467-P511 HydrophobicContact CB-CG 4.14Å
468	V	94.6	Very high	92.7	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.042	25%	0.254	C	S	.	.			trans	-85.8	114.2	174.8	-178.9	0	0	0	0	107.9	I463 L465 P470 F515 F516 V611	I463-V468 HydrophobicContact CG2-CG2 3.47Å; I463-V468 VanDerWaalsContact CG2-CG2 3.47Å; L465-V468 PolarHBondContact O-N 2.94Å; V468-P470 WeakPolarHBondContact O-CD 3.49Å; V468-F515 HydrophobicContact CG1-CB 4.26Å; V468-F515 HydrophobicContact CG1-CD1 3.69Å; V468-F515 HydrophobicContact CG1-CE1 4.14Å; V468-F515 HydrophobicContact CG1-CG 3.98Å; V468-F515 HydrophobicContact CG2-CB 4.13Å; V468-F515 HydrophobicContact CG2-CD2 4.21Å; V468-F515 HydrophobicContact CG2-CG 4.07Å; V468-F516 HydrophobicContact CG1-CE2 3.85Å; V468-F516 HydrophobicContact CG1-CZ 4.4Å; V468-V611 HydrophobicContact CG1-CG1 4.43Å; V468-V611 HydrophobicContact CG1-CG2 4.31Å
469	D	93.5	Very high	92.6	Very high	38 Å²	38	48 Å²	48	20%	0.203	25%	0.252	C	S	.	.			trans	-85.4	111.6	172.4	178.2	11.1	0	0	0	109.6	L471 Y472 S512 F516	D469-L471 PolarHBondContact O-N 3.22Å; D469-L471 WeakPolarHBondContact OD1-CB 3.3Å; D469-L471 PolarHBondContact OD1-N 2.78Å; D469-Y472 WeakPolarHBondContact O-CB 3.5Å; D469-Y472 PolarHBondContact O-N 3.36Å; D469-S512 PolarHBondContact N-OG 3.39Å; D469-F516 WeakPolarHBondContact O-CE2 3.29Å
470	P	93.8	Very high	92.6	Very high	25 Å²	25	46.9 Å²	46.9	16%	0.162	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-16.1	-178.8	-9.4	25.1	0	0	0	113.6	V468 Y472 V611 L632 F636	V468-P470 WeakPolarHBondContact O-CD 3.49Å; P470-Y472 VanDerWaalsContact C-N 3.29Å; P470-V611 HydrophobicContact CB-CG1 4.3Å; P470-V611 HydrophobicContact CG-CG1 4.33Å; P470-L632 HydrophobicContact CB-CD2 4.2Å; P470-F636 HydrophobicContact CB-CZ 3.8Å
471	L	93.8	Very high	92.3	Very high	54 Å²	54	52.6 Å²	52.6	28%	0.283	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-15.6	175.8	-71.8	167.6	0	0	0	112.9	D469 V473 F474 F498 V502 L632	D469-L471 PolarHBondContact O-N 3.22Å; D469-L471 WeakPolarHBondContact OD1-CB 3.3Å; D469-L471 PolarHBondContact OD1-N 2.78Å; L471-V473 VanDerWaalsContact C-N 3.27Å; L471-V473 PolarHBondContact O-N 3.4Å; L471-F474 PolarHBondContact O-N 2.86Å; L471-F474 VanDerWaalsContact O-N 3.09Å; L471-F498 HydrophobicContact CD2-CE1 4.43Å; L471-F498 HydrophobicContact CD2-CZ 4.02Å; L471-V502 HydrophobicContact CB-CG1 3.82Å; L471-V502 HydrophobicContact CD2-CG1 3.88Å; L471-V502 HydrophobicContact CD2-CG2 3.82Å; L471-V502 HydrophobicContact CG-CG1 4.29Å; L471-L632 HydrophobicContact CD2-CD1 3.8Å; L471-L632 HydrophobicContact CG-CD1 4.43Å
472	Y	94.2	Very high	92.3	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.008	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-49.9	-43.7	-177.5	166	-106.6	0	0	0	113.3	D469 P470 F474 Q475 R479 P508 E513 F516	D469-Y472 WeakPolarHBondContact O-CB 3.5Å; D469-Y472 PolarHBondContact O-N 3.36Å; P470-Y472 VanDerWaalsContact C-N 3.29Å; Y472-F474 PolarHBondContact O-N 3.26Å; Y472-F474 VanDerWaalsContact O-N 3.11Å; Y472-Q475 WeakPolarHBondContact O-CB 3.22Å; Y472-Q475 PolarHBondContact O-N 3.25Å; Y472-R479 PolarHBondContact OH-N 3.44Å; Y472-P508 HydrophobicContact CD2-CB 4.23Å; Y472-P508 HydrophobicContact CE2-CB 3.79Å; Y472-E513 HydrophobicContact CE2-CG 3.85Å; Y472-E513 WeakPolarHBondContact OH-CG 3.44Å; Y472-F516 HydrophobicContact CD1-CB 4.24Å; Y472-F516 AromaticContact CD1-CD2 3.65Å; Y472-F516 HydrophobicContact CD1-CD2 3.65Å; Y472-F516 HydrophobicContact CD1-CE2 4.43Å; Y472-F516 HydrophobicContact CD1-CG 4.28Å; Y472-F516 HydrophobicContact CE1-CB 4.23Å; Y472-F516 HydrophobicContact CE1-CD2 4.42Å
473	V	94.3	Very high	92.2	Very high	6 Å²	6	49.7 Å²	49.7	4%	0.036	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-68.4	-12.1	-174.4	-61.2	0	0	0	0	114.5	L471 V480 L482 F516 F636	L471-V473 VanDerWaalsContact C-N 3.27Å; L471-V473 PolarHBondContact O-N 3.4Å; V473-V480 HydrophobicContact CB-CG2 4.19Å; V473-V480 HydrophobicContact CG1-CG2 3.79Å; V473-L482 HydrophobicContact CB-CD1 4.02Å; V473-L482 HydrophobicContact CG2-CD1 3.92Å; V473-L482 WeakPolarHBondContact O-CD1 3.36Å; V473-F516 HydrophobicContact CG1-CB 3.71Å; V473-F516 HydrophobicContact CG1-CD1 3.33Å; V473-F516 HydrophobicContact CG1-CD2 3.58Å; V473-F516 HydrophobicContact CG1-CE1 3.73Å; V473-F516 HydrophobicContact CG1-CE2 3.94Å; V473-F516 HydrophobicContact CG1-CG 3.23Å; V473-F516 HydrophobicContact CG1-CZ 4.01Å; V473-F636 HydrophobicContact CG2-CE1 4.25Å
474	F	93.2	Very high	92	Very high	10 Å²	10	53.1 Å²	53.1	4%	0.044	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-100	-3.5	176.8	-54.9	-74.5	0	0	0	112.8	L471 Y472 L482 F498 V502 L632 A635 F636	L471-F474 PolarHBondContact O-N 2.86Å; L471-F474 VanDerWaalsContact O-N 3.09Å; Y472-F474 PolarHBondContact O-N 3.26Å; Y472-F474 VanDerWaalsContact O-N 3.11Å; F474-L482 HydrophobicContact CD1-CD1 3.8Å; F474-L482 HydrophobicContact CE1-CD1 3.64Å; F474-L482 HydrophobicContact CZ-CD1 4.34Å; F474-F498 HydrophobicContact CD1-CD1 4.11Å; F474-F498 HydrophobicContact CD1-CE1 4.23Å; F474-F498 HydrophobicContact CD2-CD1 4.45Å; F474-F498 AromaticContact CD2-CE1 3.78Å; F474-F498 HydrophobicContact CD2-CE1 3.78Å; F474-F498 HydrophobicContact CE1-CD1 4.33Å; F474-F498 HydrophobicContact CE1-CE1 4.34Å; F474-F498 AromaticContact CE2-CE1 3.91Å; F474-F498 HydrophobicContact CE2-CE1 3.91Å; F474-F498 HydrophobicContact CG-CD1 4.16Å; F474-F498 AromaticContact CG-CE1 3.94Å; F474-F498 HydrophobicContact CG-CE1 3.94Å; F474-F498 HydrophobicContact CZ-CE1 4.18Å; F474-V502 HydrophobicContact CB-CG1 4.43Å; F474-L632 HydrophobicContact CD2-CD1 4.3Å; F474-L632 HydrophobicContact CE2-CD1 3.66Å; F474-A635 HydrophobicContact CE1-CB 3.72Å; F474-A635 WeakPolarHBondContact CE1-O 3.26Å; F474-A635 HydrophobicContact CZ-CB 3.61Å; F474-F636 AromaticContact CE2-CD1 3.88Å; F474-F636 HydrophobicContact CE2-CD1 3.88Å; F474-F636 AromaticContact CE2-CE1 3.74Å; F474-F636 HydrophobicContact CE2-CE1 3.74Å; F474-F636 AromaticContact CZ-CD1 3.7Å; F474-F636 HydrophobicContact CZ-CD1 3.7Å; F474-F636 HydrophobicContact CZ-CE1 4.07Å
475	Q	91.1	Very high	91.8	Very high	13 Å²	13	50.1 Å²	50.1	6%	0.061	29%	0.285	C	S	.	.	S	Bend	trans	-83.6	150.8	178.2	-62.3	172.8	-0.5	0	0	110.8	Y472 S477 S478 V502 M506	Y472-Q475 WeakPolarHBondContact O-CB 3.22Å; Y472-Q475 PolarHBondContact O-N 3.25Å; Q475-S477 PolarHBondContact O-N 3.32Å; Q475-S478 WeakPolarHBondContact O-CB 3.3Å; Q475-S478 PolarHBondContact O-N 2.95Å; Q475-V502 HydrophobicContact CG-CG1 4.24Å; Q475-M506 PolarHBondContact OE1-O 2.86Å
476	S	87.8	Confident	91.9	Very high	107 Å²	107	50.9 Å²	50.9	75%	0.748	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.8	175.7	54.4	0	0	0	0	113.8	S478	S476-S478 VanDerWaalsContact C-N 3.28Å
477	S	89.5	Confident	92	Very high	49 Å²	49	47.9 Å²	47.9	34%	0.343	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	0	174.7	56.9	0	0	0	0	113.9	Q475 R479	Q475-S477 PolarHBondContact O-N 3.32Å; S477-R479 PolarHBondContact O-N 3.44Å
478	S	93.5	Very high	92.1	Very high	22 Å²	22	43.6 Å²	43.6	15%	0.154	26%	0.261	C	S	.	.			trans	-62.3	133.2	177.2	177.2	0	0	0	0	111.3	Q475 S476 V480	Q475-S478 WeakPolarHBondContact O-CB 3.3Å; Q475-S478 PolarHBondContact O-N 2.95Å; S476-S478 VanDerWaalsContact C-N 3.28Å; S478-V480 WeakPolarHBondContact OG-CG2 3.32Å; S478-V480 PolarHBondContact OG-N 2.87Å; S478-V480 VanDerWaalsContact OG-N 3.14Å; S478-V480 PolarHBondContact OG-O 3.22Å
479	R	94.1	Very high	92.1	Very high	40 Å²	40	45.5 Å²	45.5	15%	0.151	27%	0.271	C	S	.	.	S	Bend	trans	-81.5	-5.9	172.5	-66.9	-170.2	-165.2	-92.8	-2.5	113	E417 Y472 S477 E513 M517	E417-R479 IonicContact OE1-CZ 2.85Å; E417-R479 IonicContact OE1-NH1 2.75Å; E417-R479 PolarHBondContact OE1-NH1 3.42Å; E417-R479 IonicContact OE1-NH2 2.62Å; E417-R479 PolarHBondContact OE1-NH2 3.07Å; E417-R479 IonicContact OE2-CZ 2.77Å; E417-R479 IonicContact OE2-NH2 3.78Å; E417-R479 PolarHBondContact OE2-NH2 2.62Å; Y472-R479 PolarHBondContact OH-N 3.44Å; S477-R479 PolarHBondContact O-N 3.44Å; R479-E513 IonicContact CZ-OE1 3.94Å; R479-E513 IonicContact NE-OE1 2.78Å; R479-E513 PolarHBondContact NE-OE1 3.39Å; R479-E513 IonicContact NH2-OE1 3.66Å; R479-E513 PolarHBondContact NH2-OE1 3.48Å; R479-M517 HydrophobicContact CB-CG 4.33Å; R479-M517 HydrophobicContact CB-SD 4.14Å
480	V	94.9	Very high	92.2	Very high	8 Å²	8	44.7 Å²	44.7	5%	0.048	27%	0.266	C	S	.	.	S	Bend	trans	-111.3	146	175.7	-59.7	0	0	0	0	110.4	L427 V473 S478 F516 M517 H520	L427-V480 HydrophobicContact CD1-CG1 4.37Å; V473-V480 HydrophobicContact CB-CG2 4.19Å; V473-V480 HydrophobicContact CG1-CG2 3.79Å; S478-V480 WeakPolarHBondContact OG-CG2 3.32Å; S478-V480 PolarHBondContact OG-N 2.87Å; S478-V480 VanDerWaalsContact OG-N 3.14Å; S478-V480 PolarHBondContact OG-O 3.22Å; V480-F516 HydrophobicContact CG2-CB 4.33Å; V480-M517 HydrophobicContact CG1-CG 4.15Å; V480-H520 HydrophobicContact CG1-CB 4.06Å
481	Q	89.6	Confident	92.1	Very high	121 Å²	121	47 Å²	47	57%	0.565	28%	0.28	S	S	*	.			trans	-109.3	130.2	-175.6	-61.6	178.6	16.3	0	0	110.4	I485	Q481-I485 WeakPolarHBondContact O-CD1 3.35Å
482	L	90.6	Very high	92	Very high	19 Å²	19	48.2 Å²	48.2	10%	0.099	29%	0.293	C	S	.	.			trans	-105.9	10.8	178.9	-55.5	-171	0	0	0	113.3	V473 F474 P637	V473-L482 HydrophobicContact CB-CD1 4.02Å; V473-L482 HydrophobicContact CG2-CD1 3.92Å; V473-L482 WeakPolarHBondContact O-CD1 3.36Å; F474-L482 HydrophobicContact CD1-CD1 3.8Å; F474-L482 HydrophobicContact CE1-CD1 3.64Å; F474-L482 HydrophobicContact CZ-CD1 4.34Å; L482-P637 HydrophobicContact CD1-CG 4.5Å; L482-P637 HydrophobicContact CD2-CG 3.74Å
483	Q	85.5	Confident	91.9	Very high	168 Å²	168	55.5 Å²	55.5	79%	0.785	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	133.5	-176	-64.8	-178.1	11.3	0	0	111	I485	Q483-I485 PolarHBondContact O-N 2.75Å
484	G	86.9	Confident	91.8	Very high	85 Å²	85	59 Å²	59	88%	0.876	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	4	177.8	0	0	0	0	0	115.5
485	I	90.7	Very high	91.7	Very high	51 Å²	51	58.6 Å²	58.6	26%	0.262	34%	0.344	S	S	.	.			trans	-90.3	139.2	-178.3	-52.3	-176	0	0	0	110.7	Q481 Q483 P637 F639	Q481-I485 WeakPolarHBondContact O-CD1 3.35Å; Q483-I485 PolarHBondContact O-N 2.75Å; I485-P637 HydrophobicContact CG2-CB 3.92Å; I485-F639 HydrophobicContact CD1-CE1 4.06Å; I485-F639 HydrophobicContact CG2-CD1 3.94Å; I485-F639 HydrophobicContact CG2-CE1 3.98Å
486	A	92.8	Very high	91.7	Very high	59 Å²	59	60.3 Å²	60.3	49%	0.488	36%	0.361	S	S	.	.			trans	-65.9	140.3	173.3	0	0	0	0	0	111.4	P637 E638	A486-P637 WeakPolarHBondContact O-CA 3.29Å; A486-E638 HydrophobicContact CB-CG 4.36Å; A486-E638 PolarHBondContact O-N 3.25Å
487	R	95.4	Very high	92	Very high	31 Å²	31	60.6 Å²	60.6	12%	0.117	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-119.9	151.2	-173	-60.4	179.9	-176.8	90.9	-5	111	N489 S492 A635 F636	R487-N489 VanDerWaalsContact C-N 3.35Å; R487-N489 PolarHBondContact O-N 2.79Å; R487-S492 VanDerWaalsContact NH1-CA 3.32Å; R487-S492 PolarHBondContact NH1-OG 3.33Å; R487-A635 WeakPolarHBondContact CD-O 3.38Å; R487-F636 CarbonylContact C-O 3.52Å; R487-F636 WeakPolarHBondContact CA-O 3.37Å; R487-F636 WeakPolarHBondContact CB-O 3.47Å
488	M	95.3	Very high	92.1	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.341	C	S	.	.	S	Bend	trans	-44.8	-55.7	-176.7	-67.2	-61.2	179	0	0	113	F633 F636 P637 I641 F681 N682 L686	M488-F633 HydrophobicContact CB-CD1 4.37Å; M488-F633 HydrophobicContact CB-CE1 4.08Å; M488-F633 WeakPolarHBondContact CB-O 3.28Å; M488-F633 HydrophobicContact CG-CE1 4.2Å; M488-F633 HydrophobicContact CG-CZ 4.25Å; M488-F633 WeakPolarHBondContact CG-O 3.38Å; M488-F633 HydrophobicContact SD-CZ 4.38Å; M488-F636 HydrophobicContact CG-CB 4.25Å; M488-F636 WeakPolarHBondContact CG-O 3.33Å; M488-F636 PolarHBondContact N-O 2.84Å; M488-P637 WeakPolarHBondContact CE-O 3.21Å; M488-I641 HydrophobicContact CE-CB 3.77Å; M488-I641 HydrophobicContact CE-CD1 3.44Å; M488-I641 VanDerWaalsContact CE-CD1 3.44Å; M488-I641 HydrophobicContact CE-CG1 3.44Å; M488-I641 VanDerWaalsContact CE-CG1 3.44Å; M488-I641 HydrophobicContact SD-CD1 4.11Å; M488-F681 WeakPolarHBondContact O-CA 3.34Å; M488-F681 HydrophobicContact SD-CD1 3.8Å; M488-F681 HydrophobicContact SD-CE1 3.69Å; M488-N682 PolarHBondContact O-N 3.27Å; M488-L686 HydrophobicContact SD-CD2 3.81Å
489	N	94.6	Very high	92	Very high	47 Å²	47	60.3 Å²	60.3	25%	0.251	35%	0.345	S	S	.	.	S	Bend	trans	-159.9	54	179.6	-166.8	-18	0	0	0	112.2	R487 K634 I680 N682	R487-N489 VanDerWaalsContact C-N 3.35Å; R487-N489 PolarHBondContact O-N 2.79Å; N489-K634 CarbonylContact C-O 3.37Å; N489-K634 HydrophobicContact CB-CB 4.38Å; N489-K634 HydrophobicContact CB-CG 4.18Å; N489-K634 PolarHBondContact N-O 3.23Å; N489-K634 WeakPolarHBondContact O-CB 2.97Å; N489-I680 VanDerWaalsContact CB-O 3.27Å; N489-I680 WeakPolarHBondContact CB-O 3.33Å; N489-I680 PolarHBondContact ND2-O 3.1Å; N489-N682 WeakPolarHBondContact CA-ND2 3.45Å; N489-N682 VanDerWaalsContact OD1-CG 3.28Å; N489-N682 PolarHBondContact OD1-ND2 3.36Å; N489-N682 VanDerWaalsContact OD1-ND2 3.12Å; N489-N682 PolarHBondContact OD1-OD1 3.44Å
490	M	94.6	Very high	91.8	Very high	22 Å²	22	65.5 Å²	65.5	11%	0.108	37%	0.369	C	S	.	.			trans	-147.8	128.2	177.4	-167.7	175.4	-76.6	0	0	111.2	N494 A495 F498 D631 K634 A635	M490-N494 HydrophobicContact CG-CB 3.67Å; M490-N494 HydrophobicContact SD-CB 4.26Å; M490-A495 HydrophobicContact CG-CB 4.1Å; M490-A495 WeakPolarHBondContact SD-CA 3.32Å; M490-A495 HydrophobicContact SD-CB 3.85Å; M490-F498 HydrophobicContact SD-CB 4.05Å; M490-D631 HydrophobicContact CE-CB 4.05Å; M490-D631 WeakPolarHBondContact CE-O 3.39Å; M490-K634 HydrophobicContact CB-CB 4.22Å; M490-K634 VanDerWaalsContact CB-O 3.28Å; M490-K634 WeakPolarHBondContact CB-O 3.32Å; M490-K634 HydrophobicContact CE-CB 3.95Å; M490-K634 PolarHBondContact N-O 2.9Å; M490-A635 HydrophobicContact CE-CB 3.96Å; M490-A635 HydrophobicContact SD-CB 3.76Å
491	T	92.9	Very high	91.5	Very high	74 Å²	74	69.3 Å²	69.3	45%	0.454	40%	0.396	S	S	.	.			trans	-64	155.1	174.1	60.7	0	0	0	0	111.1	E493 N494 A495	T491-E493 PolarHBondContact O-N 3.5Å; T491-N494 PolarHBondContact O-N 2.9Å; T491-N494 WeakPolarHBondContact OG1-CB 3.36Å; T491-N494 PolarHBondContact OG1-N 3.42Å; T491-N494 PolarHBondContact OG1-ND2 3.22Å; T491-A495 WeakPolarHBondContact O-CB 3.1Å; T491-A495 PolarHBondContact O-N 3.13Å
492	S	90.6	Very high	91.4	Very high	79 Å²	79	64.1 Å²	64.1	55%	0.552	37%	0.372	S	S	*	.	H	α-helix	trans	-56.6	-33.8	176.5	-65.7	0	0	0	0	115	R487 A496	R487-S492 VanDerWaalsContact NH1-CA 3.32Å; R487-S492 PolarHBondContact NH1-OG 3.33Å; S492-A496 PolarHBondContact O-N 3.21Å
493	E	91.7	Very high	90.8	Very high	154 Å²	154	68.9 Å²	68.9	72%	0.72	39%	0.394	S	S	*	.	H	α-helix	trans	-67.1	-55.5	176.4	-64.5	175.9	-172.8	0	0	111.5	T491 A495 A496 M497	T491-E493 PolarHBondContact O-N 3.5Å; E493-A495 PolarHBondContact O-N 2.98Å; E493-A496 WeakPolarHBondContact O-CB 3.47Å; E493-A496 PolarHBondContact O-N 3Å; E493-A496 VanDerWaalsContact O-N 3.09Å; E493-M497 PolarHBondContact O-N 3.38Å
494	N	93.4	Very high	90.2	Very high	80 Å²	80	64.6 Å²	64.6	43%	0.428	39%	0.394	S	S	.	.	H	α-helix	trans	-57.8	-35.9	175.7	-68.7	-12.4	0	0	0	112.7	M490 T491 M497 F498	M490-N494 HydrophobicContact CG-CB 3.67Å; M490-N494 HydrophobicContact SD-CB 4.26Å; T491-N494 PolarHBondContact O-N 2.9Å; T491-N494 WeakPolarHBondContact OG1-CB 3.36Å; T491-N494 PolarHBondContact OG1-N 3.42Å; T491-N494 PolarHBondContact OG1-ND2 3.22Å; N494-M497 HydrophobicContact CB-CE 4.36Å; N494-M497 PolarHBondContact O-N 3.36Å; N494-M497 WeakPolarHBondContact OD1-CE 3.23Å; N494-F498 WeakPolarHBondContact O-CB 3.49Å; N494-F498 PolarHBondContact O-N 3.28Å
495	A	91.1	Very high	89.2	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.008	37%	0.374	C	S	.	.	H	α-helix	trans	-69.6	-36.5	176.5	0	0	0	0	0	113.1	M490 T491 E493 M497 F498 C499	M490-A495 HydrophobicContact CG-CB 4.1Å; M490-A495 WeakPolarHBondContact SD-CA 3.32Å; M490-A495 HydrophobicContact SD-CB 3.85Å; T491-A495 WeakPolarHBondContact O-CB 3.1Å; T491-A495 PolarHBondContact O-N 3.13Å; E493-A495 PolarHBondContact O-N 2.98Å; A495-M497 VanDerWaalsContact C-N 3.3Å; A495-F498 PolarHBondContact O-N 3.26Å; A495-C499 PolarHBondContact O-N 2.81Å; A495-C499 PolarHBondContact O-SG 3.17Å
496	A	90.9	Very high	88.2	Confident	50 Å²	50	65.2 Å²	65.2	41%	0.413	38%	0.384	S	S	.	.	H	α-helix	trans	-64.3	-38.2	172.6	0	0	0	0	0	111.3	S492 E493 K500	S492-A496 PolarHBondContact O-N 3.21Å; E493-A496 WeakPolarHBondContact O-CB 3.47Å; E493-A496 PolarHBondContact O-N 3Å; E493-A496 VanDerWaalsContact O-N 3.09Å; A496-K500 WeakPolarHBondContact O-CG 3.42Å; A496-K500 PolarHBondContact O-N 2.97Å
497	M	92.7	Very high	87.4	Confident	113 Å²	113	70.3 Å²	70.3	56%	0.557	40%	0.398	S	S	*	.	H	α-helix	trans	-64.9	-41.4	172	-66.7	-170.6	-73.8	0	0	111.9	E493 N494 A495 K500 S501	E493-M497 PolarHBondContact O-N 3.38Å; N494-M497 HydrophobicContact CB-CE 4.36Å; N494-M497 PolarHBondContact O-N 3.36Å; N494-M497 WeakPolarHBondContact OD1-CE 3.23Å; A495-M497 VanDerWaalsContact C-N 3.3Å; M497-K500 PolarHBondContact O-N 3.38Å; M497-S501 PolarHBondContact O-N 3.19Å
498	F	92.6	Very high	86.7	Confident	30 Å²	30	70.8 Å²	70.8	13%	0.132	41%	0.405	C	S	.	.	H	α-helix	trans	-62	-45.7	175.6	-175.6	-103	0	0	0	111.8	L471 F474 M490 N494 A495 K500 S501 V502 D631 L632 A635	L471-F498 HydrophobicContact CD2-CE1 4.43Å; L471-F498 HydrophobicContact CD2-CZ 4.02Å; F474-F498 HydrophobicContact CD1-CD1 4.11Å; F474-F498 HydrophobicContact CD1-CE1 4.23Å; F474-F498 HydrophobicContact CD2-CD1 4.45Å; F474-F498 AromaticContact CD2-CE1 3.78Å; F474-F498 HydrophobicContact CD2-CE1 3.78Å; F474-F498 HydrophobicContact CE1-CD1 4.33Å; F474-F498 HydrophobicContact CE1-CE1 4.34Å; F474-F498 AromaticContact CE2-CE1 3.91Å; F474-F498 HydrophobicContact CE2-CE1 3.91Å; F474-F498 HydrophobicContact CG-CD1 4.16Å; F474-F498 AromaticContact CG-CE1 3.94Å; F474-F498 HydrophobicContact CG-CE1 3.94Å; F474-F498 HydrophobicContact CZ-CE1 4.18Å; M490-F498 HydrophobicContact SD-CB 4.05Å; N494-F498 WeakPolarHBondContact O-CB 3.49Å; N494-F498 PolarHBondContact O-N 3.28Å; A495-F498 PolarHBondContact O-N 3.26Å; F498-K500 VanDerWaalsContact C-N 3.32Å; F498-K500 PolarHBondContact O-N 3.23Å; F498-S501 WeakPolarHBondContact O-CB 3.47Å; F498-S501 PolarHBondContact O-N 3.11Å; F498-S501 PolarHBondContact O-OG 2.99Å; F498-V502 HydrophobicContact CD1-CG2 4.47Å; F498-V502 HydrophobicContact CE1-CG2 4.11Å; F498-V502 HydrophobicContact CE2-CG2 4.39Å; F498-V502 HydrophobicContact CZ-CG2 4.06Å; F498-V502 WeakPolarHBondContact O-CG2 3.28Å; F498-V502 PolarHBondContact O-N 2.74Å; F498-D631 HydrophobicContact CD2-CB 4.33Å; F498-D631 HydrophobicContact CE2-CB 4.12Å; F498-L632 HydrophobicContact CE1-CD1 4.42Å; F498-L632 HydrophobicContact CZ-CB 4.3Å; F498-L632 HydrophobicContact CZ-CD1 4.24Å; F498-A635 HydrophobicContact CD1-CB 3.66Å; F498-A635 HydrophobicContact CE1-CB 3.82Å; F498-A635 HydrophobicContact CG-CB 4.3Å
499	C	90.7	Very high	86.4	Confident	34 Å²	34	77.3 Å²	77.3	23%	0.23	43%	0.43	C	S	.	.	H	α-helix	trans	-57.1	-46.2	176.4	-63.5	0	0	0	0	111.4	A495 S501 V502 E503	A495-C499 PolarHBondContact O-N 2.81Å; A495-C499 PolarHBondContact O-SG 3.17Å; C499-S501 VanDerWaalsContact C-N 3.25Å; C499-S501 PolarHBondContact O-N 3.34Å; C499-V502 PolarHBondContact O-N 3.26Å; C499-E503 PolarHBondContact O-N 3.26Å
500	K	89.5	Confident	86.3	Confident	150 Å²	150	77.5 Å²	77.5	65%	0.652	43%	0.428	S	S	*	.	H	α-helix	trans	-59.5	-34.6	175.1	-71.1	177.4	-179.2	-178.7	0	113	A496 M497 F498 V502	A496-K500 WeakPolarHBondContact O-CG 3.42Å; A496-K500 PolarHBondContact O-N 2.97Å; M497-K500 PolarHBondContact O-N 3.38Å; F498-K500 VanDerWaalsContact C-N 3.32Å; F498-K500 PolarHBondContact O-N 3.23Å; K500-V502 PolarHBondContact O-N 3.16Å
501	S	89.9	Confident	86.4	Confident	87 Å²	87	78.1 Å²	78.1	61%	0.608	43%	0.434	S	S	*	.	H	α-helix	trans	-71	-16.9	178.3	77.2	0	0	0	0	113.9	M497 F498 C499	M497-S501 PolarHBondContact O-N 3.19Å; F498-S501 WeakPolarHBondContact O-CB 3.47Å; F498-S501 PolarHBondContact O-N 3.11Å; F498-S501 PolarHBondContact O-OG 2.99Å; C499-S501 VanDerWaalsContact C-N 3.25Å; C499-S501 PolarHBondContact O-N 3.34Å
502	V	86.4	Confident	86.5	Confident	12 Å²	12	74.8 Å²	74.8	7%	0.073	41%	0.414	C	S	.	.	H	α-helix	trans	-106	-9.2	-176.4	-179.3	0	0	0	0	112.1	L471 F474 Q475 F498 C499 K500 G504 A505	L471-V502 HydrophobicContact CB-CG1 3.82Å; L471-V502 HydrophobicContact CD2-CG1 3.88Å; L471-V502 HydrophobicContact CD2-CG2 3.82Å; L471-V502 HydrophobicContact CG-CG1 4.29Å; F474-V502 HydrophobicContact CB-CG1 4.43Å; Q475-V502 HydrophobicContact CG-CG1 4.24Å; F498-V502 HydrophobicContact CD1-CG2 4.47Å; F498-V502 HydrophobicContact CE1-CG2 4.11Å; F498-V502 HydrophobicContact CE2-CG2 4.39Å; F498-V502 HydrophobicContact CZ-CG2 4.06Å; F498-V502 WeakPolarHBondContact O-CG2 3.28Å; F498-V502 PolarHBondContact O-N 2.74Å; C499-V502 PolarHBondContact O-N 3.26Å; K500-V502 PolarHBondContact O-N 3.16Å; V502-G504 PolarHBondContact O-N 2.99Å; V502-A505 HydrophobicContact CG1-CB 4.39Å; V502-A505 VanDerWaalsContact O-CB 3.3Å; V502-A505 WeakPolarHBondContact O-CB 3.42Å; V502-A505 PolarHBondContact O-N 3.4Å
503	E	78.5	Confident	86.7	Confident	120 Å²	120	71.8 Å²	71.8	56%	0.561	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	130.8	177.6	-80	-177.1	-178	0	0	111.9	C499 A505	C499-E503 PolarHBondContact O-N 3.26Å; E503-A505 VanDerWaalsContact C-N 3.35Å; E503-A505 PolarHBondContact O-N 3.32Å
504	G	72.2	Confident	87	Confident	77 Å²	77	64.5 Å²	64.5	79%	0.794	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	4.3	179.1	0	0	0	0	0	115.7	V502 M506	V502-G504 PolarHBondContact O-N 2.99Å; G504-M506 PolarHBondContact O-N 2.81Å
505	A	67.5	Low	87.2	Confident	55 Å²	55	60.8 Å²	60.8	46%	0.455	34%	0.337	S	S	.	.	S	Bend	trans	-58.7	-42.7	-175.6	0	0	0	0	0	113.9	V502 E503	V502-A505 HydrophobicContact CG1-CB 4.39Å; V502-A505 VanDerWaalsContact O-CB 3.3Å; V502-A505 WeakPolarHBondContact O-CB 3.42Å; V502-A505 PolarHBondContact O-N 3.4Å; E503-A505 VanDerWaalsContact C-N 3.35Å; E503-A505 PolarHBondContact O-N 3.32Å
506	M	69	Low	87.5	Confident	95 Å²	95	60.9 Å²	60.9	47%	0.468	34%	0.337	S	S	.	.			trans	-159.5	162.2	178.5	-67.4	-169.9	72.3	0	0	112.2	Q475 G504	Q475-M506 PolarHBondContact OE1-O 2.86Å; G504-M506 PolarHBondContact O-N 2.81Å
507	Q	76.4	Confident	87.9	Confident	165 Å²	165	58.5 Å²	58.5	77%	0.771	32%	0.317	S	S	*	.			trans	-72.2	139.2	168.3	-72.5	-67.8	-29.7	0	0	110.9	R509	Q507-R509 PolarHBondContact O-N 3.5Å
508	P	79.3	Confident	88.1	Confident	42 Å²	42	53.1 Å²	53.1	27%	0.273	29%	0.291	S	S	.	.			trans	-61.7	136.5	180	28.2	-35.4	0	0	0	110.4	Y472 E513	Y472-P508 HydrophobicContact CD2-CB 4.23Å; Y472-P508 HydrophobicContact CE2-CB 3.79Å; P508-E513 HydrophobicContact CB-CG 4.21Å
509	R	90.1	Very high	88.4	Confident	137 Å²	137	51.7 Å²	51.7	52%	0.517	29%	0.285	S	S	.	.			trans	-116.1	140.5	177.3	-62.6	-178.5	176.9	165.7	-1.4	109.4	Q507 P511 S512 E513	Q507-R509 PolarHBondContact O-N 3.5Å; R509-P511 VanDerWaalsContact C-CD 3.43Å; R509-P511 VanDerWaalsContact C-N 3.3Å; R509-P511 VanDerWaalsContact O-N 3.11Å; R509-S512 PolarHBondContact O-N 3.27Å; R509-E513 PolarHBondContact O-N 3.3Å; R509-E513 VanDerWaalsContact O-N 3.08Å
510	F	93.1	Very high	88.8	Confident	50 Å²	50	50.8 Å²	50.8	22%	0.219	28%	0.277	C	S	.	.	H	α-helix	trans	-47.1	-42.2	179.5	175.6	-101.2	0	0	0	115	M410 M420 S512 E513 C514	M410-F510 HydrophobicContact CE-CD2 3.81Å; M410-F510 HydrophobicContact CE-CE2 3.43Å; M410-F510 VanDerWaalsContact CE-CE2 3.43Å; M410-F510 HydrophobicContact CE-CZ 4.31Å; M420-F510 HydrophobicContact CE-CD2 4.11Å; M420-F510 HydrophobicContact CE-CE2 4.36Å; M420-F510 HydrophobicContact SD-CD2 4.14Å; M420-F510 HydrophobicContact SD-CE2 3.97Å; F510-S512 PolarHBondContact O-N 2.85Å; F510-E513 WeakPolarHBondContact CA-OE2 3.44Å; F510-E513 PolarHBondContact N-OE2 3.3Å; F510-E513 PolarHBondContact O-N 3.12Å; F510-C514 HydrophobicContact CD2-CB 4.36Å; F510-C514 HydrophobicContact CE1-CB 4.2Å; F510-C514 HydrophobicContact CE2-CB 3.9Å; F510-C514 HydrophobicContact CZ-CB 3.82Å; F510-C514 WeakPolarHBondContact O-CB 3.45Å; F510-C514 PolarHBondContact O-N 3.11Å
511	P	95.6	Very high	89.2	Confident	35 Å²	35	43.8 Å²	43.8	23%	0.227	25%	0.247	C	C	.	.	H	α-helix	trans	-56.4	-43.4	174.9	-28.9	38.1	0	0	0	114.1	I463 K467 R509 F515	I463-P511 HydrophobicContact CG2-CB 3.99Å; K467-P511 HydrophobicContact CB-CB 3.97Å; K467-P511 HydrophobicContact CB-CG 4.14Å; R509-P511 VanDerWaalsContact C-CD 3.43Å; R509-P511 VanDerWaalsContact C-N 3.3Å; R509-P511 VanDerWaalsContact O-N 3.11Å; P511-F515 WeakPolarHBondContact O-CB 3.38Å; P511-F515 PolarHBondContact O-N 2.94Å; P511-F515 VanDerWaalsContact O-N 3.08Å
512	S	95.7	Very high	89.6	Confident	4 Å²	4	40 Å²	40	3%	0.028	22%	0.22	C	C	.	.	H	α-helix	trans	-69.6	-46.1	176.8	-54.1	0	0	0	0	111.2	D469 R509 F510 F515 F516	D469-S512 PolarHBondContact N-OG 3.39Å; R509-S512 PolarHBondContact O-N 3.27Å; F510-S512 PolarHBondContact O-N 2.85Å; S512-F515 PolarHBondContact O-N 3.14Å; S512-F516 WeakPolarHBondContact O-CD2 3.38Å; S512-F516 PolarHBondContact O-N 3.35Å
513	E	95.4	Very high	90.2	Very high	17 Å²	17	41.2 Å²	41.2	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-58.7	-53.9	179.8	-59.4	177.2	98.1	0	0	111	M420 Y472 R479 P508 R509 F510 F515 F516 M517	M420-E513 HydrophobicContact CE-CB 3.73Å; M420-E513 HydrophobicContact CE-CG 4.48Å; Y472-E513 HydrophobicContact CE2-CG 3.85Å; Y472-E513 WeakPolarHBondContact OH-CG 3.44Å; R479-E513 IonicContact CZ-OE1 3.94Å; R479-E513 IonicContact NE-OE1 2.78Å; R479-E513 PolarHBondContact NE-OE1 3.39Å; R479-E513 IonicContact NH2-OE1 3.66Å; R479-E513 PolarHBondContact NH2-OE1 3.48Å; P508-E513 HydrophobicContact CB-CG 4.21Å; R509-E513 PolarHBondContact O-N 3.3Å; R509-E513 VanDerWaalsContact O-N 3.08Å; F510-E513 WeakPolarHBondContact CA-OE2 3.44Å; F510-E513 PolarHBondContact N-OE2 3.3Å; F510-E513 PolarHBondContact O-N 3.12Å; E513-F515 PolarHBondContact O-N 3.01Å; E513-F516 PolarHBondContact O-N 3.13Å; E513-M517 VanDerWaalsContact O-CB 3.26Å; E513-M517 WeakPolarHBondContact O-CB 3.31Å; E513-M517 WeakPolarHBondContact O-CG 3.4Å; E513-M517 PolarHBondContact O-N 3.16Å
514	C	97	Very high	91	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.8	-45	-179.8	-174.9	0	0	0	0	111.4	S460 I463 F510 T518	S460-C514 PolarHBondContact OG-SG 3.01Å; I463-C514 HydrophobicContact CD1-CB 3.79Å; F510-C514 HydrophobicContact CD2-CB 4.36Å; F510-C514 HydrophobicContact CE1-CB 4.2Å; F510-C514 HydrophobicContact CE2-CB 3.9Å; F510-C514 HydrophobicContact CZ-CB 3.82Å; F510-C514 WeakPolarHBondContact O-CB 3.45Å; F510-C514 PolarHBondContact O-N 3.11Å; C514-T518 WeakPolarHBondContact O-CB 3.42Å; C514-T518 PolarHBondContact O-N 3.47Å; C514-T518 PolarHBondContact O-OG1 2.85Å
515	F	98	Very high	92.2	Very high	3 Å²	3	32.2 Å²	32.2	1%	0.013	16%	0.163	C	C	.	.	H	α-helix	trans	-60.2	-53.3	179.9	-177.2	-94.5	0	0	0	111.8	I463 L465 V468 P511 S512 E513 T518 V519 F604 K607 Q608 V611	I463-F515 HydrophobicContact CD1-CB 4.42Å; L465-F515 HydrophobicContact CD2-CE2 4.21Å; V468-F515 HydrophobicContact CG1-CB 4.26Å; V468-F515 HydrophobicContact CG1-CD1 3.69Å; V468-F515 HydrophobicContact CG1-CE1 4.14Å; V468-F515 HydrophobicContact CG1-CG 3.98Å; V468-F515 HydrophobicContact CG2-CB 4.13Å; V468-F515 HydrophobicContact CG2-CD2 4.21Å; V468-F515 HydrophobicContact CG2-CG 4.07Å; P511-F515 WeakPolarHBondContact O-CB 3.38Å; P511-F515 PolarHBondContact O-N 2.94Å; P511-F515 VanDerWaalsContact O-N 3.08Å; S512-F515 PolarHBondContact O-N 3.14Å; E513-F515 PolarHBondContact O-N 3.01Å; F515-T518 WeakPolarHBondContact O-CB 3.43Å; F515-T518 PolarHBondContact O-N 2.89Å; F515-T518 VanDerWaalsContact O-N 3.12Å; F515-V519 HydrophobicContact CD1-CG2 4.27Å; F515-V519 HydrophobicContact CE1-CG2 4.05Å; F515-V519 WeakPolarHBondContact O-CG2 3.45Å; F515-V519 PolarHBondContact O-N 2.67Å; F515-F604 AromaticContact CD2-CE2 3.8Å; F515-F604 HydrophobicContact CD2-CE2 3.8Å; F515-F604 AromaticContact CD2-CZ 3.97Å; F515-F604 HydrophobicContact CD2-CZ 3.97Å; F515-F604 AromaticContact CE2-CE2 3.98Å; F515-F604 HydrophobicContact CE2-CE2 3.98Å; F515-F604 HydrophobicContact CE2-CZ 4.02Å; F515-F604 HydrophobicContact CG-CZ 4.45Å; F515-K607 HydrophobicContact CE2-CB 4.14Å; F515-Q608 HydrophobicContact CZ-CB 4.5Å; F515-V611 HydrophobicContact CE1-CB 4.04Å; F515-V611 HydrophobicContact CE1-CG1 4.11Å; F515-V611 HydrophobicContact CE1-CG2 3.84Å; F515-V611 HydrophobicContact CE2-CG2 4.21Å; F515-V611 HydrophobicContact CZ-CB 3.92Å; F515-V611 HydrophobicContact CZ-CG1 4.49Å; F515-V611 HydrophobicContact CZ-CG2 3.46Å; F515-V611 VanDerWaalsContact CZ-CG2 3.46Å
516	F	97.7	Very high	93.7	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.009	14%	0.142	C	C	.	.	H	α-helix	trans	-73.6	-30.8	-177.2	-74.5	-70.6	0	0	0	113.2	V468 D469 Y472 V473 V480 S512 E513 T518 V519 H520 V611 Y640	V468-F516 HydrophobicContact CG1-CE2 3.85Å; V468-F516 HydrophobicContact CG1-CZ 4.4Å; D469-F516 WeakPolarHBondContact O-CE2 3.29Å; Y472-F516 HydrophobicContact CD1-CB 4.24Å; Y472-F516 AromaticContact CD1-CD2 3.65Å; Y472-F516 HydrophobicContact CD1-CD2 3.65Å; Y472-F516 HydrophobicContact CD1-CE2 4.43Å; Y472-F516 HydrophobicContact CD1-CG 4.28Å; Y472-F516 HydrophobicContact CE1-CB 4.23Å; Y472-F516 HydrophobicContact CE1-CD2 4.42Å; V473-F516 HydrophobicContact CG1-CB 3.71Å; V473-F516 HydrophobicContact CG1-CD1 3.33Å; V473-F516 HydrophobicContact CG1-CD2 3.58Å; V473-F516 HydrophobicContact CG1-CE1 3.73Å; V473-F516 HydrophobicContact CG1-CE2 3.94Å; V473-F516 HydrophobicContact CG1-CG 3.23Å; V473-F516 HydrophobicContact CG1-CZ 4.01Å; V480-F516 HydrophobicContact CG2-CB 4.33Å; S512-F516 WeakPolarHBondContact O-CD2 3.38Å; S512-F516 PolarHBondContact O-N 3.35Å; E513-F516 PolarHBondContact O-N 3.13Å; F516-T518 VanDerWaalsContact C-N 3.26Å; F516-T518 PolarHBondContact O-N 3.16Å; F516-V519 HydrophobicContact CD1-CG2 4.49Å; F516-V519 PolarHBondContact O-N 3.06Å; F516-H520 PolarHBondContact O-CD2 3.23Å; F516-H520 PolarHBondContact O-N 2.94Å; F516-V611 HydrophobicContact CZ-CG1 4.32Å; F516-Y640 HydrophobicContact CD1-CE2 4.14Å; F516-Y640 AromaticContact CD1-CZ 3.96Å; F516-Y640 WeakPolarHBondContact CD1-OH 3.24Å; F516-Y640 AromaticContact CE1-CE2 3.71Å; F516-Y640 HydrophobicContact CE1-CE2 3.71Å
517	M	97.9	Very high	95	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.5	-37.6	167.4	-74.6	-168.9	-51.1	0	0	111.6	M420 L423 L427 L456 R479 V480 E513 H520 L521	M420-M517 HydrophobicContact CE-CE 3.29Å; M420-M517 HydrophobicContact CE-SD 4.32Å; M420-M517 HydrophobicContact SD-CE 3.87Å; L423-M517 HydrophobicContact CB-SD 4.48Å; L427-M517 HydrophobicContact CD1-CB 3.72Å; L427-M517 HydrophobicContact CD1-CG 3.63Å; L427-M517 HydrophobicContact CD1-SD 4.27Å; L456-M517 HydrophobicContact CD1-CB 4.23Å; R479-M517 HydrophobicContact CB-CG 4.33Å; R479-M517 HydrophobicContact CB-SD 4.14Å; V480-M517 HydrophobicContact CG1-CG 4.15Å; E513-M517 VanDerWaalsContact O-CB 3.26Å; E513-M517 WeakPolarHBondContact O-CB 3.31Å; E513-M517 WeakPolarHBondContact O-CG 3.4Å; E513-M517 PolarHBondContact O-N 3.16Å; M517-H520 PolarHBondContact O-N 3.48Å; M517-L521 VanDerWaalsContact O-CB 3.31Å; M517-L521 WeakPolarHBondContact O-CB 3.46Å; M517-L521 PolarHBondContact O-N 3.23Å
518	T	98.5	Very high	95.9	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-66.2	-43.6	176	-51.4	0	0	0	0	111.3	L453 L456 F457 S460 C514 F515 F516 H520 L521 A522 F604	L453-T518 HydrophobicContact CD1-CG2 4.48Å; L456-T518 HydrophobicContact CB-CG2 4.04Å; L456-T518 WeakPolarHBondContact CB-OG1 3.23Å; L456-T518 PolarHBondContact O-OG1 2.82Å; F457-T518 HydrophobicContact CD1-CG2 3.45Å; F457-T518 VanDerWaalsContact CD1-CG2 3.45Å; F457-T518 HydrophobicContact CE1-CG2 3.77Å; F457-T518 HydrophobicContact CG-CG2 4.43Å; S460-T518 PolarHBondContact OG-OG1 3.17Å; C514-T518 WeakPolarHBondContact O-CB 3.42Å; C514-T518 PolarHBondContact O-N 3.47Å; C514-T518 PolarHBondContact O-OG1 2.85Å; F515-T518 WeakPolarHBondContact O-CB 3.43Å; F515-T518 PolarHBondContact O-N 2.89Å; F515-T518 VanDerWaalsContact O-N 3.12Å; F516-T518 VanDerWaalsContact C-N 3.26Å; F516-T518 PolarHBondContact O-N 3.16Å; T518-H520 PolarHBondContact O-N 3.33Å; T518-L521 PolarHBondContact O-N 3.04Å; T518-A522 WeakPolarHBondContact O-CB 3.23Å; T518-A522 PolarHBondContact O-N 3.22Å; T518-F604 VanDerWaalsContact CB-CZ 3.44Å; T518-F604 HydrophobicContact CG2-CD1 4.07Å; T518-F604 HydrophobicContact CG2-CD2 3.84Å; T518-F604 HydrophobicContact CG2-CE1 3.74Å; T518-F604 HydrophobicContact CG2-CE2 3.5Å; T518-F604 VanDerWaalsContact CG2-CE2 3.5Å; T518-F604 HydrophobicContact CG2-CG 4.11Å; T518-F604 HydrophobicContact CG2-CZ 3.47Å; T518-F604 VanDerWaalsContact CG2-CZ 3.47Å
519	V	98.5	Very high	96.7	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.006	9%	0.085	C	C	.	.	H	α-helix	trans	-56.1	-51.8	174.1	173.4	0	0	0	0	110.7	F515 F516 L521 A522 H523 F604 Q608 F639 Y640	F515-V519 HydrophobicContact CD1-CG2 4.27Å; F515-V519 HydrophobicContact CE1-CG2 4.05Å; F515-V519 WeakPolarHBondContact O-CG2 3.45Å; F515-V519 PolarHBondContact O-N 2.67Å; F516-V519 HydrophobicContact CD1-CG2 4.49Å; F516-V519 PolarHBondContact O-N 3.06Å; V519-L521 PolarHBondContact O-N 2.93Å; V519-A522 PolarHBondContact O-N 3.33Å; V519-H523 PolarHBondContact O-N 3.19Å; V519-H523 VanDerWaalsContact O-N 3.16Å; V519-F604 HydrophobicContact CB-CE1 4.49Å; V519-F604 HydrophobicContact CG2-CE1 3.73Å; V519-F604 HydrophobicContact CG2-CZ 3.78Å; V519-Q608 HydrophobicContact CG2-CG 4.12Å; V519-F639 HydrophobicContact CG1-CE2 4.01Å; V519-Y640 HydrophobicContact CG1-CD1 3.7Å; V519-Y640 HydrophobicContact CG1-CE1 3.57Å
520	H	98.3	Very high	96.9	Very high	15 Å²	15	12 Å²	12	7%	0.069	6%	0.064	C	C	.	.	H	α-helix	trans	-68.7	-34.8	-178	-78.6	-113.1	0	0	0	112.6	L427 V480 F516 M517 T518 H523 I524 F639 Y640	L427-H520 HydrophobicContact CD2-CB 3.96Å; V480-H520 HydrophobicContact CG1-CB 4.06Å; F516-H520 PolarHBondContact O-CD2 3.23Å; F516-H520 PolarHBondContact O-N 2.94Å; M517-H520 PolarHBondContact O-N 3.48Å; T518-H520 PolarHBondContact O-N 3.33Å; H520-H523 WeakPolarHBondContact O-CB 3.34Å; H520-H523 PolarHBondContact O-N 3.29Å; H520-I524 WeakPolarHBondContact O-CD1 3.31Å; H520-I524 WeakPolarHBondContact O-CG1 3.41Å; H520-I524 PolarHBondContact O-N 3.28Å; H520-F639 AromaticContact CE1-CZ 3.68Å; H520-F639 AromaticContact ND1-CZ 3.96Å; H520-F639 AromaticContact NE2-CZ 3.79Å; H520-Y640 AromaticContact NE2-CE1 3.68Å; H520-Y640 AromaticContact NE2-CZ 3.83Å; H520-Y640 PolarHBondContact NE2-OH 2.89Å
521	L	98.4	Very high	97	Very high	2 Å²	2	13.9 Å²	13.9	1%	0.01	8%	0.08	C	C	.	.	H	α-helix	trans	-72	-37.3	177.3	-168.6	58.5	0	0	0	111.1	L427 L449 I452 L453 L456 M517 T518 V519 H523 I524 A525	L427-L521 HydrophobicContact CD2-CB 3.67Å; L427-L521 HydrophobicContact CD2-CD1 3.88Å; L427-L521 HydrophobicContact CD2-CG 4.34Å; L449-L521 HydrophobicContact CD2-CD1 4.22Å; I452-L521 HydrophobicContact CB-CD2 3.98Å; I452-L521 HydrophobicContact CG2-CD2 3.52Å; L453-L521 HydrophobicContact CB-CD2 4.09Å; L453-L521 HydrophobicContact CB-CG 4.22Å; L453-L521 HydrophobicContact CD1-CB 4.13Å; L453-L521 HydrophobicContact CD1-CD2 4.48Å; L453-L521 HydrophobicContact CD1-CG 4.2Å; L456-L521 HydrophobicContact CD1-CB 3.96Å; L456-L521 HydrophobicContact CD1-CD2 3.55Å; L456-L521 HydrophobicContact CD1-CG 4.41Å; L456-L521 HydrophobicContact CG-CD2 4.24Å; M517-L521 VanDerWaalsContact O-CB 3.31Å; M517-L521 WeakPolarHBondContact O-CB 3.46Å; M517-L521 PolarHBondContact O-N 3.23Å; T518-L521 PolarHBondContact O-N 3.04Å; V519-L521 PolarHBondContact O-N 2.93Å; L521-H523 VanDerWaalsContact C-N 3.3Å; L521-H523 PolarHBondContact O-N 3.45Å; L521-I524 PolarHBondContact O-N 3Å; L521-A525 HydrophobicContact CD1-CB 4.24Å; L521-A525 HydrophobicContact CG-CB 4.27Å; L521-A525 WeakPolarHBondContact O-CB 2.79Å; L521-A525 PolarHBondContact O-N 3.37Å
522	A	98.5	Very high	96.8	Very high	7 Å²	7	14.8 Å²	14.8	6%	0.058	8%	0.079	C	C	.	.	H	α-helix	trans	-57.3	-47.9	173.9	0	0	0	0	0	110.3	L453 F457 T518 V519 I524 A525 L526 L527	L453-A522 HydrophobicContact CD1-CB 3.93Å; L453-A522 HydrophobicContact CD2-CB 4.46Å; F457-A522 HydrophobicContact CZ-CB 4.39Å; T518-A522 WeakPolarHBondContact O-CB 3.23Å; T518-A522 PolarHBondContact O-N 3.22Å; V519-A522 PolarHBondContact O-N 3.33Å; A522-I524 PolarHBondContact O-N 2.81Å; A522-A525 PolarHBondContact O-N 3.21Å; A522-L526 PolarHBondContact O-N 2.91Å; A522-L527 HydrophobicContact CB-CD2 4.32Å; A522-L527 WeakPolarHBondContact O-CD2 3.41Å; A522-L527 PolarHBondContact O-N 3.31Å
523	H	97.9	Very high	96.8	Very high	39 Å²	39	14.6 Å²	14.6	18%	0.181	8%	0.078	C	C	.	.	H	α-helix	trans	-55.6	-35.7	177.5	-174.1	65.2	0	0	0	113.6	S434 V519 H520 L521 P528 F639 D643	S434-H523 VanDerWaalsContact CB-NE2 3.3Å; S434-H523 WeakPolarHBondContact CB-NE2 3.39Å; S434-H523 PolarHBondContact OG-NE2 3.41Å; V519-H523 PolarHBondContact O-N 3.19Å; V519-H523 VanDerWaalsContact O-N 3.16Å; H520-H523 WeakPolarHBondContact O-CB 3.34Å; H520-H523 PolarHBondContact O-N 3.29Å; L521-H523 VanDerWaalsContact C-N 3.3Å; L521-H523 PolarHBondContact O-N 3.45Å; H523-P528 VanDerWaalsContact O-CD 3.27Å; H523-P528 WeakPolarHBondContact O-CD 3.35Å; H523-F639 HydrophobicContact CB-CD2 3.86Å; H523-F639 HydrophobicContact CB-CE2 3.75Å; H523-F639 AromaticContact CE1-CG 3.72Å; H523-F639 AromaticContact CG-CD2 3.54Å; H523-F639 AromaticContact CG-CE2 3.75Å; H523-F639 AromaticContact ND1-CD2 3.42Å; H523-F639 WeakPolarHBondContact ND1-CD2 3.38Å; H523-F639 AromaticContact ND1-CG 3.61Å; H523-D643 VanDerWaalsContact CA-OD2 3.31Å; H523-D643 WeakPolarHBondContact CA-OD2 3.39Å; H523-D643 WeakPolarHBondContact CB-OD2 3.4Å; H523-D643 IonicContact CE1-OD1 2.75Å; H523-D643 IonicContact CG-OD2 2.85Å; H523-D643 IonicContact ND1-OD1 3.44Å; H523-D643 PolarHBondContact ND1-OD1 3.11Å; H523-D643 IonicContact ND1-OD2 3.92Å; H523-D643 PolarHBondContact ND1-OD2 3.43Å
524	I	96.7	Very high	96.8	Very high	8 Å²	8	14.6 Å²	14.6	4%	0.041	8%	0.081	C	C	.	.	H	α-helix	trans	-90.3	-38.5	-176.2	-70.8	167	0	0	0	112.1	L427 N430 K433 L449 H520 L521 A522 P528	L427-I524 HydrophobicContact CD2-CD1 4.08Å; N430-I524 HydrophobicContact CB-CG2 3.98Å; N430-I524 VanDerWaalsContact O-CG2 3.3Å; N430-I524 WeakPolarHBondContact O-CG2 3.42Å; K433-I524 HydrophobicContact CB-CG2 3.89Å; K433-I524 HydrophobicContact CD-CG2 4.34Å; K433-I524 PolarHBondContact NZ-O 3.38Å; K433-I524 VanDerWaalsContact NZ-O 3.11Å; L449-I524 HydrophobicContact CD1-CG2 4.49Å; H520-I524 WeakPolarHBondContact O-CD1 3.31Å; H520-I524 WeakPolarHBondContact O-CG1 3.41Å; H520-I524 PolarHBondContact O-N 3.28Å; L521-I524 PolarHBondContact O-N 3Å; A522-I524 PolarHBondContact O-N 2.81Å; I524-P528 WeakPolarHBondContact O-CG 3.49Å
525	A	97.4	Very high	96.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-93.5	-46.2	-168.9	0	0	0	0	0	112.6	L449 L453 L521 A522 L529	L449-A525 HydrophobicContact CB-CB 3.67Å; L453-A525 HydrophobicContact CB-CB 4.35Å; L453-A525 HydrophobicContact CD2-CB 4.18Å; L521-A525 HydrophobicContact CD1-CB 4.24Å; L521-A525 HydrophobicContact CG-CB 4.27Å; L521-A525 WeakPolarHBondContact O-CB 2.79Å; L521-A525 PolarHBondContact O-N 3.37Å; A522-A525 PolarHBondContact O-N 3.21Å; A525-L529 WeakPolarHBondContact O-CD1 3.41Å; A525-L529 WeakPolarHBondContact O-CG 3.39Å
526	L	97.6	Very high	96.5	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-50	-171.1	179.8	63	0	0	0	112.4	L450 L453 A522 L529 F530 M592 L597 A601	L450-L526 HydrophobicContact CD2-CB 4.43Å; L450-L526 HydrophobicContact CD2-CD1 4.17Å; L453-L526 HydrophobicContact CD2-CB 3.63Å; L453-L526 HydrophobicContact CD2-CD2 4.37Å; A522-L526 PolarHBondContact O-N 2.91Å; L526-L529 WeakPolarHBondContact O-CB 3.45Å; L526-L529 PolarHBondContact O-N 2.82Å; L526-F530 HydrophobicContact CD1-CE1 3.95Å; L526-F530 HydrophobicContact CD1-CZ 4.39Å; L526-F530 HydrophobicContact CD2-CZ 4.26Å; L526-F530 HydrophobicContact CG-CE1 4.02Å; L526-F530 HydrophobicContact CG-CZ 4.01Å; L526-M592 HydrophobicContact CD1-CE 4.04Å; L526-L597 HydrophobicContact CD1-CD2 4.31Å; L526-A601 HydrophobicContact CD2-CB 3.79Å
527	L	97	Very high	96.4	Very high	15 Å²	15	26.5 Å²	26.5	8%	0.079	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-39.6	-171.3	-80.2	-57.2	0	0	0	113.9	A522 L529 F530 P531 D643 D646 V647	A522-L527 HydrophobicContact CB-CD2 4.32Å; A522-L527 WeakPolarHBondContact O-CD2 3.41Å; A522-L527 PolarHBondContact O-N 3.31Å; L527-L529 PolarHBondContact O-N 3.46Å; L527-L529 VanDerWaalsContact O-N 3.08Å; L527-F530 HydrophobicContact CD1-CD2 3.74Å; L527-F530 HydrophobicContact CD1-CE2 3.51Å; L527-F530 HydrophobicContact CD1-CZ 4.45Å; L527-F530 PolarHBondContact O-N 3.33Å; L527-F530 VanDerWaalsContact O-N 3.14Å; L527-P531 VanDerWaalsContact O-CD 3.31Å; L527-P531 WeakPolarHBondContact O-CD 3.49Å; L527-D643 HydrophobicContact CD1-CB 4.18Å; L527-D643 HydrophobicContact CD2-CB 4Å; L527-D643 HydrophobicContact CG-CB 3.91Å; L527-D646 HydrophobicContact CD1-CB 3.59Å; L527-V647 HydrophobicContact CD1-CG2 4.3Å
528	P	95.8	Very high	96.3	Very high	34 Å²	34	33.7 Å²	33.7	22%	0.221	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-17.1	176.3	-25	37.6	0	0	0	113.6	H523 I524	H523-P528 VanDerWaalsContact O-CD 3.27Å; H523-P528 WeakPolarHBondContact O-CD 3.35Å; I524-P528 WeakPolarHBondContact O-CG 3.49Å
529	L	95.4	Very high	96.2	Very high	3 Å²	3	35 Å²	35	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-77.7	-24.7	178.3	-56.7	-178.7	0	0	0	112.9	F367 D446 L450 A525 L526 L527 R532 Y533 M592	F367-L529 HydrophobicContact CZ-CD1 4.25Å; D446-L529 HydrophobicContact CB-CD2 4.32Å; L450-L529 HydrophobicContact CD1-CD1 3.77Å; L450-L529 HydrophobicContact CD2-CD1 3.91Å; L450-L529 HydrophobicContact CG-CD1 4.09Å; A525-L529 WeakPolarHBondContact O-CD1 3.41Å; A525-L529 WeakPolarHBondContact O-CG 3.39Å; L526-L529 WeakPolarHBondContact O-CB 3.45Å; L526-L529 PolarHBondContact O-N 2.82Å; L527-L529 PolarHBondContact O-N 3.46Å; L527-L529 VanDerWaalsContact O-N 3.08Å; L529-R532 PolarHBondContact O-N 3.38Å; L529-Y533 VanDerWaalsContact O-CB 3.24Å; L529-Y533 WeakPolarHBondContact O-CB 3.22Å; L529-Y533 PolarHBondContact O-N 3.45Å; L529-M592 HydrophobicContact CB-CE 3.51Å; L529-M592 HydrophobicContact CB-SD 3.62Å; L529-M592 HydrophobicContact CD1-CE 4.37Å; L529-M592 HydrophobicContact CD1-SD 3.59Å; L529-M592 VanDerWaalsContact CD1-SD 3.59Å; L529-M592 HydrophobicContact CG-SD 4.24Å
530	F	95.6	Very high	96.1	Very high	17 Å²	17	35.7 Å²	35.7	8%	0.075	18%	0.175	C	C	.	.	H	α-helix	trans	-62.6	-54.9	179.9	-64.9	-13.6	0	0	0	113.3	L526 L527 R532 Y533 A534 M592 D646 V647 F650	L526-F530 HydrophobicContact CD1-CE1 3.95Å; L526-F530 HydrophobicContact CD1-CZ 4.39Å; L526-F530 HydrophobicContact CD2-CZ 4.26Å; L526-F530 HydrophobicContact CG-CE1 4.02Å; L526-F530 HydrophobicContact CG-CZ 4.01Å; L527-F530 HydrophobicContact CD1-CD2 3.74Å; L527-F530 HydrophobicContact CD1-CE2 3.51Å; L527-F530 HydrophobicContact CD1-CZ 4.45Å; L527-F530 PolarHBondContact O-N 3.33Å; L527-F530 VanDerWaalsContact O-N 3.14Å; F530-R532 VanDerWaalsContact C-N 3.28Å; F530-R532 PolarHBondContact O-N 2.67Å; F530-Y533 PolarHBondContact O-N 2.9Å; F530-A534 PolarHBondContact O-N 3.25Å; F530-M592 HydrophobicContact CD1-CE 3.46Å; F530-M592 VanDerWaalsContact CD1-CE 3.46Å; F530-M592 HydrophobicContact CE1-CE 3.6Å; F530-D646 HydrophobicContact CD2-CB 4.15Å; F530-D646 HydrophobicContact CE2-CB 4.3Å; F530-V647 HydrophobicContact CE2-CB 4.48Å; F530-V647 HydrophobicContact CE2-CG2 3.95Å; F530-V647 HydrophobicContact CZ-CG2 4.07Å; F530-F650 HydrophobicContact CB-CD2 4.16Å; F530-F650 HydrophobicContact CD1-CB 4.39Å; F530-F650 HydrophobicContact CD1-CD1 4.47Å; F530-F650 AromaticContact CD1-CD2 3.4Å; F530-F650 HydrophobicContact CD1-CD2 3.4Å; F530-F650 VanDerWaalsContact CD1-CD2 3.4Å; F530-F650 AromaticContact CD1-CE2 3.7Å; F530-F650 HydrophobicContact CD1-CE2 3.7Å; F530-F650 AromaticContact CD1-CG 3.84Å; F530-F650 HydrophobicContact CD1-CG 3.84Å; F530-F650 HydrophobicContact CD1-CZ 4.37Å; F530-F650 HydrophobicContact CD2-CB 4.09Å; F530-F650 HydrophobicContact CD2-CD2 4.33Å; F530-F650 HydrophobicContact CD2-CG 4.41Å; F530-F650 HydrophobicContact CE1-CB 4.24Å; F530-F650 HydrophobicContact CE1-CD1 4.02Å; F530-F650 AromaticContact CE1-CD2 3.79Å; F530-F650 HydrophobicContact CE1-CD2 3.79Å; F530-F650 HydrophobicContact CE1-CE1 4.35Å; F530-F650 HydrophobicContact CE1-CE2 4.12Å; F530-F650 AromaticContact CE1-CG 3.74Å; F530-F650 HydrophobicContact CE1-CG 3.74Å; F530-F650 HydrophobicContact CE1-CZ 4.4Å; F530-F650 HydrophobicContact CE2-CB 3.92Å; F530-F650 HydrophobicContact CE2-CG 4.31Å; F530-F650 HydrophobicContact CG-CB 4.33Å; F530-F650 AromaticContact CG-CD2 3.72Å; F530-F650 HydrophobicContact CG-CD2 3.72Å; F530-F650 HydrophobicContact CG-CE2 4.36Å; F530-F650 HydrophobicContact CG-CG 4.19Å; F530-F650 HydrophobicContact CZ-CB 4Å; F530-F650 HydrophobicContact CZ-CD1 4.33Å; F530-F650 HydrophobicContact CZ-CD2 4.4Å; F530-F650 AromaticContact CZ-CG 3.99Å; F530-F650 HydrophobicContact CZ-CG 3.99Å
531	P	93.3	Very high	95.9	Very high	88 Å²	88	39.6 Å²	39.6	57%	0.571	20%	0.196	S	C	*	.	H	α-helix	trans	-65.1	-33.1	176.8	25	-34	0	0	0	112.1	L527 A534 K535	L527-P531 VanDerWaalsContact O-CD 3.31Å; L527-P531 WeakPolarHBondContact O-CD 3.49Å; P531-A534 PolarHBondContact O-N 2.98Å; P531-K535 WeakPolarHBondContact O-CB 3.19Å; P531-K535 PolarHBondContact O-N 2.87Å
532	R	93	Very high	95.7	Very high	54 Å²	54	45 Å²	45	20%	0.204	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-44	174.3	-171.7	173.2	75.9	179.2	10.4	111.6	D446 L529 F530 K535 H536	D446-R532 IonicContact OD2-CZ 3.32Å; D446-R532 IonicContact OD2-NH1 3.96Å; D446-R532 PolarHBondContact OD2-NH1 3.16Å; D446-R532 IonicContact OD2-NH2 2.71Å; D446-R532 PolarHBondContact OD2-NH2 3.2Å; L529-R532 PolarHBondContact O-N 3.38Å; F530-R532 VanDerWaalsContact C-N 3.28Å; F530-R532 PolarHBondContact O-N 2.67Å; R532-K535 WeakPolarHBondContact O-CB 3.29Å; R532-K535 PolarHBondContact O-N 3.02Å; R532-H536 PolarHBondContact O-CD2 3.49Å; R532-H536 VanDerWaalsContact O-CD2 3.29Å; R532-H536 PolarHBondContact O-N 2.82Å
533	Y	95.2	Very high	95.7	Very high	1 Å²	1	46 Å²	46	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-61.2	-48	174.4	171.6	-103.4	0	0	0	111.1	L529 F530 K535 H536 K537 L585 N588 E589 K593 F650 Y654	L529-Y533 VanDerWaalsContact O-CB 3.24Å; L529-Y533 WeakPolarHBondContact O-CB 3.22Å; L529-Y533 PolarHBondContact O-N 3.45Å; F530-Y533 PolarHBondContact O-N 2.9Å; Y533-K535 VanDerWaalsContact C-N 3.27Å; Y533-K535 PolarHBondContact O-N 3.17Å; Y533-H536 CarbonylContact O-C 3.57Å; Y533-H536 PolarHBondContact O-N 3Å; Y533-H536 VanDerWaalsContact O-N 3.08Å; Y533-K537 HydrophobicContact CE1-CD 4.14Å; Y533-K537 WeakPolarHBondContact O-CB 3.36Å; Y533-K537 PolarHBondContact O-N 3.46Å; Y533-L585 HydrophobicContact CD2-CD1 4.27Å; Y533-L585 HydrophobicContact CE2-CD1 3.69Å; Y533-N588 HydrophobicContact CD2-CB 4.19Å; Y533-E589 HydrophobicContact CE2-CG 3.61Å; Y533-E589 PolarHBondContact OH-OE1 3.39Å; Y533-K593 WeakPolarHBondContact OH-CE 3.21Å; Y533-K593 PolarHBondContact OH-NZ 3.45Å; Y533-F650 AromaticContact CD1-CE2 3.6Å; Y533-F650 HydrophobicContact CD1-CE2 3.6Å; Y533-F650 HydrophobicContact CD1-CZ 4.16Å; Y533-F650 HydrophobicContact CE1-CE2 4.11Å; Y533-F650 HydrophobicContact CE1-CZ 4.36Å; Y533-F650 HydrophobicContact CG-CE2 4.27Å; Y533-Y654 HydrophobicContact CD1-CD2 4.41Å; Y533-Y654 HydrophobicContact CD1-CE2 4.39Å; Y533-Y654 AromaticContact CE1-CD1 3.72Å; Y533-Y654 HydrophobicContact CE1-CD1 3.72Å; Y533-Y654 HydrophobicContact CE1-CD2 4.1Å; Y533-Y654 AromaticContact CE1-CE1 3.92Å; Y533-Y654 HydrophobicContact CE1-CE1 3.92Å; Y533-Y654 HydrophobicContact CE1-CE2 4.32Å; Y533-Y654 AromaticContact CE1-CG 3.8Å; Y533-Y654 HydrophobicContact CE1-CG 3.8Å
534	A	94.3	Very high	95.6	Very high	16 Å²	16	45.6 Å²	45.6	13%	0.132	23%	0.227	C	C	.	.	H	α-helix	trans	-57	-41.6	177.4	0	0	0	0	0	111.9	F530 P531 K537 R538	F530-A534 PolarHBondContact O-N 3.25Å; P531-A534 PolarHBondContact O-N 2.98Å; A534-K537 PolarHBondContact O-N 3Å; A534-R538 WeakPolarHBondContact O-CG 3.46Å; A534-R538 PolarHBondContact O-N 3Å; A534-R538 VanDerWaalsContact O-N 3.13Å
535	K	94.7	Very high	95.4	Very high	150 Å²	150	49.1 Å²	49.1	65%	0.652	25%	0.246	S	C	*	.	H	α-helix	trans	-62.2	-48	173.1	-177.9	-177.3	178.1	-177.4	0	112	P531 R532 Y533 K537 R538 A539	P531-K535 WeakPolarHBondContact O-CB 3.19Å; P531-K535 PolarHBondContact O-N 2.87Å; R532-K535 WeakPolarHBondContact O-CB 3.29Å; R532-K535 PolarHBondContact O-N 3.02Å; Y533-K535 VanDerWaalsContact C-N 3.27Å; Y533-K535 PolarHBondContact O-N 3.17Å; K535-K537 VanDerWaalsContact C-N 3.26Å; K535-K537 PolarHBondContact O-N 3.37Å; K535-R538 PolarHBondContact O-N 3.45Å; K535-A539 PolarHBondContact O-N 3.43Å; K535-A539 VanDerWaalsContact O-N 3.09Å
536	H	94.9	Very high	95.1	Very high	38 Å²	38	53.2 Å²	53.2	18%	0.176	27%	0.267	C	S	.	.	H	α-helix	trans	-67.3	-28	-179.7	-72.9	-159.7	0	0	0	112.3	D369 R532 Y533 P540 Q584 N588	D369-H536 IonicContact OD2-CE1 3.76Å; R532-H536 PolarHBondContact O-CD2 3.49Å; R532-H536 VanDerWaalsContact O-CD2 3.29Å; R532-H536 PolarHBondContact O-N 2.82Å; Y533-H536 CarbonylContact O-C 3.57Å; Y533-H536 PolarHBondContact O-N 3Å; Y533-H536 VanDerWaalsContact O-N 3.08Å; H536-P540 WeakPolarHBondContact O-CD 3.41Å; H536-Q584 WeakPolarHBondContact ND1-CG 3.37Å; H536-N588 PolarHBondContact ND1-ND2 3.22Å
537	K	94.9	Very high	95	Very high	68 Å²	68	53.6 Å²	53.6	30%	0.296	27%	0.27	S	S	.	.	H	α-helix	trans	-72	-38.5	174.4	-173.3	-178.8	180	178.5	0	112.5	Y533 A534 K535 L585 Y654	Y533-K537 HydrophobicContact CE1-CD 4.14Å; Y533-K537 WeakPolarHBondContact O-CB 3.36Å; Y533-K537 PolarHBondContact O-N 3.46Å; A534-K537 PolarHBondContact O-N 3Å; K535-K537 VanDerWaalsContact C-N 3.26Å; K535-K537 PolarHBondContact O-N 3.37Å; K537-L585 HydrophobicContact CB-CD1 4.06Å; K537-Y654 HydrophobicContact CD-CD1 4.1Å; K537-Y654 HydrophobicContact CD-CE1 3.67Å; K537-Y654 VanDerWaalsContact NZ-CE1 3.3Å
538	R	95.9	Very high	94.9	Very high	151 Å²	151	59.8 Å²	59.8	57%	0.57	29%	0.292	S	S	*	.	H	α-helix	trans	-72.8	-36.4	178.4	-70.6	175.9	-174	171.9	3.7	112.5	A534 K535 I541 E542	A534-R538 WeakPolarHBondContact O-CG 3.46Å; A534-R538 PolarHBondContact O-N 3Å; A534-R538 VanDerWaalsContact O-N 3.13Å; K535-R538 PolarHBondContact O-N 3.45Å; R538-I541 WeakPolarHBondContact O-CB 3.37Å; R538-I541 PolarHBondContact O-N 3.3Å; R538-E542 PolarHBondContact O-N 3.42Å
539	A	96.6	Very high	94.6	Very high	28 Å²	28	65.2 Å²	65.2	23%	0.231	31%	0.308	C	S	.	.	H	α-helix	trans	-55.3	-46.1	-173.5	0	0	0	0	0	114.7	K535 I541 E542 L543	K535-A539 PolarHBondContact O-N 3.43Å; K535-A539 VanDerWaalsContact O-N 3.09Å; A539-I541 VanDerWaalsContact C-N 3.3Å; A539-I541 PolarHBondContact O-N 2.87Å; A539-E542 PolarHBondContact O-N 3.04Å; A539-L543 WeakPolarHBondContact O-CB 3.49Å; A539-L543 WeakPolarHBondContact O-CD1 3.48Å; A539-L543 WeakPolarHBondContact O-CG 3.49Å; A539-L543 PolarHBondContact O-N 3Å
540	P	96.8	Very high	94.4	Very high	14 Å²	14	65.7 Å²	65.7	9%	0.091	31%	0.311	C	S	.	.	H	α-helix	trans	-62.6	-33.5	175.1	-26.5	35.5	0	0	0	114.1	H536 S544 L578 A581 L585	H536-P540 WeakPolarHBondContact O-CD 3.41Å; P540-S544 WeakPolarHBondContact O-CB 3.06Å; P540-S544 PolarHBondContact O-N 3.02Å; P540-S544 PolarHBondContact O-OG 2.94Å; P540-L578 HydrophobicContact CB-CD1 3.82Å; P540-L578 VanDerWaalsContact O-CD1 3.3Å; P540-L578 WeakPolarHBondContact O-CD1 2.88Å; P540-A581 HydrophobicContact CG-CB 4.04Å; P540-L585 HydrophobicContact CG-CD2 4.12Å
541	I	94.8	Very high	94.3	Very high	97 Å²	97	68.7 Å²	68.7	50%	0.497	33%	0.325	S	S	.	.	H	α-helix	trans	-68.3	-50.6	178.6	-59.2	173	0	0	0	109.2	R538 A539 L543 S544 D545	R538-I541 WeakPolarHBondContact O-CB 3.37Å; R538-I541 PolarHBondContact O-N 3.3Å; A539-I541 VanDerWaalsContact C-N 3.3Å; A539-I541 PolarHBondContact O-N 2.87Å; I541-L543 PolarHBondContact O-N 3.34Å; I541-S544 WeakPolarHBondContact O-CB 3.48Å; I541-S544 PolarHBondContact O-N 3.43Å; I541-D545 PolarHBondContact O-N 2.7Å
542	E	93.7	Very high	94.1	Very high	117 Å²	117	74 Å²	74	55%	0.547	33%	0.333	S	S	.	.	H	α-helix	trans	-59.5	-47.7	178.1	-67.9	172.5	-179.8	0	0	111.5	R538 A539 S544 D545 D546	R538-E542 PolarHBondContact O-N 3.42Å; A539-E542 PolarHBondContact O-N 3.04Å; E542-S544 VanDerWaalsContact C-N 3.32Å; E542-S544 PolarHBondContact O-N 3.23Å; E542-D545 PolarHBondContact O-N 2.65Å; E542-D546 PolarHBondContact O-N 2.6Å
543	L	97.4	Very high	93.9	Very high	28 Å²	28	72.8 Å²	72.8	15%	0.147	33%	0.331	C	S	.	.	H	α-helix	trans	-62.4	-38.6	176.6	-71.2	168.3	0	0	0	112.1	A539 I541 I547 L574 K577 L578 A581	A539-L543 WeakPolarHBondContact O-CB 3.49Å; A539-L543 WeakPolarHBondContact O-CD1 3.48Å; A539-L543 WeakPolarHBondContact O-CG 3.49Å; A539-L543 PolarHBondContact O-N 3Å; I541-L543 PolarHBondContact O-N 3.34Å; L543-I547 WeakPolarHBondContact O-CB 3.35Å; L543-I547 WeakPolarHBondContact O-CD1 3.14Å; L543-I547 WeakPolarHBondContact O-CG1 3.46Å; L543-I547 PolarHBondContact O-N 2.97Å; L543-L574 HydrophobicContact CD2-CD2 3.68Å; L543-K577 HydrophobicContact CD1-CB 4.15Å; L543-K577 HydrophobicContact CD2-CB 4.27Å; L543-L578 HydrophobicContact CB-CB 4.2Å; L543-L578 HydrophobicContact CB-CD1 4.1Å; L543-L578 HydrophobicContact CD1-CB 4.48Å; L543-A581 HydrophobicContact CD1-CB 3.99Å
544	S	96.8	Very high	93.7	Very high	30 Å²	30	76.7 Å²	76.7	21%	0.21	35%	0.349	C	S	.	.	H	α-helix	trans	-66.2	-39.5	176.4	-65.3	0	0	0	0	111.9	P540 I541 E542 I547 R548 L578	P540-S544 WeakPolarHBondContact O-CB 3.06Å; P540-S544 PolarHBondContact O-N 3.02Å; P540-S544 PolarHBondContact O-OG 2.94Å; I541-S544 WeakPolarHBondContact O-CB 3.48Å; I541-S544 PolarHBondContact O-N 3.43Å; E542-S544 VanDerWaalsContact C-N 3.32Å; E542-S544 PolarHBondContact O-N 3.23Å; S544-I547 PolarHBondContact O-N 3.08Å; S544-R548 WeakPolarHBondContact O-CB 3.46Å; S544-R548 VanDerWaalsContact O-CG 3.23Å; S544-R548 WeakPolarHBondContact O-CG 3.45Å; S544-R548 PolarHBondContact O-N 3.33Å; S544-L578 WeakPolarHBondContact OG-CD1 3.42Å
545	D	92.2	Very high	93.4	Very high	81 Å²	81	84.2 Å²	84.2	43%	0.433	38%	0.379	S	S	.	.	H	α-helix	trans	-69.3	-40	177.9	-73.9	-17.6	0	0	0	111.7	I541 E542 I547 R548 W549	I541-D545 PolarHBondContact O-N 2.7Å; E542-D545 PolarHBondContact O-N 2.65Å; D545-I547 PolarHBondContact O-N 2.88Å; D545-R548 PolarHBondContact O-N 3.1Å; D545-R548 IonicContact OD1-NH1 3.57Å; D545-R548 PolarHBondContact OD1-NH1 3.49Å; D545-W549 WeakPolarHBondContact O-CB 3.38Å; D545-W549 PolarHBondContact O-N 2.98Å
546	D	91.3	Very high	92.8	Very high	86 Å²	86	82 Å²	82	46%	0.46	37%	0.371	S	S	.	.	H	α-helix	trans	-60.7	-43.1	172.4	-76.1	-15.3	0	0	0	112	E542 W549 L550 L574	E542-D546 PolarHBondContact O-N 2.6Å; D546-W549 PolarHBondContact O-N 3.14Å; D546-L550 PolarHBondContact O-N 3.28Å; D546-L574 HydrophobicContact CB-CD1 4.32Å
547	I	96.6	Very high	92.5	Very high	10 Å²	10	80.5 Å²	80.5	5%	0.051	36%	0.364	C	S	.	.	H	α-helix	trans	-63.2	-50.6	176	-71.5	162.2	0	0	0	110.3	L543 S544 D545 W549 L550 E551 L571 L574 K575 L578	L543-I547 WeakPolarHBondContact O-CB 3.35Å; L543-I547 WeakPolarHBondContact O-CD1 3.14Å; L543-I547 WeakPolarHBondContact O-CG1 3.46Å; L543-I547 PolarHBondContact O-N 2.97Å; S544-I547 PolarHBondContact O-N 3.08Å; D545-I547 PolarHBondContact O-N 2.88Å; I547-W549 PolarHBondContact O-N 3.42Å; I547-L550 PolarHBondContact O-N 3.41Å; I547-L550 VanDerWaalsContact O-N 3.15Å; I547-E551 HydrophobicContact CG2-CG 4.28Å; I547-E551 WeakPolarHBondContact O-CG 3.45Å; I547-E551 PolarHBondContact O-N 3.03Å; I547-L571 HydrophobicContact CG2-CD2 4.25Å; I547-L574 HydrophobicContact CD1-CB 4.11Å; I547-L574 HydrophobicContact CG1-CB 3.72Å; I547-L574 HydrophobicContact CG1-CD1 4.47Å; I547-K575 HydrophobicContact CD1-CG 3.9Å; I547-K575 HydrophobicContact CG1-CG 4.39Å; I547-K575 HydrophobicContact CG2-CG 4.49Å; I547-L578 HydrophobicContact CD1-CB 4.05Å; I547-L578 HydrophobicContact CD1-CD2 3.68Å
548	R	94.6	Very high	92.3	Very high	144 Å²	144	81 Å²	81	54%	0.543	37%	0.369	S	S	.	.	H	α-helix	trans	-59.2	-37.4	178.6	-75.7	169.4	-177.8	167.8	-1.3	111.7	S544 D545 R552	S544-R548 WeakPolarHBondContact O-CB 3.46Å; S544-R548 VanDerWaalsContact O-CG 3.23Å; S544-R548 WeakPolarHBondContact O-CG 3.45Å; S544-R548 PolarHBondContact O-N 3.33Å; D545-R548 PolarHBondContact O-N 3.1Å; D545-R548 IonicContact OD1-NH1 3.57Å; D545-R548 PolarHBondContact OD1-NH1 3.49Å; R548-R552 WeakPolarHBondContact O-CB 3.39Å; R548-R552 PolarHBondContact O-N 3.46Å
549	W	88.1	Confident	91.9	Very high	149 Å²	149	82.6 Å²	82.6	56%	0.564	38%	0.375	S	S	*	.	H	α-helix	trans	-64.1	-48.8	175.5	-177.8	91.3	0	0	0	111.1	D545 D546 I547 E551 R552 N553	D545-W549 WeakPolarHBondContact O-CB 3.38Å; D545-W549 PolarHBondContact O-N 2.98Å; D546-W549 PolarHBondContact O-N 3.14Å; I547-W549 PolarHBondContact O-N 3.42Å; W549-E551 PolarHBondContact O-N 3.37Å; W549-R552 PolarHBondContact O-N 3.37Å; W549-N553 VanDerWaalsContact CE2-ND2 3.35Å; W549-N553 PolarHBondContact NE1-ND2 3.01Å; W549-N553 PolarHBondContact O-N 3.47Å; W549-N553 VanDerWaalsContact O-N 3.11Å; W549-N553 PolarHBondContact O-ND2 3.39Å
550	L	91.3	Very high	91.4	Very high	13 Å²	13	85.8 Å²	85.8	7%	0.068	38%	0.381	C	S	.	.	H	α-helix	trans	-62	-41.4	178	-78	171.9	0	0	0	112.6	D546 I547 E554 W557 N567 A570 L571 L574	D546-L550 PolarHBondContact O-N 3.28Å; I547-L550 PolarHBondContact O-N 3.41Å; I547-L550 VanDerWaalsContact O-N 3.15Å; L550-E554 PolarHBondContact O-N 3.1Å; L550-W557 PolarHBondContact O-NE1 3.47Å; L550-N567 HydrophobicContact CD2-CB 4.34Å; L550-A570 HydrophobicContact CD1-CB 4.43Å; L550-L571 HydrophobicContact CB-CD1 4.41Å; L550-L571 HydrophobicContact CB-CD2 3.53Å; L550-L571 HydrophobicContact CB-CG 3.96Å; L550-L571 HydrophobicContact CD1-CD2 3.9Å; L550-L571 HydrophobicContact CD1-CG 4Å; L550-L571 HydrophobicContact CG-CD2 4.38Å; L550-L574 HydrophobicContact CD1-CD1 3.57Å
551	E	94.2	Very high	91	Very high	79 Å²	79	90.3 Å²	90.3	37%	0.369	41%	0.411	S	S	.	.	H	α-helix	trans	-67.9	-42.8	178.2	-70.9	177.9	158.2	0	0	111.8	I547 W549 N553 E554 L571 K575	I547-E551 HydrophobicContact CG2-CG 4.28Å; I547-E551 WeakPolarHBondContact O-CG 3.45Å; I547-E551 PolarHBondContact O-N 3.03Å; W549-E551 PolarHBondContact O-N 3.37Å; E551-N553 VanDerWaalsContact C-N 3.29Å; E551-N553 PolarHBondContact O-N 3.42Å; E551-E554 VanDerWaalsContact O-CB 3.24Å; E551-E554 WeakPolarHBondContact O-CB 3.41Å; E551-E554 PolarHBondContact O-N 3.41Å; E551-L571 HydrophobicContact CG-CD2 3.99Å; E551-K575 WeakPolarHBondContact OE1-CE 3.43Å; E551-K575 IonicContact OE1-NZ 2.8Å; E551-K575 PolarHBondContact OE1-NZ 3.27Å
552	R	89.9	Confident	90.6	Very high	199 Å²	199	89.7 Å²	89.7	75%	0.751	42%	0.42	S	S	*	.	H	α-helix	trans	-61.1	-38.6	177.2	-174.5	-177.3	-63.4	162.9	1.5	112.1	R548 W549 E554	R548-R552 WeakPolarHBondContact O-CB 3.39Å; R548-R552 PolarHBondContact O-N 3.46Å; W549-R552 PolarHBondContact O-N 3.37Å; R552-E554 VanDerWaalsContact C-N 3.31Å; R552-E554 PolarHBondContact O-N 3.03Å
553	N	87.5	Confident	90.3	Very high	29 Å²	29	86.1 Å²	86.1	16%	0.155	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	11.3	-179.3	-62.5	-69.9	0	0	0	113.3	W549 E551 K555 E556 W557	W549-N553 VanDerWaalsContact CE2-ND2 3.35Å; W549-N553 PolarHBondContact NE1-ND2 3.01Å; W549-N553 PolarHBondContact O-N 3.47Å; W549-N553 VanDerWaalsContact O-N 3.11Å; W549-N553 PolarHBondContact O-ND2 3.39Å; E551-N553 VanDerWaalsContact C-N 3.29Å; E551-N553 PolarHBondContact O-N 3.42Å; N553-K555 VanDerWaalsContact C-N 3.26Å; N553-K555 PolarHBondContact O-N 2.97Å; N553-E556 WeakPolarHBondContact O-CB 3.47Å; N553-E556 PolarHBondContact O-N 3.24Å; N553-W557 PolarHBondContact O-N 3.11Å; N553-W557 PolarHBondContact O-NE1 3Å
554	E	91	Very high	89.9	Confident	84 Å²	84	84.9 Å²	84.9	39%	0.393	40%	0.399	S	S	.	.	H	α-helix	trans	-53.8	-40.9	-176	178	165.4	-157.5	0	0	113.9	L550 E551 R552 E556 W557 I558	L550-E554 PolarHBondContact O-N 3.1Å; E551-E554 VanDerWaalsContact O-CB 3.24Å; E551-E554 WeakPolarHBondContact O-CB 3.41Å; E551-E554 PolarHBondContact O-N 3.41Å; R552-E554 VanDerWaalsContact C-N 3.31Å; R552-E554 PolarHBondContact O-N 3.03Å; E554-E556 PolarHBondContact O-N 3.03Å; E554-E556 VanDerWaalsContact O-N 3.15Å; E554-W557 VanDerWaalsContact CA-CE2 3.43Å; E554-W557 HydrophobicContact CB-CH2 4.28Å; E554-W557 HydrophobicContact CB-CZ2 3.7Å; E554-W557 HydrophobicContact CG-CH2 3.67Å; E554-W557 HydrophobicContact CG-CZ2 3.62Å; E554-W557 HydrophobicContact CG-CZ3 4.32Å; E554-W557 PolarHBondContact O-N 3Å; E554-I558 VanDerWaalsContact O-CB 3.29Å; E554-I558 WeakPolarHBondContact O-CB 3.34Å; E554-I558 WeakPolarHBondContact O-CG2 3.45Å; E554-I558 PolarHBondContact O-N 3.38Å; E554-I558 VanDerWaalsContact O-N 3.07Å
555	K	88.8	Confident	89.7	Confident	173 Å²	173	92.3 Å²	92.3	75%	0.752	42%	0.422	S	S	*	.	H	α-helix	trans	-61.1	-25.3	179.8	-63.1	-178.4	-177.9	177.5	0	113.5	N553 R559	N553-K555 VanDerWaalsContact C-N 3.26Å; N553-K555 PolarHBondContact O-N 2.97Å; K555-R559 PolarHBondContact O-NE 3.28Å
556	E	81.7	Confident	89.7	Confident	103 Å²	103	95.3 Å²	95.3	48%	0.481	43%	0.427	S	S	.	.	H	α-helix	trans	-84.6	-50.4	-176.5	-60.1	-179.1	175.8	0	0	110.9	N553 E554	N553-E556 WeakPolarHBondContact O-CB 3.47Å; N553-E556 PolarHBondContact O-N 3.24Å; E554-E556 PolarHBondContact O-N 3.03Å; E554-E556 VanDerWaalsContact O-N 3.15Å
557	W	87.7	Confident	89.8	Confident	8 Å²	8	91.6 Å²	91.6	3%	0.03	41%	0.408	C	S	.	.	H	α-helix	trans	-81.2	-19.4	-175	54.7	-107.7	0	0	0	113.8	L550 N553 E554 R559 Y560 L563 A564 N567 R568 L571	L550-W557 PolarHBondContact O-NE1 3.47Å; N553-W557 PolarHBondContact O-N 3.11Å; N553-W557 PolarHBondContact O-NE1 3Å; E554-W557 VanDerWaalsContact CA-CE2 3.43Å; E554-W557 HydrophobicContact CB-CH2 4.28Å; E554-W557 HydrophobicContact CB-CZ2 3.7Å; E554-W557 HydrophobicContact CG-CH2 3.67Å; E554-W557 HydrophobicContact CG-CZ2 3.62Å; E554-W557 HydrophobicContact CG-CZ3 4.32Å; E554-W557 PolarHBondContact O-N 3Å; W557-R559 PolarHBondContact O-N 3.22Å; W557-Y560 PolarHBondContact O-N 2.95Å; W557-L563 HydrophobicContact CB-CD2 3.53Å; W557-L563 HydrophobicContact CB-CG 3.78Å; W557-A564 HydrophobicContact CE3-CB 4.04Å; W557-A564 HydrophobicContact CZ3-CB 4.24Å; W557-N567 WeakPolarHBondContact CB-ND2 3.45Å; W557-N567 VanDerWaalsContact CD1-ND2 3.25Å; W557-N567 HydrophobicContact CD2-CB 3.8Å; W557-N567 HydrophobicContact CE3-CB 4Å; W557-N567 HydrophobicContact CG-CB 4.27Å; W557-N567 HydrophobicContact CH2-CB 4.48Å; W557-N567 HydrophobicContact CZ2-CB 4.28Å; W557-N567 HydrophobicContact CZ3-CB 4.33Å; W557-R568 HydrophobicContact CH2-CG 4.17Å; W557-R568 HydrophobicContact CZ3-CG 4.1Å; W557-L571 HydrophobicContact CH2-CD1 4.26Å; W557-L571 HydrophobicContact CZ2-CD1 3.93Å
558	I	91.5	Very high	89.7	Confident	77 Å²	77	97.5 Å²	97.5	40%	0.395	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-24.2	177.5	-158.5	163.7	0	0	0	112.7	E554 Y560	E554-I558 VanDerWaalsContact O-CB 3.29Å; E554-I558 WeakPolarHBondContact O-CB 3.34Å; E554-I558 WeakPolarHBondContact O-CG2 3.45Å; E554-I558 PolarHBondContact O-N 3.38Å; E554-I558 VanDerWaalsContact O-N 3.07Å; I558-Y560 PolarHBondContact O-N 3.47Å
559	R	86.9	Confident	89.7	Confident	185 Å²	185	95.3 Å²	95.3	70%	0.698	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-22.1	178.1	-61.3	-179.1	-176.5	-173	-0	113	K555 W557	K555-R559 PolarHBondContact O-NE 3.28Å; W557-R559 PolarHBondContact O-N 3.22Å
560	Y	87	Confident	90	Very high	95 Å²	95	89.7 Å²	89.7	37%	0.373	41%	0.413	S	S	.	.	S	Bend	trans	-111.9	107.4	-176.2	-60.5	-77.6	0	0	0	110.1	W557 I558 A562 L563 A564 W819	W557-Y560 PolarHBondContact O-N 2.95Å; I558-Y560 PolarHBondContact O-N 3.47Å; Y560-A562 PolarHBondContact O-N 3.3Å; Y560-L563 HydrophobicContact CD2-CD2 4.36Å; Y560-L563 PolarHBondContact O-N 3.21Å; Y560-L563 VanDerWaalsContact O-N 3.11Å; Y560-A564 WeakPolarHBondContact O-CB 3.46Å; Y560-A564 PolarHBondContact O-N 2.95Å; Y560-W819 HydrophobicContact CD2-CH2 4.4Å; Y560-W819 HydrophobicContact CD2-CZ3 4.44Å; Y560-W819 HydrophobicContact CE2-CD2 4.36Å; Y560-W819 HydrophobicContact CE2-CE3 4.03Å; Y560-W819 AromaticContact CE2-CH2 3.67Å; Y560-W819 HydrophobicContact CE2-CH2 3.67Å; Y560-W819 HydrophobicContact CE2-CZ2 4.01Å; Y560-W819 AromaticContact CE2-CZ3 3.67Å; Y560-W819 HydrophobicContact CE2-CZ3 3.67Å; Y560-W819 AromaticContact CZ-CE3 3.85Å; Y560-W819 AromaticContact CZ-CZ3 3.96Å; Y560-W819 VanDerWaalsContact OH-CD2 3.31Å
561	P	87.3	Confident	90.3	Very high	110 Å²	110	89.9 Å²	89.9	71%	0.714	41%	0.414	S	S	*	.	H	α-helix	trans	-55.3	-43.1	-169.7	-29.6	35.2	0	0	0	115.4	A564 R565	P561-A564 PolarHBondContact O-N 3.21Å; P561-R565 PolarHBondContact O-N 3.4Å
562	A	87.2	Confident	90.4	Very high	84 Å²	84	91.9 Å²	91.9	69%	0.694	42%	0.422	S	S	*	.	H	α-helix	trans	-66.2	-43.7	178.9	0	0	0	0	0	112.1	Y560 R565 R566	Y560-A562 PolarHBondContact O-N 3.3Å; A562-R565 PolarHBondContact O-N 3.07Å; A562-R566 PolarHBondContact O-N 3.28Å; A562-R566 VanDerWaalsContact O-N 3.07Å
563	L	86.6	Confident	90.7	Very high	42 Å²	42	87.3 Å²	87.3	22%	0.22	41%	0.411	C	S	.	.	H	α-helix	trans	-67.2	-40.2	177.5	-172.9	63	0	0	0	111.3	W557 Y560 R566 N567	W557-L563 HydrophobicContact CB-CD2 3.53Å; W557-L563 HydrophobicContact CB-CG 3.78Å; Y560-L563 HydrophobicContact CD2-CD2 4.36Å; Y560-L563 PolarHBondContact O-N 3.21Å; Y560-L563 VanDerWaalsContact O-N 3.11Å; L563-R566 VanDerWaalsContact CD1-CZ 3.5Å; L563-R566 PolarHBondContact O-N 3.01Å; L563-N567 WeakPolarHBondContact O-CB 3.15Å; L563-N567 PolarHBondContact O-N 3.27Å
564	A	89.8	Confident	91.2	Very high	2 Å²	2	87.3 Å²	87.3	2%	0.017	41%	0.411	C	S	.	.	H	α-helix	trans	-61.1	-45.1	175.9	0	0	0	0	0	112.1	W557 Y560 P561 R568	W557-A564 HydrophobicContact CE3-CB 4.04Å; W557-A564 HydrophobicContact CZ3-CB 4.24Å; Y560-A564 WeakPolarHBondContact O-CB 3.46Å; Y560-A564 PolarHBondContact O-N 2.95Å; P561-A564 PolarHBondContact O-N 3.21Å; A564-R568 WeakPolarHBondContact O-CB 3.45Å; A564-R568 WeakPolarHBondContact O-CG 3.41Å; A564-R568 PolarHBondContact O-N 3.29Å
565	R	91.8	Very high	91.6	Very high	186 Å²	186	88.1 Å²	88.1	70%	0.702	41%	0.413	S	S	*	.	H	α-helix	trans	-60.1	-46.6	174.5	-175.4	179.4	176.7	-174.8	-1	111.2	P561 A562 L569	P561-R565 PolarHBondContact O-N 3.4Å; A562-R565 PolarHBondContact O-N 3.07Å; R565-L569 HydrophobicContact CG-CD1 4.42Å; R565-L569 WeakPolarHBondContact O-CG 3.49Å; R565-L569 PolarHBondContact O-N 3.36Å
566	R	92.6	Very high	91.9	Very high	143 Å²	143	86.9 Å²	86.9	54%	0.54	40%	0.404	S	S	.	.	H	α-helix	trans	-60.8	-51.2	178.7	-171.4	-168	75.4	168.8	6.5	112.1	A562 L563 R568 L569 A570	A562-R566 PolarHBondContact O-N 3.28Å; A562-R566 VanDerWaalsContact O-N 3.07Å; L563-R566 VanDerWaalsContact CD1-CZ 3.5Å; L563-R566 PolarHBondContact O-N 3.01Å; R566-R568 PolarHBondContact O-N 3.11Å; R566-L569 PolarHBondContact O-N 2.51Å; R566-A570 WeakPolarHBondContact O-CB 3.47Å; R566-A570 PolarHBondContact O-N 3.42Å
567	N	93.5	Very high	92.6	Very high	9 Å²	9	88.4 Å²	88.4	5%	0.048	41%	0.409	C	S	.	.	H	α-helix	trans	-69.2	-34	-175.9	-72.4	5.3	0	0	0	112.1	L550 W557 L563 A570 L571	L550-N567 HydrophobicContact CD2-CB 4.34Å; W557-N567 WeakPolarHBondContact CB-ND2 3.45Å; W557-N567 VanDerWaalsContact CD1-ND2 3.25Å; W557-N567 HydrophobicContact CD2-CB 3.8Å; W557-N567 HydrophobicContact CE3-CB 4Å; W557-N567 HydrophobicContact CG-CB 4.27Å; W557-N567 HydrophobicContact CH2-CB 4.48Å; W557-N567 HydrophobicContact CZ2-CB 4.28Å; W557-N567 HydrophobicContact CZ3-CB 4.33Å; L563-N567 WeakPolarHBondContact O-CB 3.15Å; L563-N567 PolarHBondContact O-N 3.27Å; N567-A570 PolarHBondContact O-N 3.25Å; N567-L571 WeakPolarHBondContact O-CB 3.34Å; N567-L571 WeakPolarHBondContact O-CG 3.24Å; N567-L571 PolarHBondContact O-N 2.97Å
568	R	94.9	Very high	93.1	Very high	134 Å²	134	89.6 Å²	89.6	51%	0.506	42%	0.416	S	S	.	.	H	α-helix	trans	-61.9	-43	170.7	-75.1	175	-174.6	147.1	1.7	112.4	W557 A564 R566 K572	W557-R568 HydrophobicContact CH2-CG 4.17Å; W557-R568 HydrophobicContact CZ3-CG 4.1Å; A564-R568 WeakPolarHBondContact O-CB 3.45Å; A564-R568 WeakPolarHBondContact O-CG 3.41Å; A564-R568 PolarHBondContact O-N 3.29Å; R566-R568 PolarHBondContact O-N 3.11Å; R568-K572 PolarHBondContact O-N 3.05Å; R568-K572 VanDerWaalsContact O-N 3.1Å
569	L	94.7	Very high	93.2	Very high	97 Å²	97	91 Å²	91	51%	0.508	42%	0.421	S	S	.	.	H	α-helix	trans	-65.5	-44.4	175.2	-71.1	171.9	0	0	0	111.3	R565 R566 L571 K572 L573	R565-L569 HydrophobicContact CG-CD1 4.42Å; R565-L569 WeakPolarHBondContact O-CG 3.49Å; R565-L569 PolarHBondContact O-N 3.36Å; R566-L569 PolarHBondContact O-N 2.51Å; L569-L571 PolarHBondContact O-N 3.04Å; L569-K572 PolarHBondContact O-N 2.91Å; L569-L573 WeakPolarHBondContact O-CG 3.36Å; L569-L573 PolarHBondContact O-N 3.27Å
570	A	94.4	Very high	93.5	Very high	32 Å²	32	88.7 Å²	88.7	26%	0.264	42%	0.416	S	S	.	.	H	α-helix	trans	-58.8	-46.8	175.9	0	0	0	0	0	111.7	L550 R566 N567 K572 L573 L574	L550-A570 HydrophobicContact CD1-CB 4.43Å; R566-A570 WeakPolarHBondContact O-CB 3.47Å; R566-A570 PolarHBondContact O-N 3.42Å; N567-A570 PolarHBondContact O-N 3.25Å; A570-K572 VanDerWaalsContact C-N 3.34Å; A570-K572 PolarHBondContact O-N 3.2Å; A570-L573 PolarHBondContact O-N 3.06Å; A570-L574 WeakPolarHBondContact O-CB 3.45Å; A570-L574 WeakPolarHBondContact O-CG 3.49Å; A570-L574 PolarHBondContact O-N 2.85Å
571	L	96.7	Very high	93.9	Very high	17 Å²	17	85 Å²	85	9%	0.089	41%	0.406	C	S	.	.	H	α-helix	trans	-56.1	-45.9	174.6	-83.1	172.4	0	0	0	112	I547 L550 E551 W557 N567 L569 L573 L574 K575	I547-L571 HydrophobicContact CG2-CD2 4.25Å; L550-L571 HydrophobicContact CB-CD1 4.41Å; L550-L571 HydrophobicContact CB-CD2 3.53Å; L550-L571 HydrophobicContact CB-CG 3.96Å; L550-L571 HydrophobicContact CD1-CD2 3.9Å; L550-L571 HydrophobicContact CD1-CG 4Å; L550-L571 HydrophobicContact CG-CD2 4.38Å; E551-L571 HydrophobicContact CG-CD2 3.99Å; W557-L571 HydrophobicContact CH2-CD1 4.26Å; W557-L571 HydrophobicContact CZ2-CD1 3.93Å; N567-L571 WeakPolarHBondContact O-CB 3.34Å; N567-L571 WeakPolarHBondContact O-CG 3.24Å; N567-L571 PolarHBondContact O-N 2.97Å; L569-L571 PolarHBondContact O-N 3.04Å; L571-L573 VanDerWaalsContact C-N 3.35Å; L571-L573 PolarHBondContact O-N 3.09Å; L571-L574 PolarHBondContact O-N 3.2Å; L571-K575 WeakPolarHBondContact O-CB 2.99Å; L571-K575 VanDerWaalsContact O-CG 3.28Å; L571-K575 WeakPolarHBondContact O-CG 3.29Å; L571-K575 PolarHBondContact O-N 3.36Å
572	K	97.3	Very high	94.2	Very high	121 Å²	121	82.1 Å²	82.1	53%	0.526	39%	0.386	S	S	.	.	H	α-helix	trans	-61.6	-42.1	177.4	-173.6	177.8	-179.6	178.7	0	111.9	R568 L569 A570 R576	R568-K572 PolarHBondContact O-N 3.05Å; R568-K572 VanDerWaalsContact O-N 3.1Å; L569-K572 PolarHBondContact O-N 2.91Å; A570-K572 VanDerWaalsContact C-N 3.34Å; A570-K572 PolarHBondContact O-N 3.2Å; K572-R576 WeakPolarHBondContact O-CG 3.33Å; K572-R576 PolarHBondContact O-N 3.27Å
573	L	97	Very high	94.5	Very high	102 Å²	102	79.7 Å²	79.7	53%	0.534	36%	0.359	S	S	.	.	H	α-helix	trans	-70.3	-43.4	178.6	-68.8	174.2	0	0	0	112.3	L569 A570 L571 R576 K577	L569-L573 WeakPolarHBondContact O-CG 3.36Å; L569-L573 PolarHBondContact O-N 3.27Å; A570-L573 PolarHBondContact O-N 3.06Å; L571-L573 VanDerWaalsContact C-N 3.35Å; L571-L573 PolarHBondContact O-N 3.09Å; L573-R576 PolarHBondContact O-N 2.76Å; L573-K577 WeakPolarHBondContact O-CG 3.3Å; L573-K577 PolarHBondContact O-N 3.43Å
574	L	97.7	Very high	94.8	Very high	30 Å²	30	78.2 Å²	78.2	16%	0.157	35%	0.351	C	S	.	.	H	α-helix	trans	-63.1	-42.8	177.4	-73.2	169.8	0	0	0	111.3	L543 D546 I547 L550 A570 L571 R576 K577 L578	L543-L574 HydrophobicContact CD2-CD2 3.68Å; D546-L574 HydrophobicContact CB-CD1 4.32Å; I547-L574 HydrophobicContact CD1-CB 4.11Å; I547-L574 HydrophobicContact CG1-CB 3.72Å; I547-L574 HydrophobicContact CG1-CD1 4.47Å; L550-L574 HydrophobicContact CD1-CD1 3.57Å; A570-L574 WeakPolarHBondContact O-CB 3.45Å; A570-L574 WeakPolarHBondContact O-CG 3.49Å; A570-L574 PolarHBondContact O-N 2.85Å; L571-L574 PolarHBondContact O-N 3.2Å; L574-R576 VanDerWaalsContact C-N 3.34Å; L574-R576 PolarHBondContact O-N 3.26Å; L574-K577 PolarHBondContact O-N 3.27Å; L574-L578 WeakPolarHBondContact O-CB 3.26Å; L574-L578 PolarHBondContact O-N 3.03Å
575	K	97.8	Very high	95	Very high	100 Å²	100	79.2 Å²	79.2	44%	0.435	36%	0.357	S	S	.	.	H	α-helix	trans	-60.2	-41.4	175.7	-75.1	179.6	179.2	-172.5	0	112.3	I547 E551 L571 L578 E579	I547-K575 HydrophobicContact CD1-CG 3.9Å; I547-K575 HydrophobicContact CG1-CG 4.39Å; I547-K575 HydrophobicContact CG2-CG 4.49Å; E551-K575 WeakPolarHBondContact OE1-CE 3.43Å; E551-K575 IonicContact OE1-NZ 2.8Å; E551-K575 PolarHBondContact OE1-NZ 3.27Å; L571-K575 WeakPolarHBondContact O-CB 2.99Å; L571-K575 VanDerWaalsContact O-CG 3.28Å; L571-K575 WeakPolarHBondContact O-CG 3.29Å; L571-K575 PolarHBondContact O-N 3.36Å; K575-L578 PolarHBondContact O-N 3.25Å; K575-E579 PolarHBondContact O-N 3.34Å
576	R	96.4	Very high	95.1	Very high	148 Å²	148	70.4 Å²	70.4	56%	0.558	32%	0.323	S	S	*	.	H	α-helix	trans	-66.2	-41.7	174.1	-72.7	174.4	175.5	-173.1	-7.8	112.7	K572 L573 L574 L578 E579 K580	K572-R576 WeakPolarHBondContact O-CG 3.33Å; K572-R576 PolarHBondContact O-N 3.27Å; L573-R576 PolarHBondContact O-N 2.76Å; L574-R576 VanDerWaalsContact C-N 3.34Å; L574-R576 PolarHBondContact O-N 3.26Å; R576-L578 VanDerWaalsContact C-N 3.34Å; R576-E579 PolarHBondContact O-N 3.35Å; R576-K580 PolarHBondContact O-N 2.89Å
577	K	96.9	Very high	95.1	Very high	134 Å²	134	63.6 Å²	63.6	58%	0.583	30%	0.298	S	S	*	.	H	α-helix	trans	-63.5	-41.2	175.2	-76.2	-176.1	177.2	-174.1	0	111.6	L543 L573 L574 K580 A581	L543-K577 HydrophobicContact CD1-CB 4.15Å; L543-K577 HydrophobicContact CD2-CB 4.27Å; L573-K577 WeakPolarHBondContact O-CG 3.3Å; L573-K577 PolarHBondContact O-N 3.43Å; L574-K577 PolarHBondContact O-N 3.27Å; K577-K580 PolarHBondContact O-N 3.21Å; K577-A581 VanDerWaalsContact O-CB 3.28Å; K577-A581 WeakPolarHBondContact O-CB 3.41Å; K577-A581 PolarHBondContact O-N 3.05Å
578	L	97.2	Very high	95.2	Very high	34 Å²	34	63.3 Å²	63.3	18%	0.178	30%	0.296	C	S	.	.	H	α-helix	trans	-60.3	-50.1	175.7	174.9	61.2	0	0	0	110.1	P540 L543 S544 I547 L574 K575 R576 K580 A581 T582	P540-L578 HydrophobicContact CB-CD1 3.82Å; P540-L578 VanDerWaalsContact O-CD1 3.3Å; P540-L578 WeakPolarHBondContact O-CD1 2.88Å; L543-L578 HydrophobicContact CB-CB 4.2Å; L543-L578 HydrophobicContact CB-CD1 4.1Å; L543-L578 HydrophobicContact CD1-CB 4.48Å; S544-L578 WeakPolarHBondContact OG-CD1 3.42Å; I547-L578 HydrophobicContact CD1-CB 4.05Å; I547-L578 HydrophobicContact CD1-CD2 3.68Å; L574-L578 WeakPolarHBondContact O-CB 3.26Å; L574-L578 PolarHBondContact O-N 3.03Å; K575-L578 PolarHBondContact O-N 3.25Å; R576-L578 VanDerWaalsContact C-N 3.34Å; L578-K580 VanDerWaalsContact C-N 3.35Å; L578-K580 PolarHBondContact O-N 3.4Å; L578-A581 PolarHBondContact O-N 2.91Å; L578-T582 WeakPolarHBondContact O-CB 3.49Å; L578-T582 PolarHBondContact O-N 3.04Å; L578-T582 PolarHBondContact O-OG1 3.1Å
579	E	93.5	Very high	95.1	Very high	107 Å²	107	58.7 Å²	58.7	50%	0.5	28%	0.28	S	S	.	.	H	α-helix	trans	-55.3	-48.9	177.1	-172.5	-171.3	161.7	0	0	111.7	K575 R576 A581 T582 K583	K575-E579 PolarHBondContact O-N 3.34Å; R576-E579 PolarHBondContact O-N 3.35Å; E579-A581 PolarHBondContact O-N 2.93Å; E579-T582 PolarHBondContact O-N 3.36Å; E579-K583 WeakPolarHBondContact O-CG 3.36Å; E579-K583 PolarHBondContact O-N 3.2Å; E579-K583 VanDerWaalsContact O-N 3.1Å; E579-K583 WeakPolarHBondContact OE1-CE 3.42Å; E579-K583 IonicContact OE1-NZ 2.78Å; E579-K583 PolarHBondContact OE1-NZ 3.35Å
580	K	93.3	Very high	95.1	Very high	135 Å²	135	54.1 Å²	54.1	59%	0.587	26%	0.256	S	S	*	.	H	α-helix	trans	-60.2	-46.5	176.5	-175.4	178.5	177.6	179.4	0	112	R576 K577 L578 K583 Q584	R576-K580 PolarHBondContact O-N 2.89Å; K577-K580 PolarHBondContact O-N 3.21Å; L578-K580 VanDerWaalsContact C-N 3.35Å; L578-K580 PolarHBondContact O-N 3.4Å; K580-K583 PolarHBondContact O-N 2.83Å; K580-Q584 WeakPolarHBondContact O-CB 3.18Å; K580-Q584 PolarHBondContact O-N 3.34Å
581	A	95	Very high	95.1	Very high	19 Å²	19	52.6 Å²	52.6	16%	0.157	24%	0.244	C	C	.	.	H	α-helix	trans	-65.4	-38.4	-179	0	0	0	0	0	112.3	P540 L543 K577 L578 E579 Q584 L585	P540-A581 HydrophobicContact CG-CB 4.04Å; L543-A581 HydrophobicContact CD1-CB 3.99Å; K577-A581 VanDerWaalsContact O-CB 3.28Å; K577-A581 WeakPolarHBondContact O-CB 3.41Å; K577-A581 PolarHBondContact O-N 3.05Å; L578-A581 PolarHBondContact O-N 2.91Å; E579-A581 PolarHBondContact O-N 2.93Å; A581-Q584 PolarHBondContact O-N 3.29Å; A581-L585 WeakPolarHBondContact O-CB 3.41Å; A581-L585 PolarHBondContact O-N 3.25Å
582	T	93.8	Very high	95	Very high	48 Å²	48	51.9 Å²	51.9	29%	0.294	24%	0.24	S	C	.	.	H	α-helix	trans	-63.5	-44	175.9	-66.3	0	0	0	0	111.5	L578 E579 L585 A586	L578-T582 WeakPolarHBondContact O-CB 3.49Å; L578-T582 PolarHBondContact O-N 3.04Å; L578-T582 PolarHBondContact O-OG1 3.1Å; E579-T582 PolarHBondContact O-N 3.36Å; T582-L585 PolarHBondContact O-N 3.27Å; T582-A586 PolarHBondContact O-N 3.23Å
583	K	92.6	Very high	94.7	Very high	33 Å²	33	47.7 Å²	47.7	14%	0.143	22%	0.222	C	C	.	.	H	α-helix	trans	-66.2	-46.4	175.9	-65.7	179.2	-171.3	169	0	111.7	L368 D375 C378 E579 K580 L585 A586 F587	L368-K583 HydrophobicContact CD2-CB 4.27Å; D375-K583 WeakPolarHBondContact OD1-CD 3.29Å; D375-K583 WeakPolarHBondContact OD1-CE 3.46Å; D375-K583 IonicContact OD1-NZ 3.31Å; D375-K583 PolarHBondContact OD1-NZ 2.88Å; D375-K583 IonicContact OD2-NZ 2.65Å; C378-K583 HydrophobicContact CB-CD 4.48Å; E579-K583 WeakPolarHBondContact O-CG 3.36Å; E579-K583 PolarHBondContact O-N 3.2Å; E579-K583 VanDerWaalsContact O-N 3.1Å; E579-K583 WeakPolarHBondContact OE1-CE 3.42Å; E579-K583 IonicContact OE1-NZ 2.78Å; E579-K583 PolarHBondContact OE1-NZ 3.35Å; K580-K583 PolarHBondContact O-N 2.83Å; K583-L585 PolarHBondContact O-N 3.23Å; K583-A586 WeakPolarHBondContact O-CB 3.27Å; K583-A586 PolarHBondContact O-N 2.81Å; K583-F587 WeakPolarHBondContact O-CD2 3.42Å; K583-F587 PolarHBondContact O-N 3.16Å; K583-F587 VanDerWaalsContact O-N 3.11Å
584	Q	93.8	Very high	94.4	Very high	11 Å²	11	43.3 Å²	43.3	5%	0.051	20%	0.199	C	C	.	.	H	α-helix	trans	-54.7	-42.8	174.9	-176.8	65.7	49.4	0	0	111.9	D369 H536 K580 A581 F587 N588	D369-Q584 PolarHBondContact OD1-OE1 3.22Å; D369-Q584 PolarHBondContact OD2-NE2 3.17Å; D369-Q584 PolarHBondContact OD2-OE1 3.02Å; H536-Q584 WeakPolarHBondContact ND1-CG 3.37Å; K580-Q584 WeakPolarHBondContact O-CB 3.18Å; K580-Q584 PolarHBondContact O-N 3.34Å; A581-Q584 PolarHBondContact O-N 3.29Å; Q584-F587 PolarHBondContact O-N 3.03Å; Q584-N588 PolarHBondContact NE2-OD1 3.44Å; Q584-N588 PolarHBondContact O-N 3.29Å; Q584-N588 PolarHBondContact O-OD1 3.08Å
585	L	94.5	Very high	94	Very high	24 Å²	24	48.5 Å²	48.5	13%	0.126	22%	0.222	C	C	.	.	H	α-helix	trans	-62.8	-43.1	176.4	179.9	60.5	0	0	0	111.5	Y533 K537 P540 A581 T582 K583 F587 N588 E589	Y533-L585 HydrophobicContact CD2-CD1 4.27Å; Y533-L585 HydrophobicContact CE2-CD1 3.69Å; K537-L585 HydrophobicContact CB-CD1 4.06Å; P540-L585 HydrophobicContact CG-CD2 4.12Å; A581-L585 WeakPolarHBondContact O-CB 3.41Å; A581-L585 PolarHBondContact O-N 3.25Å; T582-L585 PolarHBondContact O-N 3.27Å; K583-L585 PolarHBondContact O-N 3.23Å; L585-F587 PolarHBondContact O-N 3.43Å; L585-N588 PolarHBondContact O-N 3.24Å; L585-E589 HydrophobicContact CD1-CG 4.02Å; L585-E589 HydrophobicContact CG-CG 4.3Å; L585-E589 WeakPolarHBondContact O-CB 3.41Å; L585-E589 WeakPolarHBondContact O-CG 3.3Å; L585-E589 PolarHBondContact O-N 3.11Å
586	A	93	Very high	93.6	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-59.4	-43.4	178	0	0	0	0	0	112.3	H384 H388 T582 K583 E589 A590	H384-A586 HydrophobicContact CB-CB 4.16Å; H388-A586 PolarHBondContact CD2-O 3.29Å; H388-A586 PolarHBondContact NE2-O 3.42Å; H388-A586 VanDerWaalsContact NE2-O 3.16Å; T582-A586 PolarHBondContact O-N 3.23Å; K583-A586 WeakPolarHBondContact O-CB 3.27Å; K583-A586 PolarHBondContact O-N 2.81Å; A586-E589 PolarHBondContact O-N 3.31Å; A586-A590 PolarHBondContact O-N 3.44Å
587	F	94.1	Very high	93.5	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.9	-45.2	174	-81.9	-85.4	0	0	0	112.3	L368 L374 M377 V387 I391 K583 Q584 L585 E589 A590 V591	L368-F587 HydrophobicContact CB-CD2 4.2Å; L368-F587 HydrophobicContact CB-CG 4.33Å; L374-F587 HydrophobicContact CB-CD1 4.4Å; L374-F587 HydrophobicContact CB-CE1 3.58Å; L374-F587 HydrophobicContact CB-CE2 4.44Å; L374-F587 HydrophobicContact CB-CZ 3.63Å; L374-F587 HydrophobicContact CD1-CD1 4.22Å; L374-F587 HydrophobicContact CD1-CE1 4.01Å; L374-F587 HydrophobicContact CG-CE1 4.29Å; L374-F587 VanDerWaalsContact O-CZ 3.29Å; L374-F587 WeakPolarHBondContact O-CZ 3.31Å; M377-F587 HydrophobicContact CE-CE1 3.41Å; M377-F587 VanDerWaalsContact CE-CE1 3.41Å; M377-F587 HydrophobicContact CE-CZ 3.7Å; V387-F587 HydrophobicContact CG1-CE1 4.36Å; V387-F587 HydrophobicContact CG1-CZ 4.2Å; I391-F587 HydrophobicContact CD1-CD1 3.52Å; I391-F587 HydrophobicContact CD1-CE1 3.43Å; I391-F587 VanDerWaalsContact CD1-CE1 3.43Å; I391-F587 HydrophobicContact CD1-CZ 4.4Å; K583-F587 WeakPolarHBondContact O-CD2 3.42Å; K583-F587 PolarHBondContact O-N 3.16Å; K583-F587 VanDerWaalsContact O-N 3.11Å; Q584-F587 PolarHBondContact O-N 3.03Å; L585-F587 PolarHBondContact O-N 3.43Å; F587-E589 VanDerWaalsContact C-N 3.28Å; F587-E589 PolarHBondContact O-N 3.28Å; F587-A590 WeakPolarHBondContact O-CB 3.45Å; F587-A590 PolarHBondContact O-N 3Å; F587-V591 WeakPolarHBondContact O-CG2 3.48Å; F587-V591 PolarHBondContact O-N 3.03Å
588	N	94.3	Very high	93.3	Very high	3 Å²	3	33 Å²	33	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-60.1	-40	175.8	-74.1	13.2	0	0	0	111.7	F367 Y533 H536 Q584 L585 V591 M592	F367-N588 WeakPolarHBondContact CD1-OD1 3.22Å; Y533-N588 HydrophobicContact CD2-CB 4.19Å; H536-N588 PolarHBondContact ND1-ND2 3.22Å; Q584-N588 PolarHBondContact NE2-OD1 3.44Å; Q584-N588 PolarHBondContact O-N 3.29Å; Q584-N588 PolarHBondContact O-OD1 3.08Å; L585-N588 PolarHBondContact O-N 3.24Å; N588-V591 PolarHBondContact O-N 2.98Å; N588-M592 WeakPolarHBondContact O-CB 3.21Å; N588-M592 WeakPolarHBondContact O-CG 3.4Å; N588-M592 PolarHBondContact O-N 3.47Å
589	E	94	Very high	93.1	Very high	37 Å²	37	32.8 Å²	32.8	17%	0.173	16%	0.163	C	C	.	.	H	α-helix	trans	-70	-35.7	177	-72.9	-168.3	140.1	0	0	112.7	R392 Y533 L585 A586 F587 V591 K593	R392-E589 PolarHBondContact NH2-O 2.91Å; Y533-E589 HydrophobicContact CE2-CG 3.61Å; Y533-E589 PolarHBondContact OH-OE1 3.39Å; L585-E589 HydrophobicContact CD1-CG 4.02Å; L585-E589 HydrophobicContact CG-CG 4.3Å; L585-E589 WeakPolarHBondContact O-CB 3.41Å; L585-E589 WeakPolarHBondContact O-CG 3.3Å; L585-E589 PolarHBondContact O-N 3.11Å; A586-E589 PolarHBondContact O-N 3.31Å; F587-E589 VanDerWaalsContact C-N 3.28Å; F587-E589 PolarHBondContact O-N 3.28Å; E589-V591 PolarHBondContact O-N 3.09Å; E589-K593 HydrophobicContact CB-CD 4.14Å; E589-K593 HydrophobicContact CB-CG 4.4Å; E589-K593 HydrophobicContact CG-CD 4.07Å; E589-K593 WeakPolarHBondContact O-CB 3.24Å; E589-K593 PolarHBondContact O-N 3.47Å; E589-K593 VanDerWaalsContact O-N 3.16Å; E589-K593 IonicContact OE1-NZ 3.08Å; E589-K593 PolarHBondContact OE1-NZ 2.83Å
590	A	93.3	Very high	93.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-56.5	-41.1	174.1	0	0	0	0	0	111.6	H388 I391 R392 A586 F587	H388-A590 HydrophobicContact CB-CB 4.45Å; I391-A590 HydrophobicContact CB-CB 4.06Å; I391-A590 HydrophobicContact CD1-CB 3.85Å; I391-A590 HydrophobicContact CG2-CB 3.81Å; R392-A590 VanDerWaalsContact CG-O 3.3Å; R392-A590 WeakPolarHBondContact CG-O 3.27Å; R392-A590 PolarHBondContact NE-O 3.45Å; A586-A590 PolarHBondContact O-N 3.44Å; F587-A590 WeakPolarHBondContact O-CB 3.45Å; F587-A590 PolarHBondContact O-N 3Å
591	V	94.7	Very high	93.2	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-86.9	-52.7	-176.8	-176.7	0	0	0	0	112.7	C366 F367 I391 L395 L450 F587 N588 E589 K593 D594	C366-V591 HydrophobicContact CB-CG2 3.92Å; C366-V591 VanDerWaalsContact SG-CG2 3.56Å; F367-V591 HydrophobicContact CE1-CB 4.12Å; F367-V591 HydrophobicContact CE1-CG1 4.26Å; F367-V591 HydrophobicContact CE1-CG2 4.26Å; F367-V591 HydrophobicContact CE2-CG1 4.4Å; F367-V591 HydrophobicContact CZ-CB 4.12Å; F367-V591 HydrophobicContact CZ-CG1 3.75Å; F367-V591 HydrophobicContact CZ-CG2 4.39Å; I391-V591 HydrophobicContact CG2-CG2 4.43Å; L395-V591 HydrophobicContact CD1-CG2 4.03Å; L450-V591 HydrophobicContact CD1-CG1 3.71Å; F587-V591 WeakPolarHBondContact O-CG2 3.48Å; F587-V591 PolarHBondContact O-N 3.03Å; N588-V591 PolarHBondContact O-N 2.98Å; E589-V591 PolarHBondContact O-N 3.09Å; V591-K593 VanDerWaalsContact C-N 3.3Å; V591-K593 PolarHBondContact O-N 3.1Å; V591-D594 VanDerWaalsContact O-CB 3.25Å; V591-D594 WeakPolarHBondContact O-CB 3.42Å; V591-D594 PolarHBondContact O-N 2.6Å
592	M	93.8	Very high	93.1	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-73.3	-24.5	-171.9	-65.7	-60.6	-63.3	0	0	113.1	L526 L529 F530 N588 L598 F650	L526-M592 HydrophobicContact CD1-CE 4.04Å; L529-M592 HydrophobicContact CB-CE 3.51Å; L529-M592 HydrophobicContact CB-SD 3.62Å; L529-M592 HydrophobicContact CD1-CE 4.37Å; L529-M592 HydrophobicContact CD1-SD 3.59Å; L529-M592 VanDerWaalsContact CD1-SD 3.59Å; L529-M592 HydrophobicContact CG-SD 4.24Å; F530-M592 HydrophobicContact CD1-CE 3.46Å; F530-M592 VanDerWaalsContact CD1-CE 3.46Å; F530-M592 HydrophobicContact CE1-CE 3.6Å; N588-M592 WeakPolarHBondContact O-CB 3.21Å; N588-M592 WeakPolarHBondContact O-CG 3.4Å; N588-M592 PolarHBondContact O-N 3.47Å; M592-L598 WeakPolarHBondContact O-CD1 3.2Å; M592-L598 WeakPolarHBondContact O-CD2 3.11Å; M592-L598 WeakPolarHBondContact O-CG 3.22Å; M592-F650 HydrophobicContact CB-CZ 4.21Å; M592-F650 HydrophobicContact CE-CE2 4.41Å; M592-F650 HydrophobicContact CE-CZ 4.31Å
593	K	91.3	Very high	93.1	Very high	33 Å²	33	23.4 Å²	23.4	14%	0.143	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	18.1	177.2	-50.8	-170.1	154.3	168.1	0	112.5	R392 Y533 E589 V591 E595 E655	R392-K593 PolarHBondContact NH1-O 2.62Å; R392-K593 VanDerWaalsContact NH2-C 3.35Å; R392-K593 PolarHBondContact NH2-O 3.46Å; Y533-K593 WeakPolarHBondContact OH-CE 3.21Å; Y533-K593 PolarHBondContact OH-NZ 3.45Å; E589-K593 HydrophobicContact CB-CD 4.14Å; E589-K593 HydrophobicContact CB-CG 4.4Å; E589-K593 HydrophobicContact CG-CD 4.07Å; E589-K593 WeakPolarHBondContact O-CB 3.24Å; E589-K593 PolarHBondContact O-N 3.47Å; E589-K593 VanDerWaalsContact O-N 3.16Å; E589-K593 IonicContact OE1-NZ 3.08Å; E589-K593 PolarHBondContact OE1-NZ 2.83Å; V591-K593 VanDerWaalsContact C-N 3.3Å; V591-K593 PolarHBondContact O-N 3.1Å; K593-E595 PolarHBondContact O-N 3.17Å; K593-E655 WeakPolarHBondContact CB-OE1 3.34Å; K593-E655 WeakPolarHBondContact CD-OE1 3.49Å; K593-E655 WeakPolarHBondContact CE-OE1 3.28Å; K593-E655 WeakPolarHBondContact CG-OE1 3.36Å
594	D	91.2	Very high	93.3	Very high	10 Å²	10	22 Å²	22	5%	0.053	11%	0.106	C	C	.	.			trans	-66.8	118.7	171.9	172.8	24.1	0	0	0	109.3	R392 R399 V591 N596 L597 L598	R392-D594 HydrophobicContact CG-CB 4.31Å; R399-D594 IonicContact CZ-OD2 3.76Å; R399-D594 IonicContact NH1-OD2 3.27Å; R399-D594 PolarHBondContact NH1-OD2 3.44Å; V591-D594 VanDerWaalsContact O-CB 3.25Å; V591-D594 WeakPolarHBondContact O-CB 3.42Å; V591-D594 PolarHBondContact O-N 2.6Å; D594-N596 PolarHBondContact O-N 3.2Å; D594-N596 PolarHBondContact OD1-N 2.9Å; D594-L597 HydrophobicContact CB-CB 4.11Å; D594-L597 PolarHBondContact O-N 3.45Å; D594-L598 PolarHBondContact O-N 2.97Å
595	E	89.1	Confident	93.4	Very high	140 Å²	140	21.8 Å²	21.8	65%	0.654	11%	0.105	S	C	*	.	H	α-helix	trans	-56.7	-37.3	-177.6	-67.3	179.2	-169.7	0	0	111.5	K593 S599	K593-E595 PolarHBondContact O-N 3.17Å; E595-S599 WeakPolarHBondContact O-CB 3.47Å; E595-S599 PolarHBondContact O-N 2.82Å; E595-S599 PolarHBondContact O-OG 2.7Å
596	N	90.5	Very high	93.4	Very high	49 Å²	49	21.9 Å²	21.9	26%	0.262	11%	0.106	S	C	.	.	H	α-helix	trans	-67.8	-49.3	-179.6	-174.2	39	0	0	0	111.6	D594 L598 S599 L600	D594-N596 PolarHBondContact O-N 3.2Å; D594-N596 PolarHBondContact OD1-N 2.9Å; N596-L598 PolarHBondContact O-N 3.28Å; N596-S599 PolarHBondContact O-N 2.48Å; N596-L600 WeakPolarHBondContact O-CB 3.37Å; N596-L600 WeakPolarHBondContact O-CG 3.02Å; N596-L600 PolarHBondContact O-N 3.38Å
597	L	93.8	Very high	93.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-56.9	-49.2	176.6	174.5	62.8	0	0	0	111.5	V454 F457 L526 D594 L600 A601	V454-L597 HydrophobicContact CG2-CD1 3.77Å; F457-L597 HydrophobicContact CE2-CD1 4.36Å; L526-L597 HydrophobicContact CD1-CD2 4.31Å; D594-L597 HydrophobicContact CB-CB 4.11Å; D594-L597 PolarHBondContact O-N 3.45Å; L597-L600 PolarHBondContact O-N 3.43Å; L597-A601 WeakPolarHBondContact O-CB 3.37Å; L597-A601 PolarHBondContact O-N 3.2Å
598	L	92.9	Very high	93.7	Very high	8 Å²	8	23.1 Å²	23.1	4%	0.042	11%	0.111	C	C	.	.	H	α-helix	trans	-68.7	-36.3	-177.4	-70.4	-176	0	0	0	112.5	M592 D594 N596 A601 A602 F650 L651 E655	M592-L598 WeakPolarHBondContact O-CD1 3.2Å; M592-L598 WeakPolarHBondContact O-CD2 3.11Å; M592-L598 WeakPolarHBondContact O-CG 3.22Å; D594-L598 PolarHBondContact O-N 2.97Å; N596-L598 PolarHBondContact O-N 3.28Å; L598-A601 PolarHBondContact O-N 2.94Å; L598-A602 VanDerWaalsContact O-CB 3.23Å; L598-A602 WeakPolarHBondContact O-CB 3.42Å; L598-A602 PolarHBondContact O-N 3.04Å; L598-F650 HydrophobicContact CD1-CE1 4.22Å; L598-F650 HydrophobicContact CD2-CD1 4.12Å; L598-F650 HydrophobicContact CD2-CE1 3.91Å; L598-L651 HydrophobicContact CB-CD2 4.01Å; L598-L651 HydrophobicContact CD1-CD2 4.13Å; L598-L651 HydrophobicContact CD2-CD2 4.27Å; L598-L651 HydrophobicContact CG-CD2 4.39Å; L598-E655 HydrophobicContact CD1-CG 3.28Å
599	S	91.6	Very high	93.8	Very high	29 Å²	29	23 Å²	23	20%	0.203	11%	0.11	C	C	.	.	H	α-helix	trans	-63	-44.8	174.5	-65.7	0	0	0	0	112	E595 N596 Y603 Y661	E595-S599 WeakPolarHBondContact O-CB 3.47Å; E595-S599 PolarHBondContact O-N 2.82Å; E595-S599 PolarHBondContact O-OG 2.7Å; N596-S599 PolarHBondContact O-N 2.48Å; S599-Y603 VanDerWaalsContact O-CB 3.26Å; S599-Y603 WeakPolarHBondContact O-CB 3.47Å; S599-Y603 PolarHBondContact O-N 3.33Å; S599-Y661 WeakPolarHBondContact CB-OH 3.02Å; S599-Y661 PolarHBondContact OG-OH 2.84Å
600	L	94.4	Very high	93.9	Very high	14 Å²	14	22.5 Å²	22.5	7%	0.073	11%	0.109	C	C	.	.	H	α-helix	trans	-64.4	-45.9	176.1	-72.9	173.1	0	0	0	111.5	V454 F457 L461 N596 L597 Y603 F604	V454-L600 HydrophobicContact CG1-CD1 3.85Å; F457-L600 HydrophobicContact CB-CB 3.96Å; F457-L600 HydrophobicContact CB-CD1 4.24Å; F457-L600 HydrophobicContact CB-CD2 4.28Å; F457-L600 HydrophobicContact CB-CG 4.4Å; F457-L600 HydrophobicContact CD2-CB 3.7Å; F457-L600 HydrophobicContact CE2-CB 4.43Å; F457-L600 HydrophobicContact CG-CB 4.02Å; L461-L600 HydrophobicContact CD1-CD2 4.15Å; L461-L600 HydrophobicContact CD2-CD2 3.93Å; L461-L600 HydrophobicContact CG-CD2 4.31Å; N596-L600 WeakPolarHBondContact O-CB 3.37Å; N596-L600 WeakPolarHBondContact O-CG 3.02Å; N596-L600 PolarHBondContact O-N 3.38Å; L597-L600 PolarHBondContact O-N 3.43Å; L600-Y603 PolarHBondContact O-N 3.25Å; L600-F604 VanDerWaalsContact O-CB 3.27Å; L600-F604 WeakPolarHBondContact O-CB 3.44Å; L600-F604 PolarHBondContact O-N 3.38Å
601	A	95.4	Very high	94	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-59.7	-50.8	177.1	0	0	0	0	0	111.1	F457 L526 L597 L598 Y603 F604 S605 V647	F457-A601 HydrophobicContact CE2-CB 4.08Å; F457-A601 HydrophobicContact CZ-CB 4.03Å; L526-A601 HydrophobicContact CD2-CB 3.79Å; L597-A601 WeakPolarHBondContact O-CB 3.37Å; L597-A601 PolarHBondContact O-N 3.2Å; L598-A601 PolarHBondContact O-N 2.94Å; A601-Y603 PolarHBondContact O-N 3Å; A601-F604 PolarHBondContact O-N 3.05Å; A601-S605 WeakPolarHBondContact O-CB 3.19Å; A601-S605 PolarHBondContact O-N 3.22Å; A601-S605 PolarHBondContact O-OG 3.16Å; A601-V647 HydrophobicContact CB-CG1 4.41Å
602	A	93.7	Very high	94.1	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.4	-47.1	179.9	0	0	0	0	0	111.9	L598 F604 S605 L606 L651 M662	L598-A602 VanDerWaalsContact O-CB 3.23Å; L598-A602 WeakPolarHBondContact O-CB 3.42Å; L598-A602 PolarHBondContact O-N 3.04Å; A602-F604 VanDerWaalsContact C-N 3.34Å; A602-F604 PolarHBondContact O-N 3.04Å; A602-S605 PolarHBondContact O-N 3.27Å; A602-L606 WeakPolarHBondContact O-CG 3.37Å; A602-L606 PolarHBondContact O-N 3.27Å; A602-L606 VanDerWaalsContact O-N 3.09Å; A602-L651 HydrophobicContact CB-CD1 3.66Å; A602-M662 HydrophobicContact CB-CE 3.38Å; A602-M662 HydrophobicContact CB-SD 3.69Å
603	Y	93.4	Very high	94.2	Very high	96 Å²	96	23 Å²	23	38%	0.376	11%	0.112	S	C	.	.	H	α-helix	trans	-62.2	-42.5	178.7	179.1	-100	0	0	0	111.8	L461 S599 L600 A601 L606 K607	L461-Y603 HydrophobicContact CD2-CD1 3.64Å; L461-Y603 HydrophobicContact CD2-CE1 3.66Å; S599-Y603 VanDerWaalsContact O-CB 3.26Å; S599-Y603 WeakPolarHBondContact O-CB 3.47Å; S599-Y603 PolarHBondContact O-N 3.33Å; L600-Y603 PolarHBondContact O-N 3.25Å; A601-Y603 PolarHBondContact O-N 3Å; Y603-L606 PolarHBondContact O-N 2.78Å; Y603-K607 HydrophobicContact CE1-CD 4.08Å; Y603-K607 PolarHBondContact O-N 2.76Å; Y603-K607 WeakPolarHBondContact OH-CE 3.43Å
604	F	96.3	Very high	94.3	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.018	13%	0.126	C	C	.	.	H	α-helix	trans	-68.5	-41.4	177	-174	-92.6	0	0	0	112.2	F457 F515 T518 V519 L600 A601 A602 L606 K607 Q608	F457-F604 HydrophobicContact CD1-CB 3.64Å; F457-F604 HydrophobicContact CD1-CD1 4.15Å; F457-F604 HydrophobicContact CD1-CD2 4.12Å; F457-F604 AromaticContact CD1-CG 3.69Å; F457-F604 HydrophobicContact CD1-CG 3.69Å; F457-F604 HydrophobicContact CE1-CB 3.67Å; F457-F604 AromaticContact CE1-CD1 3.71Å; F457-F604 HydrophobicContact CE1-CD1 3.71Å; F457-F604 AromaticContact CE1-CG 3.69Å; F457-F604 HydrophobicContact CE1-CG 3.69Å; F515-F604 AromaticContact CD2-CE2 3.8Å; F515-F604 HydrophobicContact CD2-CE2 3.8Å; F515-F604 AromaticContact CD2-CZ 3.97Å; F515-F604 HydrophobicContact CD2-CZ 3.97Å; F515-F604 AromaticContact CE2-CE2 3.98Å; F515-F604 HydrophobicContact CE2-CE2 3.98Å; F515-F604 HydrophobicContact CE2-CZ 4.02Å; F515-F604 HydrophobicContact CG-CZ 4.45Å; T518-F604 VanDerWaalsContact CB-CZ 3.44Å; T518-F604 HydrophobicContact CG2-CD1 4.07Å; T518-F604 HydrophobicContact CG2-CD2 3.84Å; T518-F604 HydrophobicContact CG2-CE1 3.74Å; T518-F604 HydrophobicContact CG2-CE2 3.5Å; T518-F604 VanDerWaalsContact CG2-CE2 3.5Å; T518-F604 HydrophobicContact CG2-CG 4.11Å; T518-F604 HydrophobicContact CG2-CZ 3.47Å; T518-F604 VanDerWaalsContact CG2-CZ 3.47Å; V519-F604 HydrophobicContact CB-CE1 4.49Å; V519-F604 HydrophobicContact CG2-CE1 3.73Å; V519-F604 HydrophobicContact CG2-CZ 3.78Å; L600-F604 VanDerWaalsContact O-CB 3.27Å; L600-F604 WeakPolarHBondContact O-CB 3.44Å; L600-F604 PolarHBondContact O-N 3.38Å; A601-F604 PolarHBondContact O-N 3.05Å; A602-F604 VanDerWaalsContact C-N 3.34Å; A602-F604 PolarHBondContact O-N 3.04Å; F604-L606 VanDerWaalsContact C-N 3.26Å; F604-L606 PolarHBondContact O-N 3.43Å; F604-K607 CarbonylContact O-C 3.42Å; F604-K607 WeakPolarHBondContact O-CA 3.18Å; F604-K607 WeakPolarHBondContact O-CB 2.93Å; F604-K607 PolarHBondContact O-N 3.2Å; F604-Q608 HydrophobicContact CE1-CB 4.39Å; F604-Q608 WeakPolarHBondContact O-CB 3.02Å; F604-Q608 PolarHBondContact O-N 3.48Å
605	S	96.3	Very high	94.5	Very high	7 Å²	7	26.3 Å²	26.3	5%	0.049	13%	0.128	C	C	.	.	H	α-helix	trans	-59.2	-35.8	176.2	-66.7	0	0	0	0	112.3	A601 A602 Q608 M609	A601-S605 WeakPolarHBondContact O-CB 3.19Å; A601-S605 PolarHBondContact O-N 3.22Å; A601-S605 PolarHBondContact O-OG 3.16Å; A602-S605 PolarHBondContact O-N 3.27Å; S605-Q608 WeakPolarHBondContact O-CB 3.41Å; S605-Q608 PolarHBondContact O-N 3.04Å; S605-M609 WeakPolarHBondContact O-CB 3.37Å; S605-M609 PolarHBondContact O-N 2.77Å
606	L	95.2	Very high	94.8	Very high	26 Å²	26	19.9 Å²	19.9	14%	0.136	10%	0.098	C	C	.	.	H	α-helix	trans	-64.1	-44.2	171.4	-69.6	-179.6	0	0	0	112.3	A602 Y603 F604 M609 D610 F648 M662 F667	A602-L606 WeakPolarHBondContact O-CG 3.37Å; A602-L606 PolarHBondContact O-N 3.27Å; A602-L606 VanDerWaalsContact O-N 3.09Å; Y603-L606 PolarHBondContact O-N 2.78Å; F604-L606 VanDerWaalsContact C-N 3.26Å; F604-L606 PolarHBondContact O-N 3.43Å; L606-M609 PolarHBondContact O-N 3.21Å; L606-D610 PolarHBondContact O-N 3.23Å; L606-F648 HydrophobicContact CD1-CZ 4.44Å; L606-F648 HydrophobicContact CD2-CE2 3.93Å; L606-F648 HydrophobicContact CD2-CZ 3.53Å; L606-F648 HydrophobicContact CG-CE2 4.23Å; L606-F648 HydrophobicContact CG-CZ 3.82Å; L606-M662 HydrophobicContact CD1-CE 3.47Å; L606-M662 VanDerWaalsContact CD1-CE 3.47Å; L606-M662 HydrophobicContact CG-CE 4.16Å; L606-F667 HydrophobicContact CD2-CB 3.58Å; L606-F667 HydrophobicContact CD2-CD1 3.8Å; L606-F667 HydrophobicContact CD2-CD2 4.44Å; L606-F667 HydrophobicContact CD2-CG 3.7Å
607	K	95.3	Very high	94.8	Very high	21 Å²	21	18.4 Å²	18.4	9%	0.091	9%	0.091	C	C	.	.	H	α-helix	trans	-62.8	-41.2	174.7	-76.4	-168.2	175.3	-172.5	0	112.3	S460 L461 I463 L465 F515 Y603 F604 D610 V611	S460-K607 PolarHBondContact O-NZ 3.25Å; S460-K607 VanDerWaalsContact O-NZ 3.11Å; L461-K607 PolarHBondContact O-NZ 3.16Å; I463-K607 PolarHBondContact O-NZ 3.45Å; L465-K607 HydrophobicContact CD2-CB 4Å; L465-K607 HydrophobicContact CD2-CD 4.11Å; L465-K607 HydrophobicContact CD2-CG 4.11Å; F515-K607 HydrophobicContact CE2-CB 4.14Å; Y603-K607 HydrophobicContact CE1-CD 4.08Å; Y603-K607 PolarHBondContact O-N 2.76Å; Y603-K607 WeakPolarHBondContact OH-CE 3.43Å; F604-K607 CarbonylContact O-C 3.42Å; F604-K607 WeakPolarHBondContact O-CA 3.18Å; F604-K607 WeakPolarHBondContact O-CB 2.93Å; F604-K607 PolarHBondContact O-N 3.2Å; K607-D610 PolarHBondContact O-N 2.83Å; K607-V611 PolarHBondContact O-N 2.98Å; K607-V611 VanDerWaalsContact O-N 3.12Å
608	Q	97.4	Very high	94.4	Very high	5 Å²	5	20.3 Å²	20.3	2%	0.023	11%	0.111	C	C	.	.	H	α-helix	trans	-57.1	-51	173.6	178.2	174.4	-25.2	0	0	110.8	F515 V519 F604 S605 D610 V611 V612 Y640 V644	F515-Q608 HydrophobicContact CZ-CB 4.5Å; V519-Q608 HydrophobicContact CG2-CG 4.12Å; F604-Q608 HydrophobicContact CE1-CB 4.39Å; F604-Q608 WeakPolarHBondContact O-CB 3.02Å; F604-Q608 PolarHBondContact O-N 3.48Å; S605-Q608 WeakPolarHBondContact O-CB 3.41Å; S605-Q608 PolarHBondContact O-N 3.04Å; Q608-D610 VanDerWaalsContact C-N 3.33Å; Q608-D610 PolarHBondContact O-N 2.88Å; Q608-V611 PolarHBondContact O-N 3.44Å; Q608-V612 WeakPolarHBondContact O-CG2 3.29Å; Q608-V612 PolarHBondContact O-N 2.99Å; Q608-V612 VanDerWaalsContact O-N 3.09Å; Q608-Y640 PolarHBondContact NE2-O 2.87Å; Q608-V644 HydrophobicContact CB-CG2 4.11Å; Q608-V644 HydrophobicContact CG-CG2 3.83Å
609	M	96.9	Very high	93.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.5	-44.2	176.8	-165.8	66.7	171.3	0	0	112	S605 L606 V611 V612 M613 I641 V644 F667 H670 L674	S605-M609 WeakPolarHBondContact O-CB 3.37Å; S605-M609 PolarHBondContact O-N 2.77Å; L606-M609 PolarHBondContact O-N 3.21Å; M609-V611 VanDerWaalsContact C-N 3.31Å; M609-V611 PolarHBondContact O-N 3.27Å; M609-V612 PolarHBondContact O-N 3.41Å; M609-M613 HydrophobicContact CE-CG 3.96Å; M609-M613 HydrophobicContact CE-SD 3.92Å; M609-M613 HydrophobicContact CG-CG 4.02Å; M609-M613 VanDerWaalsContact O-CB 3.3Å; M609-M613 WeakPolarHBondContact O-CB 3.35Å; M609-M613 WeakPolarHBondContact O-CG 3.29Å; M609-M613 PolarHBondContact O-N 3.32Å; M609-M613 HydrophobicContact SD-CG 4.21Å; M609-I641 HydrophobicContact SD-CG1 4.48Å; M609-V644 HydrophobicContact CB-CG1 4.14Å; M609-V644 HydrophobicContact CG-CG1 4.49Å; M609-V644 HydrophobicContact SD-CG1 4.23Å; M609-F667 HydrophobicContact CB-CD2 4.44Å; M609-F667 HydrophobicContact CB-CE2 4.49Å; M609-F667 HydrophobicContact CE-CD2 4.34Å; M609-F667 HydrophobicContact CE-CE2 3.88Å; M609-F667 HydrophobicContact CG-CD2 3.78Å; M609-F667 HydrophobicContact CG-CE2 3.79Å; M609-F667 HydrophobicContact SD-CE2 4.1Å; M609-H670 HydrophobicContact CE-CB 3.83Å; M609-H670 HydrophobicContact CG-CB 4.3Å; M609-L674 HydrophobicContact CE-CD1 3.36Å; M609-L674 HydrophobicContact CE-CG 4.18Å
610	D	95	Very high	92.6	Very high	27 Å²	27	34.4 Å²	34.4	14%	0.144	17%	0.171	C	C	.	.	H	α-helix	trans	-58.8	-40.1	178.1	-81.9	6.8	0	0	0	112.5	L465 L606 K607 Q608 K614 R666 H670	L465-D610 HydrophobicContact CD1-CB 3.55Å; L606-D610 PolarHBondContact O-N 3.23Å; K607-D610 PolarHBondContact O-N 2.83Å; Q608-D610 VanDerWaalsContact C-N 3.33Å; Q608-D610 PolarHBondContact O-N 2.88Å; D610-K614 VanDerWaalsContact O-CB 3.24Å; D610-K614 WeakPolarHBondContact O-CB 3.43Å; D610-K614 PolarHBondContact O-N 3.44Å; D610-R666 WeakPolarHBondContact OD1-CD 3.4Å; D610-R666 IonicContact OD1-CZ 3.04Å; D610-R666 IonicContact OD1-NE 2.99Å; D610-R666 PolarHBondContact OD1-NE 2.84Å; D610-R666 IonicContact OD1-NH1 3.3Å; D610-R666 IonicContact OD2-CZ 2.65Å; D610-R666 IonicContact OD2-NE 2.72Å; D610-R666 IonicContact OD2-NH1 2.75Å; D610-R666 PolarHBondContact OD2-NH1 3.44Å; D610-H670 IonicContact OD1-CE1 3.26Å; D610-H670 PolarHBondContact OD1-CE1 3.22Å; D610-H670 IonicContact OD1-ND1 3.65Å
611	V	95.9	Very high	91.2	Very high	8 Å²	8	37.4 Å²	37.4	5%	0.048	19%	0.194	C	C	.	.	H	α-helix	trans	-67.8	-44.7	177.3	171.5	0	0	0	0	111.3	L465 V468 P470 F515 F516 K607 Q608 M609 K614 A615	L465-V611 HydrophobicContact CD2-CG2 3.98Å; V468-V611 HydrophobicContact CG1-CG1 4.43Å; V468-V611 HydrophobicContact CG1-CG2 4.31Å; P470-V611 HydrophobicContact CB-CG1 4.3Å; P470-V611 HydrophobicContact CG-CG1 4.33Å; F515-V611 HydrophobicContact CE1-CB 4.04Å; F515-V611 HydrophobicContact CE1-CG1 4.11Å; F515-V611 HydrophobicContact CE1-CG2 3.84Å; F515-V611 HydrophobicContact CE2-CG2 4.21Å; F515-V611 HydrophobicContact CZ-CB 3.92Å; F515-V611 HydrophobicContact CZ-CG1 4.49Å; F515-V611 HydrophobicContact CZ-CG2 3.46Å; F515-V611 VanDerWaalsContact CZ-CG2 3.46Å; F516-V611 HydrophobicContact CZ-CG1 4.32Å; K607-V611 PolarHBondContact O-N 2.98Å; K607-V611 VanDerWaalsContact O-N 3.12Å; Q608-V611 PolarHBondContact O-N 3.44Å; M609-V611 VanDerWaalsContact C-N 3.31Å; M609-V611 PolarHBondContact O-N 3.27Å; V611-K614 PolarHBondContact O-N 3.03Å; V611-A615 PolarHBondContact O-N 3.13Å
612	V	97	Very high	89.8	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.018	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-45.9	178.2	176.1	0	0	0	0	110.8	Q608 M609 K614 A615 L616 F633 F636 Y640 I641	Q608-V612 WeakPolarHBondContact O-CG2 3.29Å; Q608-V612 PolarHBondContact O-N 2.99Å; Q608-V612 VanDerWaalsContact O-N 3.09Å; M609-V612 PolarHBondContact O-N 3.41Å; V612-K614 VanDerWaalsContact C-N 3.34Å; V612-K614 PolarHBondContact O-N 2.82Å; V612-A615 WeakPolarHBondContact O-CB 3.44Å; V612-A615 PolarHBondContact O-N 3.18Å; V612-A615 VanDerWaalsContact O-N 3.08Å; V612-L616 PolarHBondContact O-N 2.99Å; V612-F633 HydrophobicContact CG1-CD2 4.12Å; V612-F633 HydrophobicContact CG1-CE2 3.83Å; V612-F636 HydrophobicContact CG1-CD2 4.42Å; V612-Y640 HydrophobicContact CG2-CD2 4.29Å; V612-I641 HydrophobicContact CG1-CD1 3.89Å; V612-I641 HydrophobicContact CG1-CG1 3.78Å
613	M	95.7	Very high	89.2	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-70.1	-31.1	-178.8	-66.7	-59.9	-59.9	0	0	112.3	M609 A615 L616 C617 H670 I673 L674	M609-M613 HydrophobicContact CE-CG 3.96Å; M609-M613 HydrophobicContact CE-SD 3.92Å; M609-M613 HydrophobicContact CG-CG 4.02Å; M609-M613 VanDerWaalsContact O-CB 3.3Å; M609-M613 WeakPolarHBondContact O-CB 3.35Å; M609-M613 WeakPolarHBondContact O-CG 3.29Å; M609-M613 PolarHBondContact O-N 3.32Å; M609-M613 HydrophobicContact SD-CG 4.21Å; M613-A615 VanDerWaalsContact C-N 3.27Å; M613-A615 PolarHBondContact O-N 3.37Å; M613-L616 HydrophobicContact CE-CD2 3.94Å; M613-L616 PolarHBondContact O-N 2.77Å; M613-L616 HydrophobicContact SD-CD2 4.12Å; M613-C617 WeakPolarHBondContact O-CB 3.18Å; M613-C617 PolarHBondContact O-N 2.97Å; M613-H670 HydrophobicContact CE-CB 4.04Å; M613-H670 HydrophobicContact CG-CB 3.84Å; M613-H670 HydrophobicContact SD-CB 4.27Å; M613-I673 HydrophobicContact CE-CB 4.1Å; M613-I673 HydrophobicContact CE-CD1 4.3Å; M613-I673 HydrophobicContact CE-CG2 3.95Å; M613-L674 HydrophobicContact CE-CD2 4.28Å; M613-L674 HydrophobicContact SD-CD2 3.81Å; M613-L674 HydrophobicContact SD-CG 4.19Å
614	K	94.1	Very high	88.9	Confident	102 Å²	102	43.8 Å²	43.8	44%	0.443	24%	0.239	S	C	.	.	H	α-helix	trans	-62.8	-33.9	169.5	-174.3	178.8	178.6	-174.7	0	112.1	D610 V611 V612 G618	D610-K614 VanDerWaalsContact O-CB 3.24Å; D610-K614 WeakPolarHBondContact O-CB 3.43Å; D610-K614 PolarHBondContact O-N 3.44Å; V611-K614 PolarHBondContact O-N 3.03Å; V612-K614 VanDerWaalsContact C-N 3.34Å; V612-K614 PolarHBondContact O-N 2.82Å; K614-G618 WeakPolarHBondContact O-CA 3.16Å; K614-G618 PolarHBondContact O-N 3.29Å
615	A	94.6	Very high	88.5	Confident	10 Å²	10	48.6 Å²	48.6	8%	0.083	26%	0.262	C	S	.	.	H	α-helix	trans	-71.6	-29.7	174.1	0	0	0	0	0	113.1	V611 V612 M613 P630 L632 F636	V611-A615 PolarHBondContact O-N 3.13Å; V612-A615 WeakPolarHBondContact O-CB 3.44Å; V612-A615 PolarHBondContact O-N 3.18Å; V612-A615 VanDerWaalsContact O-N 3.08Å; M613-A615 VanDerWaalsContact C-N 3.27Å; M613-A615 PolarHBondContact O-N 3.37Å; A615-P630 WeakPolarHBondContact O-CG 3.47Å; A615-L632 HydrophobicContact CB-CD2 3.8Å; A615-L632 HydrophobicContact CB-CG 3.92Å; A615-F636 HydrophobicContact CB-CD2 4.32Å; A615-F636 HydrophobicContact CB-CE2 3.44Å; A615-F636 VanDerWaalsContact CB-CE2 3.44Å; A615-F636 HydrophobicContact CB-CZ 4.11Å
616	L	94.9	Very high	88.1	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-78.3	-51.9	176.6	-176.2	56.3	0	0	0	112.4	V612 M613 L626 V629 P630 F633 I673 L674 I680	V612-L616 PolarHBondContact O-N 2.99Å; M613-L616 HydrophobicContact CE-CD2 3.94Å; M613-L616 PolarHBondContact O-N 2.77Å; M613-L616 HydrophobicContact SD-CD2 4.12Å; L616-L626 HydrophobicContact CD1-CD1 3.75Å; L616-L626 HydrophobicContact CD2-CD1 3.79Å; L616-L626 HydrophobicContact CG-CD1 3.76Å; L616-V629 HydrophobicContact CD1-CG1 3.99Å; L616-P630 WeakPolarHBondContact O-CD 3.25Å; L616-F633 HydrophobicContact CB-CB 4.47Å; L616-F633 HydrophobicContact CB-CD2 3.58Å; L616-F633 HydrophobicContact CB-CE2 3.93Å; L616-F633 HydrophobicContact CB-CG 4.06Å; L616-F633 HydrophobicContact CD1-CB 4.32Å; L616-F633 HydrophobicContact CD1-CD1 3.78Å; L616-F633 HydrophobicContact CD1-CD2 4.02Å; L616-F633 HydrophobicContact CD1-CE1 4.02Å; L616-F633 HydrophobicContact CD1-CE2 4.22Å; L616-F633 HydrophobicContact CD1-CG 3.76Å; L616-F633 HydrophobicContact CD1-CZ 4.23Å; L616-F633 HydrophobicContact CD2-CD2 4.34Å; L616-F633 HydrophobicContact CD2-CE2 3.89Å; L616-F633 HydrophobicContact CD2-CZ 4.03Å; L616-F633 HydrophobicContact CG-CD2 4.19Å; L616-F633 HydrophobicContact CG-CE2 4.24Å; L616-F633 HydrophobicContact CG-CG 4.42Å; L616-I673 HydrophobicContact CD2-CG2 4.45Å; L616-L674 HydrophobicContact CD2-CD2 4.1Å; L616-I680 HydrophobicContact CD2-CD1 3.89Å
617	C	91.8	Very high	87.5	Confident	18 Å²	18	55.1 Å²	55.1	12%	0.122	30%	0.301	C	S	.	.	H	α-helix	trans	-95.5	-17	-169.7	-59.3	0	0	0	0	113	M613 N619 R620	M613-C617 WeakPolarHBondContact O-CB 3.18Å; M613-C617 PolarHBondContact O-N 2.97Å; C617-N619 PolarHBondContact O-N 2.79Å; C617-R620 WeakPolarHBondContact CB-O 3.22Å; C617-R620 VanDerWaalsContact O-CB 3.25Å; C617-R620 WeakPolarHBondContact O-CB 3.44Å; C617-R620 WeakPolarHBondContact O-CG 3.45Å; C617-R620 PolarHBondContact O-N 2.83Å
618	G	85.6	Confident	87.1	Confident	41 Å²	41	61 Å²	61	42%	0.423	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	-128.9	-170.7	0	0	0	0	0	111	K614	K614-G618 WeakPolarHBondContact O-CA 3.16Å; K614-G618 PolarHBondContact O-N 3.29Å
619	N	75.9	Confident	86.9	Confident	160 Å²	160	62.1 Å²	62.1	86%	0.856	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	3.8	173.7	-65.9	-15.3	0	0	0	113.2	C617 S621	C617-N619 PolarHBondContact O-N 2.79Å; N619-S621 PolarHBondContact O-N 3.17Å
620	R	71	Confident	86.8	Confident	173 Å²	173	64.4 Å²	64.4	65%	0.653	35%	0.35	S	S	*	.			trans	-81.8	105.7	-179.2	-54.8	176.1	-179.6	177.2	1.8	108.2	C617	C617-R620 WeakPolarHBondContact CB-O 3.22Å; C617-R620 VanDerWaalsContact O-CB 3.25Å; C617-R620 WeakPolarHBondContact O-CB 3.44Å; C617-R620 WeakPolarHBondContact O-CG 3.45Å; C617-R620 PolarHBondContact O-N 2.83Å
621	S	64.2	Low	86.8	Confident	77 Å²	77	67.2 Å²	67.2	54%	0.538	37%	0.365	S	S	.	.			trans	-94.8	-20.7	-177.5	-165	0	0	0	0	114.1	N619	N619-S621 PolarHBondContact O-N 3.17Å
622	D	66.5	Low	86.8	Confident	146 Å²	146	68.5 Å²	68.5	78%	0.781	37%	0.372	S	S	*	.	S	Bend	trans	-109.4	-14	-156.5	-56.9	-28.2	0	0	0	115.3
623	S	81.4	Confident	86.8	Confident	72 Å²	72	68.3 Å²	68.3	50%	0.503	37%	0.371	S	S	.	.			trans	-93.6	123.2	179.8	-174.3	0	0	0	0	111.6	H625	S623-H625 PolarHBondContact OG-O 3.25Å
624	I	87.1	Confident	86.8	Confident	12 Å²	12	70.7 Å²	70.7	6%	0.062	38%	0.381	C	S	.	.	S	Bend	trans	-67.1	-41.7	173.2	-64.3	170.3	0	0	0	110.9	L672 C676 N677 A721	I624-L672 HydrophobicContact CD1-CD2 3.69Å; I624-L672 HydrophobicContact CD1-CG 4.27Å; I624-L672 HydrophobicContact CG1-CD2 3.98Å; I624-L672 HydrophobicContact CG1-CG 4.35Å; I624-L672 HydrophobicContact CG2-CG 4.32Å; I624-C676 HydrophobicContact CG2-CB 3.4Å; I624-C676 VanDerWaalsContact CG2-SG 3.52Å; I624-N677 PolarHBondContact O-ND2 3.36Å; I624-A721 HydrophobicContact CD1-CB 4.08Å; I624-A721 HydrophobicContact CG2-CB 4Å
625	H	86.4	Confident	86.9	Confident	105 Å²	105	65.8 Å²	65.8	49%	0.486	36%	0.36	S	S	.	.	S	Bend	trans	-88.6	133	-177.7	-64.9	-63.1	0	0	0	111.2	S623	S623-H625 PolarHBondContact OG-O 3.25Å
626	L	87.6	Confident	87	Confident	43 Å²	43	65.3 Å²	65.3	23%	0.225	36%	0.356	C	S	.	.			trans	-98.1	133.5	179.4	-58.6	175.6	0	0	0	110	L616 I673 N677 I680	L616-L626 HydrophobicContact CD1-CD1 3.75Å; L616-L626 HydrophobicContact CD2-CD1 3.79Å; L616-L626 HydrophobicContact CG-CD1 3.76Å; L626-I673 HydrophobicContact CD1-CG2 4.04Å; L626-I673 HydrophobicContact CD2-CG2 4.35Å; L626-I673 HydrophobicContact CG-CG2 4.27Å; L626-N677 HydrophobicContact CD1-CB 4.14Å; L626-N677 HydrophobicContact CG-CB 4.5Å; L626-N677 PolarHBondContact N-OD1 3.49Å; L626-I680 HydrophobicContact CD1-CG2 4.31Å
627	T	83.9	Confident	87.1	Confident	127 Å²	127	65.2 Å²	65.2	78%	0.779	36%	0.355	S	S	*	.	S	Bend	trans	-89.6	-31.1	176.5	56.3	0	0	0	0	112.7
628	E	87.4	Confident	87.4	Confident	146 Å²	146	65.4 Å²	65.4	68%	0.682	35%	0.354	S	S	*	.			trans	-147.8	142.5	-175.2	-174	176.4	-168.8	0	0	109.1
629	V	92.5	Very high	87.9	Confident	27 Å²	27	63.8 Å²	63.8	16%	0.164	34%	0.336	C	S	.	.			trans	-105.5	119.1	178.3	-174.4	0	0	0	0	108.5	L616 F633 K634 I680	L616-V629 HydrophobicContact CD1-CG1 3.99Å; V629-F633 HydrophobicContact CG1-CB 4.49Å; V629-F633 HydrophobicContact CG1-CD1 3.6Å; V629-F633 HydrophobicContact CG1-CE1 4.29Å; V629-F633 HydrophobicContact CG1-CG 4.41Å; V629-K634 HydrophobicContact CB-CG 4.48Å; V629-K634 HydrophobicContact CG1-CG 3.8Å; V629-K634 WeakPolarHBondContact O-CE 3.49Å; V629-K634 PolarHBondContact O-NZ 3.41Å; V629-K634 VanDerWaalsContact O-NZ 3.08Å; V629-I680 HydrophobicContact CG2-CB 4.21Å; V629-I680 HydrophobicContact CG2-CG2 3.52Å
630	P	94.5	Very high	89	Confident	48 Å²	48	56.3 Å²	56.3	31%	0.312	30%	0.296	S	S	.	.			trans	-64.6	144.8	179.5	-25.2	36.6	0	0	0	113.3	A615 L616 L632 F633 K634	A615-P630 WeakPolarHBondContact O-CG 3.47Å; L616-P630 WeakPolarHBondContact O-CD 3.25Å; P630-L632 PolarHBondContact O-N 2.92Å; P630-F633 PolarHBondContact O-N 3.43Å; P630-F633 VanDerWaalsContact O-N 3.08Å; P630-K634 PolarHBondContact O-N 3.38Å; P630-K634 VanDerWaalsContact O-N 3.13Å
631	D	94.7	Very high	90.3	Very high	86 Å²	86	48 Å²	48	46%	0.46	27%	0.265	S	S	.	.	H	α-helix	trans	-62.1	-31.1	-179.6	-70.8	-20.2	0	0	0	113.2	M490 F498 F633 K634 A635	M490-D631 HydrophobicContact CE-CB 4.05Å; M490-D631 WeakPolarHBondContact CE-O 3.39Å; F498-D631 HydrophobicContact CD2-CB 4.33Å; F498-D631 HydrophobicContact CE2-CB 4.12Å; D631-F633 PolarHBondContact O-N 2.86Å; D631-K634 WeakPolarHBondContact O-CB 3.29Å; D631-K634 PolarHBondContact O-N 3.12Å; D631-K634 IonicContact OD1-NZ 3.53Å; D631-K634 PolarHBondContact OD1-NZ 3.3Å; D631-A635 VanDerWaalsContact O-CB 3.29Å; D631-A635 WeakPolarHBondContact O-CB 3.25Å; D631-A635 PolarHBondContact O-N 3.13Å
632	L	95.3	Very high	91.9	Very high	35 Å²	35	47.3 Å²	47.3	18%	0.183	25%	0.252	C	S	.	.	H	α-helix	trans	-57.8	-46.3	172.9	175.7	59.6	0	0	0	112	P470 L471 F474 F498 A615 P630 A635 F636	P470-L632 HydrophobicContact CB-CD2 4.2Å; L471-L632 HydrophobicContact CD2-CD1 3.8Å; L471-L632 HydrophobicContact CG-CD1 4.43Å; F474-L632 HydrophobicContact CD2-CD1 4.3Å; F474-L632 HydrophobicContact CE2-CD1 3.66Å; F498-L632 HydrophobicContact CE1-CD1 4.42Å; F498-L632 HydrophobicContact CZ-CB 4.3Å; F498-L632 HydrophobicContact CZ-CD1 4.24Å; A615-L632 HydrophobicContact CB-CD2 3.8Å; A615-L632 HydrophobicContact CB-CG 3.92Å; P630-L632 PolarHBondContact O-N 2.92Å; L632-A635 PolarHBondContact O-N 3.46Å; L632-F636 HydrophobicContact CD1-CE1 3.97Å; L632-F636 HydrophobicContact CD1-CZ 3.91Å; L632-F636 HydrophobicContact CG-CE2 4.42Å; L632-F636 HydrophobicContact CG-CZ 4.09Å; L632-F636 PolarHBondContact O-N 2.83Å
633	F	96.9	Very high	93.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66	-45.6	176.9	176.4	-91.5	0	0	0	111.1	M488 V612 L616 V629 P630 D631 A635 F636 I641 I680 F681	M488-F633 HydrophobicContact CB-CD1 4.37Å; M488-F633 HydrophobicContact CB-CE1 4.08Å; M488-F633 WeakPolarHBondContact CB-O 3.28Å; M488-F633 HydrophobicContact CG-CE1 4.2Å; M488-F633 HydrophobicContact CG-CZ 4.25Å; M488-F633 WeakPolarHBondContact CG-O 3.38Å; M488-F633 HydrophobicContact SD-CZ 4.38Å; V612-F633 HydrophobicContact CG1-CD2 4.12Å; V612-F633 HydrophobicContact CG1-CE2 3.83Å; L616-F633 HydrophobicContact CB-CB 4.47Å; L616-F633 HydrophobicContact CB-CD2 3.58Å; L616-F633 HydrophobicContact CB-CE2 3.93Å; L616-F633 HydrophobicContact CB-CG 4.06Å; L616-F633 HydrophobicContact CD1-CB 4.32Å; L616-F633 HydrophobicContact CD1-CD1 3.78Å; L616-F633 HydrophobicContact CD1-CD2 4.02Å; L616-F633 HydrophobicContact CD1-CE1 4.02Å; L616-F633 HydrophobicContact CD1-CE2 4.22Å; L616-F633 HydrophobicContact CD1-CG 3.76Å; L616-F633 HydrophobicContact CD1-CZ 4.23Å; L616-F633 HydrophobicContact CD2-CD2 4.34Å; L616-F633 HydrophobicContact CD2-CE2 3.89Å; L616-F633 HydrophobicContact CD2-CZ 4.03Å; L616-F633 HydrophobicContact CG-CD2 4.19Å; L616-F633 HydrophobicContact CG-CE2 4.24Å; L616-F633 HydrophobicContact CG-CG 4.42Å; V629-F633 HydrophobicContact CG1-CB 4.49Å; V629-F633 HydrophobicContact CG1-CD1 3.6Å; V629-F633 HydrophobicContact CG1-CE1 4.29Å; V629-F633 HydrophobicContact CG1-CG 4.41Å; P630-F633 PolarHBondContact O-N 3.43Å; P630-F633 VanDerWaalsContact O-N 3.08Å; D631-F633 PolarHBondContact O-N 2.86Å; F633-A635 PolarHBondContact O-N 3.08Å; F633-F636 PolarHBondContact O-N 3.08Å; F633-F636 VanDerWaalsContact O-N 3.12Å; F633-I641 HydrophobicContact CE2-CD1 4Å; F633-I641 HydrophobicContact CZ-CD1 4.06Å; F633-I680 HydrophobicContact CE1-CB 4.15Å; F633-I680 HydrophobicContact CE1-CD1 3.99Å; F633-I680 HydrophobicContact CE1-CG1 4.04Å; F633-I680 HydrophobicContact CZ-CD1 3.84Å; F633-I680 HydrophobicContact CZ-CG1 4.29Å; F633-F681 HydrophobicContact CE1-CE1 4.48Å; F633-F681 AromaticContact CZ-CE1 3.96Å; F633-F681 HydrophobicContact CZ-CE1 3.96Å
634	K	96.7	Very high	94.2	Very high	51 Å²	51	37.1 Å²	37.1	22%	0.222	19%	0.193	C	C	.	.	H	α-helix	trans	-56	-36.2	177.5	-67.2	-176.5	-165.1	143.4	0	112.5	N489 M490 V629 P630 D631	N489-K634 CarbonylContact C-O 3.37Å; N489-K634 HydrophobicContact CB-CB 4.38Å; N489-K634 HydrophobicContact CB-CG 4.18Å; N489-K634 PolarHBondContact N-O 3.23Å; N489-K634 WeakPolarHBondContact O-CB 2.97Å; M490-K634 HydrophobicContact CB-CB 4.22Å; M490-K634 VanDerWaalsContact CB-O 3.28Å; M490-K634 WeakPolarHBondContact CB-O 3.32Å; M490-K634 HydrophobicContact CE-CB 3.95Å; M490-K634 PolarHBondContact N-O 2.9Å; V629-K634 HydrophobicContact CB-CG 4.48Å; V629-K634 HydrophobicContact CG1-CG 3.8Å; V629-K634 WeakPolarHBondContact O-CE 3.49Å; V629-K634 PolarHBondContact O-NZ 3.41Å; V629-K634 VanDerWaalsContact O-NZ 3.08Å; P630-K634 PolarHBondContact O-N 3.38Å; P630-K634 VanDerWaalsContact O-N 3.13Å; D631-K634 WeakPolarHBondContact O-CB 3.29Å; D631-K634 PolarHBondContact O-N 3.12Å; D631-K634 IonicContact OD1-NZ 3.53Å; D631-K634 PolarHBondContact OD1-NZ 3.3Å
635	A	96.1	Very high	94.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-77.5	-17.8	-178.5	0	0	0	0	0	114.1	F474 R487 M490 F498 D631 L632 F633	F474-A635 HydrophobicContact CE1-CB 3.72Å; F474-A635 WeakPolarHBondContact CE1-O 3.26Å; F474-A635 HydrophobicContact CZ-CB 3.61Å; R487-A635 WeakPolarHBondContact CD-O 3.38Å; M490-A635 HydrophobicContact CE-CB 3.96Å; M490-A635 HydrophobicContact SD-CB 3.76Å; F498-A635 HydrophobicContact CD1-CB 3.66Å; F498-A635 HydrophobicContact CE1-CB 3.82Å; F498-A635 HydrophobicContact CG-CB 4.3Å; D631-A635 VanDerWaalsContact O-CB 3.29Å; D631-A635 WeakPolarHBondContact O-CB 3.25Å; D631-A635 PolarHBondContact O-N 3.13Å; L632-A635 PolarHBondContact O-N 3.46Å; F633-A635 PolarHBondContact O-N 3.08Å
636	F	97.6	Very high	95.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.176	C	C	.	.	S	Bend	trans	-65.8	148	-179.2	-78.2	-33.4	0	0	0	112.9	P470 V473 F474 R487 M488 V612 A615 L632 F633 Y640	P470-F636 HydrophobicContact CB-CZ 3.8Å; V473-F636 HydrophobicContact CG2-CE1 4.25Å; F474-F636 AromaticContact CE2-CD1 3.88Å; F474-F636 HydrophobicContact CE2-CD1 3.88Å; F474-F636 AromaticContact CE2-CE1 3.74Å; F474-F636 HydrophobicContact CE2-CE1 3.74Å; F474-F636 AromaticContact CZ-CD1 3.7Å; F474-F636 HydrophobicContact CZ-CD1 3.7Å; F474-F636 HydrophobicContact CZ-CE1 4.07Å; R487-F636 CarbonylContact C-O 3.52Å; R487-F636 WeakPolarHBondContact CA-O 3.37Å; R487-F636 WeakPolarHBondContact CB-O 3.47Å; M488-F636 HydrophobicContact CG-CB 4.25Å; M488-F636 WeakPolarHBondContact CG-O 3.33Å; M488-F636 PolarHBondContact N-O 2.84Å; V612-F636 HydrophobicContact CG1-CD2 4.42Å; A615-F636 HydrophobicContact CB-CD2 4.32Å; A615-F636 HydrophobicContact CB-CE2 3.44Å; A615-F636 VanDerWaalsContact CB-CE2 3.44Å; A615-F636 HydrophobicContact CB-CZ 4.11Å; L632-F636 HydrophobicContact CD1-CE1 3.97Å; L632-F636 HydrophobicContact CD1-CZ 3.91Å; L632-F636 HydrophobicContact CG-CE2 4.42Å; L632-F636 HydrophobicContact CG-CZ 4.09Å; L632-F636 PolarHBondContact O-N 2.83Å; F633-F636 PolarHBondContact O-N 3.08Å; F633-F636 VanDerWaalsContact O-N 3.12Å; F636-Y640 HydrophobicContact CB-CD2 4.04Å; F636-Y640 AromaticContact CD1-CD2 3.94Å; F636-Y640 HydrophobicContact CD1-CD2 3.94Å; F636-Y640 AromaticContact CD1-CE2 3.77Å; F636-Y640 HydrophobicContact CD1-CE2 3.77Å; F636-Y640 HydrophobicContact CD2-CD2 4.42Å; F636-Y640 HydrophobicContact CE1-CE2 4.19Å; F636-Y640 AromaticContact CG-CD2 3.91Å; F636-Y640 HydrophobicContact CG-CD2 3.91Å; F636-Y640 HydrophobicContact CG-CE2 4.24Å
637	P	96.7	Very high	95.6	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.013	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-58.9	140.7	169.2	-24.3	35.4	0	0	0	112.7	L482 I485 A486 M488 F639 Y640	L482-P637 HydrophobicContact CD1-CG 4.5Å; L482-P637 HydrophobicContact CD2-CG 3.74Å; I485-P637 HydrophobicContact CG2-CB 3.92Å; A486-P637 WeakPolarHBondContact O-CA 3.29Å; M488-P637 WeakPolarHBondContact CE-O 3.21Å; P637-F639 HydrophobicContact CB-CD1 3.42Å; P637-F639 VanDerWaalsContact CB-CD1 3.42Å; P637-F639 HydrophobicContact CB-CE1 3.37Å; P637-F639 HydrophobicContact CB-CG 4.33Å; P637-F639 HydrophobicContact CB-CZ 4.25Å; P637-F639 HydrophobicContact CG-CD1 4.44Å; P637-F639 HydrophobicContact CG-CE1 3.91Å; P637-F639 PolarHBondContact O-N 3.13Å; P637-Y640 HydrophobicContact CB-CD1 4.03Å; P637-Y640 HydrophobicContact CB-CE1 4.18Å; P637-Y640 HydrophobicContact CB-CG 4.43Å; P637-Y640 HydrophobicContact CG-CD1 4.15Å; P637-Y640 HydrophobicContact CG-CE1 3.84Å; P637-Y640 HydrophobicContact CG-CE2 4.36Å; P637-Y640 WeakPolarHBondContact O-CB 3.37Å; P637-Y640 PolarHBondContact O-N 3.19Å; P637-Y640 VanDerWaalsContact O-N 3.13Å
638	E	96.7	Very high	96.2	Very high	22 Å²	22	25.5 Å²	25.5	10%	0.103	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-38.3	177.8	-69.8	179.7	-167	0	0	112.5	A486 Y640 I641 E642 N683 L686	A486-E638 HydrophobicContact CB-CG 4.36Å; A486-E638 PolarHBondContact O-N 3.25Å; E638-Y640 PolarHBondContact O-N 2.83Å; E638-I641 PolarHBondContact O-N 2.81Å; E638-E642 PolarHBondContact O-N 2.85Å; E638-E642 VanDerWaalsContact O-N 3.1Å; E638-N683 WeakPolarHBondContact OE1-CB 3.46Å; E638-N683 VanDerWaalsContact OE2-CB 3.29Å; E638-N683 WeakPolarHBondContact OE2-CB 3.13Å; E638-N683 PolarHBondContact OE2-ND2 3.49Å; E638-L686 HydrophobicContact CB-CD2 4.17Å; E638-L686 HydrophobicContact CG-CD2 4.31Å
639	F	96.8	Very high	96.5	Very high	8 Å²	8	19.1 Å²	19.1	4%	0.035	10%	0.1	C	C	.	.	H	α-helix	trans	-62.7	-16.2	-178.4	80.3	-98.7	0	0	0	113.7	I485 V519 H520 H523 P637 I641 E642 D643	I485-F639 HydrophobicContact CD1-CE1 4.06Å; I485-F639 HydrophobicContact CG2-CD1 3.94Å; I485-F639 HydrophobicContact CG2-CE1 3.98Å; V519-F639 HydrophobicContact CG1-CE2 4.01Å; H520-F639 AromaticContact CE1-CZ 3.68Å; H520-F639 AromaticContact ND1-CZ 3.96Å; H520-F639 AromaticContact NE2-CZ 3.79Å; H523-F639 HydrophobicContact CB-CD2 3.86Å; H523-F639 HydrophobicContact CB-CE2 3.75Å; H523-F639 AromaticContact CE1-CG 3.72Å; H523-F639 AromaticContact CG-CD2 3.54Å; H523-F639 AromaticContact CG-CE2 3.75Å; H523-F639 AromaticContact ND1-CD2 3.42Å; H523-F639 WeakPolarHBondContact ND1-CD2 3.38Å; H523-F639 AromaticContact ND1-CG 3.61Å; P637-F639 HydrophobicContact CB-CD1 3.42Å; P637-F639 VanDerWaalsContact CB-CD1 3.42Å; P637-F639 HydrophobicContact CB-CE1 3.37Å; P637-F639 HydrophobicContact CB-CG 4.33Å; P637-F639 HydrophobicContact CB-CZ 4.25Å; P637-F639 HydrophobicContact CG-CD1 4.44Å; P637-F639 HydrophobicContact CG-CE1 3.91Å; P637-F639 PolarHBondContact O-N 3.13Å; F639-I641 PolarHBondContact O-N 3.32Å; F639-E642 PolarHBondContact O-N 3.05Å; F639-D643 WeakPolarHBondContact CD2-OD2 3.14Å; F639-D643 VanDerWaalsContact O-CB 3.26Å; F639-D643 WeakPolarHBondContact O-CB 3.46Å; F639-D643 VanDerWaalsContact O-CG 3.23Å; F639-D643 PolarHBondContact O-N 3.02Å
640	Y	98.3	Very high	96.6	Very high	2 Å²	2	18.1 Å²	18.1	1%	0.008	9%	0.093	C	C	.	.	H	α-helix	trans	-62.9	-27.5	174	-77.9	12.3	0	0	0	112.8	F516 V519 H520 Q608 V612 F636 P637 E638	F516-Y640 HydrophobicContact CD1-CE2 4.14Å; F516-Y640 AromaticContact CD1-CZ 3.96Å; F516-Y640 WeakPolarHBondContact CD1-OH 3.24Å; F516-Y640 AromaticContact CE1-CE2 3.71Å; F516-Y640 HydrophobicContact CE1-CE2 3.71Å; V519-Y640 HydrophobicContact CG1-CD1 3.7Å; V519-Y640 HydrophobicContact CG1-CE1 3.57Å; H520-Y640 AromaticContact NE2-CE1 3.68Å; H520-Y640 AromaticContact NE2-CZ 3.83Å; H520-Y640 PolarHBondContact NE2-OH 2.89Å; Q608-Y640 PolarHBondContact NE2-O 2.87Å; V612-Y640 HydrophobicContact CG2-CD2 4.29Å; F636-Y640 HydrophobicContact CB-CD2 4.04Å; F636-Y640 AromaticContact CD1-CD2 3.94Å; F636-Y640 HydrophobicContact CD1-CD2 3.94Å; F636-Y640 AromaticContact CD1-CE2 3.77Å; F636-Y640 HydrophobicContact CD1-CE2 3.77Å; F636-Y640 HydrophobicContact CD2-CD2 4.42Å; F636-Y640 HydrophobicContact CE1-CE2 4.19Å; F636-Y640 AromaticContact CG-CD2 3.91Å; F636-Y640 HydrophobicContact CG-CD2 3.91Å; F636-Y640 HydrophobicContact CG-CE2 4.24Å; P637-Y640 HydrophobicContact CB-CD1 4.03Å; P637-Y640 HydrophobicContact CB-CE1 4.18Å; P637-Y640 HydrophobicContact CB-CG 4.43Å; P637-Y640 HydrophobicContact CG-CD1 4.15Å; P637-Y640 HydrophobicContact CG-CE1 3.84Å; P637-Y640 HydrophobicContact CG-CE2 4.36Å; P637-Y640 WeakPolarHBondContact O-CB 3.37Å; P637-Y640 PolarHBondContact O-N 3.19Å; P637-Y640 VanDerWaalsContact O-N 3.13Å; E638-Y640 PolarHBondContact O-N 2.83Å
641	I	98.3	Very high	96.5	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-98.1	-43.3	169.4	-69.6	175.2	0	0	0	109.9	M488 M609 V612 F633 E638 F639 D643 V644 L645 L674 F681 L686	M488-I641 HydrophobicContact CE-CB 3.77Å; M488-I641 HydrophobicContact CE-CD1 3.44Å; M488-I641 VanDerWaalsContact CE-CD1 3.44Å; M488-I641 HydrophobicContact CE-CG1 3.44Å; M488-I641 VanDerWaalsContact CE-CG1 3.44Å; M488-I641 HydrophobicContact SD-CD1 4.11Å; M609-I641 HydrophobicContact SD-CG1 4.48Å; V612-I641 HydrophobicContact CG1-CD1 3.89Å; V612-I641 HydrophobicContact CG1-CG1 3.78Å; F633-I641 HydrophobicContact CE2-CD1 4Å; F633-I641 HydrophobicContact CZ-CD1 4.06Å; E638-I641 PolarHBondContact O-N 2.81Å; F639-I641 PolarHBondContact O-N 3.32Å; I641-D643 VanDerWaalsContact C-N 3.31Å; I641-D643 PolarHBondContact O-N 3.26Å; I641-V644 WeakPolarHBondContact O-CB 3.45Å; I641-V644 PolarHBondContact O-N 3.19Å; I641-L645 HydrophobicContact CG2-CD1 3.84Å; I641-L645 HydrophobicContact CG2-CD2 4.47Å; I641-L645 HydrophobicContact CG2-CG 3.98Å; I641-L645 WeakPolarHBondContact O-CG 3.28Å; I641-L645 PolarHBondContact O-N 3.36Å; I641-L674 HydrophobicContact CD1-CD1 4.12Å; I641-L674 HydrophobicContact CD1-CD2 4.22Å; I641-L674 HydrophobicContact CG2-CD1 3.98Å; I641-F681 HydrophobicContact CD1-CE1 3.82Å; I641-F681 HydrophobicContact CD1-CZ 3.99Å; I641-L686 HydrophobicContact CG2-CD1 4.28Å
642	E	97.9	Very high	96.3	Very high	61 Å²	61	12.2 Å²	12.2	29%	0.285	6%	0.059	S	C	.	.	H	α-helix	trans	-53.8	-47.3	-174.9	-157.1	-173.8	168.9	0	0	112.6	E638 F639 V644 L645 D646 L686 K689	E638-E642 PolarHBondContact O-N 2.85Å; E638-E642 VanDerWaalsContact O-N 3.1Å; F639-E642 PolarHBondContact O-N 3.05Å; E642-V644 VanDerWaalsContact C-N 3.29Å; E642-V644 PolarHBondContact O-N 3.36Å; E642-L645 WeakPolarHBondContact O-CB 3.36Å; E642-L645 PolarHBondContact O-N 3.16Å; E642-L645 VanDerWaalsContact O-N 3.1Å; E642-D646 PolarHBondContact O-N 2.86Å; E642-L686 HydrophobicContact CB-CD1 4.06Å; E642-L686 HydrophobicContact CG-CD1 4.24Å; E642-K689 HydrophobicContact CG-CD 3.9Å; E642-K689 IonicContact OE1-NZ 2.76Å; E642-K689 PolarHBondContact OE1-NZ 3.4Å
643	D	98.4	Very high	96	Very high	5 Å²	5	12.6 Å²	12.6	3%	0.027	6%	0.06	C	C	.	.	H	α-helix	trans	-63.3	-36.4	-178.9	-70.3	4.8	0	0	0	111.9	H523 L527 F639 I641 D646 V647	H523-D643 VanDerWaalsContact CA-OD2 3.31Å; H523-D643 WeakPolarHBondContact CA-OD2 3.39Å; H523-D643 WeakPolarHBondContact CB-OD2 3.4Å; H523-D643 IonicContact CE1-OD1 2.75Å; H523-D643 IonicContact CG-OD2 2.85Å; H523-D643 IonicContact ND1-OD1 3.44Å; H523-D643 PolarHBondContact ND1-OD1 3.11Å; H523-D643 IonicContact ND1-OD2 3.92Å; H523-D643 PolarHBondContact ND1-OD2 3.43Å; L527-D643 HydrophobicContact CD1-CB 4.18Å; L527-D643 HydrophobicContact CD2-CB 4Å; L527-D643 HydrophobicContact CG-CB 3.91Å; F639-D643 WeakPolarHBondContact CD2-OD2 3.14Å; F639-D643 VanDerWaalsContact O-CB 3.26Å; F639-D643 WeakPolarHBondContact O-CB 3.46Å; F639-D643 VanDerWaalsContact O-CG 3.23Å; F639-D643 PolarHBondContact O-N 3.02Å; I641-D643 VanDerWaalsContact C-N 3.31Å; I641-D643 PolarHBondContact O-N 3.26Å; D643-D646 PolarHBondContact O-N 2.67Å; D643-V647 VanDerWaalsContact O-CG2 3.29Å; D643-V647 WeakPolarHBondContact O-CG2 3.29Å; D643-V647 PolarHBondContact O-N 3.23Å
644	V	98.3	Very high	95.2	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64.4	-45.1	175.6	175.8	0	0	0	0	109.7	Q608 M609 I641 E642 D646 V647 F648 F667	Q608-V644 HydrophobicContact CB-CG2 4.11Å; Q608-V644 HydrophobicContact CG-CG2 3.83Å; M609-V644 HydrophobicContact CB-CG1 4.14Å; M609-V644 HydrophobicContact CG-CG1 4.49Å; M609-V644 HydrophobicContact SD-CG1 4.23Å; I641-V644 WeakPolarHBondContact O-CB 3.45Å; I641-V644 PolarHBondContact O-N 3.19Å; E642-V644 VanDerWaalsContact C-N 3.29Å; E642-V644 PolarHBondContact O-N 3.36Å; V644-D646 VanDerWaalsContact C-N 3.34Å; V644-V647 PolarHBondContact O-N 3.04Å; V644-F648 HydrophobicContact CG1-CD2 4.29Å; V644-F648 HydrophobicContact CG1-CE2 4.48Å; V644-F648 WeakPolarHBondContact O-CD2 3.48Å; V644-F648 PolarHBondContact O-N 3.01Å; V644-F667 HydrophobicContact CG1-CE2 3.95Å; V644-F667 HydrophobicContact CG1-CZ 3.83Å
645	L	98	Very high	93.9	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61.2	-45.9	177.3	-58.2	174.6	0	0	0	110.5	I641 E642 V647 F648 I649 L686 K689 V690 L693	I641-L645 HydrophobicContact CG2-CD1 3.84Å; I641-L645 HydrophobicContact CG2-CD2 4.47Å; I641-L645 HydrophobicContact CG2-CG 3.98Å; I641-L645 WeakPolarHBondContact O-CG 3.28Å; I641-L645 PolarHBondContact O-N 3.36Å; E642-L645 WeakPolarHBondContact O-CB 3.36Å; E642-L645 PolarHBondContact O-N 3.16Å; E642-L645 VanDerWaalsContact O-N 3.1Å; L645-V647 PolarHBondContact O-N 3.06Å; L645-F648 PolarHBondContact O-N 3.33Å; L645-I649 WeakPolarHBondContact O-CB 3.37Å; L645-I649 VanDerWaalsContact O-CG1 3.26Å; L645-I649 WeakPolarHBondContact O-CG1 3.28Å; L645-I649 PolarHBondContact O-N 2.98Å; L645-L686 HydrophobicContact CD1-CD1 4.11Å; L645-K689 HydrophobicContact CB-CG 4.49Å; L645-K689 HydrophobicContact CD1-CB 4.23Å; L645-K689 HydrophobicContact CD1-CG 4.22Å; L645-V690 HydrophobicContact CD1-CB 4.4Å; L645-V690 HydrophobicContact CD1-CG2 3.66Å; L645-L693 HydrophobicContact CD2-CB 4.23Å; L645-L693 HydrophobicContact CD2-CD2 3.51Å
646	D	97.3	Very high	92.6	Very high	39 Å²	39	16.1 Å²	16.1	21%	0.209	8%	0.083	C	C	.	.	H	α-helix	trans	-61.6	-41.7	179.7	-85.9	-30.8	0	0	0	113.2	L527 F530 E642 D643 V644 F648 I649 F650 K689	L527-D646 HydrophobicContact CD1-CB 3.59Å; F530-D646 HydrophobicContact CD2-CB 4.15Å; F530-D646 HydrophobicContact CE2-CB 4.3Å; E642-D646 PolarHBondContact O-N 2.86Å; D643-D646 PolarHBondContact O-N 2.67Å; V644-D646 VanDerWaalsContact C-N 3.34Å; D646-F648 VanDerWaalsContact C-N 3.35Å; D646-F648 PolarHBondContact O-N 3.05Å; D646-I649 PolarHBondContact O-N 3.49Å; D646-F650 VanDerWaalsContact O-CB 3.3Å; D646-F650 WeakPolarHBondContact O-CB 3.28Å; D646-F650 PolarHBondContact O-N 2.74Å; D646-K689 VanDerWaalsContact CG-CE 3.42Å; D646-K689 WeakPolarHBondContact OD1-CE 3.49Å; D646-K689 IonicContact OD1-NZ 3.84Å; D646-K689 PolarHBondContact OD1-NZ 3.33Å; D646-K689 IonicContact OD2-NZ 3.41Å; D646-K689 PolarHBondContact OD2-NZ 3.2Å
647	V	96.1	Very high	91.2	Very high	4 Å²	4	21.3 Å²	21.3	2%	0.024	12%	0.117	C	C	.	.	H	α-helix	trans	-60.2	-46.5	175.2	168.7	0	0	0	0	110.5	L527 F530 A601 D643 V644 L645 F650 L651	L527-V647 HydrophobicContact CD1-CG2 4.3Å; F530-V647 HydrophobicContact CE2-CB 4.48Å; F530-V647 HydrophobicContact CE2-CG2 3.95Å; F530-V647 HydrophobicContact CZ-CG2 4.07Å; A601-V647 HydrophobicContact CB-CG1 4.41Å; D643-V647 VanDerWaalsContact O-CG2 3.29Å; D643-V647 WeakPolarHBondContact O-CG2 3.29Å; D643-V647 PolarHBondContact O-N 3.23Å; V644-V647 PolarHBondContact O-N 3.04Å; L645-V647 PolarHBondContact O-N 3.06Å; V647-F650 PolarHBondContact O-N 3.2Å; V647-L651 HydrophobicContact CG1-CD1 4.03Å; V647-L651 VanDerWaalsContact O-CG 3.25Å; V647-L651 WeakPolarHBondContact O-CG 3.35Å; V647-L651 PolarHBondContact O-N 3.44Å
648	F	95	Very high	90	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-73	-34	-179.3	-84.6	-91.1	0	0	0	113.5	L606 V644 L645 D646 L651 L652 L658 M662 V664 F667 L693 F708	L606-F648 HydrophobicContact CD1-CZ 4.44Å; L606-F648 HydrophobicContact CD2-CE2 3.93Å; L606-F648 HydrophobicContact CD2-CZ 3.53Å; L606-F648 HydrophobicContact CG-CE2 4.23Å; L606-F648 HydrophobicContact CG-CZ 3.82Å; V644-F648 HydrophobicContact CG1-CD2 4.29Å; V644-F648 HydrophobicContact CG1-CE2 4.48Å; V644-F648 WeakPolarHBondContact O-CD2 3.48Å; V644-F648 PolarHBondContact O-N 3.01Å; L645-F648 PolarHBondContact O-N 3.33Å; D646-F648 VanDerWaalsContact C-N 3.35Å; D646-F648 PolarHBondContact O-N 3.05Å; F648-L651 HydrophobicContact CD1-CD1 4.45Å; F648-L651 PolarHBondContact O-N 2.85Å; F648-L652 WeakPolarHBondContact O-CB 3.2Å; F648-L652 VanDerWaalsContact O-CG 3.29Å; F648-L652 WeakPolarHBondContact O-CG 3.38Å; F648-L652 PolarHBondContact O-N 2.84Å; F648-L658 HydrophobicContact CD1-CD2 4.23Å; F648-L658 HydrophobicContact CE1-CD2 4.24Å; F648-M662 HydrophobicContact CZ-CE 4.28Å; F648-V664 HydrophobicContact CE1-CG1 4.34Å; F648-F667 HydrophobicContact CB-CE1 4.25Å; F648-F667 HydrophobicContact CD1-CD1 4.25Å; F648-F667 AromaticContact CD1-CE1 3.77Å; F648-F667 HydrophobicContact CD1-CE1 3.77Å; F648-F667 HydrophobicContact CD2-CD1 4.36Å; F648-F667 AromaticContact CD2-CE1 3.52Å; F648-F667 HydrophobicContact CD2-CE1 3.52Å; F648-F667 AromaticContact CD2-CZ 4Å; F648-F667 HydrophobicContact CD2-CZ 4Å; F648-F667 AromaticContact CE1-CD1 4Å; F648-F667 HydrophobicContact CE1-CD1 4Å; F648-F667 AromaticContact CE1-CE1 3.94Å; F648-F667 HydrophobicContact CE1-CE1 3.94Å; F648-F667 HydrophobicContact CE2-CD1 4.11Å; F648-F667 AromaticContact CE2-CE1 3.7Å; F648-F667 HydrophobicContact CE2-CE1 3.7Å; F648-F667 HydrophobicContact CE2-CZ 4.31Å; F648-F667 HydrophobicContact CG-CD1 4.43Å; F648-F667 AromaticContact CG-CE1 3.56Å; F648-F667 HydrophobicContact CG-CE1 3.56Å; F648-F667 HydrophobicContact CG-CZ 4.3Å; F648-F667 AromaticContact CZ-CD1 3.93Å; F648-F667 HydrophobicContact CZ-CD1 3.93Å; F648-F667 AromaticContact CZ-CE1 3.91Å; F648-F667 HydrophobicContact CZ-CE1 3.91Å; F648-L693 HydrophobicContact CB-CD1 3.74Å; F648-L693 HydrophobicContact CB-CD2 4.26Å; F648-F708 HydrophobicContact CD1-CE1 4.12Å
649	I	94.8	Very high	88.6	Confident	12 Å²	12	22.8 Å²	22.8	6%	0.062	13%	0.127	C	C	.	.	H	α-helix	trans	-60.3	-48.8	170.2	-71.3	168.1	0	0	0	109.1	L645 D646 L651 L652 E653 K689 E692 L693 Y696	L645-I649 WeakPolarHBondContact O-CB 3.37Å; L645-I649 VanDerWaalsContact O-CG1 3.26Å; L645-I649 WeakPolarHBondContact O-CG1 3.28Å; L645-I649 PolarHBondContact O-N 2.98Å; D646-I649 PolarHBondContact O-N 3.49Å; I649-L651 PolarHBondContact O-N 3.31Å; I649-L652 PolarHBondContact O-N 3.2Å; I649-E653 WeakPolarHBondContact O-CB 3.29Å; I649-E653 PolarHBondContact O-N 2.95Å; I649-K689 HydrophobicContact CD1-CG 4.28Å; I649-E692 HydrophobicContact CD1-CG 4.13Å; I649-L693 HydrophobicContact CD1-CB 4.46Å; I649-L693 HydrophobicContact CG1-CB 4.22Å; I649-L693 HydrophobicContact CG1-CD1 4.04Å; I649-Y696 HydrophobicContact CG1-CD2 4.06Å; I649-Y696 HydrophobicContact CG1-CE2 4.47Å; I649-Y696 HydrophobicContact CG2-CD2 3.99Å; I649-Y696 HydrophobicContact CG2-CE2 3.75Å
650	F	94.1	Very high	87.1	Confident	5 Å²	5	26.5 Å²	26.5	2%	0.022	17%	0.168	C	C	.	.	H	α-helix	trans	-57.7	-45.5	178	-176.9	-86.6	0	0	0	112.3	F530 Y533 M592 L598 D646 V647 E653 Y654	F530-F650 HydrophobicContact CB-CD2 4.16Å; F530-F650 HydrophobicContact CD1-CB 4.39Å; F530-F650 HydrophobicContact CD1-CD1 4.47Å; F530-F650 AromaticContact CD1-CD2 3.4Å; F530-F650 HydrophobicContact CD1-CD2 3.4Å; F530-F650 VanDerWaalsContact CD1-CD2 3.4Å; F530-F650 AromaticContact CD1-CE2 3.7Å; F530-F650 HydrophobicContact CD1-CE2 3.7Å; F530-F650 AromaticContact CD1-CG 3.84Å; F530-F650 HydrophobicContact CD1-CG 3.84Å; F530-F650 HydrophobicContact CD1-CZ 4.37Å; F530-F650 HydrophobicContact CD2-CB 4.09Å; F530-F650 HydrophobicContact CD2-CD2 4.33Å; F530-F650 HydrophobicContact CD2-CG 4.41Å; F530-F650 HydrophobicContact CE1-CB 4.24Å; F530-F650 HydrophobicContact CE1-CD1 4.02Å; F530-F650 AromaticContact CE1-CD2 3.79Å; F530-F650 HydrophobicContact CE1-CD2 3.79Å; F530-F650 HydrophobicContact CE1-CE1 4.35Å; F530-F650 HydrophobicContact CE1-CE2 4.12Å; F530-F650 AromaticContact CE1-CG 3.74Å; F530-F650 HydrophobicContact CE1-CG 3.74Å; F530-F650 HydrophobicContact CE1-CZ 4.4Å; F530-F650 HydrophobicContact CE2-CB 3.92Å; F530-F650 HydrophobicContact CE2-CG 4.31Å; F530-F650 HydrophobicContact CG-CB 4.33Å; F530-F650 AromaticContact CG-CD2 3.72Å; F530-F650 HydrophobicContact CG-CD2 3.72Å; F530-F650 HydrophobicContact CG-CE2 4.36Å; F530-F650 HydrophobicContact CG-CG 4.19Å; F530-F650 HydrophobicContact CZ-CB 4Å; F530-F650 HydrophobicContact CZ-CD1 4.33Å; F530-F650 HydrophobicContact CZ-CD2 4.4Å; F530-F650 AromaticContact CZ-CG 3.99Å; F530-F650 HydrophobicContact CZ-CG 3.99Å; Y533-F650 AromaticContact CD1-CE2 3.6Å; Y533-F650 HydrophobicContact CD1-CE2 3.6Å; Y533-F650 HydrophobicContact CD1-CZ 4.16Å; Y533-F650 HydrophobicContact CE1-CE2 4.11Å; Y533-F650 HydrophobicContact CE1-CZ 4.36Å; Y533-F650 HydrophobicContact CG-CE2 4.27Å; M592-F650 HydrophobicContact CB-CZ 4.21Å; M592-F650 HydrophobicContact CE-CE2 4.41Å; M592-F650 HydrophobicContact CE-CZ 4.31Å; L598-F650 HydrophobicContact CD1-CE1 4.22Å; L598-F650 HydrophobicContact CD2-CD1 4.12Å; L598-F650 HydrophobicContact CD2-CE1 3.91Å; D646-F650 VanDerWaalsContact O-CB 3.3Å; D646-F650 WeakPolarHBondContact O-CB 3.28Å; D646-F650 PolarHBondContact O-N 2.74Å; V647-F650 PolarHBondContact O-N 3.2Å; F650-E653 PolarHBondContact O-N 3.46Å; F650-Y654 AromaticContact CD2-CD2 3.48Å; F650-Y654 HydrophobicContact CD2-CD2 3.48Å; F650-Y654 VanDerWaalsContact CD2-CD2 3.48Å; F650-Y654 AromaticContact CD2-CE2 3.92Å; F650-Y654 HydrophobicContact CD2-CE2 3.92Å; F650-Y654 AromaticContact CE2-CD2 3.65Å; F650-Y654 HydrophobicContact CE2-CD2 3.65Å; F650-Y654 HydrophobicContact CE2-CE2 4.21Å; F650-Y654 HydrophobicContact CE2-CG 4.38Å; F650-Y654 AromaticContact CG-CD2 3.96Å; F650-Y654 HydrophobicContact CG-CD2 3.96Å; F650-Y654 HydrophobicContact CZ-CD2 4.25Å; F650-Y654 WeakPolarHBondContact O-CB 3.41Å; F650-Y654 WeakPolarHBondContact O-CD2 3.41Å; F650-Y654 PolarHBondContact O-N 3.37Å
651	L	92.3	Very high	85.8	Confident	9 Å²	9	33.8 Å²	33.8	5%	0.047	20%	0.196	C	C	.	.	H	α-helix	trans	-61	-48.7	178.6	-70.1	167.8	0	0	0	112.3	L598 A602 V647 F648 I649 E653 E655 L658	L598-L651 HydrophobicContact CB-CD2 4.01Å; L598-L651 HydrophobicContact CD1-CD2 4.13Å; L598-L651 HydrophobicContact CD2-CD2 4.27Å; L598-L651 HydrophobicContact CG-CD2 4.39Å; A602-L651 HydrophobicContact CB-CD1 3.66Å; V647-L651 HydrophobicContact CG1-CD1 4.03Å; V647-L651 VanDerWaalsContact O-CG 3.25Å; V647-L651 WeakPolarHBondContact O-CG 3.35Å; V647-L651 PolarHBondContact O-N 3.44Å; F648-L651 HydrophobicContact CD1-CD1 4.45Å; F648-L651 PolarHBondContact O-N 2.85Å; I649-L651 PolarHBondContact O-N 3.31Å; L651-E653 VanDerWaalsContact C-N 3.29Å; L651-E653 PolarHBondContact O-N 2.67Å; L651-E655 HydrophobicContact CD2-CG 4.47Å; L651-E655 PolarHBondContact O-N 2.68Å; L651-L658 HydrophobicContact CB-CD2 4.18Å; L651-L658 HydrophobicContact CD1-CD2 4.33Å
652	L	91.3	Very high	84.7	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-68.8	-29.9	178.9	-67.1	170.9	0	0	0	112	F648 I649 L658 L693 T697 R702	F648-L652 WeakPolarHBondContact O-CB 3.2Å; F648-L652 VanDerWaalsContact O-CG 3.29Å; F648-L652 WeakPolarHBondContact O-CG 3.38Å; F648-L652 PolarHBondContact O-N 2.84Å; I649-L652 PolarHBondContact O-N 3.2Å; L652-L658 HydrophobicContact CD2-CD1 4.43Å; L652-L658 HydrophobicContact CD2-CD2 4.42Å; L652-L658 HydrophobicContact CD2-CG 4.28Å; L652-L693 HydrophobicContact CD1-CD1 3.89Å; L652-T697 HydrophobicContact CD1-CG2 4.4Å; L652-R702 PolarHBondContact O-NH1 3.26Å
653	E	87.8	Confident	84	Confident	43 Å²	43	36.1 Å²	36.1	20%	0.201	22%	0.217	C	C	.	.	H	α-helix	trans	-81.1	-33.7	-178.6	-156.3	-168.6	168.6	0	0	113.2	I649 F650 L651 Y696 R702	I649-E653 WeakPolarHBondContact O-CB 3.29Å; I649-E653 PolarHBondContact O-N 2.95Å; F650-E653 PolarHBondContact O-N 3.46Å; L651-E653 VanDerWaalsContact C-N 3.29Å; L651-E653 PolarHBondContact O-N 2.67Å; E653-Y696 HydrophobicContact CG-CE1 4.24Å; E653-R702 VanDerWaalsContact CA-NH1 3.32Å; E653-R702 PolarHBondContact O-NH1 2.85Å; E653-R702 PolarHBondContact O-NH2 3.13Å
654	Y	80.1	Confident	83.5	Confident	30 Å²	30	36.2 Å²	36.2	12%	0.118	22%	0.218	C	C	.	.	H	α-helix	trans	-125.8	-23.5	-164.6	-61.7	-63.3	0	0	0	117.5	Y533 K537 F650	Y533-Y654 HydrophobicContact CD1-CD2 4.41Å; Y533-Y654 HydrophobicContact CD1-CE2 4.39Å; Y533-Y654 AromaticContact CE1-CD1 3.72Å; Y533-Y654 HydrophobicContact CE1-CD1 3.72Å; Y533-Y654 HydrophobicContact CE1-CD2 4.1Å; Y533-Y654 AromaticContact CE1-CE1 3.92Å; Y533-Y654 HydrophobicContact CE1-CE1 3.92Å; Y533-Y654 HydrophobicContact CE1-CE2 4.32Å; Y533-Y654 AromaticContact CE1-CG 3.8Å; Y533-Y654 HydrophobicContact CE1-CG 3.8Å; K537-Y654 HydrophobicContact CD-CD1 4.1Å; K537-Y654 HydrophobicContact CD-CE1 3.67Å; K537-Y654 VanDerWaalsContact NZ-CE1 3.3Å; F650-Y654 AromaticContact CD2-CD2 3.48Å; F650-Y654 HydrophobicContact CD2-CD2 3.48Å; F650-Y654 VanDerWaalsContact CD2-CD2 3.48Å; F650-Y654 AromaticContact CD2-CE2 3.92Å; F650-Y654 HydrophobicContact CD2-CE2 3.92Å; F650-Y654 AromaticContact CE2-CD2 3.65Å; F650-Y654 HydrophobicContact CE2-CD2 3.65Å; F650-Y654 HydrophobicContact CE2-CE2 4.21Å; F650-Y654 HydrophobicContact CE2-CG 4.38Å; F650-Y654 AromaticContact CG-CD2 3.96Å; F650-Y654 HydrophobicContact CG-CD2 3.96Å; F650-Y654 HydrophobicContact CZ-CD2 4.25Å; F650-Y654 WeakPolarHBondContact O-CB 3.41Å; F650-Y654 WeakPolarHBondContact O-CD2 3.41Å; F650-Y654 PolarHBondContact O-N 3.37Å
655	E	70.5	Confident	83.1	Confident	70 Å²	70	39.1 Å²	39.1	33%	0.327	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-35.4	-175.9	-74.3	-50.5	113.1	0	0	115.1	K593 L598 L651	K593-E655 WeakPolarHBondContact CB-OE1 3.34Å; K593-E655 WeakPolarHBondContact CD-OE1 3.49Å; K593-E655 WeakPolarHBondContact CE-OE1 3.28Å; K593-E655 WeakPolarHBondContact CG-OE1 3.36Å; L598-E655 HydrophobicContact CD1-CG 3.28Å; L651-E655 HydrophobicContact CD2-CG 4.47Å; L651-E655 PolarHBondContact O-N 2.68Å
656	G	69.1	Low	82.7	Confident	25 Å²	25	45.1 Å²	45.1	26%	0.258	25%	0.254	S	S	.	.			trans	112.9	-142.1	-173.6	0	0	0	0	0	112.4	A704	G656-A704 WeakPolarHBondContact O-CB 3.1Å
657	P	66.9	Low	82.5	Confident	109 Å²	109	43.4 Å²	43.4	71%	0.708	25%	0.245	S	C	*	.	S	Bend	trans	-65	140	-174.4	28.2	-33.2	0	0	0	111.3
658	L	72.1	Confident	82.4	Confident	20 Å²	20	43.2 Å²	43.2	11%	0.105	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-58	144.8	174.1	-65.6	169.8	0	0	0	110.2	F648 L651 L652 G660 V664 F708	F648-L658 HydrophobicContact CD1-CD2 4.23Å; F648-L658 HydrophobicContact CE1-CD2 4.24Å; L651-L658 HydrophobicContact CB-CD2 4.18Å; L651-L658 HydrophobicContact CD1-CD2 4.33Å; L652-L658 HydrophobicContact CD2-CD1 4.43Å; L652-L658 HydrophobicContact CD2-CD2 4.42Å; L652-L658 HydrophobicContact CD2-CG 4.28Å; L658-G660 PolarHBondContact O-N 3.22Å; L658-V664 HydrophobicContact CD1-CG1 3.85Å; L658-F708 HydrophobicContact CD1-CB 4.37Å; L658-F708 HydrophobicContact CD1-CD1 4.12Å
659	P	67.8	Low	82.3	Confident	35 Å²	35	45.8 Å²	45.8	23%	0.227	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-55.7	125.2	-178.9	-22.5	31	0	0	0	111.3	Y661 M662	P659-Y661 HydrophobicContact CB-CD1 4Å; P659-Y661 HydrophobicContact CB-CE1 3.34Å; P659-Y661 HydrophobicContact CB-CE2 4.05Å; P659-Y661 WeakPolarHBondContact CB-OH 3.13Å; P659-Y661 HydrophobicContact CG-CE1 4.49Å; P659-Y661 PolarHBondContact O-N 3.25Å; P659-M662 HydrophobicContact CB-CG 4.09Å; P659-M662 HydrophobicContact CB-SD 4.05Å; P659-M662 HydrophobicContact CG-CG 4.45Å; P659-M662 HydrophobicContact CG-SD 3.75Å; P659-M662 VanDerWaalsContact O-CB 3.3Å; P659-M662 WeakPolarHBondContact O-CB 3.31Å; P659-M662 PolarHBondContact O-N 3.23Å
660	G	65.9	Low	82.3	Confident	86 Å²	86	46 Å²	46	89%	0.887	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-15.8	-167.7	0	0	0	0	0	115.9	L658 M662	L658-G660 PolarHBondContact O-N 3.22Å; G660-M662 VanDerWaalsContact C-N 3.31Å
661	Y	69.6	Low	82.4	Confident	156 Å²	156	45.8 Å²	45.8	61%	0.612	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-10.2	173.1	57.1	-95.8	0	0	0	113.2	S599 P659	S599-Y661 WeakPolarHBondContact CB-OH 3.02Å; S599-Y661 PolarHBondContact OG-OH 2.84Å; P659-Y661 HydrophobicContact CB-CD1 4Å; P659-Y661 HydrophobicContact CB-CE1 3.34Å; P659-Y661 HydrophobicContact CB-CE2 4.05Å; P659-Y661 WeakPolarHBondContact CB-OH 3.13Å; P659-Y661 HydrophobicContact CG-CE1 4.49Å; P659-Y661 PolarHBondContact O-N 3.25Å
662	M	75.9	Confident	82.5	Confident	20 Å²	20	45.6 Å²	45.6	10%	0.099	25%	0.254	C	S	.	.			trans	-87	113.3	180	-65.3	-174	64.9	0	0	110.7	A602 L606 F648 P659 G660 V664	A602-M662 HydrophobicContact CB-CE 3.38Å; A602-M662 HydrophobicContact CB-SD 3.69Å; L606-M662 HydrophobicContact CD1-CE 3.47Å; L606-M662 VanDerWaalsContact CD1-CE 3.47Å; L606-M662 HydrophobicContact CG-CE 4.16Å; F648-M662 HydrophobicContact CZ-CE 4.28Å; P659-M662 HydrophobicContact CB-CG 4.09Å; P659-M662 HydrophobicContact CB-SD 4.05Å; P659-M662 HydrophobicContact CG-CG 4.45Å; P659-M662 HydrophobicContact CG-SD 3.75Å; P659-M662 VanDerWaalsContact O-CB 3.3Å; P659-M662 WeakPolarHBondContact O-CB 3.31Å; P659-M662 PolarHBondContact O-N 3.23Å; G660-M662 VanDerWaalsContact C-N 3.31Å; M662-V664 PolarHBondContact O-N 3.02Å
663	S	82.9	Confident	82.7	Confident	90 Å²	90	46.1 Å²	46.1	63%	0.629	26%	0.257	S	S	*	.			trans	-78.8	114.3	167.5	-178.5	0	0	0	0	110.1
664	V	87.4	Confident	83	Confident	7 Å²	7	44 Å²	44	4%	0.042	25%	0.247	C	C	.	.			trans	-92.3	0.1	174.2	-67.5	0	0	0	0	113.4	F648 L658 M662 R666 F667 A668 F708	F648-V664 HydrophobicContact CE1-CG1 4.34Å; L658-V664 HydrophobicContact CD1-CG1 3.85Å; M662-V664 PolarHBondContact O-N 3.02Å; V664-R666 PolarHBondContact O-N 2.9Å; V664-F667 CarbonylContact O-C 3.6Å; V664-F667 PolarHBondContact O-N 2.91Å; V664-F667 VanDerWaalsContact O-N 3.08Å; V664-A668 PolarHBondContact O-N 3.47Å; V664-F708 HydrophobicContact CB-CD1 4.49Å; V664-F708 HydrophobicContact CB-CG 4.32Å; V664-F708 HydrophobicContact CG1-CD1 4.49Å; V664-F708 HydrophobicContact CG2-CB 4.04Å; V664-F708 HydrophobicContact CG2-CG 4.16Å
665	H	90	Very high	83.7	Confident	60 Å²	60	42.7 Å²	42.7	28%	0.278	24%	0.242	S	C	.	.	H	α-helix	trans	-56.3	-48.6	-175.4	174.1	-96.5	0	0	0	112.8	F667 A668 Q669 Q714	H665-F667 VanDerWaalsContact C-N 3.32Å; H665-F667 PolarHBondContact O-N 2.85Å; H665-A668 WeakPolarHBondContact O-CB 3.26Å; H665-A668 PolarHBondContact O-N 3.37Å; H665-Q669 PolarHBondContact CE1-NE2 3.37Å; H665-Q669 PolarHBondContact O-N 3.27Å; H665-Q669 VanDerWaalsContact O-N 3.14Å; H665-Q714 PolarHBondContact CD2-OE1 3.44Å; H665-Q714 PolarHBondContact NE2-OE1 3.02Å
666	R	90.2	Very high	84.9	Confident	127 Å²	127	39.9 Å²	39.9	48%	0.479	23%	0.23	S	C	.	.	H	α-helix	trans	-64.1	-39.7	177.4	-170.6	-179.1	-171.6	172.2	10.5	111.8	D610 V664 A668 Q669 H670	D610-R666 WeakPolarHBondContact OD1-CD 3.4Å; D610-R666 IonicContact OD1-CZ 3.04Å; D610-R666 IonicContact OD1-NE 2.99Å; D610-R666 PolarHBondContact OD1-NE 2.84Å; D610-R666 IonicContact OD1-NH1 3.3Å; D610-R666 IonicContact OD2-CZ 2.65Å; D610-R666 IonicContact OD2-NE 2.72Å; D610-R666 IonicContact OD2-NH1 2.75Å; D610-R666 PolarHBondContact OD2-NH1 3.44Å; V664-R666 PolarHBondContact O-N 2.9Å; R666-A668 VanDerWaalsContact C-N 3.31Å; R666-A668 PolarHBondContact O-N 3.09Å; R666-Q669 WeakPolarHBondContact O-CB 3.35Å; R666-Q669 PolarHBondContact O-N 2.81Å; R666-H670 PolarHBondContact O-N 3.49Å
667	F	93.9	Very high	86	Confident	3 Å²	3	39.7 Å²	39.7	1%	0.013	22%	0.223	C	C	.	.	H	α-helix	trans	-67	-34.6	177.9	-175.5	-142.6	0	0	0	112.3	L606 M609 V644 F648 V664 H665 H670 L671 L693 F708	L606-F667 HydrophobicContact CD2-CB 3.58Å; L606-F667 HydrophobicContact CD2-CD1 3.8Å; L606-F667 HydrophobicContact CD2-CD2 4.44Å; L606-F667 HydrophobicContact CD2-CG 3.7Å; M609-F667 HydrophobicContact CB-CD2 4.44Å; M609-F667 HydrophobicContact CB-CE2 4.49Å; M609-F667 HydrophobicContact CE-CD2 4.34Å; M609-F667 HydrophobicContact CE-CE2 3.88Å; M609-F667 HydrophobicContact CG-CD2 3.78Å; M609-F667 HydrophobicContact CG-CE2 3.79Å; M609-F667 HydrophobicContact SD-CE2 4.1Å; V644-F667 HydrophobicContact CG1-CE2 3.95Å; V644-F667 HydrophobicContact CG1-CZ 3.83Å; F648-F667 HydrophobicContact CB-CE1 4.25Å; F648-F667 HydrophobicContact CD1-CD1 4.25Å; F648-F667 AromaticContact CD1-CE1 3.77Å; F648-F667 HydrophobicContact CD1-CE1 3.77Å; F648-F667 HydrophobicContact CD2-CD1 4.36Å; F648-F667 AromaticContact CD2-CE1 3.52Å; F648-F667 HydrophobicContact CD2-CE1 3.52Å; F648-F667 AromaticContact CD2-CZ 4Å; F648-F667 HydrophobicContact CD2-CZ 4Å; F648-F667 AromaticContact CE1-CD1 4Å; F648-F667 HydrophobicContact CE1-CD1 4Å; F648-F667 AromaticContact CE1-CE1 3.94Å; F648-F667 HydrophobicContact CE1-CE1 3.94Å; F648-F667 HydrophobicContact CE2-CD1 4.11Å; F648-F667 AromaticContact CE2-CE1 3.7Å; F648-F667 HydrophobicContact CE2-CE1 3.7Å; F648-F667 HydrophobicContact CE2-CZ 4.31Å; F648-F667 HydrophobicContact CG-CD1 4.43Å; F648-F667 AromaticContact CG-CE1 3.56Å; F648-F667 HydrophobicContact CG-CE1 3.56Å; F648-F667 HydrophobicContact CG-CZ 4.3Å; F648-F667 AromaticContact CZ-CD1 3.93Å; F648-F667 HydrophobicContact CZ-CD1 3.93Å; F648-F667 AromaticContact CZ-CE1 3.91Å; F648-F667 HydrophobicContact CZ-CE1 3.91Å; V664-F667 CarbonylContact O-C 3.6Å; V664-F667 PolarHBondContact O-N 2.91Å; V664-F667 VanDerWaalsContact O-N 3.08Å; H665-F667 VanDerWaalsContact C-N 3.32Å; H665-F667 PolarHBondContact O-N 2.85Å; F667-H670 HydrophobicContact CD2-CB 4.41Å; F667-H670 WeakPolarHBondContact O-CB 3.45Å; F667-H670 PolarHBondContact O-N 3.45Å; F667-L671 WeakPolarHBondContact O-CB 3.25Å; F667-L671 PolarHBondContact O-N 3.4Å; F667-L693 HydrophobicContact CE1-CD2 4.05Å; F667-L693 HydrophobicContact CZ-CD2 3.74Å; F667-F708 AromaticContact CD1-CE1 3.58Å; F667-F708 HydrophobicContact CD1-CE1 3.58Å; F667-F708 HydrophobicContact CD1-CE2 4.32Å; F667-F708 AromaticContact CD1-CZ 3.33Å; F667-F708 HydrophobicContact CD1-CZ 3.33Å; F667-F708 AromaticContact CE1-CE1 3.57Å; F667-F708 HydrophobicContact CE1-CE1 3.57Å; F667-F708 AromaticContact CE1-CZ 3.47Å; F667-F708 HydrophobicContact CE1-CZ 3.47Å; F667-F708 VanDerWaalsContact CE1-CZ 3.47Å; F667-F708 HydrophobicContact CG-CZ 4.09Å; F667-F708 HydrophobicContact CZ-CZ 4.32Å
668	A	93.8	Very high	87.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-44	171.2	0	0	0	0	0	111.9	V664 H665 R666 H670 L671 L672 F708 L712	V664-A668 PolarHBondContact O-N 3.47Å; H665-A668 WeakPolarHBondContact O-CB 3.26Å; H665-A668 PolarHBondContact O-N 3.37Å; R666-A668 VanDerWaalsContact C-N 3.31Å; R666-A668 PolarHBondContact O-N 3.09Å; A668-H670 VanDerWaalsContact C-N 3.33Å; A668-H670 PolarHBondContact O-N 2.8Å; A668-L671 PolarHBondContact O-N 3.47Å; A668-L672 WeakPolarHBondContact O-CB 3.22Å; A668-L672 PolarHBondContact O-N 3.08Å; A668-F708 HydrophobicContact CB-CD2 3.98Å; A668-F708 HydrophobicContact CB-CE2 3.85Å; A668-L712 HydrophobicContact CB-CD2 3.78Å; A668-L712 HydrophobicContact CB-CG 3.92Å; A668-L712 WeakPolarHBondContact O-CD2 3.44Å
669	Q	92.5	Very high	87.9	Confident	53 Å²	53	38 Å²	38	25%	0.248	23%	0.225	C	C	.	.	H	α-helix	trans	-60.8	-42.5	173.5	-64.9	178.8	-21.4	0	0	112	H665 R666 L672 I673	H665-Q669 PolarHBondContact CE1-NE2 3.37Å; H665-Q669 PolarHBondContact O-N 3.27Å; H665-Q669 VanDerWaalsContact O-N 3.14Å; R666-Q669 WeakPolarHBondContact O-CB 3.35Å; R666-Q669 PolarHBondContact O-N 2.81Å; Q669-L672 PolarHBondContact O-N 3.45Å; Q669-I673 WeakPolarHBondContact O-CG1 3.43Å; Q669-I673 PolarHBondContact O-N 3.02Å
670	H	94.5	Very high	89.1	Confident	17 Å²	17	36.7 Å²	36.7	8%	0.079	22%	0.216	C	C	.	.	H	α-helix	trans	-61.9	-45.6	175.3	-63.7	162.7	0	0	0	112.3	M609 D610 M613 R666 F667 A668 L672 I673 L674	M609-H670 HydrophobicContact CE-CB 3.83Å; M609-H670 HydrophobicContact CG-CB 4.3Å; D610-H670 IonicContact OD1-CE1 3.26Å; D610-H670 PolarHBondContact OD1-CE1 3.22Å; D610-H670 IonicContact OD1-ND1 3.65Å; M613-H670 HydrophobicContact CE-CB 4.04Å; M613-H670 HydrophobicContact CG-CB 3.84Å; M613-H670 HydrophobicContact SD-CB 4.27Å; R666-H670 PolarHBondContact O-N 3.49Å; F667-H670 HydrophobicContact CD2-CB 4.41Å; F667-H670 WeakPolarHBondContact O-CB 3.45Å; F667-H670 PolarHBondContact O-N 3.45Å; A668-H670 VanDerWaalsContact C-N 3.33Å; A668-H670 PolarHBondContact O-N 2.8Å; H670-L672 VanDerWaalsContact C-N 3.32Å; H670-L672 PolarHBondContact O-N 3.34Å; H670-I673 PolarHBondContact O-N 2.97Å; H670-L674 WeakPolarHBondContact O-CG 3.3Å; H670-L674 PolarHBondContact O-N 3.23Å
671	L	95.6	Very high	90.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.2	-44	177.2	-177.6	59.2	0	0	0	111.1	F667 A668 I673 L674 I675 V690 L693 L694 F708 L712	F667-L671 WeakPolarHBondContact O-CB 3.25Å; F667-L671 PolarHBondContact O-N 3.4Å; A668-L671 PolarHBondContact O-N 3.47Å; L671-I673 PolarHBondContact O-N 3.23Å; L671-L674 PolarHBondContact O-N 3.31Å; L671-I675 HydrophobicContact CD1-CD1 4.01Å; L671-I675 HydrophobicContact CD1-CG1 4.35Å; L671-I675 HydrophobicContact CG-CD1 3.91Å; L671-I675 VanDerWaalsContact O-CG1 3.29Å; L671-I675 WeakPolarHBondContact O-CG1 3.44Å; L671-I675 PolarHBondContact O-N 3.36Å; L671-V690 HydrophobicContact CD1-CG1 3.56Å; L671-L693 HydrophobicContact CD1-CD2 4.18Å; L671-L693 HydrophobicContact CD2-CD2 4.25Å; L671-L693 HydrophobicContact CD2-CG 4.24Å; L671-L694 HydrophobicContact CD2-CB 4.49Å; L671-F708 HydrophobicContact CD2-CE2 3.77Å; L671-F708 HydrophobicContact CD2-CZ 3.78Å; L671-L712 HydrophobicContact CB-CD2 4.32Å; L671-L712 HydrophobicContact CD2-CD2 4.34Å; L671-L712 HydrophobicContact CG-CD2 4.48Å
672	L	94.8	Very high	91.3	Very high	5 Å²	5	30.1 Å²	30.1	3%	0.026	17%	0.171	C	C	.	.	H	α-helix	trans	-59.1	-46.2	175.6	-179.2	62.1	0	0	0	111.9	I624 A668 Q669 H670 L674 I675 C676 L712 N715 A718 L722	I624-L672 HydrophobicContact CD1-CD2 3.69Å; I624-L672 HydrophobicContact CD1-CG 4.27Å; I624-L672 HydrophobicContact CG1-CD2 3.98Å; I624-L672 HydrophobicContact CG1-CG 4.35Å; I624-L672 HydrophobicContact CG2-CG 4.32Å; A668-L672 WeakPolarHBondContact O-CB 3.22Å; A668-L672 PolarHBondContact O-N 3.08Å; Q669-L672 PolarHBondContact O-N 3.45Å; H670-L672 VanDerWaalsContact C-N 3.32Å; H670-L672 PolarHBondContact O-N 3.34Å; L672-L674 PolarHBondContact O-N 3.23Å; L672-I675 PolarHBondContact O-N 2.97Å; L672-C676 WeakPolarHBondContact O-CB 3.2Å; L672-C676 PolarHBondContact O-N 2.97Å; L672-C676 PolarHBondContact O-SG 3.14Å; L672-C676 VanDerWaalsContact O-SG 3.37Å; L672-L712 HydrophobicContact CB-CD2 4.29Å; L672-N715 HydrophobicContact CD2-CB 4.08Å; L672-A718 HydrophobicContact CD1-CB 4.2Å; L672-A718 HydrophobicContact CD2-CB 3.73Å; L672-L722 HydrophobicContact CD1-CB 4.33Å
673	I	94.7	Very high	91.9	Very high	12 Å²	12	31.3 Å²	31.3	6%	0.062	18%	0.177	C	C	.	.	H	α-helix	trans	-60.3	-44.8	176.9	-67.8	164.5	0	0	0	110.8	M613 L616 L626 Q669 H670 L671 C676 N677	M613-I673 HydrophobicContact CE-CB 4.1Å; M613-I673 HydrophobicContact CE-CD1 4.3Å; M613-I673 HydrophobicContact CE-CG2 3.95Å; L616-I673 HydrophobicContact CD2-CG2 4.45Å; L626-I673 HydrophobicContact CD1-CG2 4.04Å; L626-I673 HydrophobicContact CD2-CG2 4.35Å; L626-I673 HydrophobicContact CG-CG2 4.27Å; Q669-I673 WeakPolarHBondContact O-CG1 3.43Å; Q669-I673 PolarHBondContact O-N 3.02Å; H670-I673 PolarHBondContact O-N 2.97Å; L671-I673 PolarHBondContact O-N 3.23Å; I673-C676 PolarHBondContact O-N 2.8Å; I673-N677 PolarHBondContact O-N 3.16Å; I673-N677 PolarHBondContact O-ND2 3.44Å
674	L	95.8	Very high	92.2	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.7	-43.6	-179.7	-66.4	-172.6	0	0	0	112.4	M609 M613 L616 I641 H670 L671 L672 C676 N677 T678 I680 F681 V690	M609-L674 HydrophobicContact CE-CD1 3.36Å; M609-L674 HydrophobicContact CE-CG 4.18Å; M613-L674 HydrophobicContact CE-CD2 4.28Å; M613-L674 HydrophobicContact SD-CD2 3.81Å; M613-L674 HydrophobicContact SD-CG 4.19Å; L616-L674 HydrophobicContact CD2-CD2 4.1Å; I641-L674 HydrophobicContact CD1-CD1 4.12Å; I641-L674 HydrophobicContact CD1-CD2 4.22Å; I641-L674 HydrophobicContact CG2-CD1 3.98Å; H670-L674 WeakPolarHBondContact O-CG 3.3Å; H670-L674 PolarHBondContact O-N 3.23Å; L671-L674 PolarHBondContact O-N 3.31Å; L672-L674 PolarHBondContact O-N 3.23Å; L674-C676 VanDerWaalsContact C-N 3.33Å; L674-C676 PolarHBondContact O-N 3.29Å; L674-N677 CarbonylContact O-C 3.57Å; L674-N677 PolarHBondContact O-N 3.22Å; L674-T678 PolarHBondContact O-N 3.09Å; L674-I680 HydrophobicContact CD2-CD1 3.79Å; L674-F681 HydrophobicContact CD1-CZ 4.38Å; L674-F681 HydrophobicContact CD2-CZ 3.9Å; L674-V690 HydrophobicContact CB-CG1 3.75Å; L674-V690 HydrophobicContact CB-CG2 4.41Å; L674-V690 HydrophobicContact CD1-CG1 4.49Å; L674-V690 HydrophobicContact CD1-CG2 4.27Å
675	I	95	Very high	92.3	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-66.6	-39.1	179.3	-63.1	167.7	0	0	0	110.8	L671 L672 N677 T678 V690 L694 L722 L726	L671-I675 HydrophobicContact CD1-CD1 4.01Å; L671-I675 HydrophobicContact CD1-CG1 4.35Å; L671-I675 HydrophobicContact CG-CD1 3.91Å; L671-I675 VanDerWaalsContact O-CG1 3.29Å; L671-I675 WeakPolarHBondContact O-CG1 3.44Å; L671-I675 PolarHBondContact O-N 3.36Å; L672-I675 PolarHBondContact O-N 2.97Å; I675-N677 PolarHBondContact O-N 3.34Å; I675-T678 WeakPolarHBondContact O-CG2 3.34Å; I675-V690 HydrophobicContact CD1-CG1 4.27Å; I675-V690 HydrophobicContact CG1-CG1 3.42Å; I675-V690 VanDerWaalsContact CG1-CG1 3.42Å; I675-L694 HydrophobicContact CD1-CB 3.78Å; I675-L694 HydrophobicContact CD1-CD2 3.53Å; I675-L694 HydrophobicContact CD1-CG 4.17Å; I675-L722 HydrophobicContact CB-CD1 4.26Å; I675-L722 HydrophobicContact CD1-CD1 4.24Å; I675-L722 HydrophobicContact CG2-CD1 3.53Å; I675-L726 HydrophobicContact CG2-CD2 3.95Å; I675-L726 HydrophobicContact CG2-CG 4.39Å
676	C	94.2	Very high	92.4	Very high	11 Å²	11	29.9 Å²	29.9	7%	0.074	16%	0.161	C	C	.	.	H	α-helix	trans	-74.1	-10.7	-179.3	-70.3	0	0	0	0	113.7	I624 L672 I673 L674 S725	I624-C676 HydrophobicContact CG2-CB 3.4Å; I624-C676 VanDerWaalsContact CG2-SG 3.52Å; L672-C676 WeakPolarHBondContact O-CB 3.2Å; L672-C676 PolarHBondContact O-N 2.97Å; L672-C676 PolarHBondContact O-SG 3.14Å; L672-C676 VanDerWaalsContact O-SG 3.37Å; I673-C676 PolarHBondContact O-N 2.8Å; L674-C676 VanDerWaalsContact C-N 3.33Å; L674-C676 PolarHBondContact O-N 3.29Å; C676-S725 WeakPolarHBondContact CA-OG 3.21Å
677	N	93.8	Very high	92.6	Very high	21 Å²	21	24 Å²	24	11%	0.112	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.1	46.3	-178.1	-55.1	-90	0	0	0	111.9	I624 L626 I673 L674 I675 G679 I680	I624-N677 PolarHBondContact O-ND2 3.36Å; L626-N677 HydrophobicContact CD1-CB 4.14Å; L626-N677 HydrophobicContact CG-CB 4.5Å; L626-N677 PolarHBondContact N-OD1 3.49Å; I673-N677 PolarHBondContact O-N 3.16Å; I673-N677 PolarHBondContact O-ND2 3.44Å; L674-N677 CarbonylContact O-C 3.57Å; L674-N677 PolarHBondContact O-N 3.22Å; I675-N677 PolarHBondContact O-N 3.34Å; N677-G679 PolarHBondContact O-N 3.13Å; N677-I680 HydrophobicContact CB-CG2 3.96Å; N677-I680 WeakPolarHBondContact O-CG1 3.35Å; N677-I680 VanDerWaalsContact O-CG2 3.31Å; N677-I680 WeakPolarHBondContact O-CG2 3.35Å; N677-I680 PolarHBondContact O-N 3.31Å
678	T	89.7	Confident	92.6	Very high	27 Å²	27	24.4 Å²	24.4	17%	0.166	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-55.1	-24	-179.2	53.4	0	0	0	0	114.9	L674 I675 I680 F681 S687 F729	L674-T678 PolarHBondContact O-N 3.09Å; I675-T678 WeakPolarHBondContact O-CG2 3.34Å; T678-I680 PolarHBondContact O-N 3.43Å; T678-I680 VanDerWaalsContact O-N 3.17Å; T678-F681 PolarHBondContact O-N 2.9Å; T678-S687 PolarHBondContact O-OG 3.02Å; T678-F729 HydrophobicContact CG2-CD2 4.14Å; T678-F729 HydrophobicContact CG2-CE2 4.36Å
679	G	88.1	Confident	92.7	Very high	66 Å²	66	26 Å²	26	68%	0.68	15%	0.15	S	C	*	.	G	3₁₀ helix	trans	-69.1	-3.7	175.9	0	0	0	0	0	115.1	N677 F681	N677-G679 PolarHBondContact O-N 3.13Å; G679-F681 PolarHBondContact O-N 3.2Å
680	I	92.7	Very high	92.9	Very high	7 Å²	7	23.4 Å²	23.4	4%	0.036	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-73.3	-16.6	171.4	70.8	-170.3	0	0	0	112.6	N489 L616 L626 V629 F633 L674 N677 T678	N489-I680 VanDerWaalsContact CB-O 3.27Å; N489-I680 WeakPolarHBondContact CB-O 3.33Å; N489-I680 PolarHBondContact ND2-O 3.1Å; L616-I680 HydrophobicContact CD2-CD1 3.89Å; L626-I680 HydrophobicContact CD1-CG2 4.31Å; V629-I680 HydrophobicContact CG2-CB 4.21Å; V629-I680 HydrophobicContact CG2-CG2 3.52Å; F633-I680 HydrophobicContact CE1-CB 4.15Å; F633-I680 HydrophobicContact CE1-CD1 3.99Å; F633-I680 HydrophobicContact CE1-CG1 4.04Å; F633-I680 HydrophobicContact CZ-CD1 3.84Å; F633-I680 HydrophobicContact CZ-CG1 4.29Å; L674-I680 HydrophobicContact CD2-CD1 3.79Å; N677-I680 HydrophobicContact CB-CG2 3.96Å; N677-I680 WeakPolarHBondContact O-CG1 3.35Å; N677-I680 VanDerWaalsContact O-CG2 3.31Å; N677-I680 WeakPolarHBondContact O-CG2 3.35Å; N677-I680 PolarHBondContact O-N 3.31Å; T678-I680 PolarHBondContact O-N 3.43Å; T678-I680 VanDerWaalsContact O-N 3.17Å
681	F	93.2	Very high	93	Very high	12 Å²	12	22.7 Å²	22.7	5%	0.053	14%	0.135	C	C	.	.			trans	-101.1	136.9	179	-53.8	-55.8	0	0	0	111	M488 F633 I641 L674 T678 G679 L686 S687 V690	M488-F681 WeakPolarHBondContact O-CA 3.34Å; M488-F681 HydrophobicContact SD-CD1 3.8Å; M488-F681 HydrophobicContact SD-CE1 3.69Å; F633-F681 HydrophobicContact CE1-CE1 4.48Å; F633-F681 AromaticContact CZ-CE1 3.96Å; F633-F681 HydrophobicContact CZ-CE1 3.96Å; I641-F681 HydrophobicContact CD1-CE1 3.82Å; I641-F681 HydrophobicContact CD1-CZ 3.99Å; L674-F681 HydrophobicContact CD1-CZ 4.38Å; L674-F681 HydrophobicContact CD2-CZ 3.9Å; T678-F681 PolarHBondContact O-N 2.9Å; G679-F681 PolarHBondContact O-N 3.2Å; F681-L686 HydrophobicContact CD1-CD2 3.57Å; F681-L686 HydrophobicContact CD1-CG 4.26Å; F681-L686 HydrophobicContact CD2-CG 4.42Å; F681-L686 HydrophobicContact CE1-CD2 3.74Å; F681-L686 HydrophobicContact CE1-CG 4.33Å; F681-L686 HydrophobicContact CE2-CG 4.47Å; F681-L686 HydrophobicContact CG-CD2 4.01Å; F681-L686 HydrophobicContact CG-CG 4.29Å; F681-L686 HydrophobicContact CZ-CD2 4.28Å; F681-L686 HydrophobicContact CZ-CG 4.4Å; F681-S687 WeakPolarHBondContact CD2-OG 3.49Å; F681-V690 HydrophobicContact CE2-CG2 4.06Å; F681-V690 HydrophobicContact CZ-CG2 4.43Å
682	N	89.1	Confident	93	Very high	93 Å²	93	25.2 Å²	25.2	50%	0.497	15%	0.147	S	C	.	.	S	Bend	trans	-77	-37.8	168.3	-82.3	-13.1	0	0	0	111.9	M488 N489 P684	M488-N682 PolarHBondContact O-N 3.27Å; N489-N682 WeakPolarHBondContact CA-ND2 3.45Å; N489-N682 VanDerWaalsContact OD1-CG 3.28Å; N489-N682 PolarHBondContact OD1-ND2 3.36Å; N489-N682 VanDerWaalsContact OD1-ND2 3.12Å; N489-N682 PolarHBondContact OD1-OD1 3.44Å; N682-P684 VanDerWaalsContact O-CD 3.28Å; N682-P684 WeakPolarHBondContact O-CD 3.43Å
683	N	88.9	Confident	93.1	Very high	44 Å²	44	25 Å²	25	24%	0.235	15%	0.145	C	C	.	.			trans	-82.3	110	177.4	-179.8	2.5	0	0	0	110.3	E638 Y685 L686	E638-N683 WeakPolarHBondContact OE1-CB 3.46Å; E638-N683 VanDerWaalsContact OE2-CB 3.29Å; E638-N683 WeakPolarHBondContact OE2-CB 3.13Å; E638-N683 PolarHBondContact OE2-ND2 3.49Å; N683-Y685 PolarHBondContact O-N 3.06Å; N683-Y685 WeakPolarHBondContact OD1-CB 3.23Å; N683-Y685 PolarHBondContact OD1-N 2.84Å; N683-L686 HydrophobicContact CB-CB 4.45Å; N683-L686 WeakPolarHBondContact O-CB 3.48Å; N683-L686 PolarHBondContact O-N 3.45Å
684	P	87.8	Confident	93.2	Very high	43 Å²	43	24.5 Å²	24.5	28%	0.279	14%	0.143	S	C	.	.	H	α-helix	trans	-73	-17.7	-176.6	33.6	-38.8	0	0	0	113.2	N682 L686 S687 A688 L736	N682-P684 VanDerWaalsContact O-CD 3.28Å; N682-P684 WeakPolarHBondContact O-CD 3.43Å; P684-L686 VanDerWaalsContact C-N 3.29Å; P684-S687 WeakPolarHBondContact O-CB 3.41Å; P684-S687 PolarHBondContact O-N 2.67Å; P684-A688 PolarHBondContact O-N 3.39Å; P684-L736 HydrophobicContact CB-CD2 3.27Å; P684-L736 HydrophobicContact CG-CD2 3.46Å; P684-L736 VanDerWaalsContact CG-CD2 3.46Å
685	Y	89.5	Confident	93.2	Very high	81 Å²	81	25.3 Å²	25.3	32%	0.318	15%	0.147	S	C	.	.	H	α-helix	trans	-67.9	-31.4	172.5	-69.9	-78.8	0	0	0	112	N683 A688 K689 S738 S740 D744	N683-Y685 PolarHBondContact O-N 3.06Å; N683-Y685 WeakPolarHBondContact OD1-CB 3.23Å; N683-Y685 PolarHBondContact OD1-N 2.84Å; Y685-A688 WeakPolarHBondContact O-CB 3.39Å; Y685-A688 PolarHBondContact O-N 2.91Å; Y685-K689 WeakPolarHBondContact O-CB 3.46Å; Y685-K689 PolarHBondContact O-N 2.98Å; Y685-S738 WeakPolarHBondContact OH-CB 3.33Å; Y685-S738 PolarHBondContact OH-OG 3.07Å; Y685-S740 PolarHBondContact OH-OG 3.28Å; Y685-D744 HydrophobicContact CE1-CB 4.28Å; Y685-D744 WeakPolarHBondContact CE1-OD2 3.4Å; Y685-D744 PolarHBondContact OH-OD2 3.02Å
686	L	93.5	Very high	93.1	Very high	4 Å²	4	26.7 Å²	26.7	2%	0.021	15%	0.152	C	C	.	.	H	α-helix	trans	-63.9	-44.5	172	-176.9	57.7	0	0	0	110.4	M488 E638 I641 E642 L645 F681 N683 P684 A688 K689 V690	M488-L686 HydrophobicContact SD-CD2 3.81Å; E638-L686 HydrophobicContact CB-CD2 4.17Å; E638-L686 HydrophobicContact CG-CD2 4.31Å; I641-L686 HydrophobicContact CG2-CD1 4.28Å; E642-L686 HydrophobicContact CB-CD1 4.06Å; E642-L686 HydrophobicContact CG-CD1 4.24Å; L645-L686 HydrophobicContact CD1-CD1 4.11Å; F681-L686 HydrophobicContact CD1-CD2 3.57Å; F681-L686 HydrophobicContact CD1-CG 4.26Å; F681-L686 HydrophobicContact CD2-CG 4.42Å; F681-L686 HydrophobicContact CE1-CD2 3.74Å; F681-L686 HydrophobicContact CE1-CG 4.33Å; F681-L686 HydrophobicContact CE2-CG 4.47Å; F681-L686 HydrophobicContact CG-CD2 4.01Å; F681-L686 HydrophobicContact CG-CG 4.29Å; F681-L686 HydrophobicContact CZ-CD2 4.28Å; F681-L686 HydrophobicContact CZ-CG 4.4Å; N683-L686 HydrophobicContact CB-CB 4.45Å; N683-L686 WeakPolarHBondContact O-CB 3.48Å; N683-L686 PolarHBondContact O-N 3.45Å; P684-L686 VanDerWaalsContact C-N 3.29Å; L686-A688 VanDerWaalsContact C-N 3.3Å; L686-A688 PolarHBondContact O-N 3.49Å; L686-K689 WeakPolarHBondContact O-CB 3.41Å; L686-K689 PolarHBondContact O-N 3.34Å; L686-K689 VanDerWaalsContact O-N 3.13Å; L686-V690 WeakPolarHBondContact O-CG2 3.29Å; L686-V690 PolarHBondContact O-N 3.09Å
687	S	93.6	Very high	93.1	Very high	4 Å²	4	26.1 Å²	26.1	3%	0.028	15%	0.148	C	C	.	.	H	α-helix	trans	-56.6	-44.3	172.3	-53.7	0	0	0	0	112	T678 F681 P684 K689 V690 V691	T678-S687 PolarHBondContact O-OG 3.02Å; F681-S687 WeakPolarHBondContact CD2-OG 3.49Å; P684-S687 WeakPolarHBondContact O-CB 3.41Å; P684-S687 PolarHBondContact O-N 2.67Å; S687-K689 VanDerWaalsContact C-N 3.3Å; S687-K689 PolarHBondContact O-N 3.38Å; S687-V690 PolarHBondContact O-N 2.94Å; S687-V691 PolarHBondContact O-N 3.44Å
688	A	93.9	Very high	93.1	Very high	10 Å²	10	25.1 Å²	25.1	8%	0.083	14%	0.143	C	C	.	.	H	α-helix	trans	-61.6	-38.6	177.1	0	0	0	0	0	112.3	P684 Y685 L686 V691 E692 F729 I748	P684-A688 PolarHBondContact O-N 3.39Å; Y685-A688 WeakPolarHBondContact O-CB 3.39Å; Y685-A688 PolarHBondContact O-N 2.91Å; L686-A688 VanDerWaalsContact C-N 3.3Å; L686-A688 PolarHBondContact O-N 3.49Å; A688-V691 CarbonylContact O-C 2.81Å; A688-V691 WeakPolarHBondContact O-CB 3.42Å; A688-V691 PolarHBondContact O-N 3.46Å; A688-E692 PolarHBondContact O-N 3.27Å; A688-F729 HydrophobicContact CB-CZ 4.29Å; A688-I748 HydrophobicContact CB-CD1 3.54Å; A688-I748 HydrophobicContact CB-CG1 3.87Å
689	K	95.5	Very high	93.1	Very high	33 Å²	33	24.7 Å²	24.7	14%	0.143	14%	0.141	C	C	.	.	H	α-helix	trans	-70.6	-33.3	178.8	-159.2	158.4	-178.4	180	0	113.1	E642 L645 D646 I649 Y685 L686 S687 V691 E692 L693	E642-K689 HydrophobicContact CG-CD 3.9Å; E642-K689 IonicContact OE1-NZ 2.76Å; E642-K689 PolarHBondContact OE1-NZ 3.4Å; L645-K689 HydrophobicContact CB-CG 4.49Å; L645-K689 HydrophobicContact CD1-CB 4.23Å; L645-K689 HydrophobicContact CD1-CG 4.22Å; D646-K689 VanDerWaalsContact CG-CE 3.42Å; D646-K689 WeakPolarHBondContact OD1-CE 3.49Å; D646-K689 IonicContact OD1-NZ 3.84Å; D646-K689 PolarHBondContact OD1-NZ 3.33Å; D646-K689 IonicContact OD2-NZ 3.41Å; D646-K689 PolarHBondContact OD2-NZ 3.2Å; I649-K689 HydrophobicContact CD1-CG 4.28Å; Y685-K689 WeakPolarHBondContact O-CB 3.46Å; Y685-K689 PolarHBondContact O-N 2.98Å; L686-K689 WeakPolarHBondContact O-CB 3.41Å; L686-K689 PolarHBondContact O-N 3.34Å; L686-K689 VanDerWaalsContact O-N 3.13Å; S687-K689 VanDerWaalsContact C-N 3.3Å; S687-K689 PolarHBondContact O-N 3.38Å; K689-V691 VanDerWaalsContact C-N 3.31Å; K689-V691 PolarHBondContact O-N 3.49Å; K689-E692 WeakPolarHBondContact O-CB 3.46Å; K689-E692 PolarHBondContact O-N 3.36Å; K689-L693 PolarHBondContact O-N 3.17Å
690	V	97.2	Very high	93.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61	-43.3	169.7	-179.7	0	0	0	0	110.1	L645 L671 L674 I675 F681 L686 S687 L693 L694	L645-V690 HydrophobicContact CD1-CB 4.4Å; L645-V690 HydrophobicContact CD1-CG2 3.66Å; L671-V690 HydrophobicContact CD1-CG1 3.56Å; L674-V690 HydrophobicContact CB-CG1 3.75Å; L674-V690 HydrophobicContact CB-CG2 4.41Å; L674-V690 HydrophobicContact CD1-CG1 4.49Å; L674-V690 HydrophobicContact CD1-CG2 4.27Å; I675-V690 HydrophobicContact CD1-CG1 4.27Å; I675-V690 HydrophobicContact CG1-CG1 3.42Å; I675-V690 VanDerWaalsContact CG1-CG1 3.42Å; F681-V690 HydrophobicContact CE2-CG2 4.06Å; F681-V690 HydrophobicContact CZ-CG2 4.43Å; L686-V690 WeakPolarHBondContact O-CG2 3.29Å; L686-V690 PolarHBondContact O-N 3.09Å; S687-V690 PolarHBondContact O-N 2.94Å; V690-L693 PolarHBondContact O-N 3.42Å; V690-L694 PolarHBondContact O-N 2.95Å
691	V	96.6	Very high	93.1	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-67.4	-36.1	175.4	176.4	0	0	0	0	111.8	S687 A688 K689 L694 F695 L726 F729 H751 I752 I755	S687-V691 PolarHBondContact O-N 3.44Å; A688-V691 CarbonylContact O-C 2.81Å; A688-V691 WeakPolarHBondContact O-CB 3.42Å; A688-V691 PolarHBondContact O-N 3.46Å; K689-V691 VanDerWaalsContact C-N 3.31Å; K689-V691 PolarHBondContact O-N 3.49Å; V691-L694 WeakPolarHBondContact O-CB 3.46Å; V691-L694 PolarHBondContact O-N 2.82Å; V691-F695 PolarHBondContact O-N 2.79Å; V691-L726 HydrophobicContact CG1-CD2 4.13Å; V691-L726 HydrophobicContact CG2-CD2 3.99Å; V691-F729 HydrophobicContact CB-CE1 4.36Å; V691-F729 HydrophobicContact CG2-CD1 3.87Å; V691-F729 HydrophobicContact CG2-CE1 3.74Å; V691-H751 HydrophobicContact CG1-CB 4.48Å; V691-I752 HydrophobicContact CG1-CG1 3.96Å; V691-I755 HydrophobicContact CG1-CD1 3.79Å
692	E	96.3	Very high	93	Very high	53 Å²	53	30 Å²	30	25%	0.248	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-43.9	174.3	-179.2	178.9	-160.2	0	0	112	I649 A688 K689 L694 F695 Y696	I649-E692 HydrophobicContact CD1-CG 4.13Å; A688-E692 PolarHBondContact O-N 3.27Å; K689-E692 WeakPolarHBondContact O-CB 3.46Å; K689-E692 PolarHBondContact O-N 3.36Å; E692-L694 VanDerWaalsContact C-N 3.31Å; E692-L694 PolarHBondContact O-N 2.81Å; E692-F695 VanDerWaalsContact O-CB 3.31Å; E692-F695 WeakPolarHBondContact O-CB 3.41Å; E692-F695 PolarHBondContact O-N 3.07Å; E692-F695 VanDerWaalsContact O-N 3.14Å; E692-Y696 HydrophobicContact CG-CD2 4Å; E692-Y696 HydrophobicContact CG-CE2 3.68Å; E692-Y696 VanDerWaalsContact O-CD2 3.29Å; E692-Y696 WeakPolarHBondContact O-CD2 3.42Å; E692-Y696 PolarHBondContact O-N 3.06Å; E692-Y696 VanDerWaalsContact O-N 3.09Å
693	L	96.4	Very high	93	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.3	-44.5	174.8	175.8	59.5	0	0	0	111.1	L645 F648 I649 L652 F667 L671 K689 V690 F695 Y696 T697	L645-L693 HydrophobicContact CD2-CB 4.23Å; L645-L693 HydrophobicContact CD2-CD2 3.51Å; F648-L693 HydrophobicContact CB-CD1 3.74Å; F648-L693 HydrophobicContact CB-CD2 4.26Å; I649-L693 HydrophobicContact CD1-CB 4.46Å; I649-L693 HydrophobicContact CG1-CB 4.22Å; I649-L693 HydrophobicContact CG1-CD1 4.04Å; L652-L693 HydrophobicContact CD1-CD1 3.89Å; F667-L693 HydrophobicContact CE1-CD2 4.05Å; F667-L693 HydrophobicContact CZ-CD2 3.74Å; L671-L693 HydrophobicContact CD1-CD2 4.18Å; L671-L693 HydrophobicContact CD2-CD2 4.25Å; L671-L693 HydrophobicContact CD2-CG 4.24Å; K689-L693 PolarHBondContact O-N 3.17Å; V690-L693 PolarHBondContact O-N 3.42Å; L693-F695 VanDerWaalsContact C-N 3.29Å; L693-F695 PolarHBondContact O-N 3.23Å; L693-Y696 PolarHBondContact O-N 3.16Å; L693-Y696 VanDerWaalsContact O-N 3.08Å; L693-T697 WeakPolarHBondContact O-CG2 3.34Å; L693-T697 PolarHBondContact O-N 3.39Å; L693-T697 VanDerWaalsContact O-N 3.16Å
694	L	96.1	Very high	92.8	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-57.2	-43.1	175.5	174.8	61.2	0	0	0	111.6	L671 I675 V690 V691 E692 Y696 T697 C698 L712 L722 L726 I755	L671-L694 HydrophobicContact CD2-CB 4.49Å; I675-L694 HydrophobicContact CD1-CB 3.78Å; I675-L694 HydrophobicContact CD1-CD2 3.53Å; I675-L694 HydrophobicContact CD1-CG 4.17Å; V690-L694 PolarHBondContact O-N 2.95Å; V691-L694 WeakPolarHBondContact O-CB 3.46Å; V691-L694 PolarHBondContact O-N 2.82Å; E692-L694 VanDerWaalsContact C-N 3.31Å; E692-L694 PolarHBondContact O-N 2.81Å; L694-Y696 VanDerWaalsContact C-N 3.3Å; L694-Y696 PolarHBondContact O-N 3.35Å; L694-T697 WeakPolarHBondContact O-CB 3.49Å; L694-T697 PolarHBondContact O-N 3.29Å; L694-T697 PolarHBondContact O-OG1 2.85Å; L694-C698 PolarHBondContact O-N 3.06Å; L694-L712 HydrophobicContact CD1-CD1 3.29Å; L694-L722 HydrophobicContact CD2-CD1 3.66Å; L694-L722 HydrophobicContact CD2-CD2 3.94Å; L694-L722 HydrophobicContact CD2-CG 4.31Å; L694-L726 HydrophobicContact CD2-CD1 4.46Å; L694-I755 HydrophobicContact CB-CD1 4.15Å; L694-I755 HydrophobicContact CD2-CD1 3.86Å; L694-I755 HydrophobicContact CD2-CG1 4.34Å; L694-I755 HydrophobicContact CD2-CG2 3.82Å; L694-I755 HydrophobicContact CG-CD1 3.8Å; L694-I755 HydrophobicContact CG-CG1 4.07Å; L694-I755 HydrophobicContact CG-CG2 4.22Å
695	F	95.8	Very high	92.8	Very high	18 Å²	18	27.6 Å²	27.6	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-56.3	-42.2	174.6	161.6	-94.8	0	0	0	112.5	V691 E692 L693 T697 C698 V701 F750 H751 T754 I755	V691-F695 PolarHBondContact O-N 2.79Å; E692-F695 VanDerWaalsContact O-CB 3.31Å; E692-F695 WeakPolarHBondContact O-CB 3.41Å; E692-F695 PolarHBondContact O-N 3.07Å; E692-F695 VanDerWaalsContact O-N 3.14Å; L693-F695 VanDerWaalsContact C-N 3.29Å; L693-F695 PolarHBondContact O-N 3.23Å; F695-T697 VanDerWaalsContact C-N 3.27Å; F695-T697 PolarHBondContact O-N 2.68Å; F695-C698 WeakPolarHBondContact O-CB 3.24Å; F695-C698 PolarHBondContact O-N 3.15Å; F695-V701 HydrophobicContact CD1-CG1 4.25Å; F695-V701 HydrophobicContact CD2-CG2 3.94Å; F695-V701 HydrophobicContact CE1-CG1 3.6Å; F695-V701 HydrophobicContact CE2-CB 4.49Å; F695-V701 HydrophobicContact CE2-CG1 4.08Å; F695-V701 HydrophobicContact CE2-CG2 3.57Å; F695-V701 HydrophobicContact CZ-CB 4.38Å; F695-V701 HydrophobicContact CZ-CG1 3.5Å; F695-V701 HydrophobicContact CZ-CG2 3.9Å; F695-F750 HydrophobicContact CE2-CD1 4.47Å; F695-F750 HydrophobicContact CE2-CE1 4.08Å; F695-F750 HydrophobicContact CZ-CE1 4.21Å; F695-H751 HydrophobicContact CB-CB 3.94Å; F695-H751 AromaticContact CD1-CD2 3.63Å; F695-H751 HydrophobicContact CD2-CB 4.17Å; F695-H751 AromaticContact CD2-CD2 3.72Å; F695-H751 AromaticContact CE1-CD2 3.82Å; F695-H751 AromaticContact CE2-CD2 3.88Å; F695-H751 HydrophobicContact CG-CB 4.13Å; F695-H751 AromaticContact CG-CD2 3.57Å; F695-H751 AromaticContact CZ-CD2 3.94Å; F695-T754 HydrophobicContact CD2-CG2 3.9Å; F695-T754 HydrophobicContact CE2-CG2 3.68Å; F695-I755 HydrophobicContact CB-CD1 4.1Å; F695-I755 HydrophobicContact CB-CG1 4.2Å
696	Y	94.1	Very high	92.8	Very high	30 Å²	30	30.2 Å²	30.2	12%	0.118	15%	0.15	C	C	.	.	H	α-helix	trans	-71	-17.7	176.1	-76.4	-69	0	0	0	114.3	I649 E653 E692 L693 L694 C698 V701 R702	I649-Y696 HydrophobicContact CG1-CD2 4.06Å; I649-Y696 HydrophobicContact CG1-CE2 4.47Å; I649-Y696 HydrophobicContact CG2-CD2 3.99Å; I649-Y696 HydrophobicContact CG2-CE2 3.75Å; E653-Y696 HydrophobicContact CG-CE1 4.24Å; E692-Y696 HydrophobicContact CG-CD2 4Å; E692-Y696 HydrophobicContact CG-CE2 3.68Å; E692-Y696 VanDerWaalsContact O-CD2 3.29Å; E692-Y696 WeakPolarHBondContact O-CD2 3.42Å; E692-Y696 PolarHBondContact O-N 3.06Å; E692-Y696 VanDerWaalsContact O-N 3.09Å; L693-Y696 PolarHBondContact O-N 3.16Å; L693-Y696 VanDerWaalsContact O-N 3.08Å; L694-Y696 VanDerWaalsContact C-N 3.3Å; L694-Y696 PolarHBondContact O-N 3.35Å; Y696-C698 VanDerWaalsContact C-N 3.32Å; Y696-V701 HydrophobicContact CD1-CG1 4.38Å; Y696-R702 HydrophobicContact CD1-CG 4.01Å; Y696-R702 WeakPolarHBondContact O-CB 3.47Å
697	T	93.2	Very high	92.6	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-74	-25.4	171.9	73.9	0	0	0	0	112.5	L652 L693 L694 F695 G705 F708 H709	L652-T697 HydrophobicContact CD1-CG2 4.4Å; L693-T697 WeakPolarHBondContact O-CG2 3.34Å; L693-T697 PolarHBondContact O-N 3.39Å; L693-T697 VanDerWaalsContact O-N 3.16Å; L694-T697 WeakPolarHBondContact O-CB 3.49Å; L694-T697 PolarHBondContact O-N 3.29Å; L694-T697 PolarHBondContact O-OG1 2.85Å; F695-T697 VanDerWaalsContact C-N 3.27Å; F695-T697 PolarHBondContact O-N 2.68Å; T697-G705 CarbonylContact O-C 3.28Å; T697-G705 WeakPolarHBondContact O-CA 3.19Å; T697-F708 HydrophobicContact CG2-CB 4.19Å; T697-F708 HydrophobicContact CG2-CD1 3.86Å; T697-F708 HydrophobicContact CG2-CD2 4Å; T697-F708 HydrophobicContact CG2-CE1 4.19Å; T697-F708 HydrophobicContact CG2-CE2 4.29Å; T697-F708 HydrophobicContact CG2-CG 3.77Å; T697-F708 HydrophobicContact CG2-CZ 4.4Å; T697-H709 WeakPolarHBondContact O-CB 3.48Å
698	C	93.6	Very high	92.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-60.8	124.3	-175	-67.7	0	0	0	0	112.3	L694 F695 Y696 Q700 V701 R702	L694-C698 PolarHBondContact O-N 3.06Å; F695-C698 WeakPolarHBondContact O-CB 3.24Å; F695-C698 PolarHBondContact O-N 3.15Å; Y696-C698 VanDerWaalsContact C-N 3.32Å; C698-Q700 VanDerWaalsContact C-N 3.27Å; C698-Q700 PolarHBondContact O-N 3.48Å; C698-Q700 VanDerWaalsContact O-N 3.13Å; C698-V701 HydrophobicContact CB-CB 4.43Å; C698-V701 HydrophobicContact CB-CG2 3.97Å; C698-V701 WeakPolarHBondContact O-CB 3.31Å; C698-V701 PolarHBondContact O-N 3.24Å; C698-R702 PolarHBondContact O-N 3.18Å
699	P	90.5	Very high	92.3	Very high	18 Å²	18	33 Å²	33	12%	0.117	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-30.6	-172.8	-26.2	33.3	0	0	0	115.6	V701 R702 P703 R706 H709	P699-V701 VanDerWaalsContact C-N 3.31Å; P699-R702 CarbonylContact O-C 3.15Å; P699-P703 WeakPolarHBondContact O-CA 3.33Å; P699-R706 HydrophobicContact CB-CB 4.43Å; P699-R706 HydrophobicContact CG-CB 4.13Å; P699-R706 HydrophobicContact CG-CG 4.29Å; P699-H709 HydrophobicContact CG-CB 4.47Å
700	Q	90.1	Very high	92.1	Very high	86 Å²	86	35 Å²	35	40%	0.402	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-23.9	176.6	71.5	-77.5	8.7	0	0	113.2	C698 T754 S758	C698-Q700 VanDerWaalsContact C-N 3.27Å; C698-Q700 PolarHBondContact O-N 3.48Å; C698-Q700 VanDerWaalsContact O-N 3.13Å; Q700-T754 HydrophobicContact CG-CG2 4.4Å; Q700-T754 PolarHBondContact NE2-O 2.99Å; Q700-S758 PolarHBondContact NE2-OG 3.44Å; Q700-S758 PolarHBondContact OE1-OG 3.08Å; Q700-S758 VanDerWaalsContact OE1-OG 3.13Å
701	V	91.3	Very high	91.8	Very high	39 Å²	39	35.8 Å²	35.8	24%	0.236	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-53.2	173.7	-174.7	0	0	0	0	108.5	F695 Y696 C698 P699 T754	F695-V701 HydrophobicContact CD1-CG1 4.25Å; F695-V701 HydrophobicContact CD2-CG2 3.94Å; F695-V701 HydrophobicContact CE1-CG1 3.6Å; F695-V701 HydrophobicContact CE2-CB 4.49Å; F695-V701 HydrophobicContact CE2-CG1 4.08Å; F695-V701 HydrophobicContact CE2-CG2 3.57Å; F695-V701 HydrophobicContact CZ-CB 4.38Å; F695-V701 HydrophobicContact CZ-CG1 3.5Å; F695-V701 HydrophobicContact CZ-CG2 3.9Å; Y696-V701 HydrophobicContact CD1-CG1 4.38Å; C698-V701 HydrophobicContact CB-CB 4.43Å; C698-V701 HydrophobicContact CB-CG2 3.97Å; C698-V701 WeakPolarHBondContact O-CB 3.31Å; C698-V701 PolarHBondContact O-N 3.24Å; P699-V701 VanDerWaalsContact C-N 3.31Å; V701-T754 HydrophobicContact CG2-CG2 3.51Å
702	R	90.4	Very high	91.6	Very high	72 Å²	72	36 Å²	36	27%	0.272	19%	0.186	S	C	.	.			trans	-136.4	109.6	179.6	-62.9	-59	-178.8	131.7	-7.3	110.6	L652 E653 Y696 C698 P699 A704 G705	L652-R702 PolarHBondContact O-NH1 3.26Å; E653-R702 VanDerWaalsContact CA-NH1 3.32Å; E653-R702 PolarHBondContact O-NH1 2.85Å; E653-R702 PolarHBondContact O-NH2 3.13Å; Y696-R702 HydrophobicContact CD1-CG 4.01Å; Y696-R702 WeakPolarHBondContact O-CB 3.47Å; C698-R702 PolarHBondContact O-N 3.18Å; P699-R702 CarbonylContact O-C 3.15Å; R702-A704 PolarHBondContact O-N 3.14Å; R702-A704 VanDerWaalsContact O-N 3.1Å; R702-G705 PolarHBondContact O-N 2.89Å
703	P	88.5	Confident	91.2	Very high	106 Å²	106	35.6 Å²	35.6	69%	0.688	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-56.1	-31.7	177.2	-28.4	35.7	0	0	0	113.8	P699 G705 R706	P699-P703 WeakPolarHBondContact O-CA 3.33Å; P703-G705 PolarHBondContact O-N 2.96Å; P703-R706 WeakPolarHBondContact O-CB 3.31Å; P703-R706 PolarHBondContact O-N 2.96Å
704	A	84.7	Confident	90.8	Very high	22 Å²	22	41.2 Å²	41.2	18%	0.182	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-61.3	-26.6	175.4	0	0	0	0	0	114.6	G656 R702 R706	G656-A704 WeakPolarHBondContact O-CB 3.1Å; R702-A704 PolarHBondContact O-N 3.14Å; R702-A704 VanDerWaalsContact O-N 3.1Å; A704-R706 VanDerWaalsContact C-N 3.26Å; A704-R706 PolarHBondContact O-N 2.82Å
705	G	89	Confident	90.2	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-76.9	-7.9	-179.1	0	0	0	0	0	114.3	T697 R702 P703 S707 F708 H709	T697-G705 CarbonylContact O-C 3.28Å; T697-G705 WeakPolarHBondContact O-CA 3.19Å; R702-G705 PolarHBondContact O-N 2.89Å; P703-G705 PolarHBondContact O-N 2.96Å; G705-S707 PolarHBondContact O-N 3.29Å; G705-F708 WeakPolarHBondContact O-CB 3.29Å; G705-F708 PolarHBondContact O-N 3.01Å; G705-H709 PolarHBondContact O-N 3.11Å
706	R	89.1	Confident	89.7	Confident	136 Å²	136	48.3 Å²	48.3	51%	0.513	26%	0.256	S	S	.	.	H	α-helix	trans	-53.6	-46.7	-172.4	178.6	177.3	-72	-87.5	0.8	113.7	P699 P703 A704 F708 H709 D710	P699-R706 HydrophobicContact CB-CB 4.43Å; P699-R706 HydrophobicContact CG-CB 4.13Å; P699-R706 HydrophobicContact CG-CG 4.29Å; P703-R706 WeakPolarHBondContact O-CB 3.31Å; P703-R706 PolarHBondContact O-N 2.96Å; A704-R706 VanDerWaalsContact C-N 3.26Å; A704-R706 PolarHBondContact O-N 2.82Å; R706-F708 VanDerWaalsContact C-N 3.27Å; R706-F708 PolarHBondContact O-N 3.36Å; R706-H709 PolarHBondContact O-N 3.09Å; R706-D710 WeakPolarHBondContact CG-OD2 3.43Å; R706-D710 WeakPolarHBondContact O-CB 3.3Å; R706-D710 PolarHBondContact O-N 3.06Å
707	S	88	Confident	89.3	Confident	63 Å²	63	50 Å²	50	44%	0.441	27%	0.272	S	S	.	.	H	α-helix	trans	-63.2	-35	-179.4	57.6	0	0	0	0	112.8	G705 S711	G705-S707 PolarHBondContact O-N 3.29Å; S707-S711 WeakPolarHBondContact O-CB 3.47Å; S707-S711 PolarHBondContact O-N 3.36Å; S707-S711 PolarHBondContact O-OG 3.29Å
708	F	91.1	Very high	89.2	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-69.7	-50.3	174.1	-162.8	158.2	0	0	0	109.7	F648 L658 V664 F667 A668 L671 T697 G705 R706 D710 S711 L712	F648-F708 HydrophobicContact CD1-CE1 4.12Å; L658-F708 HydrophobicContact CD1-CB 4.37Å; L658-F708 HydrophobicContact CD1-CD1 4.12Å; V664-F708 HydrophobicContact CB-CD1 4.49Å; V664-F708 HydrophobicContact CB-CG 4.32Å; V664-F708 HydrophobicContact CG1-CD1 4.49Å; V664-F708 HydrophobicContact CG2-CB 4.04Å; V664-F708 HydrophobicContact CG2-CG 4.16Å; F667-F708 AromaticContact CD1-CE1 3.58Å; F667-F708 HydrophobicContact CD1-CE1 3.58Å; F667-F708 HydrophobicContact CD1-CE2 4.32Å; F667-F708 AromaticContact CD1-CZ 3.33Å; F667-F708 HydrophobicContact CD1-CZ 3.33Å; F667-F708 AromaticContact CE1-CE1 3.57Å; F667-F708 HydrophobicContact CE1-CE1 3.57Å; F667-F708 AromaticContact CE1-CZ 3.47Å; F667-F708 HydrophobicContact CE1-CZ 3.47Å; F667-F708 VanDerWaalsContact CE1-CZ 3.47Å; F667-F708 HydrophobicContact CG-CZ 4.09Å; F667-F708 HydrophobicContact CZ-CZ 4.32Å; A668-F708 HydrophobicContact CB-CD2 3.98Å; A668-F708 HydrophobicContact CB-CE2 3.85Å; L671-F708 HydrophobicContact CD2-CE2 3.77Å; L671-F708 HydrophobicContact CD2-CZ 3.78Å; T697-F708 HydrophobicContact CG2-CB 4.19Å; T697-F708 HydrophobicContact CG2-CD1 3.86Å; T697-F708 HydrophobicContact CG2-CD2 4Å; T697-F708 HydrophobicContact CG2-CE1 4.19Å; T697-F708 HydrophobicContact CG2-CE2 4.29Å; T697-F708 HydrophobicContact CG2-CG 3.77Å; T697-F708 HydrophobicContact CG2-CZ 4.4Å; G705-F708 WeakPolarHBondContact O-CB 3.29Å; G705-F708 PolarHBondContact O-N 3.01Å; R706-F708 VanDerWaalsContact C-N 3.27Å; R706-F708 PolarHBondContact O-N 3.36Å; F708-D710 VanDerWaalsContact C-N 3.34Å; F708-D710 PolarHBondContact O-N 3.49Å; F708-S711 WeakPolarHBondContact O-CA 3.42Å; F708-S711 VanDerWaalsContact O-CB 3.32Å; F708-S711 WeakPolarHBondContact O-CB 3.45Å; F708-S711 PolarHBondContact O-N 3.19Å; F708-L712 PolarHBondContact O-N 2.64Å
709	H	91.9	Very high	89.1	Confident	13 Å²	13	50.4 Å²	50.4	6%	0.06	28%	0.276	C	S	.	.	H	α-helix	trans	-54.1	-49.2	177.1	-178.5	-87	0	0	0	112.2	T697 P699 G705 R706 S711 L712 F713 S758	T697-H709 WeakPolarHBondContact O-CB 3.48Å; P699-H709 HydrophobicContact CG-CB 4.47Å; G705-H709 PolarHBondContact O-N 3.11Å; R706-H709 PolarHBondContact O-N 3.09Å; H709-S711 PolarHBondContact O-N 2.85Å; H709-L712 WeakPolarHBondContact O-CB 3.23Å; H709-L712 PolarHBondContact O-N 3.46Å; H709-L712 VanDerWaalsContact O-N 3.11Å; H709-F713 AromaticContact CD2-CE2 3.99Å; H709-F713 AromaticContact CE1-CD2 3.88Å; H709-F713 AromaticContact CE1-CE2 3.43Å; H709-F713 VanDerWaalsContact CE1-CE2 3.43Å; H709-F713 WeakPolarHBondContact CE1-CE2 3.37Å; H709-F713 AromaticContact ND1-CE2 3.9Å; H709-F713 AromaticContact NE2-CE2 3.51Å; H709-F713 VanDerWaalsContact O-CD2 3.26Å; H709-F713 WeakPolarHBondContact O-CD2 3.46Å; H709-S758 PolarHBondContact NE2-OG 2.97Å
710	D	90.5	Very high	89.1	Confident	77 Å²	77	53.8 Å²	53.8	41%	0.412	29%	0.29	S	S	.	.	H	α-helix	trans	-63	-32.1	179.3	-62.8	-13.2	0	0	0	111.6	R706 F708 L712 F713	R706-D710 WeakPolarHBondContact CG-OD2 3.43Å; R706-D710 WeakPolarHBondContact O-CB 3.3Å; R706-D710 PolarHBondContact O-N 3.06Å; F708-D710 VanDerWaalsContact C-N 3.34Å; F708-D710 PolarHBondContact O-N 3.49Å; D710-L712 VanDerWaalsContact C-N 3.33Å; D710-L712 PolarHBondContact O-N 3.06Å; D710-F713 PolarHBondContact O-N 3.09Å
711	S	91.8	Very high	89.2	Confident	15 Å²	15	50 Å²	50	11%	0.105	27%	0.274	C	S	.	.	H	α-helix	trans	-67.2	-29.6	176.3	-62.1	0	0	0	0	113.4	S707 F708 H709 Q714	S707-S711 WeakPolarHBondContact O-CB 3.47Å; S707-S711 PolarHBondContact O-N 3.36Å; S707-S711 PolarHBondContact O-OG 3.29Å; F708-S711 WeakPolarHBondContact O-CA 3.42Å; F708-S711 VanDerWaalsContact O-CB 3.32Å; F708-S711 WeakPolarHBondContact O-CB 3.45Å; F708-S711 PolarHBondContact O-N 3.19Å; H709-S711 PolarHBondContact O-N 2.85Å; S711-Q714 PolarHBondContact O-N 3.48Å
712	L	90.5	Very high	89.4	Confident	6 Å²	6	48.2 Å²	48.2	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-64.7	-41.6	177.1	-71.3	163	0	0	0	111.6	A668 L671 L672 L694 F708 H709 D710 Q714 A718	A668-L712 HydrophobicContact CB-CD2 3.78Å; A668-L712 HydrophobicContact CB-CG 3.92Å; A668-L712 WeakPolarHBondContact O-CD2 3.44Å; L671-L712 HydrophobicContact CB-CD2 4.32Å; L671-L712 HydrophobicContact CD2-CD2 4.34Å; L671-L712 HydrophobicContact CG-CD2 4.48Å; L672-L712 HydrophobicContact CB-CD2 4.29Å; L694-L712 HydrophobicContact CD1-CD1 3.29Å; F708-L712 PolarHBondContact O-N 2.64Å; H709-L712 WeakPolarHBondContact O-CB 3.23Å; H709-L712 PolarHBondContact O-N 3.46Å; H709-L712 VanDerWaalsContact O-N 3.11Å; D710-L712 VanDerWaalsContact C-N 3.33Å; D710-L712 PolarHBondContact O-N 3.06Å; L712-Q714 VanDerWaalsContact C-N 3.27Å; L712-Q714 PolarHBondContact O-N 3.01Å; L712-A718 VanDerWaalsContact O-CB 3.29Å; L712-A718 WeakPolarHBondContact O-CB 3.43Å
713	F	89.5	Confident	89.5	Confident	44 Å²	44	45 Å²	45	19%	0.193	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	5	-175.7	-62.1	-75.1	0	0	0	113.9	H709 D710 N715 A718 L722 M759 C765	H709-F713 AromaticContact CD2-CE2 3.99Å; H709-F713 AromaticContact CE1-CD2 3.88Å; H709-F713 AromaticContact CE1-CE2 3.43Å; H709-F713 VanDerWaalsContact CE1-CE2 3.43Å; H709-F713 WeakPolarHBondContact CE1-CE2 3.37Å; H709-F713 AromaticContact ND1-CE2 3.9Å; H709-F713 AromaticContact NE2-CE2 3.51Å; H709-F713 VanDerWaalsContact O-CD2 3.26Å; H709-F713 WeakPolarHBondContact O-CD2 3.46Å; D710-F713 PolarHBondContact O-N 3.09Å; F713-N715 PolarHBondContact O-N 2.86Å; F713-A718 HydrophobicContact CD1-CB 4.28Å; F713-L722 HydrophobicContact CE1-CD2 4.27Å; F713-L722 HydrophobicContact CZ-CD2 4.06Å; F713-M759 HydrophobicContact CE1-CE 4.44Å; F713-M759 HydrophobicContact CE1-CG 4.29Å; F713-M759 HydrophobicContact CZ-CG 3.85Å; F713-C765 WeakPolarHBondContact CD1-SG 3.34Å; F713-C765 WeakPolarHBondContact CE1-SG 3.33Å
714	Q	86.7	Confident	89.8	Confident	118 Å²	118	43.6 Å²	43.6	55%	0.551	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-24.5	167.4	-66.7	-176.5	18.2	0	0	112	H665 S711 L712 P716	H665-Q714 PolarHBondContact CD2-OE1 3.44Å; H665-Q714 PolarHBondContact NE2-OE1 3.02Å; S711-Q714 PolarHBondContact O-N 3.48Å; L712-Q714 VanDerWaalsContact C-N 3.27Å; L712-Q714 PolarHBondContact O-N 3.01Å; Q714-P716 WeakPolarHBondContact O-CD 3.46Å
715	N	84.7	Confident	90.3	Very high	39 Å²	39	43.4 Å²	43.4	21%	0.209	23%	0.232	C	C	.	.	S	Bend	trans	-77.5	120.3	171.7	-173.4	-45.3	0	0	0	109.5	L672 F713 S717 A718	L672-N715 HydrophobicContact CD2-CB 4.08Å; F713-N715 PolarHBondContact O-N 2.86Å; N715-S717 PolarHBondContact O-N 3.31Å; N715-S717 VanDerWaalsContact O-N 3.09Å; N715-S717 PolarHBondContact OD1-N 3.4Å; N715-A718 HydrophobicContact CB-CB 4.17Å; N715-A718 WeakPolarHBondContact O-CB 3.38Å; N715-A718 PolarHBondContact O-N 3.31Å
716	P	84.9	Confident	90.6	Very high	130 Å²	130	43.4 Å²	43.4	84%	0.844	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-30	-175.8	-26.5	34.8	0	0	0	114.5	Q714	Q714-P716 WeakPolarHBondContact O-CD 3.46Å
717	S	86.2	Confident	90.8	Very high	66 Å²	66	37 Å²	37	46%	0.462	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-1.9	-178.2	-56.4	0	0	0	0	113.3	N715 G719 E720 A721	N715-S717 PolarHBondContact O-N 3.31Å; N715-S717 VanDerWaalsContact O-N 3.09Å; N715-S717 PolarHBondContact OD1-N 3.4Å; S717-G719 PolarHBondContact O-N 3.27Å; S717-E720 PolarHBondContact O-N 3.45Å; S717-A721 WeakPolarHBondContact O-CB 3.34Å; S717-A721 PolarHBondContact O-N 3.47Å
718	A	89.9	Confident	91.1	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-59.6	-47.3	-175.9	0	0	0	0	0	112.2	L672 L712 F713 N715 E720 L722	L672-A718 HydrophobicContact CD1-CB 4.2Å; L672-A718 HydrophobicContact CD2-CB 3.73Å; L712-A718 VanDerWaalsContact O-CB 3.29Å; L712-A718 WeakPolarHBondContact O-CB 3.43Å; F713-A718 HydrophobicContact CD1-CB 4.28Å; N715-A718 HydrophobicContact CB-CB 4.17Å; N715-A718 WeakPolarHBondContact O-CB 3.38Å; N715-A718 PolarHBondContact O-N 3.31Å; A718-E720 VanDerWaalsContact C-N 3.32Å; A718-E720 PolarHBondContact O-N 3.44Å; A718-L722 WeakPolarHBondContact O-CB 3.5Å; A718-L722 PolarHBondContact O-N 2.87Å
719	G	91	Very high	91.2	Very high	7 Å²	7	39.5 Å²	39.5	7%	0.072	21%	0.21	C	C	.	.	H	α-helix	trans	-57.7	-44.5	-177.6	0	0	0	0	0	112.7	S717 F723 M759	S717-G719 PolarHBondContact O-N 3.27Å; G719-F723 WeakPolarHBondContact O-CB 3.41Å; G719-F723 PolarHBondContact O-N 2.94Å; G719-M759 WeakPolarHBondContact O-CE 3.18Å
720	E	91.6	Very high	91.2	Very high	89 Å²	89	39 Å²	39	42%	0.416	21%	0.208	S	C	.	.	H	α-helix	trans	-71.9	-52.1	-179.7	-167.3	-177.4	161	0	0	112.4	S717 A718 L722 F723 K724 V768	S717-E720 PolarHBondContact O-N 3.45Å; A718-E720 VanDerWaalsContact C-N 3.32Å; A718-E720 PolarHBondContact O-N 3.44Å; E720-L722 VanDerWaalsContact C-N 3.32Å; E720-L722 PolarHBondContact O-N 2.61Å; E720-F723 PolarHBondContact O-N 3.4Å; E720-K724 HydrophobicContact CG-CD 4.12Å; E720-K724 WeakPolarHBondContact O-CB 3.29Å; E720-K724 WeakPolarHBondContact O-CG 3.39Å; E720-K724 PolarHBondContact O-N 2.97Å; E720-K724 WeakPolarHBondContact OE1-CE 3.47Å; E720-K724 IonicContact OE1-NZ 2.7Å; E720-K724 PolarHBondContact OE1-NZ 2.9Å; E720-V768 HydrophobicContact CB-CG1 3.47Å; E720-V768 VanDerWaalsContact CB-CG1 3.47Å; E720-V768 HydrophobicContact CG-CG1 3.74Å
721	A	92.5	Very high	91.2	Very high	6 Å²	6	35.3 Å²	35.3	5%	0.05	19%	0.188	C	C	.	.	H	α-helix	trans	-62.2	-42.4	-177.5	0	0	0	0	0	111.1	I624 S717 S725	I624-A721 HydrophobicContact CD1-CB 4.08Å; I624-A721 HydrophobicContact CG2-CB 4Å; S717-A721 WeakPolarHBondContact O-CB 3.34Å; S717-A721 PolarHBondContact O-N 3.47Å; A721-S725 VanDerWaalsContact O-CB 3.29Å; A721-S725 WeakPolarHBondContact O-CB 3.41Å; A721-S725 PolarHBondContact O-N 3.17Å; A721-S725 PolarHBondContact O-OG 3.49Å
722	L	94.6	Very high	91	Very high	3 Å²	3	37 Å²	37	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-47	179.5	-174.9	62.5	0	0	0	111.4	L672 I675 L694 F713 A718 E720 S725 L726 M759	L672-L722 HydrophobicContact CD1-CB 4.33Å; I675-L722 HydrophobicContact CB-CD1 4.26Å; I675-L722 HydrophobicContact CD1-CD1 4.24Å; I675-L722 HydrophobicContact CG2-CD1 3.53Å; L694-L722 HydrophobicContact CD2-CD1 3.66Å; L694-L722 HydrophobicContact CD2-CD2 3.94Å; L694-L722 HydrophobicContact CD2-CG 4.31Å; F713-L722 HydrophobicContact CE1-CD2 4.27Å; F713-L722 HydrophobicContact CZ-CD2 4.06Å; A718-L722 WeakPolarHBondContact O-CB 3.5Å; A718-L722 PolarHBondContact O-N 2.87Å; E720-L722 VanDerWaalsContact C-N 3.32Å; E720-L722 PolarHBondContact O-N 2.61Å; L722-S725 PolarHBondContact O-N 2.83Å; L722-L726 HydrophobicContact CD1-CD1 3.83Å; L722-L726 HydrophobicContact CD1-CG 4.05Å; L722-L726 HydrophobicContact CG-CD1 3.81Å; L722-L726 HydrophobicContact CG-CG 4.37Å; L722-L726 WeakPolarHBondContact O-CB 3.47Å; L722-L726 VanDerWaalsContact O-CG 3.23Å; L722-L726 WeakPolarHBondContact O-CG 3.35Å; L722-L726 PolarHBondContact O-N 3.22Å; L722-M759 HydrophobicContact CB-CE 4.27Å; L722-M759 HydrophobicContact CD2-CE 4.12Å; L722-M759 HydrophobicContact CD2-SD 3.76Å; L722-M759 HydrophobicContact CG-CE 4.31Å; L722-M759 HydrophobicContact CG-SD 4.12Å
723	F	93.7	Very high	90.8	Very high	3 Å²	3	36.8 Å²	36.8	1%	0.013	20%	0.195	C	C	.	.	H	α-helix	trans	-61	-49.4	-180	-175.2	-127.6	0	0	0	111.6	G719 E720 S725 L726 V727 F756 M759 M769 Y772	G719-F723 WeakPolarHBondContact O-CB 3.41Å; G719-F723 PolarHBondContact O-N 2.94Å; E720-F723 PolarHBondContact O-N 3.4Å; F723-S725 PolarHBondContact O-N 3.24Å; F723-L726 PolarHBondContact O-N 3.26Å; F723-V727 HydrophobicContact CD2-CG2 4.14Å; F723-V727 HydrophobicContact CE1-CG2 4.38Å; F723-V727 HydrophobicContact CE2-CG2 3.81Å; F723-V727 HydrophobicContact CG-CG2 4.5Å; F723-V727 HydrophobicContact CZ-CG2 3.96Å; F723-V727 WeakPolarHBondContact O-CB 3.3Å; F723-V727 VanDerWaalsContact O-CG2 3.3Å; F723-V727 WeakPolarHBondContact O-CG2 3.48Å; F723-V727 PolarHBondContact O-N 3.38Å; F723-F756 AromaticContact CD2-CD1 3.82Å; F723-F756 HydrophobicContact CD2-CD1 3.82Å; F723-F756 AromaticContact CD2-CE1 3.41Å; F723-F756 HydrophobicContact CD2-CE1 3.41Å; F723-F756 VanDerWaalsContact CD2-CE1 3.41Å; F723-F756 HydrophobicContact CD2-CE2 4.44Å; F723-F756 HydrophobicContact CD2-CG 4.5Å; F723-F756 AromaticContact CD2-CZ 3.76Å; F723-F756 HydrophobicContact CD2-CZ 3.76Å; F723-F756 HydrophobicContact CE2-CD1 4.09Å; F723-F756 HydrophobicContact CE2-CD2 4.27Å; F723-F756 AromaticContact CE2-CE1 3.79Å; F723-F756 HydrophobicContact CE2-CE1 3.79Å; F723-F756 AromaticContact CE2-CE2 3.99Å; F723-F756 HydrophobicContact CE2-CE2 3.99Å; F723-F756 HydrophobicContact CE2-CG 4.32Å; F723-F756 AromaticContact CE2-CZ 3.74Å; F723-F756 HydrophobicContact CE2-CZ 3.74Å; F723-M759 HydrophobicContact CB-CE 4.01Å; F723-M769 HydrophobicContact CB-CG 4.17Å; F723-M769 HydrophobicContact CD1-CB 4.1Å; F723-M769 HydrophobicContact CD1-CG 3.72Å; F723-M769 HydrophobicContact CD2-CE 3.73Å; F723-M769 HydrophobicContact CD2-CG 3.79Å; F723-M769 HydrophobicContact CD2-SD 4.24Å; F723-M769 HydrophobicContact CE1-CB 3.89Å; F723-M769 HydrophobicContact CE1-CG 3.93Å; F723-M769 HydrophobicContact CE2-CE 3.45Å; F723-M769 VanDerWaalsContact CE2-CE 3.45Å; F723-M769 HydrophobicContact CE2-CG 4.08Å; F723-M769 HydrophobicContact CE2-SD 4.46Å; F723-M769 HydrophobicContact CG-CB 4.48Å; F723-M769 HydrophobicContact CG-CG 3.63Å; F723-M769 HydrophobicContact CZ-CB 4.18Å; F723-M769 HydrophobicContact CZ-CE 3.99Å; F723-M769 HydrophobicContact CZ-CG 4.14Å; F723-Y772 AromaticContact CD1-CD1 3.72Å; F723-Y772 HydrophobicContact CD1-CD1 3.72Å; F723-Y772 HydrophobicContact CD1-CE1 4.5Å; F723-Y772 HydrophobicContact CD1-CG 4.08Å; F723-Y772 AromaticContact CE1-CD1 3.42Å; F723-Y772 HydrophobicContact CE1-CD1 3.42Å; F723-Y772 VanDerWaalsContact CE1-CD1 3.42Å; F723-Y772 HydrophobicContact CE1-CE1 4.3Å; F723-Y772 HydrophobicContact CE1-CG 4.06Å; F723-Y772 HydrophobicContact CZ-CD1 4.39Å
724	K	93.9	Very high	90.4	Very high	77 Å²	77	37.6 Å²	37.6	34%	0.335	20%	0.2	S	C	.	.	H	α-helix	trans	-58.6	-47.1	178.5	-72.8	-179.5	173.1	176.9	0	112.2	E720 V727 K728 Y772	E720-K724 HydrophobicContact CG-CD 4.12Å; E720-K724 WeakPolarHBondContact O-CB 3.29Å; E720-K724 WeakPolarHBondContact O-CG 3.39Å; E720-K724 PolarHBondContact O-N 2.97Å; E720-K724 WeakPolarHBondContact OE1-CE 3.47Å; E720-K724 IonicContact OE1-NZ 2.7Å; E720-K724 PolarHBondContact OE1-NZ 2.9Å; K724-V727 PolarHBondContact O-N 3.23Å; K724-K728 PolarHBondContact O-N 3.36Å; K724-K728 VanDerWaalsContact O-N 3.14Å; K724-Y772 HydrophobicContact CD-CD2 4.2Å; K724-Y772 HydrophobicContact CD-CE2 4.05Å; K724-Y772 HydrophobicContact CG-CD2 3.82Å; K724-Y772 HydrophobicContact CG-CE2 3.62Å; K724-Y772 HydrophobicContact CG-CG 4.4Å
725	S	94.9	Very high	89.7	Confident	19 Å²	19	36.9 Å²	36.9	13%	0.133	20%	0.203	C	C	.	.	H	α-helix	trans	-65.7	-39.1	-179.6	-67.4	0	0	0	0	112.5	C676 A721 L722 F723 K728 F729	C676-S725 WeakPolarHBondContact CA-OG 3.21Å; A721-S725 VanDerWaalsContact O-CB 3.29Å; A721-S725 WeakPolarHBondContact O-CB 3.41Å; A721-S725 PolarHBondContact O-N 3.17Å; A721-S725 PolarHBondContact O-OG 3.49Å; L722-S725 PolarHBondContact O-N 2.83Å; F723-S725 PolarHBondContact O-N 3.24Å; S725-K728 PolarHBondContact O-N 3.48Å; S725-F729 VanDerWaalsContact O-CB 3.3Å; S725-F729 WeakPolarHBondContact O-CB 3.31Å; S725-F729 PolarHBondContact O-N 2.91Å
726	L	95.7	Very high	88.7	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-72.3	-36.7	178.1	-70.4	177.2	0	0	0	113	I675 V691 L694 L722 F723 K728 F729 Y730 I752 I755 F756	I675-L726 HydrophobicContact CG2-CD2 3.95Å; I675-L726 HydrophobicContact CG2-CG 4.39Å; V691-L726 HydrophobicContact CG1-CD2 4.13Å; V691-L726 HydrophobicContact CG2-CD2 3.99Å; L694-L726 HydrophobicContact CD2-CD1 4.46Å; L722-L726 HydrophobicContact CD1-CD1 3.83Å; L722-L726 HydrophobicContact CD1-CG 4.05Å; L722-L726 HydrophobicContact CG-CD1 3.81Å; L722-L726 HydrophobicContact CG-CG 4.37Å; L722-L726 WeakPolarHBondContact O-CB 3.47Å; L722-L726 VanDerWaalsContact O-CG 3.23Å; L722-L726 WeakPolarHBondContact O-CG 3.35Å; L722-L726 PolarHBondContact O-N 3.22Å; F723-L726 PolarHBondContact O-N 3.26Å; L726-K728 VanDerWaalsContact C-N 3.32Å; L726-K728 PolarHBondContact O-N 2.92Å; L726-F729 PolarHBondContact O-N 3.22Å; L726-Y730 WeakPolarHBondContact O-CB 3.37Å; L726-Y730 PolarHBondContact O-N 2.92Å; L726-I752 HydrophobicContact CB-CG2 4.12Å; L726-I752 HydrophobicContact CD2-CG1 4.31Å; L726-I755 HydrophobicContact CD1-CB 4.48Å; L726-I755 HydrophobicContact CD1-CG2 3.7Å; L726-F756 HydrophobicContact CB-CE1 3.54Å; L726-F756 HydrophobicContact CB-CZ 3.7Å; L726-F756 HydrophobicContact CD1-CD1 4.27Å; L726-F756 HydrophobicContact CD1-CE1 3.75Å; L726-F756 HydrophobicContact CG-CE1 4.31Å
727	V	94.3	Very high	87.4	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.4	-46.7	172.4	164.6	0	0	0	0	110.5	F723 K724 S731 F756 Y772 F780 F783	F723-V727 HydrophobicContact CD2-CG2 4.14Å; F723-V727 HydrophobicContact CE1-CG2 4.38Å; F723-V727 HydrophobicContact CE2-CG2 3.81Å; F723-V727 HydrophobicContact CG-CG2 4.5Å; F723-V727 HydrophobicContact CZ-CG2 3.96Å; F723-V727 WeakPolarHBondContact O-CB 3.3Å; F723-V727 VanDerWaalsContact O-CG2 3.3Å; F723-V727 WeakPolarHBondContact O-CG2 3.48Å; F723-V727 PolarHBondContact O-N 3.38Å; K724-V727 PolarHBondContact O-N 3.23Å; V727-S731 PolarHBondContact O-OG 3.36Å; V727-F756 HydrophobicContact CG2-CE2 4.44Å; V727-F756 HydrophobicContact CG2-CZ 3.96Å; V727-Y772 HydrophobicContact CB-CE1 4.45Å; V727-Y772 HydrophobicContact CG1-CE1 4.17Å; V727-Y772 HydrophobicContact CG2-CE1 4.27Å; V727-F780 HydrophobicContact CG1-CD2 4.47Å; V727-F783 HydrophobicContact CG1-CB 3.59Å; V727-F783 HydrophobicContact CG1-CD1 4.19Å; V727-F783 HydrophobicContact CG1-CG 3.9Å; V727-F783 HydrophobicContact CG2-CD1 4.36Å
728	K	92.8	Very high	86.1	Confident	104 Å²	104	31.7 Å²	31.7	45%	0.452	18%	0.183	S	C	.	.	H	α-helix	trans	-62.5	-50.5	175.2	-177.4	-176.4	174.1	-173.4	0	111.2	K724 S725 L726 Y730 S731 D732	K724-K728 PolarHBondContact O-N 3.36Å; K724-K728 VanDerWaalsContact O-N 3.14Å; S725-K728 PolarHBondContact O-N 3.48Å; L726-K728 VanDerWaalsContact C-N 3.32Å; L726-K728 PolarHBondContact O-N 2.92Å; K728-Y730 VanDerWaalsContact C-N 3.32Å; K728-Y730 PolarHBondContact O-N 3.44Å; K728-S731 WeakPolarHBondContact O-CB 3.49Å; K728-S731 PolarHBondContact O-N 3.11Å; K728-D732 WeakPolarHBondContact CE-OD2 3.19Å; K728-D732 WeakPolarHBondContact CG-OD2 3.41Å; K728-D732 PolarHBondContact O-N 3.01Å
729	F	93.2	Very high	84.3	Confident	13 Å²	13	37.3 Å²	37.3	6%	0.057	23%	0.229	C	C	.	.	H	α-helix	trans	-61.7	-37.6	-177	-172.9	-118.3	0	0	0	112.9	T678 A688 V691 S725 L726 S731 D732 V733 I748 I752	T678-F729 HydrophobicContact CG2-CD2 4.14Å; T678-F729 HydrophobicContact CG2-CE2 4.36Å; A688-F729 HydrophobicContact CB-CZ 4.29Å; V691-F729 HydrophobicContact CB-CE1 4.36Å; V691-F729 HydrophobicContact CG2-CD1 3.87Å; V691-F729 HydrophobicContact CG2-CE1 3.74Å; S725-F729 VanDerWaalsContact O-CB 3.3Å; S725-F729 WeakPolarHBondContact O-CB 3.31Å; S725-F729 PolarHBondContact O-N 2.91Å; L726-F729 PolarHBondContact O-N 3.22Å; F729-S731 PolarHBondContact O-N 3.24Å; F729-D732 PolarHBondContact O-N 3.47Å; F729-V733 HydrophobicContact CD1-CG2 4.23Å; F729-V733 HydrophobicContact CD2-CG2 4.28Å; F729-V733 HydrophobicContact CE1-CG2 3.89Å; F729-V733 HydrophobicContact CE2-CG2 3.95Å; F729-V733 HydrophobicContact CG-CG2 4.41Å; F729-V733 HydrophobicContact CZ-CG2 3.74Å; F729-V733 VanDerWaalsContact O-CG2 3.22Å; F729-V733 WeakPolarHBondContact O-CG2 3.3Å; F729-V733 PolarHBondContact O-N 2.98Å; F729-V733 VanDerWaalsContact O-N 3.08Å; F729-I748 HydrophobicContact CD1-CG2 4.43Å; F729-I748 HydrophobicContact CE1-CG2 3.74Å; F729-I748 HydrophobicContact CZ-CG2 4.49Å; F729-I752 HydrophobicContact CD1-CD1 3.94Å
730	Y	92.9	Very high	82.8	Confident	1 Å²	1	39.5 Å²	39.5	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-53.5	-37.6	173.9	-170.5	-75.6	0	0	0	112.5	L726 K728 R749 I752 Q753 F783 M786 L787 D790	L726-Y730 WeakPolarHBondContact O-CB 3.37Å; L726-Y730 PolarHBondContact O-N 2.92Å; K728-Y730 VanDerWaalsContact C-N 3.32Å; K728-Y730 PolarHBondContact O-N 3.44Å; Y730-R749 HydrophobicContact CD1-CG 4.25Å; Y730-R749 HydrophobicContact CD2-CB 4.12Å; Y730-R749 HydrophobicContact CD2-CG 3.77Å; Y730-R749 HydrophobicContact CE1-CG 3.88Å; Y730-R749 VanDerWaalsContact CE1-NE 3.3Å; Y730-R749 HydrophobicContact CE2-CB 3.45Å; Y730-R749 VanDerWaalsContact CE2-CB 3.45Å; Y730-R749 HydrophobicContact CE2-CG 3.4Å; Y730-R749 HydrophobicContact CG-CG 4.18Å; Y730-R749 VanDerWaalsContact CZ-CD 3.44Å; Y730-R749 VanDerWaalsContact CZ-CG 3.42Å; Y730-R749 PolarHBondContact O-NE 3.48Å; Y730-R749 PolarHBondContact O-NH2 2.88Å; Y730-R749 WeakPolarHBondContact OH-CD 3.33Å; Y730-I752 HydrophobicContact CD2-CB 4.17Å; Y730-I752 HydrophobicContact CD2-CD1 4.01Å; Y730-I752 HydrophobicContact CD2-CG2 4Å; Y730-I752 HydrophobicContact CG-CD1 4.41Å; Y730-Q753 HydrophobicContact CE2-CG 4.27Å; Y730-Q753 PolarHBondContact OH-NE2 3.45Å; Y730-F783 AromaticContact CD1-CD2 3.52Å; Y730-F783 HydrophobicContact CD1-CD2 3.52Å; Y730-F783 AromaticContact CD1-CE2 3.73Å; Y730-F783 HydrophobicContact CD1-CE2 3.73Å; Y730-F783 HydrophobicContact CD2-CD2 4.21Å; Y730-F783 AromaticContact CD2-CE2 3.67Å; Y730-F783 HydrophobicContact CD2-CE2 3.67Å; Y730-F783 HydrophobicContact CE1-CD2 4.19Å; Y730-F783 HydrophobicContact CE1-CE2 4.13Å; Y730-F783 HydrophobicContact CE2-CE2 4.03Å; Y730-F783 AromaticContact CG-CD2 3.56Å; Y730-F783 HydrophobicContact CG-CD2 3.56Å; Y730-F783 AromaticContact CG-CE2 3.51Å; Y730-F783 HydrophobicContact CG-CE2 3.51Å; Y730-M786 HydrophobicContact CD1-CB 4.07Å; Y730-M786 HydrophobicContact CE1-CB 3.88Å; Y730-L787 HydrophobicContact CE1-CD2 4.02Å; Y730-L787 HydrophobicContact CE1-CG 4.43Å; Y730-L787 HydrophobicContact CE2-CD2 4.12Å; Y730-L787 WeakPolarHBondContact OH-CD2 3.31Å; Y730-D790 WeakPolarHBondContact CE1-OD2 3.29Å; Y730-D790 PolarHBondContact OH-OD2 2.97Å
731	S	90.4	Very high	81.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-81.8	-37.1	-179.6	-55.7	0	0	0	0	112.7	V727 K728 F729 V733 E734 R782 F783	V727-S731 PolarHBondContact O-OG 3.36Å; K728-S731 WeakPolarHBondContact O-CB 3.49Å; K728-S731 PolarHBondContact O-N 3.11Å; F729-S731 PolarHBondContact O-N 3.24Å; S731-V733 VanDerWaalsContact C-N 3.28Å; S731-V733 PolarHBondContact O-N 3.38Å; S731-E734 WeakPolarHBondContact O-CB 3.39Å; S731-E734 PolarHBondContact O-N 3.44Å; S731-R782 PolarHBondContact O-NH2 3.33Å; S731-R782 VanDerWaalsContact O-NH2 3.09Å; S731-F783 WeakPolarHBondContact OG-CA 3.46Å; S731-F783 PolarHBondContact OG-N 2.92Å
732	D	87.2	Confident	79.6	Confident	51 Å²	51	41.6 Å²	41.6	27%	0.273	25%	0.251	S	S	.	.	H	α-helix	trans	-70	-25.3	-179.4	-68.5	-17	0	0	0	112.8	K728 F729 E734 T735 R782	K728-D732 WeakPolarHBondContact CE-OD2 3.19Å; K728-D732 WeakPolarHBondContact CG-OD2 3.41Å; K728-D732 PolarHBondContact O-N 3.01Å; F729-D732 PolarHBondContact O-N 3.47Å; D732-E734 PolarHBondContact O-N 3.02Å; D732-E734 VanDerWaalsContact O-N 3.14Å; D732-T735 PolarHBondContact O-N 2.73Å; D732-T735 PolarHBondContact O-OG1 3.46Å; D732-R782 IonicContact OD1-CZ 3.02Å; D732-R782 IonicContact OD1-NH1 3.93Å; D732-R782 PolarHBondContact OD1-NH1 3.31Å; D732-R782 IonicContact OD1-NH2 3.77Å
733	V	86.7	Confident	78	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.012	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-64.3	-11.5	174.8	161.8	0	0	0	0	113.5	F729 S731 T735 L736 K745 I748	F729-V733 HydrophobicContact CD1-CG2 4.23Å; F729-V733 HydrophobicContact CD2-CG2 4.28Å; F729-V733 HydrophobicContact CE1-CG2 3.89Å; F729-V733 HydrophobicContact CE2-CG2 3.95Å; F729-V733 HydrophobicContact CG-CG2 4.41Å; F729-V733 HydrophobicContact CZ-CG2 3.74Å; F729-V733 VanDerWaalsContact O-CG2 3.22Å; F729-V733 WeakPolarHBondContact O-CG2 3.3Å; F729-V733 PolarHBondContact O-N 2.98Å; F729-V733 VanDerWaalsContact O-N 3.08Å; S731-V733 VanDerWaalsContact C-N 3.28Å; S731-V733 PolarHBondContact O-N 3.38Å; V733-T735 PolarHBondContact O-N 3.25Å; V733-L736 HydrophobicContact CB-CD1 4.27Å; V733-L736 HydrophobicContact CG1-CD1 3.79Å; V733-L736 HydrophobicContact CG2-CD1 4.42Å; V733-L736 WeakPolarHBondContact O-CD1 3.46Å; V733-L736 WeakPolarHBondContact O-CG 3.42Å; V733-K745 HydrophobicContact CG1-CB 3.52Å; V733-I748 HydrophobicContact CG1-CB 4.3Å; V733-I748 HydrophobicContact CG1-CD1 4.05Å; V733-I748 HydrophobicContact CG1-CG2 4.41Å; V733-I748 HydrophobicContact CG2-CD1 4.3Å; V733-I748 HydrophobicContact CG2-CG2 3.94Å
734	E	81.3	Confident	77.2	Confident	61 Å²	61	50.5 Å²	50.5	29%	0.285	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-67.6	-20.6	176.6	-167.4	61.7	-155.7	0	0	113.2	S731 D732 K745 R749 M786	S731-E734 WeakPolarHBondContact O-CB 3.39Å; S731-E734 PolarHBondContact O-N 3.44Å; D732-E734 PolarHBondContact O-N 3.02Å; D732-E734 VanDerWaalsContact O-N 3.14Å; E734-K745 VanDerWaalsContact CD-NZ 3.27Å; E734-K745 IonicContact OE1-NZ 3.74Å; E734-K745 PolarHBondContact OE1-NZ 2.94Å; E734-K745 IonicContact OE2-NZ 3.1Å; E734-K745 PolarHBondContact OE2-NZ 3.34Å; E734-R749 IonicContact OE2-CZ 3.51Å; E734-R749 VanDerWaalsContact OE2-CZ 3.3Å; E734-R749 IonicContact OE2-NH1 3.72Å; E734-R749 PolarHBondContact OE2-NH1 3.13Å; E734-R749 IonicContact OE2-NH2 2.85Å; E734-R749 PolarHBondContact OE2-NH2 2.94Å; E734-M786 HydrophobicContact CB-SD 4.18Å; E734-M786 HydrophobicContact CG-SD 4Å
735	T	70.8	Confident	76.8	Confident	103 Å²	103	47.8 Å²	47.8	63%	0.632	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-121.3	42	-170.2	56.6	0	0	0	0	114.1	D732 V733 G737	D732-T735 PolarHBondContact O-N 2.73Å; D732-T735 PolarHBondContact O-OG1 3.46Å; V733-T735 PolarHBondContact O-N 3.25Å; T735-G737 PolarHBondContact O-N 3.08Å; T735-G737 VanDerWaalsContact O-N 3.08Å
736	L	65	Low	76.5	Confident	20 Å²	20	47.5 Å²	47.5	11%	0.105	27%	0.274	C	S	.	.			trans	-73.1	7.7	-168.3	-71.4	169.3	0	0	0	117.3	P684 V733 S738 E741 I748	P684-L736 HydrophobicContact CB-CD2 3.27Å; P684-L736 HydrophobicContact CG-CD2 3.46Å; P684-L736 VanDerWaalsContact CG-CD2 3.46Å; V733-L736 HydrophobicContact CB-CD1 4.27Å; V733-L736 HydrophobicContact CG1-CD1 3.79Å; V733-L736 HydrophobicContact CG2-CD1 4.42Å; V733-L736 WeakPolarHBondContact O-CD1 3.46Å; V733-L736 WeakPolarHBondContact O-CG 3.42Å; L736-S738 VanDerWaalsContact C-N 3.34Å; L736-S738 PolarHBondContact O-N 3.45Å; L736-E741 VanDerWaalsContact C-OE1 3.31Å; L736-E741 HydrophobicContact CB-CG 3.96Å; L736-E741 PolarHBondContact N-OE1 2.92Å; L736-I748 HydrophobicContact CD1-CD1 4.07Å
737	G	57	Low	76.1	Confident	74 Å²	74	51.8 Å²	51.8	76%	0.763	30%	0.297	S	S	*	.			trans	64.8	0.4	-179.8	0	0	0	0	0	119.5	T735 E741	T735-G737 PolarHBondContact O-N 3.08Å; T735-G737 VanDerWaalsContact O-N 3.08Å; G737-E741 WeakPolarHBondContact CA-OE1 3.47Å; G737-E741 PolarHBondContact N-OE1 3.22Å
738	S	57.9	Low	76	Confident	32 Å²	32	52.3 Å²	52.3	22%	0.224	30%	0.299	C	S	.	.	S	Bend	trans	-111.7	159.6	-166.4	89.9	0	0	0	0	116.4	Y685 L736 S740 E741	Y685-S738 WeakPolarHBondContact OH-CB 3.33Å; Y685-S738 PolarHBondContact OH-OG 3.07Å; L736-S738 VanDerWaalsContact C-N 3.34Å; L736-S738 PolarHBondContact O-N 3.45Å; S738-S740 VanDerWaalsContact C-N 3.27Å; S738-S740 PolarHBondContact O-N 2.97Å; S738-S740 PolarHBondContact OG-N 3.42Å; S738-S740 PolarHBondContact OG-OG 3.33Å; S738-E741 VanDerWaalsContact N-CD 3.27Å; S738-E741 VanDerWaalsContact N-CG 3.29Å; S738-E741 PolarHBondContact N-OE1 3.39Å; S738-E741 VanDerWaalsContact O-CB 3.22Å; S738-E741 WeakPolarHBondContact O-CB 3.3Å; S738-E741 WeakPolarHBondContact O-CG 3.41Å; S738-E741 PolarHBondContact O-N 2.83Å; S738-E741 PolarHBondContact OG-N 3.46Å; S738-E741 VanDerWaalsContact OG-N 3.14Å
739	A	53.1	Low	75.9	Confident	118 Å²	118	47.5 Å²	47.5	98%	0.975	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-20.7	177.4	0	0	0	0	0	114.4
740	S	58.7	Low	75.8	Confident	54 Å²	54	49.1 Å²	49.1	38%	0.378	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-1.3	177.2	60.6	0	0	0	0	113.8	Y685 S738 F742 Y743 D744	Y685-S740 PolarHBondContact OH-OG 3.28Å; S738-S740 VanDerWaalsContact C-N 3.27Å; S738-S740 PolarHBondContact O-N 2.97Å; S738-S740 PolarHBondContact OG-N 3.42Å; S738-S740 PolarHBondContact OG-OG 3.33Å; S740-F742 PolarHBondContact O-N 2.93Å; S740-Y743 PolarHBondContact O-N 3.49Å; S740-D744 WeakPolarHBondContact CB-OD2 3.49Å; S740-D744 PolarHBondContact O-N 3.12Å; S740-D744 PolarHBondContact OG-OD2 3.3Å
741	E	58.3	Low	75.9	Confident	64 Å²	64	50.4 Å²	50.4	30%	0.299	29%	0.291	S	S	.	.	H	α-helix	trans	-33.7	-45.7	177.8	-92.2	171.9	169.4	0	0	113.7	L736 G737 S738 Y743 K745	L736-E741 VanDerWaalsContact C-OE1 3.31Å; L736-E741 HydrophobicContact CB-CG 3.96Å; L736-E741 PolarHBondContact N-OE1 2.92Å; G737-E741 WeakPolarHBondContact CA-OE1 3.47Å; G737-E741 PolarHBondContact N-OE1 3.22Å; S738-E741 VanDerWaalsContact N-CD 3.27Å; S738-E741 VanDerWaalsContact N-CG 3.29Å; S738-E741 PolarHBondContact N-OE1 3.39Å; S738-E741 VanDerWaalsContact O-CB 3.22Å; S738-E741 WeakPolarHBondContact O-CB 3.3Å; S738-E741 WeakPolarHBondContact O-CG 3.41Å; S738-E741 PolarHBondContact O-N 2.83Å; S738-E741 PolarHBondContact OG-N 3.46Å; S738-E741 VanDerWaalsContact OG-N 3.14Å; E741-Y743 PolarHBondContact O-N 3.48Å; E741-K745 WeakPolarHBondContact O-CG 3.45Å; E741-K745 PolarHBondContact O-N 3.43Å; E741-K745 VanDerWaalsContact O-N 3.14Å
742	F	58.4	Low	76.1	Confident	74 Å²	74	50.4 Å²	50.4	33%	0.325	29%	0.291	S	S	.	.	H	α-helix	trans	-61.9	-42.5	-171.5	-169	-96.7	0	0	0	113.4	S740 K745 F746 Y793	S740-F742 PolarHBondContact O-N 2.93Å; F742-K745 WeakPolarHBondContact O-CG 3.35Å; F742-F746 HydrophobicContact CD1-CE2 4.47Å; F742-F746 AromaticContact CE1-CE2 3.93Å; F742-F746 HydrophobicContact CE1-CE2 3.93Å; F742-F746 HydrophobicContact CE2-CE2 4.38Å; F742-F746 AromaticContact CZ-CE2 3.87Å; F742-F746 HydrophobicContact CZ-CE2 3.87Å; F742-F746 HydrophobicContact CZ-CZ 4.48Å; F742-F746 WeakPolarHBondContact O-CD2 3.31Å; F742-F746 WeakPolarHBondContact O-CE2 3.4Å; F742-Y793 AromaticContact CE1-CE1 3.72Å; F742-Y793 HydrophobicContact CE1-CE1 3.72Å; F742-Y793 HydrophobicContact CE1-CE2 4.45Å; F742-Y793 AromaticContact CE1-CZ 3.62Å; F742-Y793 WeakPolarHBondContact CE1-OH 3.38Å; F742-Y793 AromaticContact CZ-CD1 3.98Å; F742-Y793 HydrophobicContact CZ-CD1 3.98Å; F742-Y793 HydrophobicContact CZ-CD2 4.27Å; F742-Y793 AromaticContact CZ-CE1 3.36Å; F742-Y793 HydrophobicContact CZ-CE1 3.36Å; F742-Y793 AromaticContact CZ-CE2 3.71Å; F742-Y793 HydrophobicContact CZ-CE2 3.71Å; F742-Y793 HydrophobicContact CZ-CG 4.41Å; F742-Y793 AromaticContact CZ-CZ 3.25Å; F742-Y793 WeakPolarHBondContact CZ-OH 3.24Å
743	Y	61.7	Low	76.4	Confident	151 Å²	151	48.3 Å²	48.3	59%	0.592	28%	0.28	S	S	*	.	H	α-helix	trans	-88.2	-34.1	-178.4	-65.3	-73.6	0	0	0	111.6	S740 E741 K745 F746	S740-Y743 PolarHBondContact O-N 3.49Å; E741-Y743 PolarHBondContact O-N 3.48Å; Y743-K745 VanDerWaalsContact C-N 3.35Å; Y743-K745 PolarHBondContact O-N 3.17Å; Y743-F746 PolarHBondContact O-N 2.8Å
744	D	76.9	Confident	76.7	Confident	43 Å²	43	49.1 Å²	49.1	23%	0.23	29%	0.285	C	S	.	.	H	α-helix	trans	-64.1	-40	-178.4	-65.3	-23.5	0	0	0	111.5	Y685 S740 F746 N747 I748	Y685-D744 HydrophobicContact CE1-CB 4.28Å; Y685-D744 WeakPolarHBondContact CE1-OD2 3.4Å; Y685-D744 PolarHBondContact OH-OD2 3.02Å; S740-D744 WeakPolarHBondContact CB-OD2 3.49Å; S740-D744 PolarHBondContact O-N 3.12Å; S740-D744 PolarHBondContact OG-OD2 3.3Å; D744-F746 VanDerWaalsContact C-N 3.3Å; D744-F746 PolarHBondContact O-N 2.77Å; D744-N747 PolarHBondContact O-N 3.48Å; D744-I748 WeakPolarHBondContact O-CG1 3.43Å; D744-I748 PolarHBondContact O-N 3.09Å; D744-I748 VanDerWaalsContact O-N 3.16Å
745	K	86.5	Confident	77.4	Confident	20 Å²	20	46.3 Å²	46.3	9%	0.087	27%	0.272	C	S	.	.	H	α-helix	trans	-58.9	-39.3	-179.1	69.4	-177.9	-170.3	177.4	0	113.2	V733 E734 E741 F742 Y743 I748 R749	V733-K745 HydrophobicContact CG1-CB 3.52Å; E734-K745 VanDerWaalsContact CD-NZ 3.27Å; E734-K745 IonicContact OE1-NZ 3.74Å; E734-K745 PolarHBondContact OE1-NZ 2.94Å; E734-K745 IonicContact OE2-NZ 3.1Å; E734-K745 PolarHBondContact OE2-NZ 3.34Å; E741-K745 WeakPolarHBondContact O-CG 3.45Å; E741-K745 PolarHBondContact O-N 3.43Å; E741-K745 VanDerWaalsContact O-N 3.14Å; F742-K745 WeakPolarHBondContact O-CG 3.35Å; Y743-K745 VanDerWaalsContact C-N 3.35Å; Y743-K745 PolarHBondContact O-N 3.17Å; K745-I748 PolarHBondContact O-N 3.38Å; K745-R749 WeakPolarHBondContact O-CB 3.43Å; K745-R749 WeakPolarHBondContact O-CG 3.46Å; K745-R749 PolarHBondContact O-N 3.44Å
746	F	87.3	Confident	78.4	Confident	13 Å²	13	41.4 Å²	41.4	6%	0.057	24%	0.242	C	C	.	.	H	α-helix	trans	-69.2	-36.7	-178.1	-73.2	-63.8	0	0	0	112.4	F742 Y743 D744 R749 F750 D790 Y793 L794 L846	F742-F746 HydrophobicContact CD1-CE2 4.47Å; F742-F746 AromaticContact CE1-CE2 3.93Å; F742-F746 HydrophobicContact CE1-CE2 3.93Å; F742-F746 HydrophobicContact CE2-CE2 4.38Å; F742-F746 AromaticContact CZ-CE2 3.87Å; F742-F746 HydrophobicContact CZ-CE2 3.87Å; F742-F746 HydrophobicContact CZ-CZ 4.48Å; F742-F746 WeakPolarHBondContact O-CD2 3.31Å; F742-F746 WeakPolarHBondContact O-CE2 3.4Å; Y743-F746 PolarHBondContact O-N 2.8Å; D744-F746 VanDerWaalsContact C-N 3.3Å; D744-F746 PolarHBondContact O-N 2.77Å; F746-R749 PolarHBondContact O-N 2.93Å; F746-F750 WeakPolarHBondContact O-CB 3.5Å; F746-F750 PolarHBondContact O-N 2.92Å; F746-D790 HydrophobicContact CE1-CB 4.23Å; F746-D790 WeakPolarHBondContact CE1-OD1 3.19Å; F746-Y793 HydrophobicContact CE2-CD1 4.06Å; F746-Y793 HydrophobicContact CE2-CE1 4.03Å; F746-Y793 AromaticContact CZ-CD1 3.58Å; F746-Y793 HydrophobicContact CZ-CD1 3.58Å; F746-Y793 HydrophobicContact CZ-CE1 4.04Å; F746-L794 HydrophobicContact CD1-CD1 4.13Å; F746-L794 HydrophobicContact CD1-CD2 4.01Å; F746-L794 HydrophobicContact CD1-CG 4.34Å; F746-L794 HydrophobicContact CE1-CD1 3.91Å; F746-L794 HydrophobicContact CE1-CD2 3.81Å; F746-L794 HydrophobicContact CE1-CG 3.84Å; F746-L794 HydrophobicContact CG-CD2 4.47Å; F746-L794 HydrophobicContact CZ-CD2 4.11Å; F746-L794 HydrophobicContact CZ-CG 4.32Å; F746-L846 HydrophobicContact CB-CD1 3.74Å; F746-L846 HydrophobicContact CB-CD2 4.49Å; F746-L846 HydrophobicContact CD1-CD1 4.45Å; F746-L846 HydrophobicContact CG-CD1 4.2Å
747	N	87.9	Confident	79.7	Confident	90 Å²	90	45.5 Å²	45.5	48%	0.481	26%	0.259	S	S	.	.	H	α-helix	trans	-63.6	-44.9	174.2	-69.1	-28.1	0	0	0	110.9	D744 R749 F750 H751	D744-N747 PolarHBondContact O-N 3.48Å; N747-R749 PolarHBondContact O-N 3.5Å; N747-F750 WeakPolarHBondContact O-CB 3.44Å; N747-F750 PolarHBondContact O-N 3.34Å; N747-H751 VanDerWaalsContact O-CG 3.32Å; N747-H751 PolarHBondContact O-N 3Å; N747-H751 PolarHBondContact O-ND1 3.37Å
748	I	92	Very high	81.3	Confident	11 Å²	11	42.2 Å²	42.2	6%	0.056	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-45	177	-60.3	166.7	0	0	0	110.6	A688 F729 V733 L736 D744 K745 F750 H751 I752	A688-I748 HydrophobicContact CB-CD1 3.54Å; A688-I748 HydrophobicContact CB-CG1 3.87Å; F729-I748 HydrophobicContact CD1-CG2 4.43Å; F729-I748 HydrophobicContact CE1-CG2 3.74Å; F729-I748 HydrophobicContact CZ-CG2 4.49Å; V733-I748 HydrophobicContact CG1-CB 4.3Å; V733-I748 HydrophobicContact CG1-CD1 4.05Å; V733-I748 HydrophobicContact CG1-CG2 4.41Å; V733-I748 HydrophobicContact CG2-CD1 4.3Å; V733-I748 HydrophobicContact CG2-CG2 3.94Å; L736-I748 HydrophobicContact CD1-CD1 4.07Å; D744-I748 WeakPolarHBondContact O-CG1 3.43Å; D744-I748 PolarHBondContact O-N 3.09Å; D744-I748 VanDerWaalsContact O-N 3.16Å; K745-I748 PolarHBondContact O-N 3.38Å; I748-F750 VanDerWaalsContact C-N 3.33Å; I748-F750 PolarHBondContact O-N 2.63Å; I748-H751 WeakPolarHBondContact O-CB 3.4Å; I748-H751 PolarHBondContact O-N 2.91Å; I748-I752 HydrophobicContact CG2-CD1 4.13Å; I748-I752 WeakPolarHBondContact O-CG1 3.45Å; I748-I752 PolarHBondContact O-N 3.48Å
749	R	91.4	Very high	82.9	Confident	3 Å²	3	40.7 Å²	40.7	1%	0.011	21%	0.213	C	C	.	.	H	α-helix	trans	-61.5	-40	177.7	-73.5	175.4	166.4	160.1	12	112.2	Y730 E734 K745 F746 N747 I752 Q753 D790	Y730-R749 HydrophobicContact CD1-CG 4.25Å; Y730-R749 HydrophobicContact CD2-CB 4.12Å; Y730-R749 HydrophobicContact CD2-CG 3.77Å; Y730-R749 HydrophobicContact CE1-CG 3.88Å; Y730-R749 VanDerWaalsContact CE1-NE 3.3Å; Y730-R749 HydrophobicContact CE2-CB 3.45Å; Y730-R749 VanDerWaalsContact CE2-CB 3.45Å; Y730-R749 HydrophobicContact CE2-CG 3.4Å; Y730-R749 HydrophobicContact CG-CG 4.18Å; Y730-R749 VanDerWaalsContact CZ-CD 3.44Å; Y730-R749 VanDerWaalsContact CZ-CG 3.42Å; Y730-R749 PolarHBondContact O-NE 3.48Å; Y730-R749 PolarHBondContact O-NH2 2.88Å; Y730-R749 WeakPolarHBondContact OH-CD 3.33Å; E734-R749 IonicContact OE2-CZ 3.51Å; E734-R749 VanDerWaalsContact OE2-CZ 3.3Å; E734-R749 IonicContact OE2-NH1 3.72Å; E734-R749 PolarHBondContact OE2-NH1 3.13Å; E734-R749 IonicContact OE2-NH2 2.85Å; E734-R749 PolarHBondContact OE2-NH2 2.94Å; K745-R749 WeakPolarHBondContact O-CB 3.43Å; K745-R749 WeakPolarHBondContact O-CG 3.46Å; K745-R749 PolarHBondContact O-N 3.44Å; F746-R749 PolarHBondContact O-N 2.93Å; N747-R749 PolarHBondContact O-N 3.5Å; R749-I752 PolarHBondContact O-N 3.39Å; R749-Q753 VanDerWaalsContact O-CG 3.27Å; R749-Q753 WeakPolarHBondContact O-CG 3.26Å; R749-Q753 PolarHBondContact O-N 3.09Å; R749-D790 VanDerWaalsContact CD-OD2 3.26Å; R749-D790 WeakPolarHBondContact CD-OD2 3.4Å; R749-D790 IonicContact CZ-OD1 2.69Å; R749-D790 IonicContact CZ-OD2 3.82Å; R749-D790 IonicContact NE-OD2 3.59Å; R749-D790 PolarHBondContact NE-OD2 2.67Å; R749-D790 VanDerWaalsContact NH1-CG 3.33Å; R749-D790 IonicContact NH1-OD1 3.74Å; R749-D790 PolarHBondContact NH1-OD1 3.2Å; R749-D790 IonicContact NH1-OD2 3.83Å; R749-D790 PolarHBondContact NH1-OD2 2.93Å
750	F	91.6	Very high	84.6	Confident	47 Å²	47	35.7 Å²	35.7	21%	0.206	17%	0.17	C	C	.	.	H	α-helix	trans	-61.5	-42.3	173.7	179.8	-103.9	0	0	0	112.7	F695 F746 N747 I748 Q753 T754 L846 A849	F695-F750 HydrophobicContact CE2-CD1 4.47Å; F695-F750 HydrophobicContact CE2-CE1 4.08Å; F695-F750 HydrophobicContact CZ-CE1 4.21Å; F746-F750 WeakPolarHBondContact O-CB 3.5Å; F746-F750 PolarHBondContact O-N 2.92Å; N747-F750 WeakPolarHBondContact O-CB 3.44Å; N747-F750 PolarHBondContact O-N 3.34Å; I748-F750 VanDerWaalsContact C-N 3.33Å; I748-F750 PolarHBondContact O-N 2.63Å; F750-Q753 PolarHBondContact O-N 3.12Å; F750-T754 WeakPolarHBondContact O-CB 3.41Å; F750-T754 PolarHBondContact O-N 3.33Å; F750-T754 PolarHBondContact O-OG1 3.42Å; F750-L846 HydrophobicContact CB-CD2 3.57Å; F750-L846 HydrophobicContact CD2-CD2 3.94Å; F750-L846 HydrophobicContact CG-CD2 4.04Å; F750-A849 HydrophobicContact CD2-CB 4.39Å
751	H	94.5	Very high	86	Confident	27 Å²	27	38.6 Å²	38.6	13%	0.125	18%	0.181	C	C	.	.	H	α-helix	trans	-58.2	-50.7	173.8	-62.7	154.7	0	0	0	110.4	V691 F695 N747 I748 Q753 T754 I755	V691-H751 HydrophobicContact CG1-CB 4.48Å; F695-H751 HydrophobicContact CB-CB 3.94Å; F695-H751 AromaticContact CD1-CD2 3.63Å; F695-H751 HydrophobicContact CD2-CB 4.17Å; F695-H751 AromaticContact CD2-CD2 3.72Å; F695-H751 AromaticContact CE1-CD2 3.82Å; F695-H751 AromaticContact CE2-CD2 3.88Å; F695-H751 HydrophobicContact CG-CB 4.13Å; F695-H751 AromaticContact CG-CD2 3.57Å; F695-H751 AromaticContact CZ-CD2 3.94Å; N747-H751 VanDerWaalsContact O-CG 3.32Å; N747-H751 PolarHBondContact O-N 3Å; N747-H751 PolarHBondContact O-ND1 3.37Å; I748-H751 WeakPolarHBondContact O-CB 3.4Å; I748-H751 PolarHBondContact O-N 2.91Å; H751-Q753 PolarHBondContact O-N 2.92Å; H751-T754 PolarHBondContact O-N 3.31Å; H751-I755 WeakPolarHBondContact O-CD1 3.42Å; H751-I755 VanDerWaalsContact O-CG1 3.23Å; H751-I755 WeakPolarHBondContact O-CG1 3.3Å; H751-I755 PolarHBondContact O-N 3.4Å
752	I	95.1	Very high	87.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.5	-46.4	179.3	-63.6	170.2	0	0	0	111.6	V691 L726 F729 Y730 I748 R749 T754 I755 F756	V691-I752 HydrophobicContact CG1-CG1 3.96Å; L726-I752 HydrophobicContact CB-CG2 4.12Å; L726-I752 HydrophobicContact CD2-CG1 4.31Å; F729-I752 HydrophobicContact CD1-CD1 3.94Å; Y730-I752 HydrophobicContact CD2-CB 4.17Å; Y730-I752 HydrophobicContact CD2-CD1 4.01Å; Y730-I752 HydrophobicContact CD2-CG2 4Å; Y730-I752 HydrophobicContact CG-CD1 4.41Å; I748-I752 HydrophobicContact CG2-CD1 4.13Å; I748-I752 WeakPolarHBondContact O-CG1 3.45Å; I748-I752 PolarHBondContact O-N 3.48Å; R749-I752 PolarHBondContact O-N 3.39Å; I752-T754 VanDerWaalsContact C-N 3.32Å; I752-T754 PolarHBondContact O-N 3.08Å; I752-I755 WeakPolarHBondContact O-CB 3.36Å; I752-I755 PolarHBondContact O-N 3.12Å; I752-F756 HydrophobicContact CG2-CD1 4.5Å; I752-F756 HydrophobicContact CG2-CD2 4.12Å; I752-F756 HydrophobicContact CG2-CE1 4.03Å; I752-F756 HydrophobicContact CG2-CE2 3.61Å; I752-F756 HydrophobicContact CG2-CZ 3.56Å; I752-F756 WeakPolarHBondContact O-CG 3.4Å; I752-F756 PolarHBondContact O-N 2.93Å
753	Q	92.8	Very high	88.7	Confident	7 Å²	7	40.3 Å²	40.3	3%	0.033	20%	0.198	C	C	.	.	H	α-helix	trans	-62.5	-40.1	179.1	-72.3	170.1	-14.6	0	0	112.2	Y730 R749 F750 H751 I755 F756 K757 A849 T850 M853	Y730-Q753 HydrophobicContact CE2-CG 4.27Å; Y730-Q753 PolarHBondContact OH-NE2 3.45Å; R749-Q753 VanDerWaalsContact O-CG 3.27Å; R749-Q753 WeakPolarHBondContact O-CG 3.26Å; R749-Q753 PolarHBondContact O-N 3.09Å; F750-Q753 PolarHBondContact O-N 3.12Å; H751-Q753 PolarHBondContact O-N 2.92Å; Q753-I755 VanDerWaalsContact C-N 3.35Å; Q753-F756 PolarHBondContact O-N 2.9Å; Q753-K757 PolarHBondContact O-N 3.49Å; Q753-A849 VanDerWaalsContact OE1-CB 3.25Å; Q753-T850 PolarHBondContact NE2-OG1 3Å; Q753-M853 HydrophobicContact CB-CE 4.14Å; Q753-M853 HydrophobicContact CG-CE 4.31Å
754	T	92.8	Very high	90	Very high	20 Å²	20	36.1 Å²	36.1	12%	0.123	20%	0.195	C	C	.	.	H	α-helix	trans	-67.2	-38.3	176.5	-57	0	0	0	0	111.5	F695 Q700 V701 F750 H751 I752 K757 S758	F695-T754 HydrophobicContact CD2-CG2 3.9Å; F695-T754 HydrophobicContact CE2-CG2 3.68Å; Q700-T754 HydrophobicContact CG-CG2 4.4Å; Q700-T754 PolarHBondContact NE2-O 2.99Å; V701-T754 HydrophobicContact CG2-CG2 3.51Å; F750-T754 WeakPolarHBondContact O-CB 3.41Å; F750-T754 PolarHBondContact O-N 3.33Å; F750-T754 PolarHBondContact O-OG1 3.42Å; H751-T754 PolarHBondContact O-N 3.31Å; I752-T754 VanDerWaalsContact C-N 3.32Å; I752-T754 PolarHBondContact O-N 3.08Å; T754-K757 WeakPolarHBondContact O-CB 3.1Å; T754-K757 PolarHBondContact O-N 3.02Å; T754-S758 PolarHBondContact O-N 3.24Å
755	I	95.1	Very high	90.6	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-47.4	174.2	-68.6	161	0	0	0	110.2	V691 L694 F695 L726 H751 I752 Q753 K757 S758 M759	V691-I755 HydrophobicContact CG1-CD1 3.79Å; L694-I755 HydrophobicContact CB-CD1 4.15Å; L694-I755 HydrophobicContact CD2-CD1 3.86Å; L694-I755 HydrophobicContact CD2-CG1 4.34Å; L694-I755 HydrophobicContact CD2-CG2 3.82Å; L694-I755 HydrophobicContact CG-CD1 3.8Å; L694-I755 HydrophobicContact CG-CG1 4.07Å; L694-I755 HydrophobicContact CG-CG2 4.22Å; F695-I755 HydrophobicContact CB-CD1 4.1Å; F695-I755 HydrophobicContact CB-CG1 4.2Å; L726-I755 HydrophobicContact CD1-CB 4.48Å; L726-I755 HydrophobicContact CD1-CG2 3.7Å; H751-I755 WeakPolarHBondContact O-CD1 3.42Å; H751-I755 VanDerWaalsContact O-CG1 3.23Å; H751-I755 WeakPolarHBondContact O-CG1 3.3Å; H751-I755 PolarHBondContact O-N 3.4Å; I752-I755 WeakPolarHBondContact O-CB 3.36Å; I752-I755 PolarHBondContact O-N 3.12Å; Q753-I755 VanDerWaalsContact C-N 3.35Å; I755-K757 VanDerWaalsContact C-N 3.29Å; I755-K757 PolarHBondContact O-N 2.91Å; I755-S758 WeakPolarHBondContact O-CA 3.16Å; I755-S758 WeakPolarHBondContact O-CB 3.26Å; I755-S758 PolarHBondContact O-N 3.33Å; I755-M759 HydrophobicContact CG2-CG 4.41Å; I755-M759 HydrophobicContact CG2-SD 4.02Å; I755-M759 WeakPolarHBondContact O-CG 3.31Å; I755-M759 PolarHBondContact O-N 3.07Å
756	F	93.4	Very high	90.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-56.8	-43.9	174.9	-70.9	-14.5	0	0	0	111.7	F723 L726 V727 I752 Q753 S758 M759 L760 M769 F783 M853	F723-F756 AromaticContact CD2-CD1 3.82Å; F723-F756 HydrophobicContact CD2-CD1 3.82Å; F723-F756 AromaticContact CD2-CE1 3.41Å; F723-F756 HydrophobicContact CD2-CE1 3.41Å; F723-F756 VanDerWaalsContact CD2-CE1 3.41Å; F723-F756 HydrophobicContact CD2-CE2 4.44Å; F723-F756 HydrophobicContact CD2-CG 4.5Å; F723-F756 AromaticContact CD2-CZ 3.76Å; F723-F756 HydrophobicContact CD2-CZ 3.76Å; F723-F756 HydrophobicContact CE2-CD1 4.09Å; F723-F756 HydrophobicContact CE2-CD2 4.27Å; F723-F756 AromaticContact CE2-CE1 3.79Å; F723-F756 HydrophobicContact CE2-CE1 3.79Å; F723-F756 AromaticContact CE2-CE2 3.99Å; F723-F756 HydrophobicContact CE2-CE2 3.99Å; F723-F756 HydrophobicContact CE2-CG 4.32Å; F723-F756 AromaticContact CE2-CZ 3.74Å; F723-F756 HydrophobicContact CE2-CZ 3.74Å; L726-F756 HydrophobicContact CB-CE1 3.54Å; L726-F756 HydrophobicContact CB-CZ 3.7Å; L726-F756 HydrophobicContact CD1-CD1 4.27Å; L726-F756 HydrophobicContact CD1-CE1 3.75Å; L726-F756 HydrophobicContact CG-CE1 4.31Å; V727-F756 HydrophobicContact CG2-CE2 4.44Å; V727-F756 HydrophobicContact CG2-CZ 3.96Å; I752-F756 HydrophobicContact CG2-CD1 4.5Å; I752-F756 HydrophobicContact CG2-CD2 4.12Å; I752-F756 HydrophobicContact CG2-CE1 4.03Å; I752-F756 HydrophobicContact CG2-CE2 3.61Å; I752-F756 HydrophobicContact CG2-CZ 3.56Å; I752-F756 WeakPolarHBondContact O-CG 3.4Å; I752-F756 PolarHBondContact O-N 2.93Å; Q753-F756 PolarHBondContact O-N 2.9Å; F756-S758 VanDerWaalsContact C-N 3.29Å; F756-S758 PolarHBondContact O-N 2.71Å; F756-M759 HydrophobicContact CD1-SD 4.15Å; F756-M759 WeakPolarHBondContact O-CB 3.06Å; F756-M759 PolarHBondContact O-N 3.43Å; F756-M759 VanDerWaalsContact O-N 3.09Å; F756-L760 WeakPolarHBondContact O-CG 3.47Å; F756-L760 PolarHBondContact O-N 3.28Å; F756-M769 HydrophobicContact CB-CE 4.21Å; F756-M769 HydrophobicContact CD1-CE 4.49Å; F756-M769 HydrophobicContact CG-CE 4.36Å; F756-F783 HydrophobicContact CE2-CE2 4.26Å; F756-F783 AromaticContact CE2-CZ 3.87Å; F756-F783 HydrophobicContact CE2-CZ 3.87Å; F756-M853 HydrophobicContact CB-CE 3.6Å; F756-M853 HydrophobicContact CB-SD 4.26Å; F756-M853 HydrophobicContact CD2-CE 3.89Å; F756-M853 HydrophobicContact CD2-SD 4.18Å; F756-M853 HydrophobicContact CG-CE 4.27Å
757	K	90.7	Very high	90.8	Very high	106 Å²	106	40.5 Å²	40.5	46%	0.461	22%	0.221	S	C	.	.	H	α-helix	trans	-57.7	-41.8	175	-167.9	166.7	-171.4	148.2	0	112.5	Q753 T754 I755 L760 D761 D852	Q753-K757 PolarHBondContact O-N 3.49Å; T754-K757 WeakPolarHBondContact O-CB 3.1Å; T754-K757 PolarHBondContact O-N 3.02Å; I755-K757 VanDerWaalsContact C-N 3.29Å; I755-K757 PolarHBondContact O-N 2.91Å; K757-L760 PolarHBondContact O-N 3.37Å; K757-D761 PolarHBondContact O-N 3.33Å; K757-D852 IonicContact NZ-OD2 3.9Å; K757-D852 PolarHBondContact NZ-OD2 3.31Å
758	S	91.8	Very high	90.8	Very high	4 Å²	4	38.3 Å²	38.3	3%	0.028	21%	0.211	C	C	.	.	H	α-helix	trans	-57.7	-48.6	172.3	-147.5	0	0	0	0	112.2	Q700 H709 T754 I755 F756 L760 D761	Q700-S758 PolarHBondContact NE2-OG 3.44Å; Q700-S758 PolarHBondContact OE1-OG 3.08Å; Q700-S758 VanDerWaalsContact OE1-OG 3.13Å; H709-S758 PolarHBondContact NE2-OG 2.97Å; T754-S758 PolarHBondContact O-N 3.24Å; I755-S758 WeakPolarHBondContact O-CA 3.16Å; I755-S758 WeakPolarHBondContact O-CB 3.26Å; I755-S758 PolarHBondContact O-N 3.33Å; F756-S758 VanDerWaalsContact C-N 3.29Å; F756-S758 PolarHBondContact O-N 2.71Å; S758-L760 VanDerWaalsContact C-N 3.26Å; S758-L760 PolarHBondContact O-N 3.45Å; S758-D761 PolarHBondContact O-N 2.89Å
759	M	91.9	Very high	90.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.7	-33.8	-178.5	-68	174.7	67.1	0	0	111.6	F713 G719 L722 F723 I755 F756 D761 E762 C765 M769	F713-M759 HydrophobicContact CE1-CE 4.44Å; F713-M759 HydrophobicContact CE1-CG 4.29Å; F713-M759 HydrophobicContact CZ-CG 3.85Å; G719-M759 WeakPolarHBondContact O-CE 3.18Å; L722-M759 HydrophobicContact CB-CE 4.27Å; L722-M759 HydrophobicContact CD2-CE 4.12Å; L722-M759 HydrophobicContact CD2-SD 3.76Å; L722-M759 HydrophobicContact CG-CE 4.31Å; L722-M759 HydrophobicContact CG-SD 4.12Å; F723-M759 HydrophobicContact CB-CE 4.01Å; I755-M759 HydrophobicContact CG2-CG 4.41Å; I755-M759 HydrophobicContact CG2-SD 4.02Å; I755-M759 WeakPolarHBondContact O-CG 3.31Å; I755-M759 PolarHBondContact O-N 3.07Å; F756-M759 HydrophobicContact CD1-SD 4.15Å; F756-M759 WeakPolarHBondContact O-CB 3.06Å; F756-M759 PolarHBondContact O-N 3.43Å; F756-M759 VanDerWaalsContact O-N 3.09Å; M759-D761 VanDerWaalsContact C-N 3.26Å; M759-D761 PolarHBondContact O-N 3.18Å; M759-E762 PolarHBondContact O-N 3.23Å; M759-E762 VanDerWaalsContact O-N 3.11Å; M759-C765 HydrophobicContact CB-CB 4.18Å; M759-C765 VanDerWaalsContact O-CB 3.23Å; M759-C765 WeakPolarHBondContact O-CB 3.47Å; M759-M769 HydrophobicContact CB-SD 3.91Å; M759-M769 HydrophobicContact CE-SD 4.37Å
760	L	88.7	Confident	90.5	Very high	13 Å²	13	39.7 Å²	39.7	7%	0.068	22%	0.217	C	C	.	.	H	α-helix	trans	-67.8	-25.2	179	-71.2	175.3	0	0	0	113.4	F756 K757 S758 E762 R766 M769 Y856	F756-L760 WeakPolarHBondContact O-CG 3.47Å; F756-L760 PolarHBondContact O-N 3.28Å; K757-L760 PolarHBondContact O-N 3.37Å; S758-L760 VanDerWaalsContact C-N 3.26Å; S758-L760 PolarHBondContact O-N 3.45Å; L760-E762 PolarHBondContact O-N 2.86Å; L760-R766 HydrophobicContact CD2-CG 4.38Å; L760-R766 VanDerWaalsContact O-CZ 3.23Å; L760-R766 PolarHBondContact O-NE 2.93Å; L760-R766 PolarHBondContact O-NH2 3.39Å; L760-M769 HydrophobicContact CD1-CE 4.34Å; L760-M769 HydrophobicContact CD2-CE 3.45Å; L760-M769 VanDerWaalsContact CD2-CE 3.45Å; L760-M769 HydrophobicContact CD2-SD 3.52Å; L760-M769 VanDerWaalsContact CD2-SD 3.52Å; L760-M769 HydrophobicContact CG-CE 3.76Å; L760-M769 HydrophobicContact CG-SD 4.07Å; L760-Y856 HydrophobicContact CD1-CD1 3.47Å; L760-Y856 VanDerWaalsContact CD1-CD1 3.47Å; L760-Y856 HydrophobicContact CD1-CD2 3.95Å; L760-Y856 HydrophobicContact CD1-CE1 3.48Å; L760-Y856 VanDerWaalsContact CD1-CE1 3.48Å; L760-Y856 HydrophobicContact CD1-CE2 3.92Å; L760-Y856 HydrophobicContact CD1-CG 3.75Å; L760-Y856 HydrophobicContact CD2-CD1 4.12Å; L760-Y856 HydrophobicContact CD2-CE1 3.24Å; L760-Y856 HydrophobicContact CD2-CE2 4.24Å; L760-Y856 VanDerWaalsContact CD2-OH 3.32Å; L760-Y856 WeakPolarHBondContact CD2-OH 3.44Å; L760-Y856 HydrophobicContact CG-CD1 4.41Å; L760-Y856 HydrophobicContact CG-CE1 3.94Å; L760-Y856 HydrophobicContact CG-CE2 4.46Å
761	D	86.5	Confident	90.4	Very high	115 Å²	115	41.9 Å²	41.9	62%	0.615	23%	0.23	S	C	*	.	H	α-helix	trans	-68	-23.8	173.4	-71.1	-25.6	0	0	0	111.8	K757 S758 M759 P763	K757-D761 PolarHBondContact O-N 3.33Å; S758-D761 PolarHBondContact O-N 2.89Å; M759-D761 VanDerWaalsContact C-N 3.26Å; M759-D761 PolarHBondContact O-N 3.18Å; D761-P763 WeakPolarHBondContact O-CD 3.35Å
762	E	86.6	Confident	90.1	Very high	89 Å²	89	41.2 Å²	41.2	42%	0.416	23%	0.227	S	C	.	.	S	Bend	trans	-88.4	116.8	177.6	-178.3	52.4	-134	0	0	111.6	M759 L760 A764 C765 R766	M759-E762 PolarHBondContact O-N 3.23Å; M759-E762 VanDerWaalsContact O-N 3.11Å; L760-E762 PolarHBondContact O-N 2.86Å; E762-A764 VanDerWaalsContact C-N 3.31Å; E762-A764 PolarHBondContact O-N 3.29Å; E762-C765 HydrophobicContact CB-CB 4.15Å; E762-C765 HydrophobicContact CG-CB 4.33Å; E762-C765 PolarHBondContact O-N 2.98Å; E762-R766 WeakPolarHBondContact O-CB 3.48Å; E762-R766 PolarHBondContact O-N 3.04Å
763	P	88	Confident	89.7	Confident	86 Å²	86	41.5 Å²	41.5	56%	0.558	23%	0.229	S	C	*	.	H	α-helix	trans	-57	-36.9	-175.5	-28	35.7	0	0	0	115.1	D761 R766 A767	D761-P763 WeakPolarHBondContact O-CD 3.35Å; P763-R766 WeakPolarHBondContact O-CB 3.27Å; P763-R766 PolarHBondContact O-N 3.36Å; P763-A767 PolarHBondContact O-N 3.32Å; P763-A767 VanDerWaalsContact O-N 3.12Å
764	A	87.7	Confident	89.4	Confident	63 Å²	63	47.4 Å²	47.4	52%	0.521	25%	0.254	S	S	.	.	H	α-helix	trans	-67.1	-46.6	179.5	0	0	0	0	0	111.6	E762 R766 A767 V768	E762-A764 VanDerWaalsContact C-N 3.31Å; E762-A764 PolarHBondContact O-N 3.29Å; A764-R766 VanDerWaalsContact C-N 3.32Å; A764-R766 PolarHBondContact O-N 3.49Å; A764-A767 PolarHBondContact O-N 2.66Å; A764-V768 WeakPolarHBondContact O-CG2 3.28Å; A764-V768 PolarHBondContact O-N 3.45Å
765	C	89.4	Confident	89.2	Confident	4 Å²	4	51.4 Å²	51.4	3%	0.027	28%	0.275	C	S	.	.	H	α-helix	trans	-63.5	-41	176.1	-68	0	0	0	0	111.2	F713 M759 E762 A767 V768 M769	F713-C765 WeakPolarHBondContact CD1-SG 3.34Å; F713-C765 WeakPolarHBondContact CE1-SG 3.33Å; M759-C765 HydrophobicContact CB-CB 4.18Å; M759-C765 VanDerWaalsContact O-CB 3.23Å; M759-C765 WeakPolarHBondContact O-CB 3.47Å; E762-C765 HydrophobicContact CB-CB 4.15Å; E762-C765 HydrophobicContact CG-CB 4.33Å; E762-C765 PolarHBondContact O-N 2.98Å; C765-A767 VanDerWaalsContact C-N 3.34Å; C765-A767 PolarHBondContact O-N 3.48Å; C765-V768 PolarHBondContact O-N 3.05Å; C765-M769 VanDerWaalsContact O-CG 3.28Å; C765-M769 WeakPolarHBondContact O-CG 3.18Å; C765-M769 PolarHBondContact O-N 3.25Å
766	R	89	Confident	88.8	Confident	100 Å²	100	52.9 Å²	52.9	38%	0.377	29%	0.288	S	S	.	.	H	α-helix	trans	-54.6	-48.7	175.7	-170.4	-176.5	-57.2	172.6	4.3	112	L760 E762 P763 A764 V768 M769 F770 Y856	L760-R766 HydrophobicContact CD2-CG 4.38Å; L760-R766 VanDerWaalsContact O-CZ 3.23Å; L760-R766 PolarHBondContact O-NE 2.93Å; L760-R766 PolarHBondContact O-NH2 3.39Å; E762-R766 WeakPolarHBondContact O-CB 3.48Å; E762-R766 PolarHBondContact O-N 3.04Å; P763-R766 WeakPolarHBondContact O-CB 3.27Å; P763-R766 PolarHBondContact O-N 3.36Å; A764-R766 VanDerWaalsContact C-N 3.32Å; A764-R766 PolarHBondContact O-N 3.49Å; R766-V768 VanDerWaalsContact C-N 3.33Å; R766-V768 PolarHBondContact O-N 3.21Å; R766-M769 PolarHBondContact O-N 2.83Å; R766-F770 HydrophobicContact CG-CD2 3.78Å; R766-F770 HydrophobicContact CG-CE2 3.61Å; R766-F770 WeakPolarHBondContact O-CD2 3.47Å; R766-F770 PolarHBondContact O-N 3.34Å; R766-Y856 VanDerWaalsContact CG-OH 3.25Å; R766-Y856 WeakPolarHBondContact CG-OH 3.32Å
767	A	89.6	Confident	88.6	Confident	63 Å²	63	55.7 Å²	55.7	52%	0.521	30%	0.303	S	S	.	.	H	α-helix	trans	-60.5	-43.4	179.9	0	0	0	0	0	112.1	P763 A764 C765 F770 D771	P763-A767 PolarHBondContact O-N 3.32Å; P763-A767 VanDerWaalsContact O-N 3.12Å; A764-A767 PolarHBondContact O-N 2.66Å; C765-A767 VanDerWaalsContact C-N 3.34Å; C765-A767 PolarHBondContact O-N 3.48Å; A767-F770 PolarHBondContact O-N 2.99Å; A767-D771 PolarHBondContact O-N 3.45Å
768	V	88.6	Confident	88.5	Confident	44 Å²	44	54.3 Å²	54.3	27%	0.267	31%	0.311	S	S	.	.	H	α-helix	trans	-65.8	-43.4	178.3	171.1	0	0	0	0	112.1	E720 A764 C765 R766 F770 D771 Y772	E720-V768 HydrophobicContact CB-CG1 3.47Å; E720-V768 VanDerWaalsContact CB-CG1 3.47Å; E720-V768 HydrophobicContact CG-CG1 3.74Å; A764-V768 WeakPolarHBondContact O-CG2 3.28Å; A764-V768 PolarHBondContact O-N 3.45Å; C765-V768 PolarHBondContact O-N 3.05Å; R766-V768 VanDerWaalsContact C-N 3.33Å; R766-V768 PolarHBondContact O-N 3.21Å; V768-F770 VanDerWaalsContact C-N 3.3Å; V768-F770 PolarHBondContact O-N 3.04Å; V768-D771 PolarHBondContact O-N 2.94Å; V768-Y772 PolarHBondContact O-N 3.43Å
769	M	89.2	Confident	88.4	Confident	8 Å²	8	56.8 Å²	56.8	4%	0.039	32%	0.324	C	S	.	.	H	α-helix	trans	-61.6	-41.5	176.6	-70.3	172.1	70.1	0	0	111.1	F723 F756 M759 L760 C765 R766 Y772 C773	F723-M769 HydrophobicContact CB-CG 4.17Å; F723-M769 HydrophobicContact CD1-CB 4.1Å; F723-M769 HydrophobicContact CD1-CG 3.72Å; F723-M769 HydrophobicContact CD2-CE 3.73Å; F723-M769 HydrophobicContact CD2-CG 3.79Å; F723-M769 HydrophobicContact CD2-SD 4.24Å; F723-M769 HydrophobicContact CE1-CB 3.89Å; F723-M769 HydrophobicContact CE1-CG 3.93Å; F723-M769 HydrophobicContact CE2-CE 3.45Å; F723-M769 VanDerWaalsContact CE2-CE 3.45Å; F723-M769 HydrophobicContact CE2-CG 4.08Å; F723-M769 HydrophobicContact CE2-SD 4.46Å; F723-M769 HydrophobicContact CG-CB 4.48Å; F723-M769 HydrophobicContact CG-CG 3.63Å; F723-M769 HydrophobicContact CZ-CB 4.18Å; F723-M769 HydrophobicContact CZ-CE 3.99Å; F723-M769 HydrophobicContact CZ-CG 4.14Å; F756-M769 HydrophobicContact CB-CE 4.21Å; F756-M769 HydrophobicContact CD1-CE 4.49Å; F756-M769 HydrophobicContact CG-CE 4.36Å; M759-M769 HydrophobicContact CB-SD 3.91Å; M759-M769 HydrophobicContact CE-SD 4.37Å; L760-M769 HydrophobicContact CD1-CE 4.34Å; L760-M769 HydrophobicContact CD2-CE 3.45Å; L760-M769 VanDerWaalsContact CD2-CE 3.45Å; L760-M769 HydrophobicContact CD2-SD 3.52Å; L760-M769 VanDerWaalsContact CD2-SD 3.52Å; L760-M769 HydrophobicContact CG-CE 3.76Å; L760-M769 HydrophobicContact CG-SD 4.07Å; C765-M769 VanDerWaalsContact O-CG 3.28Å; C765-M769 WeakPolarHBondContact O-CG 3.18Å; C765-M769 PolarHBondContact O-N 3.25Å; R766-M769 PolarHBondContact O-N 2.83Å; M769-Y772 PolarHBondContact O-N 3.32Å; M769-C773 PolarHBondContact O-N 3.17Å; M769-C773 PolarHBondContact O-SG 3.15Å
770	F	87.8	Confident	88.5	Confident	35 Å²	35	56.8 Å²	56.8	15%	0.154	32%	0.324	C	S	.	.	H	α-helix	trans	-64	-41.6	174.9	-86.3	-63.3	0	0	0	112.8	R766 A767 V768 C773 K774 Y856 D860 V861	R766-F770 HydrophobicContact CG-CD2 3.78Å; R766-F770 HydrophobicContact CG-CE2 3.61Å; R766-F770 WeakPolarHBondContact O-CD2 3.47Å; R766-F770 PolarHBondContact O-N 3.34Å; A767-F770 PolarHBondContact O-N 2.99Å; V768-F770 VanDerWaalsContact C-N 3.3Å; V768-F770 PolarHBondContact O-N 3.04Å; F770-C773 PolarHBondContact O-N 3.06Å; F770-K774 WeakPolarHBondContact O-CG 3.26Å; F770-K774 PolarHBondContact O-N 3.31Å; F770-Y856 HydrophobicContact CE2-CE1 4.38Å; F770-Y856 AromaticContact CE2-CZ 4Å; F770-Y856 WeakPolarHBondContact CE2-OH 3.4Å; F770-Y856 HydrophobicContact CZ-CE1 4.04Å; F770-Y856 AromaticContact CZ-CZ 3.85Å; F770-Y856 WeakPolarHBondContact CZ-OH 3.49Å; F770-D860 HydrophobicContact CD1-CB 4.35Å; F770-D860 HydrophobicContact CE1-CB 3.73Å; F770-D860 HydrophobicContact CZ-CB 4.32Å; F770-D860 WeakPolarHBondContact CZ-OD2 3.33Å; F770-V861 HydrophobicContact CD1-CG2 3.79Å; F770-V861 HydrophobicContact CE1-CG2 4.38Å
771	D	89.3	Confident	88.6	Confident	93 Å²	93	57 Å²	57	50%	0.497	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-44.3	176.5	-172.2	72.4	0	0	0	111.6	A767 V768 C773 K774 N775	A767-D771 PolarHBondContact O-N 3.45Å; V768-D771 PolarHBondContact O-N 2.94Å; D771-C773 VanDerWaalsContact C-N 3.35Å; D771-C773 PolarHBondContact O-N 3.02Å; D771-K774 PolarHBondContact O-N 2.74Å; D771-K774 VanDerWaalsContact O-N 3.15Å; D771-N775 PolarHBondContact O-N 3.37Å; D771-N775 PolarHBondContact O-ND2 2.94Å; D771-N775 PolarHBondContact OD1-ND2 3.02Å; D771-N775 PolarHBondContact OD2-ND2 3.29Å
772	Y	88.5	Confident	88.8	Confident	14 Å²	14	54.1 Å²	54.1	6%	0.055	31%	0.305	C	S	.	.	H	α-helix	trans	-63.5	-39.2	175.8	-174.2	-105.4	0	0	0	112.7	F723 K724 V727 V768 M769 K774 N775 A776 D777 F780	F723-Y772 AromaticContact CD1-CD1 3.72Å; F723-Y772 HydrophobicContact CD1-CD1 3.72Å; F723-Y772 HydrophobicContact CD1-CE1 4.5Å; F723-Y772 HydrophobicContact CD1-CG 4.08Å; F723-Y772 AromaticContact CE1-CD1 3.42Å; F723-Y772 HydrophobicContact CE1-CD1 3.42Å; F723-Y772 VanDerWaalsContact CE1-CD1 3.42Å; F723-Y772 HydrophobicContact CE1-CE1 4.3Å; F723-Y772 HydrophobicContact CE1-CG 4.06Å; F723-Y772 HydrophobicContact CZ-CD1 4.39Å; K724-Y772 HydrophobicContact CD-CD2 4.2Å; K724-Y772 HydrophobicContact CD-CE2 4.05Å; K724-Y772 HydrophobicContact CG-CD2 3.82Å; K724-Y772 HydrophobicContact CG-CE2 3.62Å; K724-Y772 HydrophobicContact CG-CG 4.4Å; V727-Y772 HydrophobicContact CB-CE1 4.45Å; V727-Y772 HydrophobicContact CG1-CE1 4.17Å; V727-Y772 HydrophobicContact CG2-CE1 4.27Å; V768-Y772 PolarHBondContact O-N 3.43Å; M769-Y772 PolarHBondContact O-N 3.32Å; Y772-K774 VanDerWaalsContact C-N 3.34Å; Y772-N775 CarbonylContact O-C 3.44Å; Y772-N775 VanDerWaalsContact O-C 3.28Å; Y772-N775 PolarHBondContact O-N 3.48Å; Y772-A776 WeakPolarHBondContact O-CA 3.37Å; Y772-A776 PolarHBondContact O-N 3.29Å; Y772-D777 PolarHBondContact OH-OD1 2.89Å; Y772-D777 PolarHBondContact OH-OD2 3.32Å; Y772-F780 HydrophobicContact CD1-CD2 4.03Å; Y772-F780 HydrophobicContact CE1-CB 3.92Å; Y772-F780 AromaticContact CE1-CD2 3.84Å; Y772-F780 HydrophobicContact CE1-CD2 3.84Å; Y772-F780 HydrophobicContact CE1-CG 4.29Å
773	C	87	Confident	89.1	Confident	6 Å²	6	49.9 Å²	49.9	4%	0.041	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-40.8	173.9	-66	0	0	0	0	111.1	M769 F770 D771 F780 V861 P864	M769-C773 PolarHBondContact O-N 3.17Å; M769-C773 PolarHBondContact O-SG 3.15Å; F770-C773 PolarHBondContact O-N 3.06Å; D771-C773 VanDerWaalsContact C-N 3.35Å; D771-C773 PolarHBondContact O-N 3.02Å; C773-F780 HydrophobicContact CB-CE2 4.46Å; C773-F780 HydrophobicContact CB-CZ 4.16Å; C773-V861 HydrophobicContact CB-CB 4.19Å; C773-V861 HydrophobicContact CB-CG1 3.9Å; C773-V861 HydrophobicContact CB-CG2 4.11Å; C773-P864 WeakPolarHBondContact O-CG 3.49Å
774	K	86.6	Confident	89.3	Confident	130 Å²	130	45.8 Å²	45.8	57%	0.565	26%	0.259	S	S	*	.	H	α-helix	trans	-66	-40	177.8	-74	176.4	-178.5	177.4	0	112.1	F770 D771 Y772 A776 V861	F770-K774 WeakPolarHBondContact O-CG 3.26Å; F770-K774 PolarHBondContact O-N 3.31Å; D771-K774 PolarHBondContact O-N 2.74Å; D771-K774 VanDerWaalsContact O-N 3.15Å; Y772-K774 VanDerWaalsContact C-N 3.34Å; K774-A776 VanDerWaalsContact C-N 3.32Å; K774-A776 PolarHBondContact O-N 2.89Å; K774-V861 HydrophobicContact CG-CG1 4.18Å; K774-V861 HydrophobicContact CG-CG2 3.71Å
775	N	88	Confident	89.5	Confident	105 Å²	105	42.8 Å²	42.8	56%	0.561	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.1	44.7	179.5	-59.5	-50.3	0	0	0	111.3	D771 Y772 D777	D771-N775 PolarHBondContact O-N 3.37Å; D771-N775 PolarHBondContact O-ND2 2.94Å; D771-N775 PolarHBondContact OD1-ND2 3.02Å; D771-N775 PolarHBondContact OD2-ND2 3.29Å; Y772-N775 CarbonylContact O-C 3.44Å; Y772-N775 VanDerWaalsContact O-C 3.28Å; Y772-N775 PolarHBondContact O-N 3.48Å; N775-D777 PolarHBondContact O-N 2.93Å
776	A	85.5	Confident	89.7	Confident	33 Å²	33	42.8 Å²	42.8	27%	0.273	23%	0.234	S	C	.	.			trans	-54.7	122.7	-172.9	0	0	0	0	0	112.7	Y772 K774 F780 I781 P864	Y772-A776 WeakPolarHBondContact O-CA 3.37Å; Y772-A776 PolarHBondContact O-N 3.29Å; K774-A776 VanDerWaalsContact C-N 3.32Å; K774-A776 PolarHBondContact O-N 2.89Å; A776-F780 HydrophobicContact CB-CB 4.16Å; A776-F780 HydrophobicContact CB-CD1 3.5Å; A776-F780 VanDerWaalsContact CB-CD1 3.5Å; A776-F780 HydrophobicContact CB-CE1 4.24Å; A776-F780 HydrophobicContact CB-CG 4.09Å; A776-I781 HydrophobicContact CB-CD1 4.38Å; A776-P864 HydrophobicContact CB-CB 3.69Å; A776-P864 HydrophobicContact CB-CG 3.73Å
777	D	89.8	Confident	89.8	Confident	59 Å²	59	38 Å²	38	32%	0.316	22%	0.216	S	C	.	.			trans	-91.4	179.8	172.2	70.2	17.5	0	0	0	111.5	Y772 N775 N779 F780 I781	Y772-D777 PolarHBondContact OH-OD1 2.89Å; Y772-D777 PolarHBondContact OH-OD2 3.32Å; N775-D777 PolarHBondContact O-N 2.93Å; D777-N779 PolarHBondContact O-N 3.4Å; D777-N779 WeakPolarHBondContact OD1-CA 3.27Å; D777-N779 VanDerWaalsContact OD1-CB 3.32Å; D777-N779 WeakPolarHBondContact OD1-CB 3.45Å; D777-N779 PolarHBondContact OD1-N 2.71Å; D777-F780 PolarHBondContact O-N 3.09Å; D777-F780 VanDerWaalsContact O-N 3.16Å; D777-F780 PolarHBondContact OD1-N 2.89Å; D777-I781 WeakPolarHBondContact O-CG1 3.42Å; D777-I781 PolarHBondContact O-N 3.48Å; D777-I781 VanDerWaalsContact O-N 3.11Å
778	A	88.5	Confident	90	Very high	76 Å²	76	35.2 Å²	35.2	63%	0.628	19%	0.192	S	C	*	.	H	α-helix	trans	-59.9	-29.6	177.8	0	0	0	0	0	113.8	R782	A778-R782 WeakPolarHBondContact O-CB 3.47Å; A778-R782 PolarHBondContact O-N 3.45Å
779	N	91.1	Very high	90.1	Very high	57 Å²	57	35.4 Å²	35.4	31%	0.305	19%	0.191	S	C	.	.	H	α-helix	trans	-71.1	-39.4	177.5	-63.5	-58.4	0	0	0	110.8	D777 R782 F783	D777-N779 PolarHBondContact O-N 3.4Å; D777-N779 WeakPolarHBondContact OD1-CA 3.27Å; D777-N779 VanDerWaalsContact OD1-CB 3.32Å; D777-N779 WeakPolarHBondContact OD1-CB 3.45Å; D777-N779 PolarHBondContact OD1-N 2.71Å; N779-R782 PolarHBondContact O-N 3.18Å; N779-F783 WeakPolarHBondContact O-CB 3.48Å; N779-F783 PolarHBondContact O-N 3.03Å
780	F	92	Very high	90.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64	-44.1	174.8	-172.8	-97.1	0	0	0	111.6	V727 Y772 C773 A776 D777 R782 F783 V784 M857 P864 F865	V727-F780 HydrophobicContact CG1-CD2 4.47Å; Y772-F780 HydrophobicContact CD1-CD2 4.03Å; Y772-F780 HydrophobicContact CE1-CB 3.92Å; Y772-F780 AromaticContact CE1-CD2 3.84Å; Y772-F780 HydrophobicContact CE1-CD2 3.84Å; Y772-F780 HydrophobicContact CE1-CG 4.29Å; C773-F780 HydrophobicContact CB-CE2 4.46Å; C773-F780 HydrophobicContact CB-CZ 4.16Å; A776-F780 HydrophobicContact CB-CB 4.16Å; A776-F780 HydrophobicContact CB-CD1 3.5Å; A776-F780 VanDerWaalsContact CB-CD1 3.5Å; A776-F780 HydrophobicContact CB-CE1 4.24Å; A776-F780 HydrophobicContact CB-CG 4.09Å; D777-F780 PolarHBondContact O-N 3.09Å; D777-F780 VanDerWaalsContact O-N 3.16Å; D777-F780 PolarHBondContact OD1-N 2.89Å; F780-R782 VanDerWaalsContact C-N 3.33Å; F780-R782 PolarHBondContact O-N 3.29Å; F780-F783 HydrophobicContact CD2-CD1 4.25Å; F780-F783 HydrophobicContact CE2-CD1 4.24Å; F780-F783 WeakPolarHBondContact O-CB 3.5Å; F780-F783 PolarHBondContact O-N 2.89Å; F780-V784 HydrophobicContact CD1-CG2 4.02Å; F780-V784 HydrophobicContact CE1-CG2 3.6Å; F780-V784 HydrophobicContact CE2-CG2 4.47Å; F780-V784 HydrophobicContact CZ-CG2 3.86Å; F780-V784 WeakPolarHBondContact O-CG2 3.46Å; F780-V784 PolarHBondContact O-N 3.05Å; F780-M857 HydrophobicContact CE2-SD 4.25Å; F780-M857 HydrophobicContact CZ-SD 4.25Å; F780-P864 HydrophobicContact CD1-CB 4.18Å; F780-P864 HydrophobicContact CE1-CB 3.86Å; F780-P864 HydrophobicContact CE1-CG 4.34Å; F780-F865 HydrophobicContact CE1-CZ 4.42Å; F780-F865 HydrophobicContact CZ-CZ 4.19Å
781	I	91.5	Very high	90.5	Very high	17 Å²	17	33.5 Å²	33.5	9%	0.087	18%	0.183	C	C	.	.	H	α-helix	trans	-60.5	-43.6	176.1	-60.3	-60	0	0	0	110.8	A776 D777 V784 N785 P864 T867 L870 L1020	A776-I781 HydrophobicContact CB-CD1 4.38Å; D777-I781 WeakPolarHBondContact O-CG1 3.42Å; D777-I781 PolarHBondContact O-N 3.48Å; D777-I781 VanDerWaalsContact O-N 3.11Å; I781-V784 PolarHBondContact O-N 2.8Å; I781-N785 WeakPolarHBondContact O-CB 3.39Å; I781-N785 PolarHBondContact O-N 3.11Å; I781-P864 HydrophobicContact CD1-CB 4.28Å; I781-T867 HydrophobicContact CD1-CG2 4.25Å; I781-L870 HydrophobicContact CB-CD1 4.36Å; I781-L870 HydrophobicContact CD1-CD1 3.77Å; I781-L870 HydrophobicContact CG2-CD1 3.79Å; I781-L870 HydrophobicContact CG2-CD2 4.45Å; I781-L870 HydrophobicContact CG2-CG 4.06Å; I781-L1020 HydrophobicContact CG2-CD1 4.15Å; I781-L1020 HydrophobicContact CG2-CD2 3.78Å
782	R	90.8	Very high	90.6	Very high	55 Å²	55	31 Å²	31	21%	0.208	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-40.4	174.4	-173.3	179.9	172.2	-150.1	-6.8	112.4	S731 D732 A778 N779 F780 N785 M786	S731-R782 PolarHBondContact O-NH2 3.33Å; S731-R782 VanDerWaalsContact O-NH2 3.09Å; D732-R782 IonicContact OD1-CZ 3.02Å; D732-R782 IonicContact OD1-NH1 3.93Å; D732-R782 PolarHBondContact OD1-NH1 3.31Å; D732-R782 IonicContact OD1-NH2 3.77Å; A778-R782 WeakPolarHBondContact O-CB 3.47Å; A778-R782 PolarHBondContact O-N 3.45Å; N779-R782 PolarHBondContact O-N 3.18Å; F780-R782 VanDerWaalsContact C-N 3.33Å; F780-R782 PolarHBondContact O-N 3.29Å; R782-N785 WeakPolarHBondContact O-CB 3.43Å; R782-N785 PolarHBondContact O-N 2.96Å; R782-M786 WeakPolarHBondContact O-CG 3.35Å; R782-M786 PolarHBondContact O-N 3.17Å
783	F	93.1	Very high	90.7	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63	-48.5	176.4	164.3	-110.2	0	0	0	112.3	V727 Y730 S731 F756 N779 F780 N785 M786 L787 M857	V727-F783 HydrophobicContact CG1-CB 3.59Å; V727-F783 HydrophobicContact CG1-CD1 4.19Å; V727-F783 HydrophobicContact CG1-CG 3.9Å; V727-F783 HydrophobicContact CG2-CD1 4.36Å; Y730-F783 AromaticContact CD1-CD2 3.52Å; Y730-F783 HydrophobicContact CD1-CD2 3.52Å; Y730-F783 AromaticContact CD1-CE2 3.73Å; Y730-F783 HydrophobicContact CD1-CE2 3.73Å; Y730-F783 HydrophobicContact CD2-CD2 4.21Å; Y730-F783 AromaticContact CD2-CE2 3.67Å; Y730-F783 HydrophobicContact CD2-CE2 3.67Å; Y730-F783 HydrophobicContact CE1-CD2 4.19Å; Y730-F783 HydrophobicContact CE1-CE2 4.13Å; Y730-F783 HydrophobicContact CE2-CE2 4.03Å; Y730-F783 AromaticContact CG-CD2 3.56Å; Y730-F783 HydrophobicContact CG-CD2 3.56Å; Y730-F783 AromaticContact CG-CE2 3.51Å; Y730-F783 HydrophobicContact CG-CE2 3.51Å; S731-F783 WeakPolarHBondContact OG-CA 3.46Å; S731-F783 PolarHBondContact OG-N 2.92Å; F756-F783 HydrophobicContact CE2-CE2 4.26Å; F756-F783 AromaticContact CE2-CZ 3.87Å; F756-F783 HydrophobicContact CE2-CZ 3.87Å; N779-F783 WeakPolarHBondContact O-CB 3.48Å; N779-F783 PolarHBondContact O-N 3.03Å; F780-F783 HydrophobicContact CD2-CD1 4.25Å; F780-F783 HydrophobicContact CE2-CD1 4.24Å; F780-F783 WeakPolarHBondContact O-CB 3.5Å; F780-F783 PolarHBondContact O-N 2.89Å; F783-N785 VanDerWaalsContact C-N 3.25Å; F783-N785 PolarHBondContact O-N 3.4Å; F783-M786 WeakPolarHBondContact O-CB 3.37Å; F783-M786 PolarHBondContact O-N 3.05Å; F783-L787 HydrophobicContact CD1-CD1 4.16Å; F783-L787 HydrophobicContact CD2-CG 4.38Å; F783-L787 HydrophobicContact CE1-CD1 3.55Å; F783-L787 HydrophobicContact CE1-CG 4.33Å; F783-L787 HydrophobicContact CE2-CD1 4.04Å; F783-L787 HydrophobicContact CE2-CD2 3.99Å; F783-L787 HydrophobicContact CE2-CG 3.96Å; F783-L787 HydrophobicContact CZ-CD1 3.5Å; F783-L787 VanDerWaalsContact CZ-CD1 3.5Å; F783-L787 HydrophobicContact CZ-CD2 4.05Å; F783-L787 HydrophobicContact CZ-CG 3.94Å; F783-L787 PolarHBondContact O-N 3.24Å; F783-M857 HydrophobicContact CE1-CE 4.17Å; F783-M857 HydrophobicContact CE1-SD 4.07Å
784	V	92.9	Very high	91	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.3	-41	175.8	174.4	0	0	0	0	110.6	F780 I781 M786 L787 I788 F854 F865 L870	F780-V784 HydrophobicContact CD1-CG2 4.02Å; F780-V784 HydrophobicContact CE1-CG2 3.6Å; F780-V784 HydrophobicContact CE2-CG2 4.47Å; F780-V784 HydrophobicContact CZ-CG2 3.86Å; F780-V784 WeakPolarHBondContact O-CG2 3.46Å; F780-V784 PolarHBondContact O-N 3.05Å; I781-V784 PolarHBondContact O-N 2.8Å; V784-M786 VanDerWaalsContact C-N 3.35Å; V784-M786 PolarHBondContact O-N 3.16Å; V784-L787 PolarHBondContact O-N 3.07Å; V784-I788 HydrophobicContact CG1-CD1 4.3Å; V784-I788 WeakPolarHBondContact O-CG1 3.5Å; V784-I788 PolarHBondContact O-N 3.45Å; V784-F854 HydrophobicContact CG1-CE1 4.14Å; V784-F865 HydrophobicContact CG1-CD1 3.84Å; V784-F865 HydrophobicContact CG1-CE1 3.88Å; V784-F865 HydrophobicContact CG2-CD1 4.44Å; V784-F865 HydrophobicContact CG2-CE1 3.84Å; V784-F865 HydrophobicContact CG2-CZ 4.39Å; V784-L870 HydrophobicContact CB-CD1 3.92Å; V784-L870 HydrophobicContact CG1-CD1 3.78Å; V784-L870 HydrophobicContact CG1-CD2 4.23Å
785	N	91.9	Very high	91.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-56.8	-46.4	173	173.6	44.9	0	0	0	112.6	I781 R782 F783 L787 I788 N789 L870 R873 L1020 N1021	I781-N785 WeakPolarHBondContact O-CB 3.39Å; I781-N785 PolarHBondContact O-N 3.11Å; R782-N785 WeakPolarHBondContact O-CB 3.43Å; R782-N785 PolarHBondContact O-N 2.96Å; F783-N785 VanDerWaalsContact C-N 3.25Å; F783-N785 PolarHBondContact O-N 3.4Å; N785-L787 PolarHBondContact O-N 3.42Å; N785-I788 PolarHBondContact O-N 2.84Å; N785-N789 PolarHBondContact O-N 3.48Å; N785-N789 VanDerWaalsContact O-N 3.1Å; N785-L870 HydrophobicContact CB-CD2 3.91Å; N785-R873 PolarHBondContact OD1-NH1 3.36Å; N785-R873 PolarHBondContact OD1-NH2 2.89Å; N785-L1020 HydrophobicContact CB-CB 4.18Å; N785-L1020 HydrophobicContact CB-CD1 4.14Å; N785-L1020 VanDerWaalsContact ND2-C 3.26Å; N785-L1020 VanDerWaalsContact ND2-CB 3.28Å; N785-L1020 WeakPolarHBondContact ND2-CB 3.36Å; N785-L1020 PolarHBondContact ND2-O 3.28Å; N785-N1021 PolarHBondContact ND2-OD1 3.1Å
786	M	91.9	Very high	91.6	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.015	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-40.3	177	-66.8	-61.8	101.7	0	0	112.1	Y730 E734 R782 F783 V784 I788 N789 D790 N1021	Y730-M786 HydrophobicContact CD1-CB 4.07Å; Y730-M786 HydrophobicContact CE1-CB 3.88Å; E734-M786 HydrophobicContact CB-SD 4.18Å; E734-M786 HydrophobicContact CG-SD 4Å; R782-M786 WeakPolarHBondContact O-CG 3.35Å; R782-M786 PolarHBondContact O-N 3.17Å; F783-M786 WeakPolarHBondContact O-CB 3.37Å; F783-M786 PolarHBondContact O-N 3.05Å; V784-M786 VanDerWaalsContact C-N 3.35Å; V784-M786 PolarHBondContact O-N 3.16Å; M786-I788 VanDerWaalsContact C-N 3.3Å; M786-I788 PolarHBondContact O-N 3.07Å; M786-N789 WeakPolarHBondContact CE-ND2 3.25Å; M786-N789 WeakPolarHBondContact O-CB 3.25Å; M786-N789 PolarHBondContact O-N 2.92Å; M786-D790 VanDerWaalsContact O-CG 3.24Å; M786-D790 PolarHBondContact O-N 2.97Å; M786-N1021 WeakPolarHBondContact CE-OD1 3.49Å
787	L	93.1	Very high	91.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.6	-37.8	174.6	-67.1	173.9	0	0	0	112.7	Y730 F783 V784 N785 T791 T850 F854 M857	Y730-L787 HydrophobicContact CE1-CD2 4.02Å; Y730-L787 HydrophobicContact CE1-CG 4.43Å; Y730-L787 HydrophobicContact CE2-CD2 4.12Å; Y730-L787 WeakPolarHBondContact OH-CD2 3.31Å; F783-L787 HydrophobicContact CD1-CD1 4.16Å; F783-L787 HydrophobicContact CD2-CG 4.38Å; F783-L787 HydrophobicContact CE1-CD1 3.55Å; F783-L787 HydrophobicContact CE1-CG 4.33Å; F783-L787 HydrophobicContact CE2-CD1 4.04Å; F783-L787 HydrophobicContact CE2-CD2 3.99Å; F783-L787 HydrophobicContact CE2-CG 3.96Å; F783-L787 HydrophobicContact CZ-CD1 3.5Å; F783-L787 VanDerWaalsContact CZ-CD1 3.5Å; F783-L787 HydrophobicContact CZ-CD2 4.05Å; F783-L787 HydrophobicContact CZ-CG 3.94Å; F783-L787 PolarHBondContact O-N 3.24Å; V784-L787 PolarHBondContact O-N 3.07Å; N785-L787 PolarHBondContact O-N 3.42Å; L787-T791 WeakPolarHBondContact O-CB 3.47Å; L787-T791 PolarHBondContact O-N 3.17Å; L787-T791 PolarHBondContact O-OG1 3.43Å; L787-T850 HydrophobicContact CB-CG2 4.09Å; L787-T850 HydrophobicContact CD2-CG2 3.75Å; L787-F854 HydrophobicContact CB-CE1 4.35Å; L787-F854 HydrophobicContact CB-CE2 3.65Å; L787-F854 HydrophobicContact CB-CZ 3.43Å; L787-F854 VanDerWaalsContact CB-CZ 3.43Å; L787-F854 HydrophobicContact CD1-CE1 4.48Å; L787-F854 HydrophobicContact CD1-CZ 4.26Å; L787-M857 HydrophobicContact CD1-CE 3.69Å
788	I	92.8	Very high	92.1	Very high	4 Å²	4	21.9 Å²	21.9	2%	0.021	12%	0.118	C	C	.	.	H	α-helix	trans	-64.7	-45.2	176	-65.5	168.4	0	0	0	110.2	V784 N785 M786 T791 T792 F854 L870 R873 L874 M877	V784-I788 HydrophobicContact CG1-CD1 4.3Å; V784-I788 WeakPolarHBondContact O-CG1 3.5Å; V784-I788 PolarHBondContact O-N 3.45Å; N785-I788 PolarHBondContact O-N 2.84Å; M786-I788 VanDerWaalsContact C-N 3.3Å; M786-I788 PolarHBondContact O-N 3.07Å; I788-T791 PolarHBondContact O-N 2.98Å; I788-T792 WeakPolarHBondContact O-CB 3.33Å; I788-T792 PolarHBondContact O-N 3.31Å; I788-T792 PolarHBondContact O-OG1 2.82Å; I788-F854 HydrophobicContact CG1-CE1 4.39Å; I788-F854 HydrophobicContact CG1-CZ 3.8Å; I788-L870 HydrophobicContact CD1-CD2 4.19Å; I788-R873 HydrophobicContact CD1-CB 4.22Å; I788-R873 HydrophobicContact CG2-CB 4.41Å; I788-L874 HydrophobicContact CD1-CB 4.03Å; I788-L874 HydrophobicContact CD1-CD1 4.46Å; I788-L874 HydrophobicContact CG1-CD1 4.27Å; I788-M877 HydrophobicContact CG2-CB 3.94Å; I788-M877 HydrophobicContact CG2-CG 4.21Å
789	N	90.6	Very high	92.4	Very high	48 Å²	48	18.3 Å²	18.3	26%	0.257	9%	0.089	S	C	.	.	H	α-helix	trans	-59.9	-47.6	176.9	-70.3	-16.2	0	0	0	111.3	N785 M786 T792 Y793 R873 N1021	N785-N789 PolarHBondContact O-N 3.48Å; N785-N789 VanDerWaalsContact O-N 3.1Å; M786-N789 WeakPolarHBondContact CE-ND2 3.25Å; M786-N789 WeakPolarHBondContact O-CB 3.25Å; M786-N789 PolarHBondContact O-N 2.92Å; N789-T792 PolarHBondContact O-N 2.75Å; N789-Y793 PolarHBondContact O-N 3.33Å; N789-R873 PolarHBondContact OD1-NH2 3.21Å; N789-N1021 PolarHBondContact ND2-OD1 3.45Å
790	D	91.8	Very high	92.5	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.021	10%	0.098	C	C	.	.	H	α-helix	trans	-60.1	-48.6	178.8	-70	-28.3	0	0	0	111.6	Y730 F746 R749 M786 T792 Y793 L794	Y730-D790 WeakPolarHBondContact CE1-OD2 3.29Å; Y730-D790 PolarHBondContact OH-OD2 2.97Å; F746-D790 HydrophobicContact CE1-CB 4.23Å; F746-D790 WeakPolarHBondContact CE1-OD1 3.19Å; R749-D790 VanDerWaalsContact CD-OD2 3.26Å; R749-D790 WeakPolarHBondContact CD-OD2 3.4Å; R749-D790 IonicContact CZ-OD1 2.69Å; R749-D790 IonicContact CZ-OD2 3.82Å; R749-D790 IonicContact NE-OD2 3.59Å; R749-D790 PolarHBondContact NE-OD2 2.67Å; R749-D790 VanDerWaalsContact NH1-CG 3.33Å; R749-D790 IonicContact NH1-OD1 3.74Å; R749-D790 PolarHBondContact NH1-OD1 3.2Å; R749-D790 IonicContact NH1-OD2 3.83Å; R749-D790 PolarHBondContact NH1-OD2 2.93Å; M786-D790 VanDerWaalsContact O-CG 3.24Å; M786-D790 PolarHBondContact O-N 2.97Å; D790-T792 VanDerWaalsContact C-N 3.3Å; D790-T792 PolarHBondContact O-N 2.87Å; D790-Y793 PolarHBondContact O-N 3.39Å; D790-L794 HydrophobicContact CB-CD1 4.27Å; D790-L794 VanDerWaalsContact O-CB 3.24Å; D790-L794 WeakPolarHBondContact O-CB 3.25Å; D790-L794 WeakPolarHBondContact O-CD1 3.41Å; D790-L794 WeakPolarHBondContact O-CG 3.37Å; D790-L794 PolarHBondContact O-N 2.91Å
791	T	93.4	Very high	92.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.1	-42.9	-179.6	-54.3	0	0	0	0	111.3	L787 I788 L795 T850 I851 M877	L787-T791 WeakPolarHBondContact O-CB 3.47Å; L787-T791 PolarHBondContact O-N 3.17Å; L787-T791 PolarHBondContact O-OG1 3.43Å; I788-T791 PolarHBondContact O-N 2.98Å; T791-L795 HydrophobicContact CG2-CD1 3.93Å; T791-L795 HydrophobicContact CG2-CG 4.4Å; T791-L795 WeakPolarHBondContact O-CB 3.41Å; T791-L795 WeakPolarHBondContact O-CG 3.43Å; T791-L795 PolarHBondContact O-N 3.37Å; T791-L795 VanDerWaalsContact O-N 3.09Å; T791-T850 WeakPolarHBondContact OG1-CG2 3.46Å; T791-I851 HydrophobicContact CG2-CD1 4.02Å; T791-I851 HydrophobicContact CG2-CG1 3.84Å; T791-M877 HydrophobicContact CG2-CE 4.12Å; T791-M877 HydrophobicContact CG2-CG 4.41Å; T791-M877 HydrophobicContact CG2-SD 3.55Å; T791-M877 VanDerWaalsContact CG2-SD 3.55Å
792	T	91.2	Very high	92.8	Very high	40 Å²	40	20 Å²	20	25%	0.245	9%	0.094	C	C	.	.	H	α-helix	trans	-61.7	-52.8	179.1	-53.8	0	0	0	0	110.3	I788 N789 D790 D796 M877	I788-T792 WeakPolarHBondContact O-CB 3.33Å; I788-T792 PolarHBondContact O-N 3.31Å; I788-T792 PolarHBondContact O-OG1 2.82Å; N789-T792 PolarHBondContact O-N 2.75Å; D790-T792 VanDerWaalsContact C-N 3.3Å; D790-T792 PolarHBondContact O-N 2.87Å; T792-D796 WeakPolarHBondContact O-CB 3.26Å; T792-D796 PolarHBondContact O-N 2.82Å; T792-D796 VanDerWaalsContact O-N 3.08Å; T792-M877 VanDerWaalsContact OG1-CG 3.27Å; T792-M877 WeakPolarHBondContact OG1-CG 3.43Å
793	Y	91.9	Very high	93	Very high	78 Å²	78	19.3 Å²	19.3	31%	0.306	9%	0.094	S	C	.	.	H	α-helix	trans	-62.3	-50.8	-179.5	173.9	-96.5	0	0	0	112.3	F742 F746 N789 D790 L795 D796 E797	F742-Y793 AromaticContact CE1-CE1 3.72Å; F742-Y793 HydrophobicContact CE1-CE1 3.72Å; F742-Y793 HydrophobicContact CE1-CE2 4.45Å; F742-Y793 AromaticContact CE1-CZ 3.62Å; F742-Y793 WeakPolarHBondContact CE1-OH 3.38Å; F742-Y793 AromaticContact CZ-CD1 3.98Å; F742-Y793 HydrophobicContact CZ-CD1 3.98Å; F742-Y793 HydrophobicContact CZ-CD2 4.27Å; F742-Y793 AromaticContact CZ-CE1 3.36Å; F742-Y793 HydrophobicContact CZ-CE1 3.36Å; F742-Y793 AromaticContact CZ-CE2 3.71Å; F742-Y793 HydrophobicContact CZ-CE2 3.71Å; F742-Y793 HydrophobicContact CZ-CG 4.41Å; F742-Y793 AromaticContact CZ-CZ 3.25Å; F742-Y793 WeakPolarHBondContact CZ-OH 3.24Å; F746-Y793 HydrophobicContact CE2-CD1 4.06Å; F746-Y793 HydrophobicContact CE2-CE1 4.03Å; F746-Y793 AromaticContact CZ-CD1 3.58Å; F746-Y793 HydrophobicContact CZ-CD1 3.58Å; F746-Y793 HydrophobicContact CZ-CE1 4.04Å; N789-Y793 PolarHBondContact O-N 3.33Å; D790-Y793 PolarHBondContact O-N 3.39Å; Y793-L795 VanDerWaalsContact C-N 3.35Å; Y793-L795 PolarHBondContact O-N 3.43Å; Y793-D796 PolarHBondContact O-N 3.24Å; Y793-E797 HydrophobicContact CE1-CB 4.34Å; Y793-E797 WeakPolarHBondContact O-CB 3.48Å; Y793-E797 PolarHBondContact O-N 3.39Å; Y793-E797 PolarHBondContact OH-OE2 3.34Å
794	L	93.2	Very high	93	Very high	3 Å²	3	23.1 Å²	23.1	2%	0.016	11%	0.109	C	C	.	.	H	α-helix	trans	-65	-38.9	-173.7	-68.9	166.3	0	0	0	112	F746 D790 S798 L846 A847	F746-L794 HydrophobicContact CD1-CD1 4.13Å; F746-L794 HydrophobicContact CD1-CD2 4.01Å; F746-L794 HydrophobicContact CD1-CG 4.34Å; F746-L794 HydrophobicContact CE1-CD1 3.91Å; F746-L794 HydrophobicContact CE1-CD2 3.81Å; F746-L794 HydrophobicContact CE1-CG 3.84Å; F746-L794 HydrophobicContact CG-CD2 4.47Å; F746-L794 HydrophobicContact CZ-CD2 4.11Å; F746-L794 HydrophobicContact CZ-CG 4.32Å; D790-L794 HydrophobicContact CB-CD1 4.27Å; D790-L794 VanDerWaalsContact O-CB 3.24Å; D790-L794 WeakPolarHBondContact O-CB 3.25Å; D790-L794 WeakPolarHBondContact O-CD1 3.41Å; D790-L794 WeakPolarHBondContact O-CG 3.37Å; D790-L794 PolarHBondContact O-N 2.91Å; L794-S798 VanDerWaalsContact O-CB 3.28Å; L794-S798 WeakPolarHBondContact O-CB 3.33Å; L794-S798 PolarHBondContact O-N 3.43Å; L794-S798 PolarHBondContact O-OG 3.17Å; L794-L846 HydrophobicContact CD1-CB 3.69Å; L794-L846 HydrophobicContact CD2-CB 4.07Å; L794-L846 HydrophobicContact CD2-CD1 4.02Å; L794-A847 HydrophobicContact CB-CB 3.91Å
795	L	93.8	Very high	93.1	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-71.2	-41.5	176.1	-71.8	-177.2	0	0	0	111.6	T791 Y793 S798 M799 A847 I851 N881 L908	T791-L795 HydrophobicContact CG2-CD1 3.93Å; T791-L795 HydrophobicContact CG2-CG 4.4Å; T791-L795 WeakPolarHBondContact O-CB 3.41Å; T791-L795 WeakPolarHBondContact O-CG 3.43Å; T791-L795 PolarHBondContact O-N 3.37Å; T791-L795 VanDerWaalsContact O-N 3.09Å; Y793-L795 VanDerWaalsContact C-N 3.35Å; Y793-L795 PolarHBondContact O-N 3.43Å; L795-S798 WeakPolarHBondContact O-CB 3.11Å; L795-S798 PolarHBondContact O-N 3.28Å; L795-M799 HydrophobicContact CB-CE 4.39Å; L795-M799 HydrophobicContact CD2-CE 4Å; L795-M799 VanDerWaalsContact O-CG 3.26Å; L795-M799 WeakPolarHBondContact O-CG 3.16Å; L795-M799 PolarHBondContact O-N 3.02Å; L795-A847 HydrophobicContact CD2-CB 3.64Å; L795-A847 HydrophobicContact CG-CB 4.05Å; L795-I851 HydrophobicContact CD1-CD1 3.97Å; L795-N881 VanDerWaalsContact CB-OD1 3.26Å; L795-N881 WeakPolarHBondContact CB-OD1 3.47Å; L795-N881 HydrophobicContact CD1-CB 3.93Å; L795-N881 WeakPolarHBondContact CD1-OD1 3.2Å; L795-L908 HydrophobicContact CD2-CD1 4.42Å; L795-L908 HydrophobicContact CD2-CD2 3.95Å
796	D	92.6	Very high	93.2	Very high	34 Å²	34	25 Å²	25	18%	0.182	12%	0.119	C	C	.	.	H	α-helix	trans	-60	-49.8	175.6	-84.8	-24.7	0	0	0	112.1	T792 Y793 S798 M799 E800 Y880 Q884	T792-D796 WeakPolarHBondContact O-CB 3.26Å; T792-D796 PolarHBondContact O-N 2.82Å; T792-D796 VanDerWaalsContact O-N 3.08Å; Y793-D796 PolarHBondContact O-N 3.24Å; D796-S798 PolarHBondContact O-N 2.88Å; D796-M799 PolarHBondContact O-N 3.3Å; D796-M799 VanDerWaalsContact O-N 3.14Å; D796-E800 WeakPolarHBondContact O-CG 3.48Å; D796-E800 PolarHBondContact O-N 2.92Å; D796-Y880 WeakPolarHBondContact OD1-CE1 3.49Å; D796-Y880 VanDerWaalsContact OD1-CZ 3.22Å; D796-Y880 PolarHBondContact OD1-OH 3.25Å; D796-Y880 WeakPolarHBondContact OD2-CE1 3.23Å; D796-Y880 PolarHBondContact OD2-OH 3.2Å; D796-Q884 PolarHBondContact OD1-NE2 2.83Å
797	E	93	Very high	93.2	Very high	39 Å²	39	27.7 Å²	27.7	18%	0.182	14%	0.138	C	C	.	.	H	α-helix	trans	-57.2	-39.6	176.3	-169.2	68.3	-134	0	0	111	Y793 G801 R804 I839	Y793-E797 HydrophobicContact CE1-CB 4.34Å; Y793-E797 WeakPolarHBondContact O-CB 3.48Å; Y793-E797 PolarHBondContact O-N 3.39Å; Y793-E797 PolarHBondContact OH-OE2 3.34Å; E797-G801 PolarHBondContact O-N 2.82Å; E797-R804 IonicContact OE1-NH2 2.86Å; E797-I839 HydrophobicContact CG-CG2 3.79Å
798	S	94.1	Very high	93.1	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.5	-44.9	176.6	-59.5	0	0	0	0	112.5	L794 L795 D796 L802 S843 L844	L794-S798 VanDerWaalsContact O-CB 3.28Å; L794-S798 WeakPolarHBondContact O-CB 3.33Å; L794-S798 PolarHBondContact O-N 3.43Å; L794-S798 PolarHBondContact O-OG 3.17Å; L795-S798 WeakPolarHBondContact O-CB 3.11Å; L795-S798 PolarHBondContact O-N 3.28Å; D796-S798 PolarHBondContact O-N 2.88Å; S798-L802 WeakPolarHBondContact O-CB 3.46Å; S798-L802 WeakPolarHBondContact O-CG 3.43Å; S798-L802 PolarHBondContact O-N 3.27Å; S798-S843 VanDerWaalsContact OG-CB 3.3Å; S798-S843 WeakPolarHBondContact OG-CB 3.35Å; S798-L844 PolarHBondContact OG-N 2.81Å
799	M	93.3	Very high	93	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-67.2	-44.1	-179.5	-63	-45.2	144	0	0	111.3	L795 D796 L802 L803 Q884 L885 L893 W903 L908	L795-M799 HydrophobicContact CB-CE 4.39Å; L795-M799 HydrophobicContact CD2-CE 4Å; L795-M799 VanDerWaalsContact O-CG 3.26Å; L795-M799 WeakPolarHBondContact O-CG 3.16Å; L795-M799 PolarHBondContact O-N 3.02Å; D796-M799 PolarHBondContact O-N 3.3Å; D796-M799 VanDerWaalsContact O-N 3.14Å; M799-L802 PolarHBondContact O-N 3.38Å; M799-L802 HydrophobicContact SD-CD1 4.43Å; M799-L803 WeakPolarHBondContact O-CG 3.42Å; M799-L803 PolarHBondContact O-N 2.93Å; M799-Q884 VanDerWaalsContact CG-OE1 3.27Å; M799-L885 HydrophobicContact CE-CD2 3.94Å; M799-L885 HydrophobicContact SD-CD2 4.25Å; M799-L893 HydrophobicContact CB-CD2 4.26Å; M799-L893 HydrophobicContact SD-CD1 3.69Å; M799-L893 HydrophobicContact SD-CD2 4.2Å; M799-W903 HydrophobicContact CE-CH2 3.61Å; M799-W903 HydrophobicContact CE-CZ3 3.83Å; M799-W903 HydrophobicContact SD-CH2 3.68Å; M799-W903 HydrophobicContact SD-CZ2 4.39Å; M799-W903 HydrophobicContact SD-CZ3 4.34Å; M799-L908 HydrophobicContact CE-CD2 4.31Å
800	E	93.2	Very high	92.9	Very high	108 Å²	108	29.5 Å²	29.5	51%	0.505	15%	0.153	S	C	.	.	H	α-helix	trans	-63.2	-44.7	176.1	-69.6	-170.4	177.2	0	0	111.8	D796 L802 L803 R804	D796-E800 WeakPolarHBondContact O-CG 3.48Å; D796-E800 PolarHBondContact O-N 2.92Å; E800-L802 PolarHBondContact O-N 3.08Å; E800-L803 WeakPolarHBondContact O-CB 3.4Å; E800-L803 PolarHBondContact O-N 3.47Å; E800-R804 WeakPolarHBondContact O-CG 3.2Å; E800-R804 PolarHBondContact O-N 2.8Å; E800-R804 IonicContact OE2-NH1 3.79Å
801	G	94.7	Very high	92.7	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-42.9	175.4	0	0	0	0	0	112.5	E797 L803 R804 I805	E797-G801 PolarHBondContact O-N 2.82Å; G801-L803 VanDerWaalsContact C-N 3.32Å; G801-L803 PolarHBondContact O-N 3.3Å; G801-R804 PolarHBondContact O-N 2.73Å; G801-I805 VanDerWaalsContact O-CG1 3.3Å; G801-I805 WeakPolarHBondContact O-CG1 3.42Å; G801-I805 PolarHBondContact O-N 3.42Å
802	L	95.6	Very high	92.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-37.3	175.2	-75	169.6	0	0	0	112.5	S798 M799 E800 N806 V840 L893 V895 W903	S798-L802 WeakPolarHBondContact O-CB 3.46Å; S798-L802 WeakPolarHBondContact O-CG 3.43Å; S798-L802 PolarHBondContact O-N 3.27Å; M799-L802 PolarHBondContact O-N 3.38Å; M799-L802 HydrophobicContact SD-CD1 4.43Å; E800-L802 PolarHBondContact O-N 3.08Å; L802-N806 VanDerWaalsContact O-CB 3.32Å; L802-N806 WeakPolarHBondContact O-CB 3.15Å; L802-N806 PolarHBondContact O-N 3.37Å; L802-V840 HydrophobicContact CD2-CG1 3.81Å; L802-V840 HydrophobicContact CG-CG1 3.87Å; L802-L893 HydrophobicContact CB-CD2 4.09Å; L802-V895 HydrophobicContact CD2-CG1 3.68Å; L802-V895 HydrophobicContact CD2-CG2 4.25Å; L802-W903 HydrophobicContact CD1-CD2 3.74Å; L802-W903 HydrophobicContact CD1-CE3 3.92Å; L802-W903 HydrophobicContact CD1-CG 4.29Å; L802-W903 HydrophobicContact CD1-CH2 4.02Å; L802-W903 HydrophobicContact CD1-CZ2 3.85Å; L802-W903 HydrophobicContact CD1-CZ3 4.06Å
803	L	94.3	Very high	92	Very high	42 Å²	42	39.6 Å²	39.6	22%	0.22	20%	0.201	C	C	.	.	H	α-helix	trans	-65.5	-40.3	174.7	-70.1	172.8	0	0	0	111.9	M799 E800 G801 S807 T889 R892 L893	M799-L803 WeakPolarHBondContact O-CG 3.42Å; M799-L803 PolarHBondContact O-N 2.93Å; E800-L803 WeakPolarHBondContact O-CB 3.4Å; E800-L803 PolarHBondContact O-N 3.47Å; G801-L803 VanDerWaalsContact C-N 3.32Å; G801-L803 PolarHBondContact O-N 3.3Å; L803-S807 WeakPolarHBondContact O-CB 3.3Å; L803-S807 PolarHBondContact O-N 2.95Å; L803-S807 VanDerWaalsContact O-N 3.08Å; L803-T889 HydrophobicContact CD1-CG2 4.38Å; L803-T889 HydrophobicContact CD2-CG2 4.18Å; L803-R892 HydrophobicContact CD2-CB 3.46Å; L803-R892 VanDerWaalsContact CD2-CB 3.46Å; L803-L893 HydrophobicContact CD2-CD2 3.93Å; L803-L893 HydrophobicContact CG-CD2 3.88Å
804	R	93.9	Very high	91.8	Very high	79 Å²	79	38.8 Å²	38.8	30%	0.298	20%	0.202	S	C	.	.	H	α-helix	trans	-64.9	-47.7	175.2	-69.1	-170.3	-63.7	-94.7	6.2	111	E797 E800 G801 N806 S807 V808 D836	E797-R804 IonicContact OE1-NH2 2.86Å; E800-R804 WeakPolarHBondContact O-CG 3.2Å; E800-R804 PolarHBondContact O-N 2.8Å; E800-R804 IonicContact OE2-NH1 3.79Å; G801-R804 PolarHBondContact O-N 2.73Å; R804-N806 PolarHBondContact O-N 3.43Å; R804-S807 WeakPolarHBondContact O-CB 3.28Å; R804-S807 PolarHBondContact O-N 3.17Å; R804-V808 WeakPolarHBondContact O-CG2 3.46Å; R804-V808 PolarHBondContact O-N 2.96Å; R804-D836 IonicContact CZ-OD1 2.97Å; R804-D836 IonicContact NE-OD1 2.92Å; R804-D836 PolarHBondContact NE-OD1 2.82Å; R804-D836 IonicContact NE-OD2 2.67Å; R804-D836 IonicContact NH2-OD1 3.53Å; R804-D836 PolarHBondContact NH2-OD1 2.65Å
805	I	94.7	Very high	91	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-57	-51.8	176	-67.9	167.9	0	0	0	110.2	G801 S807 V808 E809 D836 E837 V840 V895 Y901	G801-I805 VanDerWaalsContact O-CG1 3.3Å; G801-I805 WeakPolarHBondContact O-CG1 3.42Å; G801-I805 PolarHBondContact O-N 3.42Å; I805-S807 VanDerWaalsContact C-N 3.27Å; I805-S807 PolarHBondContact O-N 3.37Å; I805-V808 PolarHBondContact O-N 2.98Å; I805-V808 VanDerWaalsContact O-N 3.17Å; I805-E809 HydrophobicContact CG2-CG 3.93Å; I805-E809 WeakPolarHBondContact O-CB 3.25Å; I805-E809 WeakPolarHBondContact O-CG 3.48Å; I805-E809 PolarHBondContact O-N 2.91Å; I805-D836 HydrophobicContact CD1-CB 4.18Å; I805-D836 HydrophobicContact CG1-CB 3.78Å; I805-E837 HydrophobicContact CD1-CG 4.3Å; I805-V840 HydrophobicContact CD1-CB 4.18Å; I805-V840 HydrophobicContact CD1-CG2 3.86Å; I805-V895 HydrophobicContact CB-CG1 4.3Å; I805-V895 HydrophobicContact CG2-CB 4.45Å; I805-V895 HydrophobicContact CG2-CG1 3.78Å; I805-Y901 HydrophobicContact CD1-CD1 4.48Å; I805-Y901 HydrophobicContact CD1-CE1 4.06Å
806	N	93.5	Very high	90.5	Very high	39 Å²	39	48.9 Å²	48.9	21%	0.209	26%	0.259	C	S	.	.	H	α-helix	trans	-55.4	-42.3	178.4	173.1	-90.6	0	0	0	112.4	L802 R804 S810 R892 R894	L802-N806 VanDerWaalsContact O-CB 3.32Å; L802-N806 WeakPolarHBondContact O-CB 3.15Å; L802-N806 PolarHBondContact O-N 3.37Å; R804-N806 PolarHBondContact O-N 3.43Å; N806-S810 VanDerWaalsContact O-CB 3.28Å; N806-S810 WeakPolarHBondContact O-CB 3.22Å; N806-S810 PolarHBondContact O-N 3.39Å; N806-S810 PolarHBondContact O-OG 3.24Å; N806-R892 WeakPolarHBondContact CB-O 3.39Å; N806-R892 VanDerWaalsContact CG-O 3.31Å; N806-R894 PolarHBondContact ND2-O 3.18Å
807	S	91.9	Very high	90	Very high	60 Å²	60	56 Å²	56	42%	0.42	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-47.2	178.2	-178.2	0	0	0	0	111.9	L803 R804 I805 S810 Q811	L803-S807 WeakPolarHBondContact O-CB 3.3Å; L803-S807 PolarHBondContact O-N 2.95Å; L803-S807 VanDerWaalsContact O-N 3.08Å; R804-S807 WeakPolarHBondContact O-CB 3.28Å; R804-S807 PolarHBondContact O-N 3.17Å; I805-S807 VanDerWaalsContact C-N 3.27Å; I805-S807 PolarHBondContact O-N 3.37Å; S807-S810 PolarHBondContact O-N 3.23Å; S807-Q811 WeakPolarHBondContact O-CG 3.34Å; S807-Q811 PolarHBondContact O-N 3.19Å; S807-Q811 VanDerWaalsContact O-N 3.14Å
808	V	90.7	Very high	89.5	Confident	9 Å²	9	55.4 Å²	55.4	6%	0.055	28%	0.279	C	S	.	.	H	α-helix	trans	-69.7	-44.1	179.3	-180	0	0	0	0	110.9	R804 I805 S810 Q811 M812 L829 H833	R804-V808 WeakPolarHBondContact O-CG2 3.46Å; R804-V808 PolarHBondContact O-N 2.96Å; I805-V808 PolarHBondContact O-N 2.98Å; I805-V808 VanDerWaalsContact O-N 3.17Å; V808-S810 PolarHBondContact O-N 3.33Å; V808-Q811 WeakPolarHBondContact O-CB 3.24Å; V808-Q811 PolarHBondContact O-N 2.9Å; V808-Q811 VanDerWaalsContact O-N 3.1Å; V808-M812 HydrophobicContact CG1-CG 4.2Å; V808-M812 HydrophobicContact CG1-SD 3.92Å; V808-M812 VanDerWaalsContact O-CG 3.31Å; V808-M812 WeakPolarHBondContact O-CG 3.15Å; V808-M812 PolarHBondContact O-N 3.11Å; V808-L829 HydrophobicContact CG1-CB 4.32Å; V808-L829 HydrophobicContact CG2-CD2 4.27Å; V808-H833 HydrophobicContact CG1-CB 4.06Å
809	E	91.1	Very high	88.7	Confident	17 Å²	17	59.6 Å²	59.6	8%	0.079	30%	0.295	C	S	.	.	H	α-helix	trans	-58.7	-35.9	176.2	-75.8	-170.9	143.2	0	0	112.3	I805 N813 V895 K896	I805-E809 HydrophobicContact CG2-CG 3.93Å; I805-E809 WeakPolarHBondContact O-CB 3.25Å; I805-E809 WeakPolarHBondContact O-CG 3.48Å; I805-E809 PolarHBondContact O-N 2.91Å; E809-N813 WeakPolarHBondContact O-CB 3.39Å; E809-N813 PolarHBondContact O-N 3.33Å; E809-V895 WeakPolarHBondContact OE2-CA 3.47Å; E809-K896 HydrophobicContact CB-CD 4.21Å; E809-K896 HydrophobicContact CB-CG 4.49Å; E809-K896 HydrophobicContact CG-CD 4.36Å; E809-K896 PolarHBondContact O-NZ 3.01Å; E809-K896 WeakPolarHBondContact OE1-CB 3.46Å; E809-K896 PolarHBondContact OE1-N 3.39Å; E809-K896 PolarHBondContact OE2-N 3.24Å
810	S	89.6	Confident	88.2	Confident	65 Å²	65	66.1 Å²	66.1	46%	0.455	33%	0.33	S	S	.	.	H	α-helix	trans	-68.4	-41.5	175.9	-62.8	0	0	0	0	111.7	N806 S807 V808 N813 D814	N806-S810 VanDerWaalsContact O-CB 3.28Å; N806-S810 WeakPolarHBondContact O-CB 3.22Å; N806-S810 PolarHBondContact O-N 3.39Å; N806-S810 PolarHBondContact O-OG 3.24Å; S807-S810 PolarHBondContact O-N 3.23Å; V808-S810 PolarHBondContact O-N 3.33Å; S810-N813 WeakPolarHBondContact O-CB 3.46Å; S810-N813 PolarHBondContact O-N 2.66Å; S810-D814 PolarHBondContact O-N 2.79Å
811	Q	87.7	Confident	87.8	Confident	76 Å²	76	63.5 Å²	63.5	36%	0.355	32%	0.319	S	S	.	.	H	α-helix	trans	-65.8	-42.1	174.1	-71	178.4	67.7	0	0	111.9	S807 V808 N813 D814 W818	S807-Q811 WeakPolarHBondContact O-CG 3.34Å; S807-Q811 PolarHBondContact O-N 3.19Å; S807-Q811 VanDerWaalsContact O-N 3.14Å; V808-Q811 WeakPolarHBondContact O-CB 3.24Å; V808-Q811 PolarHBondContact O-N 2.9Å; V808-Q811 VanDerWaalsContact O-N 3.1Å; Q811-N813 PolarHBondContact O-N 2.89Å; Q811-D814 PolarHBondContact O-N 3.07Å; Q811-W818 HydrophobicContact CB-CE3 4.45Å
812	M	84.5	Confident	87.3	Confident	69 Å²	69	70.7 Å²	70.7	34%	0.34	35%	0.353	S	S	.	.	H	α-helix	trans	-65.1	-28	175.1	-67.8	176.3	78.9	0	0	112.3	V808 D814 W818	V808-M812 HydrophobicContact CG1-CG 4.2Å; V808-M812 HydrophobicContact CG1-SD 3.92Å; V808-M812 VanDerWaalsContact O-CG 3.31Å; V808-M812 WeakPolarHBondContact O-CG 3.15Å; V808-M812 PolarHBondContact O-N 3.11Å; M812-D814 VanDerWaalsContact C-N 3.34Å; M812-W818 HydrophobicContact CB-CE3 4.48Å; M812-W818 HydrophobicContact CE-CZ2 4.42Å; M812-W818 HydrophobicContact CG-CD2 4.12Å; M812-W818 HydrophobicContact CG-CE3 3.86Å; M812-W818 HydrophobicContact CG-CH2 3.65Å; M812-W818 HydrophobicContact CG-CZ2 3.91Å; M812-W818 HydrophobicContact CG-CZ3 3.62Å; M812-W818 HydrophobicContact SD-CH2 4.42Å
813	N	85.5	Confident	86.5	Confident	111 Å²	111	75.4 Å²	75.4	59%	0.594	38%	0.376	S	S	*	.	H	α-helix	trans	-73.4	-25.5	176.7	-151.9	64.6	0	0	0	113.1	E809 S810 Q811 E815 K896	E809-N813 WeakPolarHBondContact O-CB 3.39Å; E809-N813 PolarHBondContact O-N 3.33Å; S810-N813 WeakPolarHBondContact O-CB 3.46Å; S810-N813 PolarHBondContact O-N 2.66Å; Q811-N813 PolarHBondContact O-N 2.89Å; N813-E815 PolarHBondContact O-N 3.02Å; N813-K896 WeakPolarHBondContact OD1-CE 3.45Å; N813-K896 PolarHBondContact OD1-NZ 2.82Å
814	D	86.9	Confident	85.9	Confident	60 Å²	60	80.9 Å²	80.9	32%	0.321	40%	0.401	S	S	.	.			trans	-85	80.6	171.9	-172.5	-21.6	0	0	0	109	S810 Q811 M812 S816 R817 W818	S810-D814 PolarHBondContact O-N 2.79Å; Q811-D814 PolarHBondContact O-N 3.07Å; M812-D814 VanDerWaalsContact C-N 3.34Å; D814-S816 PolarHBondContact O-N 3Å; D814-S816 VanDerWaalsContact O-N 3.12Å; D814-S816 PolarHBondContact OD1-N 3.05Å; D814-R817 HydrophobicContact CB-CB 4.23Å; D814-R817 PolarHBondContact O-N 3.5Å; D814-R817 VanDerWaalsContact O-N 3.14Å; D814-R817 PolarHBondContact OD1-N 3.36Å; D814-R817 VanDerWaalsContact OD1-N 3.08Å; D814-R817 WeakPolarHBondContact OD2-CD 3.31Å; D814-R817 VanDerWaalsContact OD2-CG 3.28Å; D814-R817 WeakPolarHBondContact OD2-CG 3.47Å; D814-R817 IonicContact OD2-NE 3.53Å; D814-W818 WeakPolarHBondContact O-CB 3.48Å; D814-W818 PolarHBondContact O-N 2.89Å
815	E	77.5	Confident	85.7	Confident	129 Å²	129	79.7 Å²	79.7	60%	0.603	40%	0.399	S	S	*	.	H	α-helix	trans	-52	-38.3	-176.5	-66.8	-174	179	0	0	112.4	N813 W818 W819	N813-E815 PolarHBondContact O-N 3.02Å; E815-W818 PolarHBondContact O-N 3.41Å; E815-W819 PolarHBondContact O-N 3.39Å
816	S	82.4	Confident	85.1	Confident	87 Å²	87	81.4 Å²	81.4	61%	0.608	41%	0.405	S	S	*	.	H	α-helix	trans	-66.2	-47.9	-177.9	-63	0	0	0	0	111.1	D814 N820	D814-S816 PolarHBondContact O-N 3Å; D814-S816 VanDerWaalsContact O-N 3.12Å; D814-S816 PolarHBondContact OD1-N 3.05Å; S816-N820 PolarHBondContact O-N 3.28Å; S816-N820 PolarHBondContact O-ND2 2.87Å
817	R	82.7	Confident	84.6	Confident	184 Å²	184	85.1 Å²	85.1	69%	0.694	42%	0.421	S	S	*	.	H	α-helix	trans	-68.9	-40.3	175.9	-72.9	-171.2	-178.8	173.2	-2.3	112.2	D814 W819 N820 L821	D814-R817 HydrophobicContact CB-CB 4.23Å; D814-R817 PolarHBondContact O-N 3.5Å; D814-R817 VanDerWaalsContact O-N 3.14Å; D814-R817 PolarHBondContact OD1-N 3.36Å; D814-R817 VanDerWaalsContact OD1-N 3.08Å; D814-R817 WeakPolarHBondContact OD2-CD 3.31Å; D814-R817 VanDerWaalsContact OD2-CG 3.28Å; D814-R817 WeakPolarHBondContact OD2-CG 3.47Å; D814-R817 IonicContact OD2-NE 3.53Å; R817-W819 VanDerWaalsContact C-N 3.35Å; R817-W819 PolarHBondContact O-N 3.37Å; R817-N820 WeakPolarHBondContact O-CB 3.35Å; R817-N820 PolarHBondContact O-N 3.34Å; R817-N820 VanDerWaalsContact O-N 3.1Å; R817-L821 PolarHBondContact O-N 3.49Å
818	W	80.7	Confident	84.5	Confident	26 Å²	26	89.8 Å²	89.8	10%	0.098	43%	0.43	C	S	.	.	H	α-helix	trans	-58.2	-46.6	180	-175.3	-107.6	0	0	0	111.7	Q811 M812 D814 E815 N820 L821 R826 L829	Q811-W818 HydrophobicContact CB-CE3 4.45Å; M812-W818 HydrophobicContact CB-CE3 4.48Å; M812-W818 HydrophobicContact CE-CZ2 4.42Å; M812-W818 HydrophobicContact CG-CD2 4.12Å; M812-W818 HydrophobicContact CG-CE3 3.86Å; M812-W818 HydrophobicContact CG-CH2 3.65Å; M812-W818 HydrophobicContact CG-CZ2 3.91Å; M812-W818 HydrophobicContact CG-CZ3 3.62Å; M812-W818 HydrophobicContact SD-CH2 4.42Å; D814-W818 WeakPolarHBondContact O-CB 3.48Å; D814-W818 PolarHBondContact O-N 2.89Å; E815-W818 PolarHBondContact O-N 3.41Å; W818-N820 VanDerWaalsContact C-N 3.26Å; W818-N820 PolarHBondContact O-N 3.33Å; W818-L821 HydrophobicContact CE3-CD1 3.81Å; W818-L821 HydrophobicContact CZ3-CD1 4.11Å; W818-L821 WeakPolarHBondContact O-CB 3.33Å; W818-L821 PolarHBondContact O-N 3.16Å; W818-R826 HydrophobicContact CD2-CG 4.33Å; W818-R826 HydrophobicContact CH2-CB 4.48Å; W818-R826 HydrophobicContact CH2-CG 4.45Å; W818-R826 HydrophobicContact CZ2-CB 4.14Å; W818-R826 HydrophobicContact CZ2-CG 4.09Å; W818-R826 VanDerWaalsContact O-CD 3.3Å; W818-R826 WeakPolarHBondContact O-CD 3.46Å; W818-R826 PolarHBondContact O-NH1 2.99Å; W818-L829 HydrophobicContact CH2-CB 3.89Å; W818-L829 HydrophobicContact CH2-CD1 4.27Å; W818-L829 HydrophobicContact CZ3-CB 4.15Å; W818-L829 HydrophobicContact CZ3-CD1 3.73Å
819	W	77.8	Confident	84.5	Confident	88 Å²	88	90.3 Å²	90.3	33%	0.333	43%	0.432	S	S	.	.	H	α-helix	trans	-71.1	-20.5	178.4	-72.2	113.5	0	0	0	114	Y560 E815 R817 R826	Y560-W819 HydrophobicContact CD2-CH2 4.4Å; Y560-W819 HydrophobicContact CD2-CZ3 4.44Å; Y560-W819 HydrophobicContact CE2-CD2 4.36Å; Y560-W819 HydrophobicContact CE2-CE3 4.03Å; Y560-W819 AromaticContact CE2-CH2 3.67Å; Y560-W819 HydrophobicContact CE2-CH2 3.67Å; Y560-W819 HydrophobicContact CE2-CZ2 4.01Å; Y560-W819 AromaticContact CE2-CZ3 3.67Å; Y560-W819 HydrophobicContact CE2-CZ3 3.67Å; Y560-W819 AromaticContact CZ-CE3 3.85Å; Y560-W819 AromaticContact CZ-CZ3 3.96Å; Y560-W819 VanDerWaalsContact OH-CD2 3.31Å; E815-W819 PolarHBondContact O-N 3.39Å; R817-W819 VanDerWaalsContact C-N 3.35Å; R817-W819 PolarHBondContact O-N 3.37Å; W819-R826 VanDerWaalsContact C-NH1 3.3Å; W819-R826 VanDerWaalsContact CA-NH1 3.29Å; W819-R826 PolarHBondContact O-NH1 2.84Å
820	N	83.1	Confident	84.2	Confident	139 Å²	139	92.4 Å²	92.4	74%	0.743	45%	0.446	S	S	*	.	H	α-helix	trans	-80.9	-15.9	173.7	-71	-23	0	0	0	114.1	S816 R817 W818	S816-N820 PolarHBondContact O-N 3.28Å; S816-N820 PolarHBondContact O-ND2 2.87Å; R817-N820 WeakPolarHBondContact O-CB 3.35Å; R817-N820 PolarHBondContact O-N 3.34Å; R817-N820 VanDerWaalsContact O-N 3.1Å; W818-N820 VanDerWaalsContact C-N 3.26Å; W818-N820 PolarHBondContact O-N 3.33Å
821	L	85	Confident	84	Confident	54 Å²	54	93.8 Å²	93.8	28%	0.283	45%	0.451	S	S	.	.	S	Bend	trans	-65.7	147.5	173.1	-67.4	174.5	0	0	0	110.7	R817 W818 E825 R826 L829	R817-L821 PolarHBondContact O-N 3.49Å; W818-L821 HydrophobicContact CE3-CD1 3.81Å; W818-L821 HydrophobicContact CZ3-CD1 4.11Å; W818-L821 WeakPolarHBondContact O-CB 3.33Å; W818-L821 PolarHBondContact O-N 3.16Å; L821-E825 HydrophobicContact CD2-CG 4.44Å; L821-R826 HydrophobicContact CB-CG 3.76Å; L821-R826 HydrophobicContact CD1-CG 4.36Å; L821-R826 PolarHBondContact O-NH1 3.37Å; L821-L829 HydrophobicContact CD1-CD1 4.02Å
822	E	84.6	Confident	84.2	Confident	150 Å²	150	94 Å²	94	70%	0.701	45%	0.452	S	S	*	.			trans	-58.3	150.4	171.8	-67.4	-171.5	167.1	0	0	111.1	E824 E825 R826	E822-E824 VanDerWaalsContact C-N 3.3Å; E822-E824 PolarHBondContact O-N 2.89Å; E822-E825 HydrophobicContact CB-CB 4.46Å; E822-E825 PolarHBondContact O-N 3.02Å; E822-R826 PolarHBondContact O-N 3.27Å
823	M	78.4	Confident	84.4	Confident	100 Å²	100	91.6 Å²	91.6	49%	0.493	44%	0.44	S	S	.	.	H	α-helix	trans	-59.7	-41.1	-176	-176.6	63.1	-167.2	0	0	112.3	Q827	M823-Q827 WeakPolarHBondContact O-CB 3.49Å; M823-Q827 PolarHBondContact O-N 2.99Å; M823-Q827 VanDerWaalsContact O-N 3.1Å
824	E	82.1	Confident	84.5	Confident	157 Å²	157	88.5 Å²	88.5	73%	0.734	43%	0.43	S	S	*	.	H	α-helix	trans	-64.5	-43.1	178.3	-67.1	-175.3	178.2	0	0	111.8	E822 Q827 R828	E822-E824 VanDerWaalsContact C-N 3.3Å; E822-E824 PolarHBondContact O-N 2.89Å; E824-Q827 PolarHBondContact O-N 3.42Å; E824-R828 WeakPolarHBondContact O-CB 3.34Å; E824-R828 PolarHBondContact O-N 3.39Å
825	E	88.6	Confident	84.6	Confident	54 Å²	54	89.7 Å²	89.7	25%	0.252	43%	0.434	S	S	.	.	H	α-helix	trans	-64.4	-44.5	179.4	-178.8	56	-159.1	0	0	111.9	L821 E822 Q827 R828 L829	L821-E825 HydrophobicContact CD2-CG 4.44Å; E822-E825 HydrophobicContact CB-CB 4.46Å; E822-E825 PolarHBondContact O-N 3.02Å; E825-Q827 VanDerWaalsContact C-N 3.29Å; E825-Q827 PolarHBondContact O-N 2.92Å; E825-R828 WeakPolarHBondContact O-CB 3.44Å; E825-R828 PolarHBondContact O-N 3.08Å; E825-R828 IonicContact OE1-CZ 3.59Å; E825-R828 IonicContact OE1-NE 3.26Å; E825-R828 IonicContact OE1-NH2 3.89Å; E825-R828 PolarHBondContact OE1-NH2 2.94Å; E825-R828 IonicContact OE2-CZ 2.56Å; E825-R828 IonicContact OE2-NE 2.68Å; E825-R828 PolarHBondContact OE2-NE 2.97Å; E825-R828 IonicContact OE2-NH1 3.43Å; E825-R828 IonicContact OE2-NH2 3.63Å; E825-R828 PolarHBondContact OE2-NH2 3.34Å; E825-L829 HydrophobicContact CG-CD1 4.33Å; E825-L829 WeakPolarHBondContact O-CG 3.49Å; E825-L829 PolarHBondContact O-N 3.23Å
826	R	83.4	Confident	85.3	Confident	36 Å²	36	83.7 Å²	83.7	14%	0.136	41%	0.405	C	S	.	.	H	α-helix	trans	-58.3	-43.2	173	-76.6	-162.6	-67.9	-111.7	1.4	112.3	W818 W819 L821 E822 L829 T830	W818-R826 HydrophobicContact CD2-CG 4.33Å; W818-R826 HydrophobicContact CH2-CB 4.48Å; W818-R826 HydrophobicContact CH2-CG 4.45Å; W818-R826 HydrophobicContact CZ2-CB 4.14Å; W818-R826 HydrophobicContact CZ2-CG 4.09Å; W818-R826 VanDerWaalsContact O-CD 3.3Å; W818-R826 WeakPolarHBondContact O-CD 3.46Å; W818-R826 PolarHBondContact O-NH1 2.99Å; W819-R826 VanDerWaalsContact C-NH1 3.3Å; W819-R826 VanDerWaalsContact CA-NH1 3.29Å; W819-R826 PolarHBondContact O-NH1 2.84Å; L821-R826 HydrophobicContact CB-CG 3.76Å; L821-R826 HydrophobicContact CD1-CG 4.36Å; L821-R826 PolarHBondContact O-NH1 3.37Å; E822-R826 PolarHBondContact O-N 3.27Å; R826-L829 PolarHBondContact O-N 2.83Å; R826-T830 WeakPolarHBondContact O-CB 3.3Å; R826-T830 PolarHBondContact O-N 3.45Å; R826-T830 PolarHBondContact O-OG1 3.3Å
827	Q	82.2	Confident	85.8	Confident	117 Å²	117	80.3 Å²	80.3	55%	0.547	38%	0.38	S	S	.	.	H	α-helix	trans	-64.6	-43	179.8	-176.3	171.3	-17.9	0	0	110.7	M823 E824 E825 T830 V831	M823-Q827 WeakPolarHBondContact O-CB 3.49Å; M823-Q827 PolarHBondContact O-N 2.99Å; M823-Q827 VanDerWaalsContact O-N 3.1Å; E824-Q827 PolarHBondContact O-N 3.42Å; E825-Q827 VanDerWaalsContact C-N 3.29Å; E825-Q827 PolarHBondContact O-N 2.92Å; Q827-T830 PolarHBondContact O-N 3.11Å; Q827-V831 WeakPolarHBondContact O-CG2 3.45Å; Q827-V831 PolarHBondContact O-N 3.17Å
828	R	90	Very high	86	Confident	158 Å²	158	79.2 Å²	79.2	60%	0.596	38%	0.376	S	S	*	.	H	α-helix	trans	-57.7	-50.8	174.5	-172.7	-176.4	74.8	162.2	4.3	111.7	E824 E825 T830 V831 Q832	E824-R828 WeakPolarHBondContact O-CB 3.34Å; E824-R828 PolarHBondContact O-N 3.39Å; E825-R828 WeakPolarHBondContact O-CB 3.44Å; E825-R828 PolarHBondContact O-N 3.08Å; E825-R828 IonicContact OE1-CZ 3.59Å; E825-R828 IonicContact OE1-NE 3.26Å; E825-R828 IonicContact OE1-NH2 3.89Å; E825-R828 PolarHBondContact OE1-NH2 2.94Å; E825-R828 IonicContact OE2-CZ 2.56Å; E825-R828 IonicContact OE2-NE 2.68Å; E825-R828 PolarHBondContact OE2-NE 2.97Å; E825-R828 IonicContact OE2-NH1 3.43Å; E825-R828 IonicContact OE2-NH2 3.63Å; E825-R828 PolarHBondContact OE2-NH2 3.34Å; R828-T830 VanDerWaalsContact C-N 3.31Å; R828-T830 PolarHBondContact O-N 2.88Å; R828-V831 PolarHBondContact O-N 3.46Å; R828-Q832 WeakPolarHBondContact O-CB 3.44Å; R828-Q832 PolarHBondContact O-N 2.87Å
829	L	90.9	Very high	86.4	Confident	19 Å²	19	79.4 Å²	79.4	10%	0.099	38%	0.379	C	S	.	.	H	α-helix	trans	-62.8	-37.4	179	-69	174.3	0	0	0	112.2	V808 W818 L821 E825 R826 H833	V808-L829 HydrophobicContact CG1-CB 4.32Å; V808-L829 HydrophobicContact CG2-CD2 4.27Å; W818-L829 HydrophobicContact CH2-CB 3.89Å; W818-L829 HydrophobicContact CH2-CD1 4.27Å; W818-L829 HydrophobicContact CZ3-CB 4.15Å; W818-L829 HydrophobicContact CZ3-CD1 3.73Å; L821-L829 HydrophobicContact CD1-CD1 4.02Å; E825-L829 HydrophobicContact CG-CD1 4.33Å; E825-L829 WeakPolarHBondContact O-CG 3.49Å; E825-L829 PolarHBondContact O-N 3.23Å; R826-L829 PolarHBondContact O-N 2.83Å; L829-H833 VanDerWaalsContact O-CB 3.25Å; L829-H833 WeakPolarHBondContact O-CB 3.43Å; L829-H833 PolarHBondContact O-N 3.37Å
830	T	85.3	Confident	87.2	Confident	61 Å²	61	75.2 Å²	75.2	37%	0.374	36%	0.363	S	S	.	.	H	α-helix	trans	-67	-43.1	177.6	-55.7	0	0	0	0	111.8	R826 Q827 R828 A834	R826-T830 WeakPolarHBondContact O-CB 3.3Å; R826-T830 PolarHBondContact O-N 3.45Å; R826-T830 PolarHBondContact O-OG1 3.3Å; Q827-T830 PolarHBondContact O-N 3.11Å; R828-T830 VanDerWaalsContact C-N 3.31Å; R828-T830 PolarHBondContact O-N 2.88Å; T830-A834 PolarHBondContact O-N 3.34Å; T830-A834 VanDerWaalsContact O-N 3.09Å
831	V	85.6	Confident	87.6	Confident	95 Å²	95	74.8 Å²	74.8	58%	0.576	35%	0.351	S	S	*	.	H	α-helix	trans	-65.4	-44.6	176	171.1	0	0	0	0	110.7	Q827 R828 A834 H835	Q827-V831 WeakPolarHBondContact O-CG2 3.45Å; Q827-V831 PolarHBondContact O-N 3.17Å; R828-V831 PolarHBondContact O-N 3.46Å; V831-A834 PolarHBondContact O-N 3.28Å; V831-H835 WeakPolarHBondContact O-CB 3.25Å; V831-H835 PolarHBondContact O-N 2.98Å
832	Q	90.5	Very high	87.7	Confident	79 Å²	79	74.7 Å²	74.7	37%	0.369	36%	0.355	S	S	.	.	H	α-helix	trans	-60.8	-45.8	176.8	-177.5	60.3	41.6	0	0	111.4	R828 A834 H835 D836	R828-Q832 WeakPolarHBondContact O-CB 3.44Å; R828-Q832 PolarHBondContact O-N 2.87Å; Q832-A834 PolarHBondContact O-N 3.32Å; Q832-H835 WeakPolarHBondContact O-CB 3.33Å; Q832-H835 PolarHBondContact O-N 3.33Å; Q832-D836 VanDerWaalsContact NE2-CG 3.32Å; Q832-D836 PolarHBondContact NE2-OD1 3.37Å; Q832-D836 PolarHBondContact NE2-OD2 3.08Å; Q832-D836 PolarHBondContact O-N 2.62Å
833	H	90.2	Very high	88.1	Confident	20 Å²	20	68 Å²	68	9%	0.093	33%	0.325	C	S	.	.	H	α-helix	trans	-55.3	-55.1	175.8	-176.5	-94.2	0	0	0	110.7	V808 L829 H835 D836 E837	V808-H833 HydrophobicContact CG1-CB 4.06Å; L829-H833 VanDerWaalsContact O-CB 3.25Å; L829-H833 WeakPolarHBondContact O-CB 3.43Å; L829-H833 PolarHBondContact O-N 3.37Å; H833-H835 PolarHBondContact O-N 3.1Å; H833-H835 VanDerWaalsContact O-N 3.17Å; H833-D836 PolarHBondContact O-N 3Å; H833-D836 VanDerWaalsContact O-N 3.15Å; H833-E837 IonicContact CE1-OE1 3.85Å; H833-E837 PolarHBondContact CE1-OE1 3.27Å; H833-E837 IonicContact CE1-OE2 3.55Å; H833-E837 IonicContact ND1-OE1 3.22Å; H833-E837 IonicContact ND1-OE2 3.39Å; H833-E837 IonicContact NE2-OE1 2.82Å; H833-E837 VanDerWaalsContact O-CG 3.22Å; H833-E837 WeakPolarHBondContact O-CG 3.41Å; H833-E837 PolarHBondContact O-N 3.07Å
834	A	85.9	Confident	88.8	Confident	46 Å²	46	63.8 Å²	63.8	38%	0.38	30%	0.304	S	S	.	.	H	α-helix	trans	-59.1	-31.6	180	0	0	0	0	0	113.5	T830 V831 Q832 R838	T830-A834 PolarHBondContact O-N 3.34Å; T830-A834 VanDerWaalsContact O-N 3.09Å; V831-A834 PolarHBondContact O-N 3.28Å; Q832-A834 PolarHBondContact O-N 3.32Å; A834-R838 PolarHBondContact O-N 3.12Å
835	H	89.5	Confident	89.1	Confident	85 Å²	85	61 Å²	61	39%	0.394	29%	0.291	S	S	.	.	H	α-helix	trans	-70	-50.8	174.2	179.5	73.8	0	0	0	112.1	V831 Q832 H833 E837 R838 I839	V831-H835 WeakPolarHBondContact O-CB 3.25Å; V831-H835 PolarHBondContact O-N 2.98Å; Q832-H835 WeakPolarHBondContact O-CB 3.33Å; Q832-H835 PolarHBondContact O-N 3.33Å; H833-H835 PolarHBondContact O-N 3.1Å; H833-H835 VanDerWaalsContact O-N 3.17Å; H835-E837 VanDerWaalsContact C-N 3.3Å; H835-E837 PolarHBondContact O-N 3.05Å; H835-R838 WeakPolarHBondContact O-CB 3.48Å; H835-R838 PolarHBondContact O-N 3.41Å; H835-R838 VanDerWaalsContact O-N 3.14Å; H835-I839 WeakPolarHBondContact NE2-CD1 3.3Å; H835-I839 PolarHBondContact O-N 2.86Å; H835-I839 VanDerWaalsContact O-N 3.16Å
836	D	93.2	Very high	89.1	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.011	28%	0.284	C	S	.	.	H	α-helix	trans	-59.6	-41.2	177.1	-74.6	-45.8	0	0	0	111.3	R804 I805 Q832 H833 R838 I839 V840	R804-D836 IonicContact CZ-OD1 2.97Å; R804-D836 IonicContact NE-OD1 2.92Å; R804-D836 PolarHBondContact NE-OD1 2.82Å; R804-D836 IonicContact NE-OD2 2.67Å; R804-D836 IonicContact NH2-OD1 3.53Å; R804-D836 PolarHBondContact NH2-OD1 2.65Å; I805-D836 HydrophobicContact CD1-CB 4.18Å; I805-D836 HydrophobicContact CG1-CB 3.78Å; Q832-D836 VanDerWaalsContact NE2-CG 3.32Å; Q832-D836 PolarHBondContact NE2-OD1 3.37Å; Q832-D836 PolarHBondContact NE2-OD2 3.08Å; Q832-D836 PolarHBondContact O-N 2.62Å; H833-D836 PolarHBondContact O-N 3Å; H833-D836 VanDerWaalsContact O-N 3.15Å; D836-R838 VanDerWaalsContact C-N 3.25Å; D836-R838 PolarHBondContact O-N 3.34Å; D836-I839 PolarHBondContact O-N 3.47Å; D836-V840 WeakPolarHBondContact O-CB 3.21Å; D836-V840 VanDerWaalsContact O-CG2 3.3Å; D836-V840 WeakPolarHBondContact O-CG2 3.34Å; D836-V840 PolarHBondContact O-N 3.41Å
837	E	91.1	Very high	89.5	Confident	17 Å²	17	57.7 Å²	57.7	8%	0.079	28%	0.278	C	S	.	.	H	α-helix	trans	-56.5	-40	176.5	-71.7	-165.6	124.8	0	0	112.7	I805 H833 H835 R841 R900 Y901	I805-E837 HydrophobicContact CD1-CG 4.3Å; H833-E837 IonicContact CE1-OE1 3.85Å; H833-E837 PolarHBondContact CE1-OE1 3.27Å; H833-E837 IonicContact CE1-OE2 3.55Å; H833-E837 IonicContact ND1-OE1 3.22Å; H833-E837 IonicContact ND1-OE2 3.39Å; H833-E837 IonicContact NE2-OE1 2.82Å; H833-E837 VanDerWaalsContact O-CG 3.22Å; H833-E837 WeakPolarHBondContact O-CG 3.41Å; H833-E837 PolarHBondContact O-N 3.07Å; H835-E837 VanDerWaalsContact C-N 3.3Å; H835-E837 PolarHBondContact O-N 3.05Å; E837-R841 WeakPolarHBondContact O-CB 3.44Å; E837-R841 PolarHBondContact O-N 3.21Å; E837-R900 VanDerWaalsContact CD-CZ 3.5Å; E837-R900 VanDerWaalsContact CD-NH2 3.32Å; E837-R900 IonicContact OE1-CZ 3.43Å; E837-R900 IonicContact OE1-NE 2.75Å; E837-R900 IonicContact OE1-NH1 3.31Å; E837-R900 PolarHBondContact OE1-NH1 3.37Å; E837-R900 IonicContact OE1-NH2 3.59Å; E837-R900 PolarHBondContact OE1-NH2 3.5Å; E837-R900 IonicContact OE2-CZ 2.68Å; E837-R900 VanDerWaalsContact OE2-CZ 3.31Å; E837-R900 IonicContact OE2-NH1 3.33Å; E837-R900 PolarHBondContact OE2-NH1 3.43Å; E837-R900 IonicContact OE2-NH2 3.04Å; E837-R900 PolarHBondContact OE2-NH2 2.92Å; E837-Y901 HydrophobicContact CB-CE1 3.75Å; E837-Y901 HydrophobicContact CG-CE1 3.57Å; E837-Y901 PolarHBondContact OE1-OH 3.32Å
838	R	88.3	Confident	90	Very high	161 Å²	161	56.8 Å²	56.8	61%	0.608	27%	0.269	S	S	*	.	H	α-helix	trans	-69.6	-48.5	180	-173.6	-175.5	-61.6	144.6	1.9	110.9	A834 H835 D836 R841 S842	A834-R838 PolarHBondContact O-N 3.12Å; H835-R838 WeakPolarHBondContact O-CB 3.48Å; H835-R838 PolarHBondContact O-N 3.41Å; H835-R838 VanDerWaalsContact O-N 3.14Å; D836-R838 VanDerWaalsContact C-N 3.25Å; D836-R838 PolarHBondContact O-N 3.34Å; R838-R841 PolarHBondContact O-N 3.16Å; R838-S842 PolarHBondContact O-N 2.69Å; R838-S842 PolarHBondContact O-OG 2.92Å
839	I	89	Confident	89.9	Confident	30 Å²	30	50.3 Å²	50.3	15%	0.154	25%	0.25	C	C	.	.	H	α-helix	trans	-62.3	-50.7	-178.8	-68.7	176.5	0	0	0	110.5	E797 H835 D836 R841 S842 S843	E797-I839 HydrophobicContact CG-CG2 3.79Å; H835-I839 WeakPolarHBondContact NE2-CD1 3.3Å; H835-I839 PolarHBondContact O-N 2.86Å; H835-I839 VanDerWaalsContact O-N 3.16Å; D836-I839 PolarHBondContact O-N 3.47Å; I839-R841 VanDerWaalsContact C-N 3.3Å; I839-R841 PolarHBondContact O-N 2.65Å; I839-S842 PolarHBondContact O-N 2.84Å; I839-S842 PolarHBondContact O-OG 3Å; I839-S843 WeakPolarHBondContact O-CB 3.16Å; I839-S843 PolarHBondContact O-N 3.11Å; I839-S843 PolarHBondContact O-OG 3.03Å; I839-S843 VanDerWaalsContact O-OG 3.06Å
840	V	94.3	Very high	89.9	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.9	-43.6	-178.1	169.5	0	0	0	0	111.1	L802 I805 D836 S843 L844 Y901	L802-V840 HydrophobicContact CD2-CG1 3.81Å; L802-V840 HydrophobicContact CG-CG1 3.87Å; I805-V840 HydrophobicContact CD1-CB 4.18Å; I805-V840 HydrophobicContact CD1-CG2 3.86Å; D836-V840 WeakPolarHBondContact O-CB 3.21Å; D836-V840 VanDerWaalsContact O-CG2 3.3Å; D836-V840 WeakPolarHBondContact O-CG2 3.34Å; D836-V840 PolarHBondContact O-N 3.41Å; V840-S843 PolarHBondContact O-N 3.04Å; V840-L844 HydrophobicContact CG1-CD1 3.68Å; V840-L844 HydrophobicContact CG1-CG 4.24Å; V840-L844 VanDerWaalsContact O-CB 3.32Å; V840-L844 WeakPolarHBondContact O-CB 3.36Å; V840-L844 VanDerWaalsContact O-CG 3.31Å; V840-L844 WeakPolarHBondContact O-CG 3.46Å; V840-L844 PolarHBondContact O-N 3.28Å; V840-Y901 HydrophobicContact CG1-CD1 4.49Å
841	R	91.3	Very high	90.3	Very high	129 Å²	129	46.6 Å²	46.6	49%	0.487	23%	0.228	S	C	.	.	H	α-helix	trans	-61.7	-46.8	179.1	-175.7	179	65.5	169.7	1.7	111.9	E837 R838 I839 Q845 R900	E837-R841 WeakPolarHBondContact O-CB 3.44Å; E837-R841 PolarHBondContact O-N 3.21Å; R838-R841 PolarHBondContact O-N 3.16Å; I839-R841 VanDerWaalsContact C-N 3.3Å; I839-R841 PolarHBondContact O-N 2.65Å; R841-Q845 WeakPolarHBondContact O-CB 3.5Å; R841-Q845 PolarHBondContact O-N 3.26Å; R841-R900 WeakPolarHBondContact CD-O 3.47Å
842	S	88.3	Confident	90.6	Very high	53 Å²	53	45 Å²	45	37%	0.371	22%	0.216	S	C	.	.	H	α-helix	trans	-65.8	-45.2	178.3	48	0	0	0	0	111.9	R838 I839 L844 Q845 L846	R838-S842 PolarHBondContact O-N 2.69Å; R838-S842 PolarHBondContact O-OG 2.92Å; I839-S842 PolarHBondContact O-N 2.84Å; I839-S842 PolarHBondContact O-OG 3Å; S842-L844 PolarHBondContact O-N 3.41Å; S842-Q845 PolarHBondContact O-N 2.88Å; S842-L846 VanDerWaalsContact O-CG 3.31Å; S842-L846 WeakPolarHBondContact O-CG 3.18Å; S842-L846 PolarHBondContact O-N 3.27Å; S842-L846 VanDerWaalsContact O-N 3.1Å
843	S	91.3	Very high	90.5	Very high	10 Å²	10	41.7 Å²	41.7	7%	0.07	20%	0.201	C	C	.	.	H	α-helix	trans	-65.6	-40.3	-176.9	-61.3	0	0	0	0	112	S798 I839 V840 L846 A847	S798-S843 VanDerWaalsContact OG-CB 3.3Å; S798-S843 WeakPolarHBondContact OG-CB 3.35Å; I839-S843 WeakPolarHBondContact O-CB 3.16Å; I839-S843 PolarHBondContact O-N 3.11Å; I839-S843 PolarHBondContact O-OG 3.03Å; I839-S843 VanDerWaalsContact O-OG 3.06Å; V840-S843 PolarHBondContact O-N 3.04Å; S843-L846 PolarHBondContact O-N 2.67Å; S843-A847 WeakPolarHBondContact O-CB 3.47Å; S843-A847 PolarHBondContact O-N 2.9Å
844	L	93.5	Very high	90.6	Very high	11 Å²	11	40.8 Å²	40.8	6%	0.058	20%	0.196	C	C	.	.	H	α-helix	trans	-65.5	-41.2	175.6	-76.6	175.3	0	0	0	112.7	S798 V840 S842 L846 A847 R848 Y901 W903	S798-L844 PolarHBondContact OG-N 2.81Å; V840-L844 HydrophobicContact CG1-CD1 3.68Å; V840-L844 HydrophobicContact CG1-CG 4.24Å; V840-L844 VanDerWaalsContact O-CB 3.32Å; V840-L844 WeakPolarHBondContact O-CB 3.36Å; V840-L844 VanDerWaalsContact O-CG 3.31Å; V840-L844 WeakPolarHBondContact O-CG 3.46Å; V840-L844 PolarHBondContact O-N 3.28Å; S842-L844 PolarHBondContact O-N 3.41Å; L844-L846 VanDerWaalsContact C-N 3.31Å; L844-L846 PolarHBondContact O-N 2.91Å; L844-A847 PolarHBondContact O-N 2.93Å; L844-R848 WeakPolarHBondContact O-CB 3.48Å; L844-R848 PolarHBondContact O-N 3.01Å; L844-Y901 WeakPolarHBondContact CD1-O 3.45Å; L844-W903 HydrophobicContact CD1-CB 4.09Å; L844-W903 HydrophobicContact CD1-CD2 4.41Å; L844-W903 HydrophobicContact CD1-CE3 3.75Å; L844-W903 HydrophobicContact CD2-CE3 3.64Å; L844-W903 HydrophobicContact CD2-CZ3 3.69Å; L844-W903 HydrophobicContact CG-CE3 4.38Å
845	Q	89.2	Confident	91	Very high	99 Å²	99	40 Å²	40	46%	0.463	19%	0.187	S	C	.	.	H	α-helix	trans	-60.7	-43.8	177.4	-177.5	177	-10.4	0	0	111.1	R841 S842 A849	R841-Q845 WeakPolarHBondContact O-CB 3.5Å; R841-Q845 PolarHBondContact O-N 3.26Å; S842-Q845 PolarHBondContact O-N 2.88Å; Q845-A849 PolarHBondContact O-N 3.49Å
846	L	88.4	Confident	90.9	Very high	19 Å²	19	38.8 Å²	38.8	10%	0.099	18%	0.179	C	C	.	.	H	α-helix	trans	-67.3	-46.8	176.6	-68.2	166.1	0	0	0	112	F746 F750 L794 S842 S843 L844 R848 A849 T850	F746-L846 HydrophobicContact CB-CD1 3.74Å; F746-L846 HydrophobicContact CB-CD2 4.49Å; F746-L846 HydrophobicContact CD1-CD1 4.45Å; F746-L846 HydrophobicContact CG-CD1 4.2Å; F750-L846 HydrophobicContact CB-CD2 3.57Å; F750-L846 HydrophobicContact CD2-CD2 3.94Å; F750-L846 HydrophobicContact CG-CD2 4.04Å; L794-L846 HydrophobicContact CD1-CB 3.69Å; L794-L846 HydrophobicContact CD2-CB 4.07Å; L794-L846 HydrophobicContact CD2-CD1 4.02Å; S842-L846 VanDerWaalsContact O-CG 3.31Å; S842-L846 WeakPolarHBondContact O-CG 3.18Å; S842-L846 PolarHBondContact O-N 3.27Å; S842-L846 VanDerWaalsContact O-N 3.1Å; S843-L846 PolarHBondContact O-N 2.67Å; L844-L846 VanDerWaalsContact C-N 3.31Å; L844-L846 PolarHBondContact O-N 2.91Å; L846-R848 VanDerWaalsContact C-N 3.26Å; L846-R848 PolarHBondContact O-N 2.79Å; L846-A849 PolarHBondContact O-N 3.08Å; L846-A849 VanDerWaalsContact O-N 3.12Å; L846-T850 PolarHBondContact O-N 3.01Å; L846-T850 PolarHBondContact O-OG1 3.36Å; L846-T850 VanDerWaalsContact O-OG1 3.11Å
847	A	92.5	Very high	90.7	Very high	1 Å²	1	39 Å²	39	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-57.5	-42.2	179.4	0	0	0	0	0	111.4	L794 L795 S843 L844 T850 I851	L794-A847 HydrophobicContact CB-CB 3.91Å; L795-A847 HydrophobicContact CD2-CB 3.64Å; L795-A847 HydrophobicContact CG-CB 4.05Å; S843-A847 WeakPolarHBondContact O-CB 3.47Å; S843-A847 PolarHBondContact O-N 2.9Å; L844-A847 PolarHBondContact O-N 2.93Å; A847-T850 PolarHBondContact O-N 3.32Å; A847-I851 WeakPolarHBondContact O-CD1 3.33Å; A847-I851 VanDerWaalsContact O-CG1 3.26Å; A847-I851 WeakPolarHBondContact O-CG1 3.45Å; A847-I851 PolarHBondContact O-N 2.7Å
848	R	90.7	Very high	90.8	Very high	97 Å²	97	38.2 Å²	38.2	37%	0.366	18%	0.177	S	C	.	.	H	α-helix	trans	-63.1	-43.2	177.1	-170.8	178.7	-171.9	161.2	6.2	112.1	L844 L846 T850 I851 D852 E904 S907 E911	L844-R848 WeakPolarHBondContact O-CB 3.48Å; L844-R848 PolarHBondContact O-N 3.01Å; L846-R848 VanDerWaalsContact C-N 3.26Å; L846-R848 PolarHBondContact O-N 2.79Å; R848-T850 VanDerWaalsContact C-N 3.31Å; R848-T850 PolarHBondContact O-N 3.49Å; R848-I851 PolarHBondContact O-N 3.46Å; R848-D852 WeakPolarHBondContact O-CB 3.38Å; R848-D852 PolarHBondContact O-N 3.33Å; R848-E904 IonicContact CZ-OE2 2.82Å; R848-E904 IonicContact NH1-OE2 3.35Å; R848-E904 PolarHBondContact NH1-OE2 2.91Å; R848-E904 IonicContact NH2-OE2 2.73Å; R848-E904 PolarHBondContact NH2-OE2 3.26Å; R848-E904 VanDerWaalsContact NH2-OE2 3.08Å; R848-S907 PolarHBondContact NH2-OG 3.38Å; R848-E911 IonicContact NE-OE1 3.95Å
849	A	89.2	Confident	90.8	Very high	22 Å²	22	37 Å²	37	18%	0.182	18%	0.176	C	C	.	.	H	α-helix	trans	-61.8	-40.5	177.1	0	0	0	0	0	111.8	F750 Q753 Q845 L846 M853	F750-A849 HydrophobicContact CD2-CB 4.39Å; Q753-A849 VanDerWaalsContact OE1-CB 3.25Å; Q845-A849 PolarHBondContact O-N 3.49Å; L846-A849 PolarHBondContact O-N 3.08Å; L846-A849 VanDerWaalsContact O-N 3.12Å; A849-M853 PolarHBondContact O-N 2.69Å
850	T	91.3	Very high	90.4	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-42.2	175.8	-52.9	0	0	0	0	112.4	Q753 L787 T791 L846 A847 R848 M853 F854	Q753-T850 PolarHBondContact NE2-OG1 3Å; L787-T850 HydrophobicContact CB-CG2 4.09Å; L787-T850 HydrophobicContact CD2-CG2 3.75Å; T791-T850 WeakPolarHBondContact OG1-CG2 3.46Å; L846-T850 PolarHBondContact O-N 3.01Å; L846-T850 PolarHBondContact O-OG1 3.36Å; L846-T850 VanDerWaalsContact O-OG1 3.11Å; A847-T850 PolarHBondContact O-N 3.32Å; R848-T850 VanDerWaalsContact C-N 3.31Å; R848-T850 PolarHBondContact O-N 3.49Å; T850-M853 WeakPolarHBondContact O-CB 3.35Å; T850-M853 PolarHBondContact O-N 3.38Å; T850-F854 HydrophobicContact CG2-CD2 4.39Å; T850-F854 HydrophobicContact CG2-CE2 4.11Å; T850-F854 WeakPolarHBondContact O-CD2 3.41Å; T850-F854 PolarHBondContact O-N 3.32Å
851	I	93.8	Very high	90	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-71.8	-40.2	-179.7	-68	166.4	0	0	0	111.6	T791 L795 A847 R848 M853 F854 V855 L908 E911 L912 I915	T791-I851 HydrophobicContact CG2-CD1 4.02Å; T791-I851 HydrophobicContact CG2-CG1 3.84Å; L795-I851 HydrophobicContact CD1-CD1 3.97Å; A847-I851 WeakPolarHBondContact O-CD1 3.33Å; A847-I851 VanDerWaalsContact O-CG1 3.26Å; A847-I851 WeakPolarHBondContact O-CG1 3.45Å; A847-I851 PolarHBondContact O-N 2.7Å; R848-I851 PolarHBondContact O-N 3.46Å; I851-M853 PolarHBondContact O-N 3.05Å; I851-F854 WeakPolarHBondContact O-CB 3.35Å; I851-F854 PolarHBondContact O-N 2.75Å; I851-V855 HydrophobicContact CG2-CG2 4.4Å; I851-V855 WeakPolarHBondContact O-CG2 3.24Å; I851-V855 PolarHBondContact O-N 3.3Å; I851-L908 HydrophobicContact CD1-CD1 3.28Å; I851-E911 HydrophobicContact CG2-CB 3.64Å; I851-L912 HydrophobicContact CD1-CD2 4.11Å; I851-L912 HydrophobicContact CG1-CD2 4.49Å; I851-I915 HydrophobicContact CG2-CD1 4.36Å
852	D	90.8	Very high	89.9	Confident	62 Å²	62	36.9 Å²	36.9	33%	0.332	19%	0.187	S	C	.	.	H	α-helix	trans	-54.2	-41.9	172.6	-168.1	34.1	0	0	0	110.2	K757 R848 V855 Y856	K757-D852 IonicContact NZ-OD2 3.9Å; K757-D852 PolarHBondContact NZ-OD2 3.31Å; R848-D852 WeakPolarHBondContact O-CB 3.38Å; R848-D852 PolarHBondContact O-N 3.33Å; D852-V855 PolarHBondContact O-N 3.01Å; D852-Y856 WeakPolarHBondContact O-CB 3.21Å; D852-Y856 PolarHBondContact O-N 2.96Å
853	M	89.1	Confident	89.9	Confident	10 Å²	10	40.8 Å²	40.8	5%	0.049	20%	0.2	C	C	.	.	H	α-helix	trans	-62.1	-44.7	175.1	-162.7	61.9	62.9	0	0	112.7	Q753 F756 A849 T850 I851 Y856 M857	Q753-M853 HydrophobicContact CB-CE 4.14Å; Q753-M853 HydrophobicContact CG-CE 4.31Å; F756-M853 HydrophobicContact CB-CE 3.6Å; F756-M853 HydrophobicContact CB-SD 4.26Å; F756-M853 HydrophobicContact CD2-CE 3.89Å; F756-M853 HydrophobicContact CD2-SD 4.18Å; F756-M853 HydrophobicContact CG-CE 4.27Å; A849-M853 PolarHBondContact O-N 2.69Å; T850-M853 WeakPolarHBondContact O-CB 3.35Å; T850-M853 PolarHBondContact O-N 3.38Å; I851-M853 PolarHBondContact O-N 3.05Å; M853-Y856 PolarHBondContact O-N 3.12Å; M853-M857 HydrophobicContact CG-CE 3.79Å; M853-M857 HydrophobicContact CG-CG 4.44Å; M853-M857 HydrophobicContact CG-SD 4.1Å; M853-M857 WeakPolarHBondContact O-CG 3.46Å; M853-M857 PolarHBondContact O-N 3.26Å; M853-M857 HydrophobicContact SD-CG 4.49Å; M853-M857 HydrophobicContact SD-SD 4.48Å
854	F	92.6	Very high	89.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.3	-47.3	175.1	-83.8	-66.2	0	0	0	112.2	V784 L787 I788 T850 I851 Y856 M857 T858 F865 L874 M877 I915	V784-F854 HydrophobicContact CG1-CE1 4.14Å; L787-F854 HydrophobicContact CB-CE1 4.35Å; L787-F854 HydrophobicContact CB-CE2 3.65Å; L787-F854 HydrophobicContact CB-CZ 3.43Å; L787-F854 VanDerWaalsContact CB-CZ 3.43Å; L787-F854 HydrophobicContact CD1-CE1 4.48Å; L787-F854 HydrophobicContact CD1-CZ 4.26Å; I788-F854 HydrophobicContact CG1-CE1 4.39Å; I788-F854 HydrophobicContact CG1-CZ 3.8Å; T850-F854 HydrophobicContact CG2-CD2 4.39Å; T850-F854 HydrophobicContact CG2-CE2 4.11Å; T850-F854 WeakPolarHBondContact O-CD2 3.41Å; T850-F854 PolarHBondContact O-N 3.32Å; I851-F854 WeakPolarHBondContact O-CB 3.35Å; I851-F854 PolarHBondContact O-N 2.75Å; F854-Y856 PolarHBondContact O-N 3.25Å; F854-M857 PolarHBondContact O-N 3.05Å; F854-T858 WeakPolarHBondContact O-CB 3.5Å; F854-T858 VanDerWaalsContact O-CG2 3.28Å; F854-T858 WeakPolarHBondContact O-CG2 3.45Å; F854-T858 PolarHBondContact O-N 3.17Å; F854-T858 PolarHBondContact O-OG1 3.17Å; F854-F865 HydrophobicContact CD1-CE1 4.09Å; F854-F865 HydrophobicContact CE1-CD1 4.47Å; F854-F865 HydrophobicContact CE1-CE1 4.17Å; F854-L874 HydrophobicContact CD1-CD1 4.26Å; F854-L874 HydrophobicContact CE1-CD1 3.93Å; F854-L874 HydrophobicContact CZ-CD1 4.3Å; F854-M877 HydrophobicContact CE2-CE 4.47Å; F854-I915 HydrophobicContact CB-CD1 3.55Å; F854-I915 HydrophobicContact CB-CG1 4.17Å; F854-I915 HydrophobicContact CG-CD1 4.37Å
855	V	93.3	Very high	89.7	Confident	30 Å²	30	40.2 Å²	40.2	18%	0.182	20%	0.196	C	C	.	.	H	α-helix	trans	-57.1	-43.2	178.5	172.1	0	0	0	0	110.2	I851 D852 E911 E914 I915 N918	I851-V855 HydrophobicContact CG2-CG2 4.4Å; I851-V855 WeakPolarHBondContact O-CG2 3.24Å; I851-V855 PolarHBondContact O-N 3.3Å; D852-V855 PolarHBondContact O-N 3.01Å; V855-E911 HydrophobicContact CG2-CB 3.91Å; V855-E911 HydrophobicContact CG2-CG 4.43Å; V855-E911 WeakPolarHBondContact CG2-O 3.49Å; V855-E914 HydrophobicContact CG1-CB 4.4Å; V855-E914 HydrophobicContact CG1-CG 4.18Å; V855-I915 HydrophobicContact CG2-CD1 4.22Å; V855-I915 HydrophobicContact CG2-CG1 3.83Å; V855-N918 PolarHBondContact O-ND2 3.42Å
856	Y	88.2	Confident	89.8	Confident	59 Å²	59	36.6 Å²	36.6	23%	0.231	18%	0.18	C	C	.	.	H	α-helix	trans	-64.8	-55.4	178.4	-177.1	-88	0	0	0	112.4	L760 R766 F770 D852 M853 F854 T858 K859	L760-Y856 HydrophobicContact CD1-CD1 3.47Å; L760-Y856 VanDerWaalsContact CD1-CD1 3.47Å; L760-Y856 HydrophobicContact CD1-CD2 3.95Å; L760-Y856 HydrophobicContact CD1-CE1 3.48Å; L760-Y856 VanDerWaalsContact CD1-CE1 3.48Å; L760-Y856 HydrophobicContact CD1-CE2 3.92Å; L760-Y856 HydrophobicContact CD1-CG 3.75Å; L760-Y856 HydrophobicContact CD2-CD1 4.12Å; L760-Y856 HydrophobicContact CD2-CE1 3.24Å; L760-Y856 HydrophobicContact CD2-CE2 4.24Å; L760-Y856 VanDerWaalsContact CD2-OH 3.32Å; L760-Y856 WeakPolarHBondContact CD2-OH 3.44Å; L760-Y856 HydrophobicContact CG-CD1 4.41Å; L760-Y856 HydrophobicContact CG-CE1 3.94Å; L760-Y856 HydrophobicContact CG-CE2 4.46Å; R766-Y856 VanDerWaalsContact CG-OH 3.25Å; R766-Y856 WeakPolarHBondContact CG-OH 3.32Å; F770-Y856 HydrophobicContact CE2-CE1 4.38Å; F770-Y856 AromaticContact CE2-CZ 4Å; F770-Y856 WeakPolarHBondContact CE2-OH 3.4Å; F770-Y856 HydrophobicContact CZ-CE1 4.04Å; F770-Y856 AromaticContact CZ-CZ 3.85Å; F770-Y856 WeakPolarHBondContact CZ-OH 3.49Å; D852-Y856 WeakPolarHBondContact O-CB 3.21Å; D852-Y856 PolarHBondContact O-N 2.96Å; M853-Y856 PolarHBondContact O-N 3.12Å; F854-Y856 PolarHBondContact O-N 3.25Å; Y856-T858 PolarHBondContact O-N 3.26Å; Y856-K859 WeakPolarHBondContact O-CB 3.31Å; Y856-K859 PolarHBondContact O-N 3.38Å
857	M	88.6	Confident	89.8	Confident	8 Å²	8	37.7 Å²	37.7	4%	0.039	19%	0.187	C	C	.	.	H	α-helix	trans	-67.6	-35.7	-173.1	-66	-175.3	-58	0	0	112.8	F780 F783 L787 M853 F854 K859 F865	F780-M857 HydrophobicContact CE2-SD 4.25Å; F780-M857 HydrophobicContact CZ-SD 4.25Å; F783-M857 HydrophobicContact CE1-CE 4.17Å; F783-M857 HydrophobicContact CE1-SD 4.07Å; L787-M857 HydrophobicContact CD1-CE 3.69Å; M853-M857 HydrophobicContact CG-CE 3.79Å; M853-M857 HydrophobicContact CG-CG 4.44Å; M853-M857 HydrophobicContact CG-SD 4.1Å; M853-M857 WeakPolarHBondContact O-CG 3.46Å; M853-M857 PolarHBondContact O-N 3.26Å; M853-M857 HydrophobicContact SD-CG 4.49Å; M853-M857 HydrophobicContact SD-SD 4.48Å; F854-M857 PolarHBondContact O-N 3.05Å; M857-K859 VanDerWaalsContact C-N 3.28Å; M857-K859 PolarHBondContact O-N 3.35Å; M857-F865 HydrophobicContact CB-CE2 4.26Å; M857-F865 HydrophobicContact CB-CZ 3.7Å; M857-F865 HydrophobicContact CE-CE1 4.26Å; M857-F865 HydrophobicContact CE-CZ 4.09Å
858	T	92.4	Very high	89.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-74.7	-17.5	-178.4	56.2	0	0	0	0	113.5	F854 Y856 D860 V861 F865 I915 N918 L919	F854-T858 WeakPolarHBondContact O-CB 3.5Å; F854-T858 VanDerWaalsContact O-CG2 3.28Å; F854-T858 WeakPolarHBondContact O-CG2 3.45Å; F854-T858 PolarHBondContact O-N 3.17Å; F854-T858 PolarHBondContact O-OG1 3.17Å; Y856-T858 PolarHBondContact O-N 3.26Å; T858-D860 VanDerWaalsContact C-N 3.35Å; T858-D860 PolarHBondContact O-N 2.85Å; T858-V861 WeakPolarHBondContact CA-O 3.3Å; T858-F865 HydrophobicContact CG2-CD1 4.01Å; T858-F865 HydrophobicContact CG2-CD2 3.91Å; T858-F865 HydrophobicContact CG2-CE1 4.03Å; T858-F865 HydrophobicContact CG2-CE2 3.93Å; T858-F865 HydrophobicContact CG2-CG 3.96Å; T858-F865 HydrophobicContact CG2-CZ 4Å; T858-I915 HydrophobicContact CG2-CG2 4.3Å; T858-N918 WeakPolarHBondContact O-CB 3.34Å; T858-N918 PolarHBondContact OG1-ND2 2.99Å; T858-L919 HydrophobicContact CG2-CD1 4.29Å; T858-L919 HydrophobicContact CG2-CD2 4.1Å; T858-L919 HydrophobicContact CG2-CG 4.29Å
859	K	88.8	Confident	88.7	Confident	135 Å²	135	36.9 Å²	36.9	59%	0.587	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-44.4	-173.1	-173.6	-178.1	176.1	-174	0	113.6	Y856 M857 N918	Y856-K859 WeakPolarHBondContact O-CB 3.31Å; Y856-K859 PolarHBondContact O-N 3.38Å; M857-K859 VanDerWaalsContact C-N 3.28Å; M857-K859 PolarHBondContact O-N 3.35Å; K859-N918 PolarHBondContact N-ND2 3.28Å
860	D	81.6	Confident	88.7	Confident	97 Å²	97	35.9 Å²	35.9	52%	0.519	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-7.7	-175.8	-55.6	-62.1	0	0	0	113	F770 T858	F770-D860 HydrophobicContact CD1-CB 4.35Å; F770-D860 HydrophobicContact CE1-CB 3.73Å; F770-D860 HydrophobicContact CZ-CB 4.32Å; F770-D860 WeakPolarHBondContact CZ-OD2 3.33Å; T858-D860 VanDerWaalsContact C-N 3.35Å; T858-D860 PolarHBondContact O-N 2.85Å
861	V	85.1	Confident	88.8	Confident	5 Å²	5	35.8 Å²	35.8	3%	0.03	19%	0.19	C	C	.	.			trans	-131.8	111.3	-178.8	-177.2	0	0	0	0	110	F770 C773 K774 T858 P864 F865	F770-V861 HydrophobicContact CD1-CG2 3.79Å; F770-V861 HydrophobicContact CE1-CG2 4.38Å; C773-V861 HydrophobicContact CB-CB 4.19Å; C773-V861 HydrophobicContact CB-CG1 3.9Å; C773-V861 HydrophobicContact CB-CG2 4.11Å; K774-V861 HydrophobicContact CG-CG1 4.18Å; K774-V861 HydrophobicContact CG-CG2 3.71Å; T858-V861 WeakPolarHBondContact CA-O 3.3Å; V861-P864 HydrophobicContact CG1-CG 3.91Å; V861-F865 VanDerWaalsContact O-CD2 3.31Å; V861-F865 WeakPolarHBondContact O-CD2 3.46Å; V861-F865 VanDerWaalsContact O-CE2 3.31Å; V861-F865 WeakPolarHBondContact O-CE2 3.19Å
862	T	89.1	Confident	88.7	Confident	54 Å²	54	38.4 Å²	38.4	33%	0.331	20%	0.204	S	C	.	.			trans	-112.1	-37	-172.6	60.2	0	0	0	0	113.3	F865 L866 N918 L919	T862-F865 WeakPolarHBondContact O-CB 3.21Å; T862-F865 PolarHBondContact O-N 2.71Å; T862-L866 WeakPolarHBondContact O-CG 3.19Å; T862-N918 VanDerWaalsContact CG2-O 3.22Å; T862-N918 WeakPolarHBondContact CG2-O 3.41Å; T862-L919 HydrophobicContact CG2-CD2 3.93Å
863	E	88.6	Confident	88.7	Confident	136 Å²	136	37 Å²	37	64%	0.636	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-54	-45.4	-170.9	-177.7	167.4	-153.6	0	0	115.7	F865 L866	E863-F865 PolarHBondContact O-N 2.82Å; E863-L866 PolarHBondContact O-N 3.13Å
864	P	88.5	Confident	89	Confident	8 Å²	8	36.6 Å²	36.6	5%	0.052	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-62.3	-29.5	178.4	-18.8	28.7	0	0	0	113.8	C773 A776 F780 I781 V861 L866 T867 L870	C773-P864 WeakPolarHBondContact O-CG 3.49Å; A776-P864 HydrophobicContact CB-CB 3.69Å; A776-P864 HydrophobicContact CB-CG 3.73Å; F780-P864 HydrophobicContact CD1-CB 4.18Å; F780-P864 HydrophobicContact CE1-CB 3.86Å; F780-P864 HydrophobicContact CE1-CG 4.34Å; I781-P864 HydrophobicContact CD1-CB 4.28Å; V861-P864 HydrophobicContact CG1-CG 3.91Å; P864-L866 PolarHBondContact O-N 3.45Å; P864-T867 PolarHBondContact O-OG1 3.04Å; P864-L870 WeakPolarHBondContact O-CD1 3.47Å
865	F	92.4	Very high	89	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-78.6	-8	178.9	-59.7	-85	0	0	0	112.6	F780 V784 F854 M857 T858 V861 T862 E863 G871 L874 L919	F780-F865 HydrophobicContact CE1-CZ 4.42Å; F780-F865 HydrophobicContact CZ-CZ 4.19Å; V784-F865 HydrophobicContact CG1-CD1 3.84Å; V784-F865 HydrophobicContact CG1-CE1 3.88Å; V784-F865 HydrophobicContact CG2-CD1 4.44Å; V784-F865 HydrophobicContact CG2-CE1 3.84Å; V784-F865 HydrophobicContact CG2-CZ 4.39Å; F854-F865 HydrophobicContact CD1-CE1 4.09Å; F854-F865 HydrophobicContact CE1-CD1 4.47Å; F854-F865 HydrophobicContact CE1-CE1 4.17Å; M857-F865 HydrophobicContact CB-CE2 4.26Å; M857-F865 HydrophobicContact CB-CZ 3.7Å; M857-F865 HydrophobicContact CE-CE1 4.26Å; M857-F865 HydrophobicContact CE-CZ 4.09Å; T858-F865 HydrophobicContact CG2-CD1 4.01Å; T858-F865 HydrophobicContact CG2-CD2 3.91Å; T858-F865 HydrophobicContact CG2-CE1 4.03Å; T858-F865 HydrophobicContact CG2-CE2 3.93Å; T858-F865 HydrophobicContact CG2-CG 3.96Å; T858-F865 HydrophobicContact CG2-CZ 4Å; V861-F865 VanDerWaalsContact O-CD2 3.31Å; V861-F865 WeakPolarHBondContact O-CD2 3.46Å; V861-F865 VanDerWaalsContact O-CE2 3.31Å; V861-F865 WeakPolarHBondContact O-CE2 3.19Å; T862-F865 WeakPolarHBondContact O-CB 3.21Å; T862-F865 PolarHBondContact O-N 2.71Å; E863-F865 PolarHBondContact O-N 2.82Å; F865-G871 VanDerWaalsContact O-CA 3.27Å; F865-G871 WeakPolarHBondContact O-CA 3.5Å; F865-G871 PolarHBondContact O-N 2.82Å; F865-L874 HydrophobicContact CB-CD2 3.94Å; F865-L874 HydrophobicContact CD1-CD2 4.1Å; F865-L874 HydrophobicContact CG-CD2 4.43Å; F865-L919 HydrophobicContact CB-CD1 4.35Å; F865-L919 HydrophobicContact CB-CD2 4.06Å
866	L	91.3	Very high	89	Confident	23 Å²	23	36.6 Å²	36.6	12%	0.12	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-113.3	11	-174.8	-58.9	174.3	0	0	0	112.9	T862 E863 P864 C921 F924	T862-L866 WeakPolarHBondContact O-CG 3.19Å; E863-L866 PolarHBondContact O-N 3.13Å; P864-L866 PolarHBondContact O-N 3.45Å; L866-C921 WeakPolarHBondContact CD1-SG 3.36Å; L866-F924 HydrophobicContact CD2-CB 3.57Å; L866-F924 HydrophobicContact CD2-CD2 3.61Å; L866-F924 HydrophobicContact CD2-CG 3.94Å
867	T	87	Confident	89.4	Confident	42 Å²	42	34 Å²	34	26%	0.258	19%	0.186	S	C	.	.	S	Bend	trans	-63	151.9	169.6	61.6	0	0	0	0	109.8	I781 P864 E869 L870 G871	I781-T867 HydrophobicContact CD1-CG2 4.25Å; P864-T867 PolarHBondContact O-OG1 3.04Å; T867-E869 PolarHBondContact O-N 3.39Å; T867-L870 PolarHBondContact O-N 3.48Å; T867-L870 VanDerWaalsContact O-N 3.11Å; T867-G871 PolarHBondContact O-N 3.39Å
868	G	79.4	Confident	89.7	Confident	43 Å²	43	33.7 Å²	33.7	44%	0.443	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.3	-176.8	0	0	0	0	0	114
869	E	81.2	Confident	89.8	Confident	39 Å²	39	33.7 Å²	33.7	18%	0.182	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-34.7	-179.3	-45.6	170.9	-128.9	0	0	112.8	T867 R873 T1016 L1020	T867-E869 PolarHBondContact O-N 3.39Å; E869-R873 VanDerWaalsContact O-CD 3.3Å; E869-R873 WeakPolarHBondContact O-CD 3.48Å; E869-T1016 HydrophobicContact CG-CG2 4.25Å; E869-T1016 WeakPolarHBondContact OE2-CG2 3.2Å; E869-L1020 HydrophobicContact CB-CD1 3.94Å; E869-L1020 WeakPolarHBondContact OE2-CD1 3.47Å
870	L	90.5	Very high	90	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-39.8	-172.9	-68.1	-179.6	0	0	0	113.3	I781 V784 N785 I788 P864 T867 D872 R873 L874 L1020	I781-L870 HydrophobicContact CB-CD1 4.36Å; I781-L870 HydrophobicContact CD1-CD1 3.77Å; I781-L870 HydrophobicContact CG2-CD1 3.79Å; I781-L870 HydrophobicContact CG2-CD2 4.45Å; I781-L870 HydrophobicContact CG2-CG 4.06Å; V784-L870 HydrophobicContact CB-CD1 3.92Å; V784-L870 HydrophobicContact CG1-CD1 3.78Å; V784-L870 HydrophobicContact CG1-CD2 4.23Å; N785-L870 HydrophobicContact CB-CD2 3.91Å; I788-L870 HydrophobicContact CD1-CD2 4.19Å; P864-L870 WeakPolarHBondContact O-CD1 3.47Å; T867-L870 PolarHBondContact O-N 3.48Å; T867-L870 VanDerWaalsContact O-N 3.11Å; L870-D872 PolarHBondContact O-N 2.58Å; L870-R873 PolarHBondContact O-N 3.27Å; L870-L874 WeakPolarHBondContact O-CB 3.38Å; L870-L874 PolarHBondContact O-N 3.46Å; L870-L1020 HydrophobicContact CD2-CD1 4.2Å
871	G	92.8	Very high	90.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-55.9	-49.8	-171.2	0	0	0	0	0	113.1	F865 T867 R873 L874 A875 C927	F865-G871 VanDerWaalsContact O-CA 3.27Å; F865-G871 WeakPolarHBondContact O-CA 3.5Å; F865-G871 PolarHBondContact O-N 2.82Å; T867-G871 PolarHBondContact O-N 3.39Å; G871-R873 VanDerWaalsContact C-N 3.31Å; G871-R873 PolarHBondContact O-N 2.89Å; G871-L874 PolarHBondContact O-N 2.85Å; G871-A875 VanDerWaalsContact O-CB 3.32Å; G871-A875 WeakPolarHBondContact O-CB 3.16Å; G871-A875 PolarHBondContact O-N 2.77Å; G871-C927 VanDerWaalsContact C-SG 3.54Å
872	D	90.6	Very high	91	Very high	54 Å²	54	25.5 Å²	25.5	29%	0.289	14%	0.142	S	C	.	.	H	α-helix	trans	-63.6	-36.7	178.3	-68.8	-11.9	0	0	0	112.2	L870 A876 C927 R1017	L870-D872 PolarHBondContact O-N 2.58Å; D872-A876 VanDerWaalsContact O-CB 3.22Å; D872-A876 WeakPolarHBondContact O-CB 3.15Å; D872-A876 PolarHBondContact O-N 3.49Å; D872-C927 WeakPolarHBondContact OD1-CA 3.18Å; D872-C927 WeakPolarHBondContact OD1-CB 3.21Å; D872-C927 PolarHBondContact OD1-SG 3.47Å; D872-R1017 IonicContact OD2-NH2 2.82Å
873	R	91.2	Very high	91.1	Very high	33 Å²	33	27.5 Å²	27.5	13%	0.125	15%	0.146	C	C	.	.	H	α-helix	trans	-73.4	-42.5	-178.9	-65	-176.8	66.2	179.7	-9.8	112	N785 I788 N789 E869 L870 G871 A875 A876 M877	N785-R873 PolarHBondContact OD1-NH1 3.36Å; N785-R873 PolarHBondContact OD1-NH2 2.89Å; I788-R873 HydrophobicContact CD1-CB 4.22Å; I788-R873 HydrophobicContact CG2-CB 4.41Å; N789-R873 PolarHBondContact OD1-NH2 3.21Å; E869-R873 VanDerWaalsContact O-CD 3.3Å; E869-R873 WeakPolarHBondContact O-CD 3.48Å; L870-R873 PolarHBondContact O-N 3.27Å; G871-R873 VanDerWaalsContact C-N 3.31Å; G871-R873 PolarHBondContact O-N 2.89Å; R873-A875 VanDerWaalsContact C-N 3.34Å; R873-A876 PolarHBondContact O-N 2.76Å; R873-M877 WeakPolarHBondContact O-CB 3.26Å; R873-M877 PolarHBondContact O-N 3.28Å
874	L	94.7	Very high	91.2	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-62.2	-47.2	175.6	-178.2	60.1	0	0	0	109.6	I788 F854 F865 L870 G871 A876 M877 L878 L919	I788-L874 HydrophobicContact CD1-CB 4.03Å; I788-L874 HydrophobicContact CD1-CD1 4.46Å; I788-L874 HydrophobicContact CG1-CD1 4.27Å; F854-L874 HydrophobicContact CD1-CD1 4.26Å; F854-L874 HydrophobicContact CE1-CD1 3.93Å; F854-L874 HydrophobicContact CZ-CD1 4.3Å; F865-L874 HydrophobicContact CB-CD2 3.94Å; F865-L874 HydrophobicContact CD1-CD2 4.1Å; F865-L874 HydrophobicContact CG-CD2 4.43Å; L870-L874 WeakPolarHBondContact O-CB 3.38Å; L870-L874 PolarHBondContact O-N 3.46Å; G871-L874 PolarHBondContact O-N 2.85Å; L874-A876 PolarHBondContact O-N 3.31Å; L874-M877 HydrophobicContact CD1-CE 3.73Å; L874-M877 PolarHBondContact O-N 3.45Å; L874-L878 HydrophobicContact CD1-CD1 4.24Å; L874-L878 HydrophobicContact CD1-CG 4.34Å; L874-L878 HydrophobicContact CG-CD1 4.04Å; L874-L878 WeakPolarHBondContact O-CB 3.07Å; L874-L878 WeakPolarHBondContact O-CG 3.33Å; L874-L878 PolarHBondContact O-N 3.35Å; L874-L919 HydrophobicContact CD2-CD1 3.47Å; L874-L919 VanDerWaalsContact CD2-CD1 3.47Å; L874-L919 HydrophobicContact CG-CD1 4.47Å
875	A	94.6	Very high	91.4	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.1	-45.1	175.5	0	0	0	0	0	112.3	G871 R873 L878 N879 F924 C927 I928	G871-A875 VanDerWaalsContact O-CB 3.32Å; G871-A875 WeakPolarHBondContact O-CB 3.16Å; G871-A875 PolarHBondContact O-N 2.77Å; R873-A875 VanDerWaalsContact C-N 3.34Å; A875-L878 PolarHBondContact O-N 2.68Å; A875-N879 VanDerWaalsContact O-CB 3.3Å; A875-N879 WeakPolarHBondContact O-CB 3.21Å; A875-N879 PolarHBondContact O-N 2.8Å; A875-N879 PolarHBondContact O-ND2 3.13Å; A875-N879 PolarHBondContact O-OD1 3.08Å; A875-F924 HydrophobicContact CB-CE2 3.98Å; A875-F924 HydrophobicContact CB-CZ 4.39Å; A875-C927 HydrophobicContact CB-CB 3.86Å; A875-I928 HydrophobicContact CB-CG1 4.23Å
876	A	93.1	Very high	91.3	Very high	30 Å²	30	23.9 Å²	23.9	25%	0.248	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-45.9	177.4	0	0	0	0	0	112.4	D872 R873 L874 L878 N879 Y880 D931	D872-A876 VanDerWaalsContact O-CB 3.22Å; D872-A876 WeakPolarHBondContact O-CB 3.15Å; D872-A876 PolarHBondContact O-N 3.49Å; R873-A876 PolarHBondContact O-N 2.76Å; L874-A876 PolarHBondContact O-N 3.31Å; A876-L878 PolarHBondContact O-N 2.77Å; A876-N879 PolarHBondContact O-N 3.45Å; A876-Y880 WeakPolarHBondContact O-CB 3.44Å; A876-Y880 PolarHBondContact O-N 3.17Å; A876-D931 HydrophobicContact CB-CB 4.06Å
877	M	94.8	Very high	91	Very high	6 Å²	6	23.2 Å²	23.2	3%	0.03	13%	0.13	C	C	.	.	H	α-helix	trans	-59.4	-47	176.2	179.1	-77.6	-68.9	0	0	111	I788 T791 T792 F854 R873 L874 N881	I788-M877 HydrophobicContact CG2-CB 3.94Å; I788-M877 HydrophobicContact CG2-CG 4.21Å; T791-M877 HydrophobicContact CG2-CE 4.12Å; T791-M877 HydrophobicContact CG2-CG 4.41Å; T791-M877 HydrophobicContact CG2-SD 3.55Å; T791-M877 VanDerWaalsContact CG2-SD 3.55Å; T792-M877 VanDerWaalsContact OG1-CG 3.27Å; T792-M877 WeakPolarHBondContact OG1-CG 3.43Å; F854-M877 HydrophobicContact CE2-CE 4.47Å; R873-M877 WeakPolarHBondContact O-CB 3.26Å; R873-M877 PolarHBondContact O-N 3.28Å; L874-M877 HydrophobicContact CD1-CE 3.73Å; L874-M877 PolarHBondContact O-N 3.45Å; M877-N881 WeakPolarHBondContact O-CB 3.37Å; M877-N881 PolarHBondContact O-N 3.18Å; M877-N881 PolarHBondContact O-ND2 2.7Å; M877-N881 PolarHBondContact SD-ND2 3.27Å
878	L	96	Very high	90.8	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.1	-46.4	179	-71.7	171.4	0	0	0	112.1	L874 A875 A876 Y880 N881 L882 L912 I915 Y916 F924	L874-L878 HydrophobicContact CD1-CD1 4.24Å; L874-L878 HydrophobicContact CD1-CG 4.34Å; L874-L878 HydrophobicContact CG-CD1 4.04Å; L874-L878 WeakPolarHBondContact O-CB 3.07Å; L874-L878 WeakPolarHBondContact O-CG 3.33Å; L874-L878 PolarHBondContact O-N 3.35Å; A875-L878 PolarHBondContact O-N 2.68Å; A876-L878 PolarHBondContact O-N 2.77Å; L878-Y880 VanDerWaalsContact C-N 3.35Å; L878-Y880 PolarHBondContact O-N 3.09Å; L878-N881 PolarHBondContact O-N 3.31Å; L878-L882 WeakPolarHBondContact O-CB 3.29Å; L878-L882 PolarHBondContact O-N 3.35Å; L878-L912 HydrophobicContact CD2-CD2 3.71Å; L878-I915 HydrophobicContact CD1-CB 4.32Å; L878-I915 HydrophobicContact CD1-CG2 3.75Å; L878-I915 HydrophobicContact CD2-CB 4.22Å; L878-I915 HydrophobicContact CD2-CD1 3.91Å; L878-I915 HydrophobicContact CD2-CG2 4.27Å; L878-Y916 VanDerWaalsContact C-OH 3.24Å; L878-Y916 HydrophobicContact CB-CE2 3.56Å; L878-Y916 WeakPolarHBondContact CB-OH 3.3Å; L878-Y916 HydrophobicContact CD1-CD2 4.3Å; L878-Y916 HydrophobicContact CD1-CE2 4.07Å; L878-Y916 HydrophobicContact CD2-CE2 4.4Å; L878-Y916 HydrophobicContact CG-CE2 4.23Å; L878-F924 HydrophobicContact CD1-CZ 3.91Å
879	N	94.7	Very high	90.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.6	-46.8	-179.7	-72.8	-18.2	0	0	0	110.6	A875 A876 K883 Y916 I928 D931 F939	A875-N879 VanDerWaalsContact O-CB 3.3Å; A875-N879 WeakPolarHBondContact O-CB 3.21Å; A875-N879 PolarHBondContact O-N 2.8Å; A875-N879 PolarHBondContact O-ND2 3.13Å; A875-N879 PolarHBondContact O-OD1 3.08Å; A876-N879 PolarHBondContact O-N 3.45Å; N879-K883 WeakPolarHBondContact O-CB 3.24Å; N879-K883 PolarHBondContact O-N 3.4Å; N879-Y916 VanDerWaalsContact CA-OH 3.26Å; N879-Y916 WeakPolarHBondContact CA-OH 3.28Å; N879-Y916 PolarHBondContact N-OH 3.38Å; N879-Y916 PolarHBondContact OD1-OH 3.41Å; N879-I928 PolarHBondContact ND2-O 3.46Å; N879-D931 VanDerWaalsContact CB-OD2 3.25Å; N879-D931 WeakPolarHBondContact CB-OD2 3.34Å; N879-D931 PolarHBondContact ND2-OD2 3.21Å; N879-F939 HydrophobicContact CB-CZ 4.3Å; N879-F939 WeakPolarHBondContact O-CE2 2.78Å
880	Y	93	Very high	90.9	Very high	64 Å²	64	27.9 Å²	27.9	25%	0.251	16%	0.156	S	C	.	.	H	α-helix	trans	-61.1	-50	-179.5	175	-112.6	0	0	0	111.3	D796 A876 L878 K883 Q884	D796-Y880 WeakPolarHBondContact OD1-CE1 3.49Å; D796-Y880 VanDerWaalsContact OD1-CZ 3.22Å; D796-Y880 PolarHBondContact OD1-OH 3.25Å; D796-Y880 WeakPolarHBondContact OD2-CE1 3.23Å; D796-Y880 PolarHBondContact OD2-OH 3.2Å; A876-Y880 WeakPolarHBondContact O-CB 3.44Å; A876-Y880 PolarHBondContact O-N 3.17Å; L878-Y880 VanDerWaalsContact C-N 3.35Å; L878-Y880 PolarHBondContact O-N 3.09Å; Y880-K883 WeakPolarHBondContact O-CB 3.48Å; Y880-K883 PolarHBondContact O-N 2.78Å; Y880-Q884 WeakPolarHBondContact O-CG 3.43Å; Y880-Q884 PolarHBondContact O-N 3.01Å; Y880-Q884 VanDerWaalsContact O-N 3.14Å; Y880-Q884 PolarHBondContact OH-NE2 3.29Å; Y880-Q884 VanDerWaalsContact OH-NE2 3.14Å
881	N	93.2	Very high	90.6	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-44.7	179.6	-76.8	-57	0	0	0	112.7	L795 M877 L878 K883 Q884 L885 L912	L795-N881 VanDerWaalsContact CB-OD1 3.26Å; L795-N881 WeakPolarHBondContact CB-OD1 3.47Å; L795-N881 HydrophobicContact CD1-CB 3.93Å; L795-N881 WeakPolarHBondContact CD1-OD1 3.2Å; M877-N881 WeakPolarHBondContact O-CB 3.37Å; M877-N881 PolarHBondContact O-N 3.18Å; M877-N881 PolarHBondContact O-ND2 2.7Å; M877-N881 PolarHBondContact SD-ND2 3.27Å; L878-N881 PolarHBondContact O-N 3.31Å; N881-K883 VanDerWaalsContact C-N 3.28Å; N881-K883 PolarHBondContact O-N 3.31Å; N881-Q884 PolarHBondContact O-N 3.35Å; N881-L885 WeakPolarHBondContact O-CG 3.09Å; N881-L885 PolarHBondContact O-N 3.46Å; N881-L885 VanDerWaalsContact O-N 3.12Å; N881-L912 HydrophobicContact CB-CD1 4.16Å
882	L	94	Very high	90.3	Very high	1 Å²	1	42 Å²	42	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-64.4	-32.7	175.1	-78.3	-176.8	0	0	0	112.8	L878 Q884 L885 C886 I909 L912 T913 Y916 F939 V943	L878-L882 WeakPolarHBondContact O-CB 3.29Å; L878-L882 PolarHBondContact O-N 3.35Å; L882-Q884 VanDerWaalsContact C-N 3.32Å; L882-Q884 PolarHBondContact O-N 3.41Å; L882-L885 PolarHBondContact O-N 3.37Å; L882-C886 VanDerWaalsContact O-CB 3.31Å; L882-C886 WeakPolarHBondContact O-CB 3.31Å; L882-C886 PolarHBondContact O-N 3.41Å; L882-I909 HydrophobicContact CD2-CG2 4.32Å; L882-L912 HydrophobicContact CD2-CB 3.78Å; L882-L912 HydrophobicContact CD2-CD1 3.88Å; L882-L912 HydrophobicContact CG-CB 4.1Å; L882-L912 HydrophobicContact CG-CD1 4.25Å; L882-T913 HydrophobicContact CD1-CG2 3.79Å; L882-T913 HydrophobicContact CD2-CG2 4.06Å; L882-Y916 HydrophobicContact CD1-CD2 4.04Å; L882-Y916 HydrophobicContact CD1-CE2 3.35Å; L882-Y916 HydrophobicContact CG-CE2 4.4Å; L882-F939 HydrophobicContact CB-CE2 4Å; L882-F939 HydrophobicContact CB-CZ 3.87Å; L882-F939 HydrophobicContact CD1-CZ 4.4Å; L882-V943 HydrophobicContact CB-CG2 4.36Å; L882-V943 HydrophobicContact CD1-CG1 4.4Å; L882-V943 HydrophobicContact CD1-CG2 4.47Å
883	K	92.2	Very high	90.3	Very high	96 Å²	96	39.7 Å²	39.7	42%	0.417	20%	0.203	S	C	.	.	H	α-helix	trans	-65.9	-36.3	176.3	-177.7	176.6	-179.7	173.4	0	111.2	N879 Y880 N881 G887 R933 F939	N879-K883 WeakPolarHBondContact O-CB 3.24Å; N879-K883 PolarHBondContact O-N 3.4Å; Y880-K883 WeakPolarHBondContact O-CB 3.48Å; Y880-K883 PolarHBondContact O-N 2.78Å; N881-K883 VanDerWaalsContact C-N 3.28Å; N881-K883 PolarHBondContact O-N 3.31Å; K883-G887 WeakPolarHBondContact O-CA 3.4Å; K883-G887 PolarHBondContact O-N 2.96Å; K883-R933 PolarHBondContact NZ-O 2.91Å; K883-R933 VanDerWaalsContact NZ-O 3.13Å; K883-F939 HydrophobicContact CB-CD2 4.2Å; K883-F939 HydrophobicContact CB-CE2 3.97Å
884	Q	90.3	Very high	90.2	Very high	38 Å²	38	47 Å²	47	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-66.2	-44.8	173.2	-63.4	-164.1	54	0	0	111.6	D796 M799 Y880 N881 L882	D796-Q884 PolarHBondContact OD1-NE2 2.83Å; M799-Q884 VanDerWaalsContact CG-OE1 3.27Å; Y880-Q884 WeakPolarHBondContact O-CG 3.43Å; Y880-Q884 PolarHBondContact O-N 3.01Å; Y880-Q884 VanDerWaalsContact O-N 3.14Å; Y880-Q884 PolarHBondContact OH-NE2 3.29Å; Y880-Q884 VanDerWaalsContact OH-NE2 3.14Å; N881-Q884 PolarHBondContact O-N 3.35Å; L882-Q884 VanDerWaalsContact C-N 3.32Å; L882-Q884 PolarHBondContact O-N 3.41Å
885	L	91.8	Very high	90	Very high	11 Å²	11	47.6 Å²	47.6	6%	0.058	23%	0.234	C	C	.	.	H	α-helix	trans	-74.6	-32.8	-175.4	-64	170.7	0	0	0	114.3	M799 N881 L882 S890 W903 L908 I909 L912	M799-L885 HydrophobicContact CE-CD2 3.94Å; M799-L885 HydrophobicContact SD-CD2 4.25Å; N881-L885 WeakPolarHBondContact O-CG 3.09Å; N881-L885 PolarHBondContact O-N 3.46Å; N881-L885 VanDerWaalsContact O-N 3.12Å; L882-L885 PolarHBondContact O-N 3.37Å; L885-S890 WeakPolarHBondContact O-CB 3Å; L885-W903 HydrophobicContact CD2-CH2 3.55Å; L885-W903 HydrophobicContact CD2-CZ2 4.21Å; L885-L908 HydrophobicContact CD1-CD2 3.69Å; L885-L908 HydrophobicContact CD1-CG 3.79Å; L885-L908 HydrophobicContact CD2-CD2 4.02Å; L885-L908 HydrophobicContact CG-CD2 4.49Å; L885-I909 HydrophobicContact CB-CD1 4.13Å; L885-I909 HydrophobicContact CB-CG1 3.88Å; L885-I909 HydrophobicContact CD1-CG1 3.96Å; L885-I909 HydrophobicContact CG-CG1 4.48Å; L885-L912 HydrophobicContact CD1-CD1 3.54Å
886	C	91	Very high	89.6	Confident	19 Å²	19	53.2 Å²	53.2	13%	0.128	26%	0.259	C	S	.	.	H	α-helix	trans	-108.7	1.6	-178	-62.6	0	0	0	0	113.1	L882 V943 C946	L882-C886 VanDerWaalsContact O-CB 3.31Å; L882-C886 WeakPolarHBondContact O-CB 3.31Å; L882-C886 PolarHBondContact O-N 3.41Å; C886-V943 HydrophobicContact CB-CG2 4.13Å; C886-C946 HydrophobicContact CB-CB 4.35Å
887	G	84.9	Confident	89.3	Confident	9 Å²	9	55.5 Å²	55.5	9%	0.093	27%	0.267	C	S	.	.	S	Bend	trans	-90.1	-177.3	-179.5	0	0	0	0	0	114.1	K883 T889 S890	K883-G887 WeakPolarHBondContact O-CA 3.4Å; K883-G887 PolarHBondContact O-N 2.96Å; G887-T889 PolarHBondContact O-N 3.38Å; G887-S890 VanDerWaalsContact O-CB 3.26Å; G887-S890 WeakPolarHBondContact O-CB 3.4Å; G887-S890 PolarHBondContact O-N 2.84Å; G887-S890 VanDerWaalsContact O-N 3.15Å; G887-S890 PolarHBondContact O-OG 3.13Å
888	P	81.7	Confident	89.1	Confident	120 Å²	120	57.7 Å²	57.7	78%	0.779	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-58.6	-32.8	179.5	-24	34	0	0	0	113.8	S890	P888-S890 PolarHBondContact O-N 3.49Å
889	T	80.1	Confident	88.7	Confident	59 Å²	59	66.5 Å²	66.5	36%	0.362	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-67.5	-20.4	-179.5	-44.7	0	0	0	0	112.9	L803 G887 Q891 R892	L803-T889 HydrophobicContact CD1-CG2 4.38Å; L803-T889 HydrophobicContact CD2-CG2 4.18Å; G887-T889 PolarHBondContact O-N 3.38Å; T889-Q891 PolarHBondContact O-N 3.19Å; T889-Q891 VanDerWaalsContact O-N 3.07Å; T889-R892 WeakPolarHBondContact O-CB 3.26Å; T889-R892 PolarHBondContact O-N 3.16Å
890	S	84	Confident	88.3	Confident	43 Å²	43	72.8 Å²	72.8	30%	0.301	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-54.9	-31	-178	62.9	0	0	0	0	114.2	L885 G887 P888 R892 L893	L885-S890 WeakPolarHBondContact O-CB 3Å; G887-S890 VanDerWaalsContact O-CB 3.26Å; G887-S890 WeakPolarHBondContact O-CB 3.4Å; G887-S890 PolarHBondContact O-N 2.84Å; G887-S890 VanDerWaalsContact O-N 3.15Å; G887-S890 PolarHBondContact O-OG 3.13Å; P888-S890 PolarHBondContact O-N 3.49Å; S890-R892 VanDerWaalsContact C-N 3.28Å; S890-R892 PolarHBondContact O-N 3Å; S890-L893 PolarHBondContact O-N 3.43Å
891	Q	83.7	Confident	88.1	Confident	144 Å²	144	69.9 Å²	69.9	67%	0.673	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-66.6	-30	176.9	-63.9	-174.9	-0	0	0	112.9	T889 L893 R894	T889-Q891 PolarHBondContact O-N 3.19Å; T889-Q891 VanDerWaalsContact O-N 3.07Å; Q891-L893 VanDerWaalsContact C-N 3.33Å; Q891-R894 WeakPolarHBondContact O-CG 3.4Å
892	R	87	Confident	87.8	Confident	153 Å²	153	72.7 Å²	72.7	58%	0.577	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-81.9	-12	-179.1	-62.3	173.9	60.1	-166.9	-3.1	113	L803 N806 T889 S890 R894	L803-R892 HydrophobicContact CD2-CB 3.46Å; L803-R892 VanDerWaalsContact CD2-CB 3.46Å; N806-R892 WeakPolarHBondContact CB-O 3.39Å; N806-R892 VanDerWaalsContact CG-O 3.31Å; T889-R892 WeakPolarHBondContact O-CB 3.26Å; T889-R892 PolarHBondContact O-N 3.16Å; S890-R892 VanDerWaalsContact C-N 3.28Å; S890-R892 PolarHBondContact O-N 3Å; R892-R894 PolarHBondContact O-N 2.92Å
893	L	90.8	Very high	87.8	Confident	6 Å²	6	73.6 Å²	73.6	3%	0.031	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-82.7	9.9	175.3	-57.4	174.7	0	0	0	112.8	M799 L802 L803 S890 Q891 W903	M799-L893 HydrophobicContact CB-CD2 4.26Å; M799-L893 HydrophobicContact SD-CD1 3.69Å; M799-L893 HydrophobicContact SD-CD2 4.2Å; L802-L893 HydrophobicContact CB-CD2 4.09Å; L803-L893 HydrophobicContact CD2-CD2 3.93Å; L803-L893 HydrophobicContact CG-CD2 3.88Å; S890-L893 PolarHBondContact O-N 3.43Å; Q891-L893 VanDerWaalsContact C-N 3.33Å; L893-W903 HydrophobicContact CB-CZ2 4.26Å; L893-W903 HydrophobicContact CD1-CZ2 4.27Å; L893-W903 PolarHBondContact O-NE1 3.37Å
894	R	88.6	Confident	87.8	Confident	185 Å²	185	73.8 Å²	73.8	70%	0.698	36%	0.355	S	S	*	.			trans	-78.9	125.4	178	-71.8	-177.9	176.8	-163.4	1	109.7	N806 Q891 R892	N806-R894 PolarHBondContact ND2-O 3.18Å; Q891-R894 WeakPolarHBondContact O-CG 3.4Å; R892-R894 PolarHBondContact O-N 2.92Å
895	V	90.2	Very high	87.9	Confident	14 Å²	14	74.1 Å²	74.1	9%	0.085	36%	0.361	C	S	.	.			trans	-117.8	156.3	174.4	-66.4	0	0	0	0	109.4	L802 I805 E809 D897 P898 Y901	L802-V895 HydrophobicContact CD2-CG1 3.68Å; L802-V895 HydrophobicContact CD2-CG2 4.25Å; I805-V895 HydrophobicContact CB-CG1 4.3Å; I805-V895 HydrophobicContact CG2-CB 4.45Å; I805-V895 HydrophobicContact CG2-CG1 3.78Å; E809-V895 WeakPolarHBondContact OE2-CA 3.47Å; V895-D897 PolarHBondContact O-N 3.45Å; V895-P898 HydrophobicContact CG2-CB 4.31Å; V895-P898 HydrophobicContact CG2-CG 4.15Å; V895-P898 WeakPolarHBondContact O-CD 3.39Å; V895-Y901 HydrophobicContact CB-CD2 4.38Å; V895-Y901 HydrophobicContact CB-CE2 3.97Å; V895-Y901 HydrophobicContact CG1-CE2 4.48Å; V895-Y901 HydrophobicContact CG2-CD2 3.67Å; V895-Y901 HydrophobicContact CG2-CE2 3.74Å
896	K	86.1	Confident	88	Confident	119 Å²	119	81.1 Å²	81.1	52%	0.517	39%	0.386	S	S	.	.	S	Bend	trans	-62.7	-41.6	-175.2	-72.4	176.2	170.2	177.8	0	112.7	E809 N813 P898	E809-K896 HydrophobicContact CB-CD 4.21Å; E809-K896 HydrophobicContact CB-CG 4.49Å; E809-K896 HydrophobicContact CG-CD 4.36Å; E809-K896 PolarHBondContact O-NZ 3.01Å; E809-K896 WeakPolarHBondContact OE1-CB 3.46Å; E809-K896 PolarHBondContact OE1-N 3.39Å; E809-K896 PolarHBondContact OE2-N 3.24Å; N813-K896 WeakPolarHBondContact OD1-CE 3.45Å; N813-K896 PolarHBondContact OD1-NZ 2.82Å; K896-P898 WeakPolarHBondContact O-CD 3.23Å
897	D	87.1	Confident	88.2	Confident	78 Å²	78	81.6 Å²	81.6	42%	0.417	39%	0.39	S	S	.	.			trans	-123.3	80.5	178.5	-171.5	-2.3	0	0	0	111.9	V895 K899 R900 Y901	V895-D897 PolarHBondContact O-N 3.45Å; D897-K899 PolarHBondContact O-N 3.1Å; D897-K899 PolarHBondContact OD1-N 2.92Å; D897-R900 HydrophobicContact CB-CB 4.12Å; D897-R900 VanDerWaalsContact O-CB 3.31Å; D897-R900 WeakPolarHBondContact O-CB 3.37Å; D897-R900 PolarHBondContact O-N 2.79Å; D897-R900 PolarHBondContact OD1-N 2.85Å; D897-Y901 VanDerWaalsContact O-CD2 3.23Å; D897-Y901 WeakPolarHBondContact O-CD2 3.16Å; D897-Y901 WeakPolarHBondContact O-CE2 3.42Å
898	P	89.9	Confident	88.7	Confident	52 Å²	52	81.8 Å²	81.8	34%	0.338	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-58.3	-32.8	-178.9	-24.9	34.5	0	0	0	113.7	V895 K896 R900 Y901 T902 W903	V895-P898 HydrophobicContact CG2-CB 4.31Å; V895-P898 HydrophobicContact CG2-CG 4.15Å; V895-P898 WeakPolarHBondContact O-CD 3.39Å; K896-P898 WeakPolarHBondContact O-CD 3.23Å; P898-R900 VanDerWaalsContact C-N 3.27Å; P898-R900 PolarHBondContact O-N 3.43Å; P898-Y901 PolarHBondContact O-N 3.19Å; P898-T902 PolarHBondContact O-N 3.43Å; P898-W903 HydrophobicContact CB-CB 4.25Å; P898-W903 PolarHBondContact O-N 3.23Å
899	K	88.7	Confident	89.4	Confident	185 Å²	185	76.4 Å²	76.4	80%	0.804	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-64.9	-34.5	-178.2	-70.8	-174.9	176.3	-176.7	0	111.5	D897 Y901 T902	D897-K899 PolarHBondContact O-N 3.1Å; D897-K899 PolarHBondContact OD1-N 2.92Å; K899-Y901 PolarHBondContact O-N 2.97Å; K899-T902 PolarHBondContact O-N 3.03Å
900	R	85.3	Confident	90.2	Very high	132 Å²	132	76.2 Å²	76.2	50%	0.498	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-57.4	-31.3	177	-171.2	171.8	-179.6	-153.1	-15.4	113.2	E837 R841 D897 P898	E837-R900 VanDerWaalsContact CD-CZ 3.5Å; E837-R900 VanDerWaalsContact CD-NH2 3.32Å; E837-R900 IonicContact OE1-CZ 3.43Å; E837-R900 IonicContact OE1-NE 2.75Å; E837-R900 IonicContact OE1-NH1 3.31Å; E837-R900 PolarHBondContact OE1-NH1 3.37Å; E837-R900 IonicContact OE1-NH2 3.59Å; E837-R900 PolarHBondContact OE1-NH2 3.5Å; E837-R900 IonicContact OE2-CZ 2.68Å; E837-R900 VanDerWaalsContact OE2-CZ 3.31Å; E837-R900 IonicContact OE2-NH1 3.33Å; E837-R900 PolarHBondContact OE2-NH1 3.43Å; E837-R900 IonicContact OE2-NH2 3.04Å; E837-R900 PolarHBondContact OE2-NH2 2.92Å; R841-R900 WeakPolarHBondContact CD-O 3.47Å; D897-R900 HydrophobicContact CB-CB 4.12Å; D897-R900 VanDerWaalsContact O-CB 3.31Å; D897-R900 WeakPolarHBondContact O-CB 3.37Å; D897-R900 PolarHBondContact O-N 2.79Å; D897-R900 PolarHBondContact OD1-N 2.85Å; P898-R900 VanDerWaalsContact C-N 3.27Å; P898-R900 PolarHBondContact O-N 3.43Å
901	Y	89.2	Confident	90.8	Very high	2 Å²	2	75.2 Å²	75.2	1%	0.008	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-100.1	3.2	179.9	-47.6	-69.2	0	0	0	113.4	I805 E837 V840 L844 V895 D897 P898 K899 W903	I805-Y901 HydrophobicContact CD1-CD1 4.48Å; I805-Y901 HydrophobicContact CD1-CE1 4.06Å; E837-Y901 HydrophobicContact CB-CE1 3.75Å; E837-Y901 HydrophobicContact CG-CE1 3.57Å; E837-Y901 PolarHBondContact OE1-OH 3.32Å; V840-Y901 HydrophobicContact CG1-CD1 4.49Å; L844-Y901 WeakPolarHBondContact CD1-O 3.45Å; V895-Y901 HydrophobicContact CB-CD2 4.38Å; V895-Y901 HydrophobicContact CB-CE2 3.97Å; V895-Y901 HydrophobicContact CG1-CE2 4.48Å; V895-Y901 HydrophobicContact CG2-CD2 3.67Å; V895-Y901 HydrophobicContact CG2-CE2 3.74Å; D897-Y901 VanDerWaalsContact O-CD2 3.23Å; D897-Y901 WeakPolarHBondContact O-CD2 3.16Å; D897-Y901 WeakPolarHBondContact O-CE2 3.42Å; P898-Y901 PolarHBondContact O-N 3.19Å; K899-Y901 PolarHBondContact O-N 2.97Å; Y901-W903 PolarHBondContact O-N 3.1Å
902	T	87.9	Confident	91.4	Very high	61 Å²	61	68.3 Å²	68.3	37%	0.374	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	27.7	-167.2	65.5	0	0	0	0	113.3	P898 K899 E904	P898-T902 PolarHBondContact O-N 3.43Å; K899-T902 PolarHBondContact O-N 3.03Å; T902-E904 PolarHBondContact O-N 3.27Å; T902-E904 VanDerWaalsContact O-N 3.1Å
903	W	93.6	Very high	91.9	Very high	19 Å²	19	61.1 Å²	61.1	7%	0.072	28%	0.281	C	S	.	.			trans	-79.1	98	-176.3	-179.9	-130.2	0	0	0	111.3	M799 L802 L844 L885 L893 P898 Y901 P905 L908	M799-W903 HydrophobicContact CE-CH2 3.61Å; M799-W903 HydrophobicContact CE-CZ3 3.83Å; M799-W903 HydrophobicContact SD-CH2 3.68Å; M799-W903 HydrophobicContact SD-CZ2 4.39Å; M799-W903 HydrophobicContact SD-CZ3 4.34Å; L802-W903 HydrophobicContact CD1-CD2 3.74Å; L802-W903 HydrophobicContact CD1-CE3 3.92Å; L802-W903 HydrophobicContact CD1-CG 4.29Å; L802-W903 HydrophobicContact CD1-CH2 4.02Å; L802-W903 HydrophobicContact CD1-CZ2 3.85Å; L802-W903 HydrophobicContact CD1-CZ3 4.06Å; L844-W903 HydrophobicContact CD1-CB 4.09Å; L844-W903 HydrophobicContact CD1-CD2 4.41Å; L844-W903 HydrophobicContact CD1-CE3 3.75Å; L844-W903 HydrophobicContact CD2-CE3 3.64Å; L844-W903 HydrophobicContact CD2-CZ3 3.69Å; L844-W903 HydrophobicContact CG-CE3 4.38Å; L885-W903 HydrophobicContact CD2-CH2 3.55Å; L885-W903 HydrophobicContact CD2-CZ2 4.21Å; L893-W903 HydrophobicContact CB-CZ2 4.26Å; L893-W903 HydrophobicContact CD1-CZ2 4.27Å; L893-W903 PolarHBondContact O-NE1 3.37Å; P898-W903 HydrophobicContact CB-CB 4.25Å; P898-W903 PolarHBondContact O-N 3.23Å; Y901-W903 PolarHBondContact O-N 3.1Å; W903-P905 HydrophobicContact CH2-CB 4.18Å; W903-P905 HydrophobicContact CZ2-CB 3.77Å; W903-P905 HydrophobicContact CZ2-CG 4.25Å; W903-P905 WeakPolarHBondContact O-CD 3.5Å; W903-L908 HydrophobicContact CH2-CD2 4.35Å; W903-L908 HydrophobicContact CZ3-CD2 3.97Å
904	E	92.7	Very high	92.2	Very high	101 Å²	101	62.7 Å²	62.7	47%	0.472	29%	0.289	S	S	.	.			trans	-119.8	71.7	-179.7	-63.3	-171.9	147.6	0	0	111	R848 T902 R906 S907 L908	R848-E904 IonicContact CZ-OE2 2.82Å; R848-E904 IonicContact NH1-OE2 3.35Å; R848-E904 PolarHBondContact NH1-OE2 2.91Å; R848-E904 IonicContact NH2-OE2 2.73Å; R848-E904 PolarHBondContact NH2-OE2 3.26Å; R848-E904 VanDerWaalsContact NH2-OE2 3.08Å; T902-E904 PolarHBondContact O-N 3.27Å; T902-E904 VanDerWaalsContact O-N 3.1Å; E904-R906 PolarHBondContact O-N 3.19Å; E904-S907 PolarHBondContact O-N 2.89Å; E904-L908 PolarHBondContact O-N 3.38Å; E904-L908 VanDerWaalsContact O-N 3.12Å
905	P	92.6	Very high	92.6	Very high	45 Å²	45	53.9 Å²	53.9	29%	0.292	26%	0.255	S	S	.	.	H	α-helix	trans	-58.8	-29.2	-172	21.5	-33.1	0	0	0	113.2	W903 L908 I909	W903-P905 HydrophobicContact CH2-CB 4.18Å; W903-P905 HydrophobicContact CZ2-CB 3.77Å; W903-P905 HydrophobicContact CZ2-CG 4.25Å; W903-P905 WeakPolarHBondContact O-CD 3.5Å; P905-L908 PolarHBondContact O-N 2.67Å; P905-I909 WeakPolarHBondContact O-CB 3.35Å; P905-I909 WeakPolarHBondContact O-CD1 3.46Å; P905-I909 WeakPolarHBondContact O-CG1 3.34Å; P905-I909 PolarHBondContact O-N 2.98Å
906	R	94	Very high	92.9	Very high	157 Å²	157	53.2 Å²	53.2	59%	0.592	25%	0.251	S	S	*	.	H	α-helix	trans	-67.9	-41.2	176.8	-62.4	-180	-172	163.3	2.7	112.3	E904 N910 I952	E904-R906 PolarHBondContact O-N 3.19Å; R906-N910 WeakPolarHBondContact O-CB 3.28Å; R906-N910 PolarHBondContact O-N 3.35Å; R906-I952 HydrophobicContact CB-CD1 4.26Å; R906-I952 HydrophobicContact CB-CG1 4.27Å; R906-I952 HydrophobicContact CG-CD1 4.22Å; R906-I952 HydrophobicContact CG-CG1 4.36Å; R906-I952 WeakPolarHBondContact O-CG2 3.39Å
907	S	94.4	Very high	93.4	Very high	30 Å²	30	48.4 Å²	48.4	21%	0.21	23%	0.231	C	C	.	.	H	α-helix	trans	-64.8	-45.8	175.2	-162.4	0	0	0	0	109.7	R848 E904 I909 N910 E911	R848-S907 PolarHBondContact NH2-OG 3.38Å; E904-S907 PolarHBondContact O-N 2.89Å; S907-I909 PolarHBondContact O-N 3.09Å; S907-N910 WeakPolarHBondContact O-CA 3.5Å; S907-N910 VanDerWaalsContact O-CB 3.32Å; S907-N910 WeakPolarHBondContact O-CB 3.31Å; S907-N910 PolarHBondContact O-N 3.17Å; S907-N910 VanDerWaalsContact O-N 3.1Å; S907-E911 WeakPolarHBondContact O-CG 3.48Å; S907-E911 PolarHBondContact O-N 2.85Å; S907-E911 PolarHBondContact OG-OE1 3.01Å
908	L	95	Very high	93.8	Very high	13 Å²	13	45.9 Å²	45.9	7%	0.068	22%	0.218	C	C	.	.	H	α-helix	trans	-60.2	-46.1	179.1	-177.9	59.5	0	0	0	112.2	L795 M799 I851 L885 W903 E904 P905 N910 E911 L912	L795-L908 HydrophobicContact CD2-CD1 4.42Å; L795-L908 HydrophobicContact CD2-CD2 3.95Å; M799-L908 HydrophobicContact CE-CD2 4.31Å; I851-L908 HydrophobicContact CD1-CD1 3.28Å; L885-L908 HydrophobicContact CD1-CD2 3.69Å; L885-L908 HydrophobicContact CD1-CG 3.79Å; L885-L908 HydrophobicContact CD2-CD2 4.02Å; L885-L908 HydrophobicContact CG-CD2 4.49Å; W903-L908 HydrophobicContact CH2-CD2 4.35Å; W903-L908 HydrophobicContact CZ3-CD2 3.97Å; E904-L908 PolarHBondContact O-N 3.38Å; E904-L908 VanDerWaalsContact O-N 3.12Å; P905-L908 PolarHBondContact O-N 2.67Å; L908-N910 VanDerWaalsContact C-N 3.32Å; L908-N910 PolarHBondContact O-N 3.49Å; L908-E911 PolarHBondContact O-N 3.38Å; L908-L912 HydrophobicContact CD1-CD1 4.16Å; L908-L912 HydrophobicContact CD1-CG 4.25Å; L908-L912 HydrophobicContact CG-CD1 4.04Å; L908-L912 WeakPolarHBondContact O-CB 3.4Å; L908-L912 VanDerWaalsContact O-CG 3.29Å; L908-L912 WeakPolarHBondContact O-CG 3.19Å; L908-L912 PolarHBondContact O-N 3.07Å
909	I	96.2	Very high	94.1	Very high	7 Å²	7	43.5 Å²	43.5	4%	0.036	20%	0.202	C	C	.	.	H	α-helix	trans	-61.5	-42.5	174.6	-67.8	163.2	0	0	0	110.6	L882 L885 P905 S907 E911 T913 L947 I952	L882-I909 HydrophobicContact CD2-CG2 4.32Å; L885-I909 HydrophobicContact CB-CD1 4.13Å; L885-I909 HydrophobicContact CB-CG1 3.88Å; L885-I909 HydrophobicContact CD1-CG1 3.96Å; L885-I909 HydrophobicContact CG-CG1 4.48Å; P905-I909 WeakPolarHBondContact O-CB 3.35Å; P905-I909 WeakPolarHBondContact O-CD1 3.46Å; P905-I909 WeakPolarHBondContact O-CG1 3.34Å; P905-I909 PolarHBondContact O-N 2.98Å; S907-I909 PolarHBondContact O-N 3.09Å; I909-E911 VanDerWaalsContact C-N 3.34Å; I909-E911 PolarHBondContact O-N 3.33Å; I909-T913 HydrophobicContact CG2-CG2 4.33Å; I909-T913 WeakPolarHBondContact O-CB 3.5Å; I909-T913 WeakPolarHBondContact O-CG2 3.48Å; I909-T913 PolarHBondContact O-N 3.02Å; I909-T913 PolarHBondContact O-OG1 3.31Å; I909-L947 HydrophobicContact CG2-CD2 3.72Å; I909-I952 HydrophobicContact CB-CD1 4.32Å; I909-I952 HydrophobicContact CD1-CD1 4.29Å; I909-I952 HydrophobicContact CG2-CD1 4.11Å
910	N	96.8	Very high	94.4	Very high	54 Å²	54	37.2 Å²	37.2	29%	0.289	18%	0.177	S	C	.	.	H	α-helix	trans	-59.3	-44.9	177.6	177.9	58.1	0	0	0	112.1	R906 S907 L908 T913 E914 I952 K953	R906-N910 WeakPolarHBondContact O-CB 3.28Å; R906-N910 PolarHBondContact O-N 3.35Å; S907-N910 WeakPolarHBondContact O-CA 3.5Å; S907-N910 VanDerWaalsContact O-CB 3.32Å; S907-N910 WeakPolarHBondContact O-CB 3.31Å; S907-N910 PolarHBondContact O-N 3.17Å; S907-N910 VanDerWaalsContact O-N 3.1Å; L908-N910 VanDerWaalsContact C-N 3.32Å; L908-N910 PolarHBondContact O-N 3.49Å; N910-T913 PolarHBondContact O-OG1 3.26Å; N910-E914 WeakPolarHBondContact O-CB 3.35Å; N910-E914 PolarHBondContact O-N 3.11Å; N910-I952 HydrophobicContact CB-CG2 3.6Å; N910-K953 WeakPolarHBondContact O-CE 3.22Å; N910-K953 PolarHBondContact O-NZ 3.35Å; N910-K953 WeakPolarHBondContact OD1-CG 3.42Å; N910-K953 PolarHBondContact OD1-NZ 3.12Å
911	E	96.6	Very high	94.7	Very high	22 Å²	22	32.9 Å²	32.9	10%	0.103	17%	0.167	C	C	.	.	H	α-helix	trans	-68.7	-50.4	-179.6	-70.3	160.3	-153.4	0	0	111	R848 I851 V855 S907 L908 I909 T913 E914 I915	R848-E911 IonicContact NE-OE1 3.95Å; I851-E911 HydrophobicContact CG2-CB 3.64Å; V855-E911 HydrophobicContact CG2-CB 3.91Å; V855-E911 HydrophobicContact CG2-CG 4.43Å; V855-E911 WeakPolarHBondContact CG2-O 3.49Å; S907-E911 WeakPolarHBondContact O-CG 3.48Å; S907-E911 PolarHBondContact O-N 2.85Å; S907-E911 PolarHBondContact OG-OE1 3.01Å; L908-E911 PolarHBondContact O-N 3.38Å; I909-E911 VanDerWaalsContact C-N 3.34Å; I909-E911 PolarHBondContact O-N 3.33Å; E911-T913 VanDerWaalsContact C-N 3.31Å; E911-T913 PolarHBondContact O-N 3.4Å; E911-E914 WeakPolarHBondContact O-CB 3.48Å; E911-E914 PolarHBondContact O-N 3.29Å; E911-I915 PolarHBondContact O-N 3.22Å
912	L	96.8	Very high	94.9	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56.7	-44.6	177.2	-71.6	171.2	0	0	0	112	I851 L878 N881 L882 L885 L908 E914 I915 Y916	I851-L912 HydrophobicContact CD1-CD2 4.11Å; I851-L912 HydrophobicContact CG1-CD2 4.49Å; L878-L912 HydrophobicContact CD2-CD2 3.71Å; N881-L912 HydrophobicContact CB-CD1 4.16Å; L882-L912 HydrophobicContact CD2-CB 3.78Å; L882-L912 HydrophobicContact CD2-CD1 3.88Å; L882-L912 HydrophobicContact CG-CB 4.1Å; L882-L912 HydrophobicContact CG-CD1 4.25Å; L885-L912 HydrophobicContact CD1-CD1 3.54Å; L908-L912 HydrophobicContact CD1-CD1 4.16Å; L908-L912 HydrophobicContact CD1-CG 4.25Å; L908-L912 HydrophobicContact CG-CD1 4.04Å; L908-L912 WeakPolarHBondContact O-CB 3.4Å; L908-L912 VanDerWaalsContact O-CG 3.29Å; L908-L912 WeakPolarHBondContact O-CG 3.19Å; L908-L912 PolarHBondContact O-N 3.07Å; L912-E914 VanDerWaalsContact C-N 3.33Å; L912-E914 PolarHBondContact O-N 3.42Å; L912-I915 WeakPolarHBondContact O-CB 3.42Å; L912-I915 PolarHBondContact O-N 3.05Å; L912-Y916 WeakPolarHBondContact O-CD2 3.43Å
913	T	97.1	Very high	95.1	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	21%	0.211	C	C	.	.	H	α-helix	trans	-73.3	-22.1	178	52.1	0	0	0	0	113.3	L882 I909 N910 E911 I915 Y916 L917 V943 L947 K953 L961	L882-T913 HydrophobicContact CD1-CG2 3.79Å; L882-T913 HydrophobicContact CD2-CG2 4.06Å; I909-T913 HydrophobicContact CG2-CG2 4.33Å; I909-T913 WeakPolarHBondContact O-CB 3.5Å; I909-T913 WeakPolarHBondContact O-CG2 3.48Å; I909-T913 PolarHBondContact O-N 3.02Å; I909-T913 PolarHBondContact O-OG1 3.31Å; N910-T913 PolarHBondContact O-OG1 3.26Å; E911-T913 VanDerWaalsContact C-N 3.31Å; E911-T913 PolarHBondContact O-N 3.4Å; T913-I915 VanDerWaalsContact C-N 3.34Å; T913-Y916 PolarHBondContact O-N 2.99Å; T913-L917 WeakPolarHBondContact O-CG 3.32Å; T913-L917 PolarHBondContact O-N 3.42Å; T913-V943 HydrophobicContact CG2-CG1 3.88Å; T913-L947 HydrophobicContact CG2-CD1 4.34Å; T913-K953 WeakPolarHBondContact OG1-CE 3.48Å; T913-L961 HydrophobicContact CG2-CD2 4.47Å
914	E	97.5	Very high	95.2	Very high	39 Å²	39	41.8 Å²	41.8	18%	0.182	21%	0.207	C	C	.	.	H	α-helix	trans	-67.1	-37.2	170.8	-163.5	65	-159.8	0	0	110.9	V855 N910 E911 L912 Y916 L917 N918 K953 K957	V855-E914 HydrophobicContact CG1-CB 4.4Å; V855-E914 HydrophobicContact CG1-CG 4.18Å; N910-E914 WeakPolarHBondContact O-CB 3.35Å; N910-E914 PolarHBondContact O-N 3.11Å; E911-E914 WeakPolarHBondContact O-CB 3.48Å; E911-E914 PolarHBondContact O-N 3.29Å; L912-E914 VanDerWaalsContact C-N 3.33Å; L912-E914 PolarHBondContact O-N 3.42Å; E914-Y916 VanDerWaalsContact C-N 3.3Å; E914-Y916 PolarHBondContact O-N 3.35Å; E914-L917 PolarHBondContact O-N 3.37Å; E914-N918 WeakPolarHBondContact O-CB 3.45Å; E914-N918 VanDerWaalsContact O-CG 3.26Å; E914-N918 PolarHBondContact O-N 2.74Å; E914-N918 PolarHBondContact O-OD1 3.36Å; E914-K953 IonicContact OE2-NZ 3.78Å; E914-K953 PolarHBondContact OE2-NZ 3.46Å; E914-K957 IonicContact OE1-NZ 2.66Å; E914-K957 PolarHBondContact OE1-NZ 3.15Å; E914-K957 IonicContact OE2-NZ 3.33Å
915	I	96.9	Very high	95.2	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-40.4	176.2	-58.8	165.9	0	0	0	111.1	I851 F854 V855 T858 L878 E911 L912 T913 L917 N918 L919	I851-I915 HydrophobicContact CG2-CD1 4.36Å; F854-I915 HydrophobicContact CB-CD1 3.55Å; F854-I915 HydrophobicContact CB-CG1 4.17Å; F854-I915 HydrophobicContact CG-CD1 4.37Å; V855-I915 HydrophobicContact CG2-CD1 4.22Å; V855-I915 HydrophobicContact CG2-CG1 3.83Å; T858-I915 HydrophobicContact CG2-CG2 4.3Å; L878-I915 HydrophobicContact CD1-CB 4.32Å; L878-I915 HydrophobicContact CD1-CG2 3.75Å; L878-I915 HydrophobicContact CD2-CB 4.22Å; L878-I915 HydrophobicContact CD2-CD1 3.91Å; L878-I915 HydrophobicContact CD2-CG2 4.27Å; E911-I915 PolarHBondContact O-N 3.22Å; L912-I915 WeakPolarHBondContact O-CB 3.42Å; L912-I915 PolarHBondContact O-N 3.05Å; T913-I915 VanDerWaalsContact C-N 3.34Å; I915-L917 VanDerWaalsContact C-N 3.31Å; I915-L917 PolarHBondContact O-N 3.35Å; I915-N918 PolarHBondContact O-N 3.48Å; I915-L919 HydrophobicContact CG2-CD1 3.93Å; I915-L919 WeakPolarHBondContact O-CB 3.19Å; I915-L919 WeakPolarHBondContact O-CG 3.35Å; I915-L919 PolarHBondContact O-N 2.89Å; I915-L919 VanDerWaalsContact O-N 3.07Å
916	Y	96.7	Very high	95.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.9	-41.3	173.8	-79.5	-95.9	0	0	0	112.8	L878 N879 L882 L912 T913 E914 L919 D920 F924 I928 F940 L964	L878-Y916 VanDerWaalsContact C-OH 3.24Å; L878-Y916 HydrophobicContact CB-CE2 3.56Å; L878-Y916 WeakPolarHBondContact CB-OH 3.3Å; L878-Y916 HydrophobicContact CD1-CD2 4.3Å; L878-Y916 HydrophobicContact CD1-CE2 4.07Å; L878-Y916 HydrophobicContact CD2-CE2 4.4Å; L878-Y916 HydrophobicContact CG-CE2 4.23Å; N879-Y916 VanDerWaalsContact CA-OH 3.26Å; N879-Y916 WeakPolarHBondContact CA-OH 3.28Å; N879-Y916 PolarHBondContact N-OH 3.38Å; N879-Y916 PolarHBondContact OD1-OH 3.41Å; L882-Y916 HydrophobicContact CD1-CD2 4.04Å; L882-Y916 HydrophobicContact CD1-CE2 3.35Å; L882-Y916 HydrophobicContact CG-CE2 4.4Å; L912-Y916 WeakPolarHBondContact O-CD2 3.43Å; T913-Y916 PolarHBondContact O-N 2.99Å; E914-Y916 VanDerWaalsContact C-N 3.3Å; E914-Y916 PolarHBondContact O-N 3.35Å; Y916-L919 CarbonylContact O-C 3.57Å; Y916-L919 PolarHBondContact O-N 3.04Å; Y916-D920 PolarHBondContact O-N 3.21Å; Y916-F924 AromaticContact CD1-CE1 3.78Å; Y916-F924 HydrophobicContact CD1-CE1 3.78Å; Y916-F924 HydrophobicContact CD1-CZ 4.35Å; Y916-F924 HydrophobicContact CE1-CE1 4.34Å; Y916-F924 HydrophobicContact CG-CE1 4.3Å; Y916-I928 HydrophobicContact CD1-CD1 3.81Å; Y916-I928 HydrophobicContact CD1-CG1 4.44Å; Y916-I928 HydrophobicContact CE1-CD1 3.85Å; Y916-I928 HydrophobicContact CE1-CG1 4.04Å; Y916-F940 HydrophobicContact CD1-CE1 4.25Å; Y916-F940 HydrophobicContact CD1-CZ 4.06Å; Y916-F940 HydrophobicContact CE1-CE1 4.23Å; Y916-F940 AromaticContact CE1-CZ 3.85Å; Y916-F940 HydrophobicContact CE1-CZ 3.85Å; Y916-L964 HydrophobicContact CD1-CD2 4.32Å
917	L	96.3	Very high	95.1	Very high	18 Å²	18	28.6 Å²	28.6	9%	0.094	15%	0.153	C	C	.	.	H	α-helix	trans	-73	-36.7	-178.1	-65.6	174.9	0	0	0	111.4	T913 E914 I915 L919 D920 K953 K957 Q960 L961	T913-L917 WeakPolarHBondContact O-CG 3.32Å; T913-L917 PolarHBondContact O-N 3.42Å; E914-L917 PolarHBondContact O-N 3.37Å; I915-L917 VanDerWaalsContact C-N 3.31Å; I915-L917 PolarHBondContact O-N 3.35Å; L917-L919 VanDerWaalsContact C-N 3.26Å; L917-L919 PolarHBondContact O-N 3.01Å; L917-D920 PolarHBondContact O-N 3.41Å; L917-K953 HydrophobicContact CD1-CD 4.2Å; L917-K957 HydrophobicContact CD1-CB 4.07Å; L917-K957 HydrophobicContact CD1-CD 3.55Å; L917-K957 HydrophobicContact CD1-CG 4.43Å; L917-Q960 HydrophobicContact CD2-CB 3.85Å; L917-L961 HydrophobicContact CD2-CB 4.17Å; L917-L961 HydrophobicContact CD2-CD1 4.13Å
918	N	95.9	Very high	95	Very high	26 Å²	26	27.1 Å²	27.1	14%	0.139	14%	0.143	C	C	.	.	H	α-helix	trans	-62.5	-35.9	173.9	-71.9	-8.4	0	0	0	111.7	V855 T858 K859 T862 E914 I915	V855-N918 PolarHBondContact O-ND2 3.42Å; T858-N918 WeakPolarHBondContact O-CB 3.34Å; T858-N918 PolarHBondContact OG1-ND2 2.99Å; K859-N918 PolarHBondContact N-ND2 3.28Å; T862-N918 VanDerWaalsContact CG2-O 3.22Å; T862-N918 WeakPolarHBondContact CG2-O 3.41Å; E914-N918 WeakPolarHBondContact O-CB 3.45Å; E914-N918 VanDerWaalsContact O-CG 3.26Å; E914-N918 PolarHBondContact O-N 2.74Å; E914-N918 PolarHBondContact O-OD1 3.36Å; I915-N918 PolarHBondContact O-N 3.48Å
919	L	95.7	Very high	94.8	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	12.1	-178.4	-60.2	177.6	0	0	0	114.1	T858 T862 F865 L874 I915 Y916 L917 C921 F924	T858-L919 HydrophobicContact CG2-CD1 4.29Å; T858-L919 HydrophobicContact CG2-CD2 4.1Å; T858-L919 HydrophobicContact CG2-CG 4.29Å; T862-L919 HydrophobicContact CG2-CD2 3.93Å; F865-L919 HydrophobicContact CB-CD1 4.35Å; F865-L919 HydrophobicContact CB-CD2 4.06Å; L874-L919 HydrophobicContact CD2-CD1 3.47Å; L874-L919 VanDerWaalsContact CD2-CD1 3.47Å; L874-L919 HydrophobicContact CG-CD1 4.47Å; I915-L919 HydrophobicContact CG2-CD1 3.93Å; I915-L919 WeakPolarHBondContact O-CB 3.19Å; I915-L919 WeakPolarHBondContact O-CG 3.35Å; I915-L919 PolarHBondContact O-N 2.89Å; I915-L919 VanDerWaalsContact O-N 3.07Å; Y916-L919 CarbonylContact O-C 3.57Å; Y916-L919 PolarHBondContact O-N 3.04Å; L917-L919 VanDerWaalsContact C-N 3.26Å; L917-L919 PolarHBondContact O-N 3.01Å; L919-C921 PolarHBondContact O-N 3.13Å; L919-F924 HydrophobicContact CB-CB 4.34Å; L919-F924 HydrophobicContact CB-CD1 3.62Å; L919-F924 HydrophobicContact CB-CD2 4.12Å; L919-F924 HydrophobicContact CB-CE1 3.88Å; L919-F924 HydrophobicContact CB-CE2 4.36Å; L919-F924 HydrophobicContact CB-CG 3.76Å; L919-F924 HydrophobicContact CB-CZ 4.25Å; L919-F924 HydrophobicContact CD1-CD2 4.19Å; L919-F924 HydrophobicContact CD1-CE1 4.46Å; L919-F924 HydrophobicContact CD1-CE2 3.85Å; L919-F924 HydrophobicContact CD1-CZ 4.01Å; L919-F924 WeakPolarHBondContact O-CB 3.31Å; L919-F924 WeakPolarHBondContact O-CD1 3.26Å; L919-F924 WeakPolarHBondContact O-CG 3.32Å
920	D	94.4	Very high	94.3	Very high	53 Å²	53	28.4 Å²	28.4	28%	0.283	16%	0.156	S	C	.	.			trans	-62.7	95.1	-178.6	-179.9	4.5	0	0	0	111.9	Y916 L917 K967	Y916-D920 PolarHBondContact O-N 3.21Å; L917-D920 PolarHBondContact O-N 3.41Å; D920-K967 IonicContact OD1-NZ 3.73Å; D920-K967 PolarHBondContact OD1-NZ 3.01Å; D920-K967 IonicContact OD2-NZ 2.96Å
921	C	92.9	Very high	93.9	Very high	41 Å²	41	26.8 Å²	26.8	28%	0.277	15%	0.147	S	C	.	.	S	Bend	trans	-153.6	166.3	170.1	67.9	0	0	0	0	110.6	L866 L919 K923 F924 V925	L866-C921 WeakPolarHBondContact CD1-SG 3.36Å; L919-C921 PolarHBondContact O-N 3.13Å; C921-K923 PolarHBondContact O-N 2.89Å; C921-F924 PolarHBondContact O-N 3.41Å; C921-F924 VanDerWaalsContact O-N 3.14Å; C921-V925 WeakPolarHBondContact O-CG2 3.45Å; C921-V925 PolarHBondContact O-N 2.88Å
922	D	92.6	Very high	93.1	Very high	132 Å²	132	32.6 Å²	32.6	71%	0.706	17%	0.174	S	C	*	.	H	α-helix	trans	-61.1	-31.4	-176.3	-64.9	-26.1	0	0	0	113.4	G926	D922-G926 PolarHBondContact O-N 3.22Å; D922-G926 VanDerWaalsContact O-N 3.08Å
923	K	92	Very high	92.5	Very high	138 Å²	138	42.2 Å²	42.2	60%	0.6	21%	0.21	S	C	*	.	H	α-helix	trans	-63.2	-50.4	174.9	-68.6	-176	179.5	179.3	0	111	C921 V925 G926 C927	C921-K923 PolarHBondContact O-N 2.89Å; K923-V925 VanDerWaalsContact C-N 3.33Å; K923-V925 PolarHBondContact O-N 3.37Å; K923-G926 WeakPolarHBondContact O-CA 3.46Å; K923-G926 PolarHBondContact O-N 3.27Å; K923-G926 VanDerWaalsContact O-N 3.07Å; K923-C927 PolarHBondContact O-N 3.05Å; K923-C927 VanDerWaalsContact O-N 3.15Å
924	F	95.1	Very high	92	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.7	-36.3	179.7	-168	-123.4	0	0	0	112.3	L866 A875 L878 Y916 L919 C921 G926 C927 I928	L866-F924 HydrophobicContact CD2-CB 3.57Å; L866-F924 HydrophobicContact CD2-CD2 3.61Å; L866-F924 HydrophobicContact CD2-CG 3.94Å; A875-F924 HydrophobicContact CB-CE2 3.98Å; A875-F924 HydrophobicContact CB-CZ 4.39Å; L878-F924 HydrophobicContact CD1-CZ 3.91Å; Y916-F924 AromaticContact CD1-CE1 3.78Å; Y916-F924 HydrophobicContact CD1-CE1 3.78Å; Y916-F924 HydrophobicContact CD1-CZ 4.35Å; Y916-F924 HydrophobicContact CE1-CE1 4.34Å; Y916-F924 HydrophobicContact CG-CE1 4.3Å; L919-F924 HydrophobicContact CB-CB 4.34Å; L919-F924 HydrophobicContact CB-CD1 3.62Å; L919-F924 HydrophobicContact CB-CD2 4.12Å; L919-F924 HydrophobicContact CB-CE1 3.88Å; L919-F924 HydrophobicContact CB-CE2 4.36Å; L919-F924 HydrophobicContact CB-CG 3.76Å; L919-F924 HydrophobicContact CB-CZ 4.25Å; L919-F924 HydrophobicContact CD1-CD2 4.19Å; L919-F924 HydrophobicContact CD1-CE1 4.46Å; L919-F924 HydrophobicContact CD1-CE2 3.85Å; L919-F924 HydrophobicContact CD1-CZ 4.01Å; L919-F924 WeakPolarHBondContact O-CB 3.31Å; L919-F924 WeakPolarHBondContact O-CD1 3.26Å; L919-F924 WeakPolarHBondContact O-CG 3.32Å; C921-F924 PolarHBondContact O-N 3.41Å; C921-F924 VanDerWaalsContact O-N 3.14Å; F924-G926 PolarHBondContact O-N 3.42Å; F924-C927 HydrophobicContact CD2-CB 4.35Å; F924-C927 WeakPolarHBondContact O-CB 3.38Å; F924-C927 PolarHBondContact O-N 3.03Å; F924-I928 HydrophobicContact CD1-CD1 3.72Å; F924-I928 HydrophobicContact CD1-CG1 4.2Å; F924-I928 HydrophobicContact CE1-CD1 3.65Å; F924-I928 HydrophobicContact CE1-CG1 3.97Å; F924-I928 HydrophobicContact CG-CD1 4.47Å; F924-I928 HydrophobicContact CZ-CD1 4.36Å; F924-I928 HydrophobicContact CZ-CG1 4.19Å; F924-I928 WeakPolarHBondContact O-CG1 3.36Å; F924-I928 PolarHBondContact O-N 3.27Å
925	V	94	Very high	91.5	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-53.9	-44.9	170	169.6	0	0	0	0	110.5	C921 K923 C927 I928 V929 L964 K967 V968 V971	C921-V925 WeakPolarHBondContact O-CG2 3.45Å; C921-V925 PolarHBondContact O-N 2.88Å; K923-V925 VanDerWaalsContact C-N 3.33Å; K923-V925 PolarHBondContact O-N 3.37Å; V925-C927 VanDerWaalsContact C-N 3.34Å; V925-C927 PolarHBondContact O-N 2.85Å; V925-I928 PolarHBondContact O-N 3.43Å; V925-V929 WeakPolarHBondContact O-CG2 3.48Å; V925-V929 PolarHBondContact O-N 3.48Å; V925-L964 HydrophobicContact CG2-CD1 3.56Å; V925-K967 HydrophobicContact CG1-CB 4.4Å; V925-K967 HydrophobicContact CG2-CB 4.12Å; V925-K967 HydrophobicContact CG2-CD 4.45Å; V925-V968 HydrophobicContact CB-CG2 4.37Å; V925-V968 HydrophobicContact CG1-CB 4.39Å; V925-V968 HydrophobicContact CG1-CG2 3.96Å; V925-V968 HydrophobicContact CG2-CG2 4.11Å; V925-V971 HydrophobicContact CG1-CB 4Å; V925-V971 HydrophobicContact CG1-CG1 4.49Å; V925-V971 HydrophobicContact CG1-CG2 3.7Å
926	G	91.6	Very high	90.9	Very high	11 Å²	11	43.3 Å²	43.3	11%	0.113	22%	0.221	C	C	.	.	H	α-helix	trans	-58.9	-40.6	173.7	0	0	0	0	0	113.7	D922 K923 F924 V929 A930 R975	D922-G926 PolarHBondContact O-N 3.22Å; D922-G926 VanDerWaalsContact O-N 3.08Å; K923-G926 WeakPolarHBondContact O-CA 3.46Å; K923-G926 PolarHBondContact O-N 3.27Å; K923-G926 VanDerWaalsContact O-N 3.07Å; F924-G926 PolarHBondContact O-N 3.42Å; G926-V929 PolarHBondContact O-N 3.46Å; G926-A930 PolarHBondContact O-N 2.92Å; G926-R975 PolarHBondContact O-NH1 3.02Å; G926-R975 PolarHBondContact O-NH2 3.12Å
927	C	92.2	Very high	90.1	Very high	13 Å²	13	46.4 Å²	46.4	9%	0.088	24%	0.24	C	C	.	.	H	α-helix	trans	-67.5	-41.7	177	-64.3	0	0	0	0	112.6	G871 D872 A875 K923 F924 V925 V929 A930	G871-C927 VanDerWaalsContact C-SG 3.54Å; D872-C927 WeakPolarHBondContact OD1-CA 3.18Å; D872-C927 WeakPolarHBondContact OD1-CB 3.21Å; D872-C927 PolarHBondContact OD1-SG 3.47Å; A875-C927 HydrophobicContact CB-CB 3.86Å; K923-C927 PolarHBondContact O-N 3.05Å; K923-C927 VanDerWaalsContact O-N 3.15Å; F924-C927 HydrophobicContact CD2-CB 4.35Å; F924-C927 WeakPolarHBondContact O-CB 3.38Å; F924-C927 PolarHBondContact O-N 3.03Å; V925-C927 VanDerWaalsContact C-N 3.34Å; V925-C927 PolarHBondContact O-N 2.85Å; C927-V929 VanDerWaalsContact C-N 3.29Å; C927-V929 PolarHBondContact O-N 2.81Å; C927-A930 WeakPolarHBondContact O-CB 3.47Å; C927-A930 PolarHBondContact O-N 2.8Å; C927-A930 VanDerWaalsContact O-N 3.15Å
928	I	93.1	Very high	89.7	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.8	-42.3	176.7	-64.1	164	0	0	0	110.9	A875 N879 Y916 F924 V925 A930 Y935 F940 V968	A875-I928 HydrophobicContact CB-CG1 4.23Å; N879-I928 PolarHBondContact ND2-O 3.46Å; Y916-I928 HydrophobicContact CD1-CD1 3.81Å; Y916-I928 HydrophobicContact CD1-CG1 4.44Å; Y916-I928 HydrophobicContact CE1-CD1 3.85Å; Y916-I928 HydrophobicContact CE1-CG1 4.04Å; F924-I928 HydrophobicContact CD1-CD1 3.72Å; F924-I928 HydrophobicContact CD1-CG1 4.2Å; F924-I928 HydrophobicContact CE1-CD1 3.65Å; F924-I928 HydrophobicContact CE1-CG1 3.97Å; F924-I928 HydrophobicContact CG-CD1 4.47Å; F924-I928 HydrophobicContact CZ-CD1 4.36Å; F924-I928 HydrophobicContact CZ-CG1 4.19Å; F924-I928 WeakPolarHBondContact O-CG1 3.36Å; F924-I928 PolarHBondContact O-N 3.27Å; V925-I928 PolarHBondContact O-N 3.43Å; I928-A930 VanDerWaalsContact C-N 3.3Å; I928-A930 PolarHBondContact O-N 3.11Å; I928-Y935 HydrophobicContact CG2-CD2 3.97Å; I928-Y935 HydrophobicContact CG2-CE2 4.39Å; I928-F940 HydrophobicContact CD1-CZ 4.37Å; I928-F940 HydrophobicContact CG2-CE2 3.94Å; I928-F940 HydrophobicContact CG2-CZ 4.21Å; I928-V968 HydrophobicContact CB-CG1 4.26Å; I928-V968 HydrophobicContact CB-CG2 4.39Å; I928-V968 HydrophobicContact CD1-CG2 3.93Å; I928-V968 HydrophobicContact CG2-CG1 3.69Å; I928-V968 HydrophobicContact CG2-CG2 4.26Å
929	V	90	Very high	89.4	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.024	24%	0.243	C	C	.	.	H	α-helix	trans	-68.9	-28.9	179.3	174.5	0	0	0	0	112.1	V925 G926 C927 D931 V968 V971 W972 R975	V925-V929 WeakPolarHBondContact O-CG2 3.48Å; V925-V929 PolarHBondContact O-N 3.48Å; G926-V929 PolarHBondContact O-N 3.46Å; C927-V929 VanDerWaalsContact C-N 3.29Å; C927-V929 PolarHBondContact O-N 2.81Å; V929-D931 VanDerWaalsContact C-N 3.27Å; V929-D931 PolarHBondContact O-N 3.31Å; V929-V968 HydrophobicContact CG2-CG1 3.58Å; V929-V968 WeakPolarHBondContact CG2-O 3.49Å; V929-V971 HydrophobicContact CB-CG1 4.47Å; V929-V971 HydrophobicContact CG2-CB 4.16Å; V929-V971 HydrophobicContact CG2-CG1 4.05Å; V929-W972 HydrophobicContact CG1-CB 3.84Å; V929-W972 HydrophobicContact CG1-CG 4.33Å; V929-W972 HydrophobicContact CG2-CB 3.96Å; V929-R975 HydrophobicContact CG1-CB 4.45Å; V929-R975 HydrophobicContact CG1-CG 4.46Å
930	A	86.7	Confident	89.2	Confident	43 Å²	43	46.4 Å²	46.4	36%	0.355	24%	0.244	S	C	.	.	H	α-helix	trans	-68.7	-24.5	-178.3	0	0	0	0	0	113.1	G926 C927 I928 E932	G926-A930 PolarHBondContact O-N 2.92Å; C927-A930 WeakPolarHBondContact O-CB 3.47Å; C927-A930 PolarHBondContact O-N 2.8Å; C927-A930 VanDerWaalsContact O-N 3.15Å; I928-A930 VanDerWaalsContact C-N 3.3Å; I928-A930 PolarHBondContact O-N 3.11Å; A930-E932 PolarHBondContact O-N 3.18Å; A930-E932 VanDerWaalsContact O-N 3.08Å
931	D	87.2	Confident	89.1	Confident	20 Å²	20	50.7 Å²	50.7	11%	0.107	26%	0.256	C	S	.	.			trans	-82.2	80.3	175.2	171.7	34.2	0	0	0	112	A876 N879 V929 R933 S934 Y935	A876-D931 HydrophobicContact CB-CB 4.06Å; N879-D931 VanDerWaalsContact CB-OD2 3.25Å; N879-D931 WeakPolarHBondContact CB-OD2 3.34Å; N879-D931 PolarHBondContact ND2-OD2 3.21Å; V929-D931 VanDerWaalsContact C-N 3.27Å; V929-D931 PolarHBondContact O-N 3.31Å; D931-R933 PolarHBondContact O-N 3.43Å; D931-R933 PolarHBondContact OD1-N 2.96Å; D931-S934 PolarHBondContact OD1-N 3.23Å; D931-S934 WeakPolarHBondContact OD2-CB 3.44Å; D931-S934 PolarHBondContact OD2-OG 3.34Å; D931-S934 VanDerWaalsContact OD2-OG 3.13Å; D931-Y935 WeakPolarHBondContact O-CB 3.25Å; D931-Y935 PolarHBondContact O-N 3.41Å
932	E	81.3	Confident	89.1	Confident	143 Å²	143	51.7 Å²	51.7	67%	0.668	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.7	179	-59.6	-170.9	164.5	0	0	113.9	A930	A930-E932 PolarHBondContact O-N 3.18Å; A930-E932 VanDerWaalsContact O-N 3.08Å
933	R	83.1	Confident	89.1	Confident	202 Å²	202	45.5 Å²	45.5	76%	0.762	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-42.8	-178	-176.3	-179.4	178.5	-168.5	-2.5	111.4	K883 D931	K883-R933 PolarHBondContact NZ-O 2.91Å; K883-R933 VanDerWaalsContact NZ-O 3.13Å; D931-R933 PolarHBondContact O-N 3.43Å; D931-R933 PolarHBondContact OD1-N 2.96Å
934	S	86.1	Confident	89.2	Confident	4 Å²	4	39.8 Å²	39.8	3%	0.028	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-38.8	-176.2	-42.9	0	0	0	0	112.3	D931	D931-S934 PolarHBondContact OD1-N 3.23Å; D931-S934 WeakPolarHBondContact OD2-CB 3.44Å; D931-S934 PolarHBondContact OD2-OG 3.34Å; D931-S934 VanDerWaalsContact OD2-OG 3.13Å
935	Y	87.2	Confident	89.2	Confident	15 Å²	15	43.8 Å²	43.8	6%	0.059	22%	0.22	C	C	.	.			trans	-69.2	138.5	-176.8	-179.4	-99.8	0	0	0	112.5	I928 D931 F939 F940 V968 W972	I928-Y935 HydrophobicContact CG2-CD2 3.97Å; I928-Y935 HydrophobicContact CG2-CE2 4.39Å; D931-Y935 WeakPolarHBondContact O-CB 3.25Å; D931-Y935 PolarHBondContact O-N 3.41Å; Y935-F939 HydrophobicContact CD2-CD1 4.09Å; Y935-F940 HydrophobicContact CD2-CD2 4.46Å; Y935-F940 HydrophobicContact CD2-CE2 4.29Å; Y935-F940 AromaticContact CE2-CD2 3.76Å; Y935-F940 HydrophobicContact CE2-CD2 3.76Å; Y935-F940 AromaticContact CE2-CE2 3.84Å; Y935-F940 HydrophobicContact CE2-CE2 3.84Å; Y935-V968 HydrophobicContact CD2-CG1 4.19Å; Y935-V968 HydrophobicContact CE1-CG1 4.34Å; Y935-V968 HydrophobicContact CE2-CG1 3.42Å; Y935-V968 VanDerWaalsContact CE2-CG1 3.42Å; Y935-V968 WeakPolarHBondContact OH-CG1 3.3Å; Y935-W972 AromaticContact CD1-CD1 3.7Å; Y935-W972 HydrophobicContact CD1-CG 4.22Å; Y935-W972 HydrophobicContact CE1-CB 3.81Å; Y935-W972 AromaticContact CE1-CD1 3.47Å; Y935-W972 VanDerWaalsContact CE1-CD1 3.47Å; Y935-W972 HydrophobicContact CE1-CD2 4.15Å; Y935-W972 AromaticContact CE1-CG 3.53Å; Y935-W972 HydrophobicContact CE1-CG 3.53Å
936	S	85.1	Confident	89.1	Confident	45 Å²	45	44.5 Å²	44.5	32%	0.315	23%	0.225	S	C	.	.			trans	-152.6	160	168.7	64.6	0	0	0	0	109.5	A938 F939	S936-A938 PolarHBondContact O-N 2.92Å; S936-F939 WeakPolarHBondContact O-CB 3.4Å; S936-F939 PolarHBondContact O-N 3.16Å; S936-F939 PolarHBondContact OG-N 2.86Å
937	P	80.3	Confident	89.3	Confident	64 Å²	64	44 Å²	44	42%	0.416	22%	0.22	S	C	.	.	H	α-helix	trans	-56.6	-26.5	174.8	-26.9	35.5	0	0	0	114	W972	P937-W972 HydrophobicContact CG-CE3 4.22Å; P937-W972 HydrophobicContact CG-CH2 3.72Å; P937-W972 HydrophobicContact CG-CZ2 4.19Å; P937-W972 HydrophobicContact CG-CZ3 3.75Å
938	A	87	Confident	89.4	Confident	30 Å²	30	47.9 Å²	47.9	25%	0.248	24%	0.239	C	C	.	.	H	α-helix	trans	-79.5	-20.5	176.3	0	0	0	0	0	113.5	S936 R941 N942	S936-A938 PolarHBondContact O-N 2.92Å; A938-R941 PolarHBondContact O-N 3.43Å; A938-N942 PolarHBondContact O-N 3.39Å; A938-N942 PolarHBondContact O-OD1 2.83Å
939	F	90.6	Very high	89.4	Confident	8 Å²	8	56.1 Å²	56.1	4%	0.035	27%	0.27	C	S	.	.	H	α-helix	trans	-58.8	-60.1	-173.5	168.4	-107.5	0	0	0	112.3	N879 L882 K883 Y935 S936 R941 N942 V943	N879-F939 HydrophobicContact CB-CZ 4.3Å; N879-F939 WeakPolarHBondContact O-CE2 2.78Å; L882-F939 HydrophobicContact CB-CE2 4Å; L882-F939 HydrophobicContact CB-CZ 3.87Å; L882-F939 HydrophobicContact CD1-CZ 4.4Å; K883-F939 HydrophobicContact CB-CD2 4.2Å; K883-F939 HydrophobicContact CB-CE2 3.97Å; Y935-F939 HydrophobicContact CD2-CD1 4.09Å; S936-F939 WeakPolarHBondContact O-CB 3.4Å; S936-F939 PolarHBondContact O-N 3.16Å; S936-F939 PolarHBondContact OG-N 2.86Å; F939-R941 VanDerWaalsContact C-N 3.27Å; F939-R941 PolarHBondContact O-N 3.4Å; F939-N942 WeakPolarHBondContact O-CB 3.44Å; F939-N942 PolarHBondContact O-N 2.96Å; F939-N942 VanDerWaalsContact O-N 3.13Å; F939-V943 HydrophobicContact CD2-CG2 4.4Å; F939-V943 HydrophobicContact CE2-CG2 4Å; F939-V943 HydrophobicContact CZ-CG2 4.07Å; F939-V943 WeakPolarHBondContact O-CG2 3.31Å; F939-V943 PolarHBondContact O-N 3.19Å
940	F	91.9	Very high	89.5	Confident	7 Å²	7	59.8 Å²	59.8	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-63.7	-33.2	-179.5	-87.1	-65.5	0	0	0	112.9	Y916 I928 Y935 N942 V943 I944 L961 A965 V968	Y916-F940 HydrophobicContact CD1-CE1 4.25Å; Y916-F940 HydrophobicContact CD1-CZ 4.06Å; Y916-F940 HydrophobicContact CE1-CE1 4.23Å; Y916-F940 AromaticContact CE1-CZ 3.85Å; Y916-F940 HydrophobicContact CE1-CZ 3.85Å; I928-F940 HydrophobicContact CD1-CZ 4.37Å; I928-F940 HydrophobicContact CG2-CE2 3.94Å; I928-F940 HydrophobicContact CG2-CZ 4.21Å; Y935-F940 HydrophobicContact CD2-CD2 4.46Å; Y935-F940 HydrophobicContact CD2-CE2 4.29Å; Y935-F940 AromaticContact CE2-CD2 3.76Å; Y935-F940 HydrophobicContact CE2-CD2 3.76Å; Y935-F940 AromaticContact CE2-CE2 3.84Å; Y935-F940 HydrophobicContact CE2-CE2 3.84Å; F940-N942 VanDerWaalsContact C-N 3.34Å; F940-N942 PolarHBondContact O-N 3.43Å; F940-V943 PolarHBondContact O-N 2.73Å; F940-I944 HydrophobicContact CB-CD1 4.43Å; F940-I944 WeakPolarHBondContact O-CB 3.44Å; F940-I944 WeakPolarHBondContact O-CD1 3.35Å; F940-I944 VanDerWaalsContact O-CG1 3.24Å; F940-I944 WeakPolarHBondContact O-CG1 3.27Å; F940-I944 PolarHBondContact O-N 3.24Å; F940-L961 HydrophobicContact CE1-CD1 4.24Å; F940-A965 HydrophobicContact CB-CB 3.61Å; F940-A965 HydrophobicContact CD1-CB 4.21Å; F940-A965 HydrophobicContact CD2-CB 4.04Å; F940-A965 HydrophobicContact CG-CB 3.7Å; F940-V968 HydrophobicContact CE2-CB 4.18Å; F940-V968 HydrophobicContact CE2-CG1 4.06Å; F940-V968 HydrophobicContact CE2-CG2 4.05Å
941	R	91.6	Very high	89.9	Confident	143 Å²	143	64 Å²	64	54%	0.54	30%	0.303	S	S	.	.	H	α-helix	trans	-59.2	-47.6	174.4	179	177.4	57.6	-154.6	-3.9	110.8	A938 F939 V943 I944 E945	A938-R941 PolarHBondContact O-N 3.43Å; F939-R941 VanDerWaalsContact C-N 3.27Å; F939-R941 PolarHBondContact O-N 3.4Å; R941-V943 VanDerWaalsContact C-N 3.33Å; R941-V943 PolarHBondContact O-N 3.13Å; R941-I944 PolarHBondContact O-N 3.31Å; R941-E945 HydrophobicContact CG-CG 4.45Å; R941-E945 WeakPolarHBondContact CG-OE1 3.41Å; R941-E945 WeakPolarHBondContact O-CB 3.41Å; R941-E945 WeakPolarHBondContact O-CG 3.09Å; R941-E945 PolarHBondContact O-N 3.22Å
942	N	91.9	Very high	90.2	Very high	63 Å²	63	64.2 Å²	64.2	34%	0.337	30%	0.304	S	S	.	.	H	α-helix	trans	-62.5	-41	177.8	-64.1	-9.3	0	0	0	111.7	A938 F939 F940 C946	A938-N942 PolarHBondContact O-N 3.39Å; A938-N942 PolarHBondContact O-OD1 2.83Å; F939-N942 WeakPolarHBondContact O-CB 3.44Å; F939-N942 PolarHBondContact O-N 2.96Å; F939-N942 VanDerWaalsContact O-N 3.13Å; F940-N942 VanDerWaalsContact C-N 3.34Å; F940-N942 PolarHBondContact O-N 3.43Å; N942-C946 VanDerWaalsContact O-CB 3.27Å; N942-C946 WeakPolarHBondContact O-CB 3.41Å; N942-C946 PolarHBondContact O-N 3.1Å
943	V	93.6	Very high	90.8	Very high	1 Å²	1	58 Å²	58	1%	0.006	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-49.6	176.3	175	0	0	0	0	110.9	L882 C886 T913 F939 F940 R941 C946 L947 L961	L882-V943 HydrophobicContact CB-CG2 4.36Å; L882-V943 HydrophobicContact CD1-CG1 4.4Å; L882-V943 HydrophobicContact CD1-CG2 4.47Å; C886-V943 HydrophobicContact CB-CG2 4.13Å; T913-V943 HydrophobicContact CG2-CG1 3.88Å; F939-V943 HydrophobicContact CD2-CG2 4.4Å; F939-V943 HydrophobicContact CE2-CG2 4Å; F939-V943 HydrophobicContact CZ-CG2 4.07Å; F939-V943 WeakPolarHBondContact O-CG2 3.31Å; F939-V943 PolarHBondContact O-N 3.19Å; F940-V943 PolarHBondContact O-N 2.73Å; R941-V943 VanDerWaalsContact C-N 3.33Å; R941-V943 PolarHBondContact O-N 3.13Å; V943-C946 WeakPolarHBondContact O-CB 3.42Å; V943-C946 PolarHBondContact O-N 3.1Å; V943-L947 HydrophobicContact CG1-CD1 4.32Å; V943-L947 WeakPolarHBondContact O-CG 3.08Å; V943-L947 PolarHBondContact O-N 3.35Å; V943-L961 HydrophobicContact CG1-CD2 4.21Å
944	I	94.8	Very high	91.4	Very high	18 Å²	18	51.7 Å²	51.7	9%	0.092	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-43.5	-179.6	-69.4	161.3	0	0	0	111.1	F940 R941 C946 L947 I948 V958 L961 K962 A965	F940-I944 HydrophobicContact CB-CD1 4.43Å; F940-I944 WeakPolarHBondContact O-CB 3.44Å; F940-I944 WeakPolarHBondContact O-CD1 3.35Å; F940-I944 VanDerWaalsContact O-CG1 3.24Å; F940-I944 WeakPolarHBondContact O-CG1 3.27Å; F940-I944 PolarHBondContact O-N 3.24Å; R941-I944 PolarHBondContact O-N 3.31Å; I944-C946 VanDerWaalsContact C-N 3.3Å; I944-C946 PolarHBondContact O-N 3.34Å; I944-L947 PolarHBondContact O-N 3.3Å; I944-I948 HydrophobicContact CG2-CD1 3.8Å; I944-I948 WeakPolarHBondContact O-CG1 3.48Å; I944-I948 PolarHBondContact O-N 3.45Å; I944-V958 HydrophobicContact CG2-CG1 4.24Å; I944-L961 HydrophobicContact CG1-CD2 4.01Å; I944-L961 HydrophobicContact CG1-CG 4.31Å; I944-K962 HydrophobicContact CD1-CB 4.49Å; I944-K962 HydrophobicContact CD1-CG 3.85Å; I944-K962 HydrophobicContact CG2-CG 4.14Å; I944-A965 HydrophobicContact CD1-CB 4.1Å
945	E	93.7	Very high	91.7	Very high	85 Å²	85	57.6 Å²	57.6	40%	0.397	29%	0.293	S	S	.	.	H	α-helix	trans	-59.9	-40.9	174.3	-77.4	179.2	-160.2	0	0	111.8	R941 R949	R941-E945 HydrophobicContact CG-CG 4.45Å; R941-E945 WeakPolarHBondContact CG-OE1 3.41Å; R941-E945 WeakPolarHBondContact O-CB 3.41Å; R941-E945 WeakPolarHBondContact O-CG 3.09Å; R941-E945 PolarHBondContact O-N 3.22Å; E945-R949 WeakPolarHBondContact O-CB 3.45Å; E945-R949 PolarHBondContact O-N 3.29Å; E945-R949 IonicContact OE2-NH2 2.75Å
946	C	92.8	Very high	92.1	Very high	16 Å²	16	60.6 Å²	60.6	11%	0.108	32%	0.316	C	S	.	.	H	α-helix	trans	-62.1	-47	175.9	-173.6	0	0	0	0	111.5	C886 N942 V943 I944 I948 R949 H950	C886-C946 HydrophobicContact CB-CB 4.35Å; N942-C946 VanDerWaalsContact O-CB 3.27Å; N942-C946 WeakPolarHBondContact O-CB 3.41Å; N942-C946 PolarHBondContact O-N 3.1Å; V943-C946 WeakPolarHBondContact O-CB 3.42Å; V943-C946 PolarHBondContact O-N 3.1Å; I944-C946 VanDerWaalsContact C-N 3.3Å; I944-C946 PolarHBondContact O-N 3.34Å; C946-I948 PolarHBondContact O-N 3.18Å; C946-R949 PolarHBondContact O-N 3.12Å; C946-H950 PolarHBondContact O-CD2 3.34Å; C946-H950 PolarHBondContact O-N 3.06Å; C946-H950 VanDerWaalsContact O-N 3.08Å
947	L	95.1	Very high	92.6	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-59.4	-44.2	178.2	-69.9	174.8	0	0	0	112.4	I909 T913 V943 I944 N951 I952 K953 V958 L961	I909-L947 HydrophobicContact CG2-CD2 3.72Å; T913-L947 HydrophobicContact CG2-CD1 4.34Å; V943-L947 HydrophobicContact CG1-CD1 4.32Å; V943-L947 WeakPolarHBondContact O-CG 3.08Å; V943-L947 PolarHBondContact O-N 3.35Å; I944-L947 PolarHBondContact O-N 3.3Å; L947-N951 WeakPolarHBondContact O-CA 3.3Å; L947-N951 PolarHBondContact O-N 3.02Å; L947-I952 HydrophobicContact CD2-CB 3.74Å; L947-I952 HydrophobicContact CD2-CD1 4.28Å; L947-I952 HydrophobicContact CD2-CG2 3.76Å; L947-I952 PolarHBondContact O-N 2.8Å; L947-K953 HydrophobicContact CD2-CG 4.42Å; L947-V958 HydrophobicContact CB-CG2 4.42Å; L947-L961 HydrophobicContact CD1-CD2 3.41Å; L947-L961 VanDerWaalsContact CD1-CD2 3.41Å
948	I	94.7	Very high	93.3	Very high	94 Å²	94	58.4 Å²	58.4	48%	0.482	29%	0.294	S	S	.	.	H	α-helix	trans	-69.7	-50.2	179.2	-66	168.5	0	0	0	110.5	I944 C946 H950 N951 V958	I944-I948 HydrophobicContact CG2-CD1 3.8Å; I944-I948 WeakPolarHBondContact O-CG1 3.48Å; I944-I948 PolarHBondContact O-N 3.45Å; C946-I948 PolarHBondContact O-N 3.18Å; I948-H950 PolarHBondContact O-N 3.12Å; I948-N951 PolarHBondContact O-N 3.44Å; I948-V958 HydrophobicContact CD1-CG1 3.99Å; I948-V958 HydrophobicContact CG1-CG1 3.84Å
949	R	92.9	Very high	93.8	Very high	173 Å²	173	61.5 Å²	61.5	65%	0.653	30%	0.304	S	S	*	.	H	α-helix	trans	-58.5	-35.3	-176.6	-175.6	-175.7	-59.4	162	5.2	112.4	E945 C946	E945-R949 WeakPolarHBondContact O-CB 3.45Å; E945-R949 PolarHBondContact O-N 3.29Å; E945-R949 IonicContact OE2-NH2 2.75Å; C946-R949 PolarHBondContact O-N 3.12Å
950	H	92.1	Very high	94	Very high	82 Å²	82	64.8 Å²	64.8	38%	0.38	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	5.7	-177.9	-65.4	-57.2	0	0	0	114.1	C946 I948 I952	C946-H950 PolarHBondContact O-CD2 3.34Å; C946-H950 PolarHBondContact O-N 3.06Å; C946-H950 VanDerWaalsContact O-N 3.08Å; I948-H950 PolarHBondContact O-N 3.12Å; H950-I952 VanDerWaalsContact C-N 3.32Å; H950-I952 HydrophobicContact CB-CD1 3.92Å; H950-I952 HydrophobicContact CB-CG1 3.76Å; H950-I952 PolarHBondContact O-N 3.49Å
951	N	94.3	Very high	94.2	Very high	130 Å²	130	64.5 Å²	64.5	70%	0.695	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	49.6	-179.1	-166.9	37.1	0	0	0	113	L947 I948	L947-N951 WeakPolarHBondContact O-CA 3.3Å; L947-N951 PolarHBondContact O-N 3.02Å; I948-N951 PolarHBondContact O-N 3.44Å
952	I	94.6	Very high	94.3	Very high	26 Å²	26	60.9 Å²	60.9	13%	0.133	31%	0.306	C	S	.	.			trans	-81.6	-37.5	-173	-62.6	176.2	0	0	0	111.7	R906 I909 N910 L947 H950	R906-I952 HydrophobicContact CB-CD1 4.26Å; R906-I952 HydrophobicContact CB-CG1 4.27Å; R906-I952 HydrophobicContact CG-CD1 4.22Å; R906-I952 HydrophobicContact CG-CG1 4.36Å; R906-I952 WeakPolarHBondContact O-CG2 3.39Å; I909-I952 HydrophobicContact CB-CD1 4.32Å; I909-I952 HydrophobicContact CD1-CD1 4.29Å; I909-I952 HydrophobicContact CG2-CD1 4.11Å; N910-I952 HydrophobicContact CB-CG2 3.6Å; L947-I952 HydrophobicContact CD2-CB 3.74Å; L947-I952 HydrophobicContact CD2-CD1 4.28Å; L947-I952 HydrophobicContact CD2-CG2 3.76Å; L947-I952 PolarHBondContact O-N 2.8Å; H950-I952 VanDerWaalsContact C-N 3.32Å; H950-I952 HydrophobicContact CB-CD1 3.92Å; H950-I952 HydrophobicContact CB-CG1 3.76Å; H950-I952 PolarHBondContact O-N 3.49Å
953	K	94.5	Very high	94.5	Very high	13 Å²	13	62.5 Å²	62.5	6%	0.057	31%	0.314	C	S	.	.	S	Bend	trans	-124.8	157.7	179.6	-81.5	-162.2	-171	-68.7	0	111.7	N910 T913 E914 L917 L947 K957 V958	N910-K953 WeakPolarHBondContact O-CE 3.22Å; N910-K953 PolarHBondContact O-NZ 3.35Å; N910-K953 WeakPolarHBondContact OD1-CG 3.42Å; N910-K953 PolarHBondContact OD1-NZ 3.12Å; T913-K953 WeakPolarHBondContact OG1-CE 3.48Å; E914-K953 IonicContact OE2-NZ 3.78Å; E914-K953 PolarHBondContact OE2-NZ 3.46Å; L917-K953 HydrophobicContact CD1-CD 4.2Å; L947-K953 HydrophobicContact CD2-CG 4.42Å; K953-K957 HydrophobicContact CB-CB 4.35Å; K953-K957 HydrophobicContact CD-CB 4.02Å; K953-V958 HydrophobicContact CB-CG2 4.07Å
954	S	94.5	Very high	94.6	Very high	69 Å²	69	62.4 Å²	62.4	48%	0.483	31%	0.314	S	S	.	.			trans	-63.4	151.1	173.8	68.7	0	0	0	0	111.8	S956 K957 V958	S954-S956 PolarHBondContact O-N 3.42Å; S954-K957 PolarHBondContact O-N 2.99Å; S954-V958 WeakPolarHBondContact O-CG2 3.34Å; S954-V958 PolarHBondContact O-N 2.96Å
955	N	93.5	Very high	94.5	Very high	128 Å²	128	62.3 Å²	62.3	68%	0.684	32%	0.315	S	S	*	.	H	α-helix	trans	-53.7	-40.1	179.8	-68.8	-26	0	0	0	112.4	K957 V958 E959	N955-K957 PolarHBondContact O-N 3.38Å; N955-V958 PolarHBondContact O-N 2.93Å; N955-E959 WeakPolarHBondContact O-CG 3.28Å; N955-E959 PolarHBondContact O-N 3.23Å
956	S	95	Very high	94.5	Very high	77 Å²	77	64.4 Å²	64.4	54%	0.538	33%	0.325	S	S	.	.	H	α-helix	trans	-59	-47.5	177.4	177.6	0	0	0	0	112.5	S954 V958 E959 Q960	S954-S956 PolarHBondContact O-N 3.42Å; S956-V958 VanDerWaalsContact C-N 3.35Å; S956-V958 PolarHBondContact O-N 3.43Å; S956-E959 PolarHBondContact O-N 3.25Å; S956-Q960 WeakPolarHBondContact O-CG 3.37Å; S956-Q960 PolarHBondContact O-N 3.29Å
957	K	95.5	Very high	94.6	Very high	60 Å²	60	67.4 Å²	67.4	26%	0.261	34%	0.337	S	S	.	.	H	α-helix	trans	-68.9	-33.7	178.4	-71.3	-86	180	167.5	0	112	E914 L917 K953 S954 N955 Q960 L961	E914-K957 IonicContact OE1-NZ 2.66Å; E914-K957 PolarHBondContact OE1-NZ 3.15Å; E914-K957 IonicContact OE2-NZ 3.33Å; L917-K957 HydrophobicContact CD1-CB 4.07Å; L917-K957 HydrophobicContact CD1-CD 3.55Å; L917-K957 HydrophobicContact CD1-CG 4.43Å; K953-K957 HydrophobicContact CB-CB 4.35Å; K953-K957 HydrophobicContact CD-CB 4.02Å; S954-K957 PolarHBondContact O-N 2.99Å; N955-K957 PolarHBondContact O-N 3.38Å; K957-Q960 PolarHBondContact O-N 2.87Å; K957-L961 PolarHBondContact O-N 3.28Å
958	V	95.9	Very high	94.5	Very high	4 Å²	4	67.4 Å²	67.4	2%	0.024	34%	0.337	C	S	.	.	H	α-helix	trans	-64.2	-41.2	172.7	172.8	0	0	0	0	111.3	I944 L947 I948 K953 S954 N955 S956 L961 K962	I944-V958 HydrophobicContact CG2-CG1 4.24Å; L947-V958 HydrophobicContact CB-CG2 4.42Å; I948-V958 HydrophobicContact CD1-CG1 3.99Å; I948-V958 HydrophobicContact CG1-CG1 3.84Å; K953-V958 HydrophobicContact CB-CG2 4.07Å; S954-V958 WeakPolarHBondContact O-CG2 3.34Å; S954-V958 PolarHBondContact O-N 2.96Å; N955-V958 PolarHBondContact O-N 2.93Å; S956-V958 VanDerWaalsContact C-N 3.35Å; S956-V958 PolarHBondContact O-N 3.43Å; V958-L961 PolarHBondContact O-N 2.94Å; V958-K962 WeakPolarHBondContact O-CG 3.45Å; V958-K962 PolarHBondContact O-N 2.91Å
959	E	95.9	Very high	94.4	Very high	95 Å²	95	66.9 Å²	66.9	44%	0.444	33%	0.332	S	S	.	.	H	α-helix	trans	-65.5	-40.1	174.7	-68	-50.2	129.5	0	0	112.2	N955 S956 L961 K962 L963	N955-E959 WeakPolarHBondContact O-CG 3.28Å; N955-E959 PolarHBondContact O-N 3.23Å; S956-E959 PolarHBondContact O-N 3.25Å; E959-L961 VanDerWaalsContact C-N 3.3Å; E959-L961 PolarHBondContact O-N 2.98Å; E959-K962 WeakPolarHBondContact O-CB 3.12Å; E959-K962 PolarHBondContact O-N 2.78Å; E959-K962 IonicContact OE1-NZ 2.93Å; E959-K962 PolarHBondContact OE1-NZ 3.17Å; E959-K962 WeakPolarHBondContact OE2-CD 3.35Å; E959-K962 IonicContact OE2-NZ 3.5Å; E959-L963 WeakPolarHBondContact O-CG 3.5Å; E959-L963 PolarHBondContact O-N 2.88Å
960	Q	95.9	Very high	94.3	Very high	77 Å²	77	61.6 Å²	61.6	36%	0.36	33%	0.325	S	S	.	.	H	α-helix	trans	-57.9	-43.7	172.5	-70.2	176	-3.7	0	0	111.6	L917 S956 K957 K962 L963 L964	L917-Q960 HydrophobicContact CD2-CB 3.85Å; S956-Q960 WeakPolarHBondContact O-CG 3.37Å; S956-Q960 PolarHBondContact O-N 3.29Å; K957-Q960 PolarHBondContact O-N 2.87Å; Q960-K962 VanDerWaalsContact C-N 3.34Å; Q960-K962 PolarHBondContact O-N 2.87Å; Q960-L963 WeakPolarHBondContact O-CB 3.2Å; Q960-L963 PolarHBondContact O-N 3.21Å; Q960-L964 PolarHBondContact O-N 3.28Å
961	L	95.1	Very high	94.3	Very high	1 Å²	1	60 Å²	60	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-66.7	-34.1	177.7	-165.2	67.6	0	0	0	112.7	T913 L917 F940 V943 I944 L947 K957 V958 E959 L964 A965	T913-L961 HydrophobicContact CG2-CD2 4.47Å; L917-L961 HydrophobicContact CD2-CB 4.17Å; L917-L961 HydrophobicContact CD2-CD1 4.13Å; F940-L961 HydrophobicContact CE1-CD1 4.24Å; V943-L961 HydrophobicContact CG1-CD2 4.21Å; I944-L961 HydrophobicContact CG1-CD2 4.01Å; I944-L961 HydrophobicContact CG1-CG 4.31Å; L947-L961 HydrophobicContact CD1-CD2 3.41Å; L947-L961 VanDerWaalsContact CD1-CD2 3.41Å; K957-L961 PolarHBondContact O-N 3.28Å; V958-L961 PolarHBondContact O-N 2.94Å; E959-L961 VanDerWaalsContact C-N 3.3Å; E959-L961 PolarHBondContact O-N 2.98Å; L961-L964 HydrophobicContact CD1-CD2 4.18Å; L961-L964 PolarHBondContact O-N 3.05Å; L961-A965 WeakPolarHBondContact O-CB 3.23Å; L961-A965 PolarHBondContact O-N 2.87Å
962	K	95.3	Very high	94	Very high	66 Å²	66	56.5 Å²	56.5	29%	0.287	30%	0.298	S	S	.	.	H	α-helix	trans	-62.9	-43	172.2	-75.6	171.5	-179.7	174.4	0	111.5	I944 V958 E959 Q960 A965 Q966	I944-K962 HydrophobicContact CD1-CB 4.49Å; I944-K962 HydrophobicContact CD1-CG 3.85Å; I944-K962 HydrophobicContact CG2-CG 4.14Å; V958-K962 WeakPolarHBondContact O-CG 3.45Å; V958-K962 PolarHBondContact O-N 2.91Å; E959-K962 WeakPolarHBondContact O-CB 3.12Å; E959-K962 PolarHBondContact O-N 2.78Å; E959-K962 IonicContact OE1-NZ 2.93Å; E959-K962 PolarHBondContact OE1-NZ 3.17Å; E959-K962 WeakPolarHBondContact OE2-CD 3.35Å; E959-K962 IonicContact OE2-NZ 3.5Å; Q960-K962 VanDerWaalsContact C-N 3.34Å; Q960-K962 PolarHBondContact O-N 2.87Å; K962-A965 PolarHBondContact O-N 3.5Å; K962-Q966 WeakPolarHBondContact O-CG 3.41Å; K962-Q966 PolarHBondContact O-N 3.46Å
963	L	95.3	Very high	93.7	Very high	97 Å²	97	62.1 Å²	62.1	51%	0.508	32%	0.322	S	S	.	.	H	α-helix	trans	-63.4	-44.6	176.3	-67.7	173.1	0	0	0	111.1	E959 Q960 A965 Q966 K967	E959-L963 WeakPolarHBondContact O-CG 3.5Å; E959-L963 PolarHBondContact O-N 2.88Å; Q960-L963 WeakPolarHBondContact O-CB 3.2Å; Q960-L963 PolarHBondContact O-N 3.21Å; L963-A965 PolarHBondContact O-N 3.45Å; L963-Q966 WeakPolarHBondContact O-CB 3.31Å; L963-Q966 PolarHBondContact O-N 3.37Å; L963-K967 WeakPolarHBondContact O-CG 3.43Å; L963-K967 PolarHBondContact O-N 3.11Å
964	L	94.6	Very high	93.2	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-57.7	-47.9	173.5	177.7	58.9	0	0	0	111.2	Y916 V925 Q960 L961 Q966 K967 V968	Y916-L964 HydrophobicContact CD1-CD2 4.32Å; V925-L964 HydrophobicContact CG2-CD1 3.56Å; Q960-L964 PolarHBondContact O-N 3.28Å; L961-L964 HydrophobicContact CD1-CD2 4.18Å; L961-L964 PolarHBondContact O-N 3.05Å; L964-Q966 VanDerWaalsContact C-N 3.26Å; L964-Q966 PolarHBondContact O-N 2.94Å; L964-K967 WeakPolarHBondContact O-CB 3.39Å; L964-K967 PolarHBondContact O-N 3.26Å; L964-K967 VanDerWaalsContact O-N 3.1Å; L964-V968 HydrophobicContact CD1-CG2 4.1Å; L964-V968 HydrophobicContact CG-CG2 4.36Å; L964-V968 VanDerWaalsContact O-CG2 3.31Å; L964-V968 WeakPolarHBondContact O-CG2 3.33Å; L964-V968 PolarHBondContact O-N 3.5Å
965	A	93.8	Very high	92.6	Very high	15 Å²	15	68.7 Å²	68.7	12%	0.124	34%	0.339	C	S	.	.	H	α-helix	trans	-58.5	-36.4	177.9	0	0	0	0	0	112.9	F940 I944 L961 K962 L963 H969	F940-A965 HydrophobicContact CB-CB 3.61Å; F940-A965 HydrophobicContact CD1-CB 4.21Å; F940-A965 HydrophobicContact CD2-CB 4.04Å; F940-A965 HydrophobicContact CG-CB 3.7Å; I944-A965 HydrophobicContact CD1-CB 4.1Å; L961-A965 WeakPolarHBondContact O-CB 3.23Å; L961-A965 PolarHBondContact O-N 2.87Å; K962-A965 PolarHBondContact O-N 3.5Å; L963-A965 PolarHBondContact O-N 3.45Å; A965-H969 WeakPolarHBondContact O-CB 3.34Å; A965-H969 PolarHBondContact O-N 3.26Å
966	Q	93.6	Very high	91.9	Very high	130 Å²	130	68 Å²	68	61%	0.607	33%	0.33	S	S	*	.	H	α-helix	trans	-66	-44.9	174.4	-71.5	171.8	2.4	0	0	112	K962 L963 L964 H969 A970	K962-Q966 WeakPolarHBondContact O-CG 3.41Å; K962-Q966 PolarHBondContact O-N 3.46Å; L963-Q966 WeakPolarHBondContact O-CB 3.31Å; L963-Q966 PolarHBondContact O-N 3.37Å; L964-Q966 VanDerWaalsContact C-N 3.26Å; L964-Q966 PolarHBondContact O-N 2.94Å; Q966-H969 PolarHBondContact O-N 3.49Å; Q966-A970 PolarHBondContact O-N 3.36Å
967	K	94.3	Very high	90.8	Very high	79 Å²	79	68.7 Å²	68.7	34%	0.343	33%	0.325	S	S	.	.	H	α-helix	trans	-58.8	-48.4	175.3	-64.4	177.1	-166.6	169.4	0	111	D920 V925 L963 L964 H969 A970 V971	D920-K967 IonicContact OD1-NZ 3.73Å; D920-K967 PolarHBondContact OD1-NZ 3.01Å; D920-K967 IonicContact OD2-NZ 2.96Å; V925-K967 HydrophobicContact CG1-CB 4.4Å; V925-K967 HydrophobicContact CG2-CB 4.12Å; V925-K967 HydrophobicContact CG2-CD 4.45Å; L963-K967 WeakPolarHBondContact O-CG 3.43Å; L963-K967 PolarHBondContact O-N 3.11Å; L964-K967 WeakPolarHBondContact O-CB 3.39Å; L964-K967 PolarHBondContact O-N 3.26Å; L964-K967 VanDerWaalsContact O-N 3.1Å; K967-H969 VanDerWaalsContact C-N 3.34Å; K967-H969 PolarHBondContact O-N 2.92Å; K967-A970 PolarHBondContact O-N 3.05Å; K967-V971 WeakPolarHBondContact O-CG2 3.42Å; K967-V971 PolarHBondContact O-N 3.43Å
968	V	93.6	Very high	89.6	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.2	-44	178.1	-178.6	0	0	0	0	111.2	V925 I928 V929 Y935 F940 L964 A970 V971 W972	V925-V968 HydrophobicContact CB-CG2 4.37Å; V925-V968 HydrophobicContact CG1-CB 4.39Å; V925-V968 HydrophobicContact CG1-CG2 3.96Å; V925-V968 HydrophobicContact CG2-CG2 4.11Å; I928-V968 HydrophobicContact CB-CG1 4.26Å; I928-V968 HydrophobicContact CB-CG2 4.39Å; I928-V968 HydrophobicContact CD1-CG2 3.93Å; I928-V968 HydrophobicContact CG2-CG1 3.69Å; I928-V968 HydrophobicContact CG2-CG2 4.26Å; V929-V968 HydrophobicContact CG2-CG1 3.58Å; V929-V968 WeakPolarHBondContact CG2-O 3.49Å; Y935-V968 HydrophobicContact CD2-CG1 4.19Å; Y935-V968 HydrophobicContact CE1-CG1 4.34Å; Y935-V968 HydrophobicContact CE2-CG1 3.42Å; Y935-V968 VanDerWaalsContact CE2-CG1 3.42Å; Y935-V968 WeakPolarHBondContact OH-CG1 3.3Å; F940-V968 HydrophobicContact CE2-CB 4.18Å; F940-V968 HydrophobicContact CE2-CG1 4.06Å; F940-V968 HydrophobicContact CE2-CG2 4.05Å; L964-V968 HydrophobicContact CD1-CG2 4.1Å; L964-V968 HydrophobicContact CG-CG2 4.36Å; L964-V968 VanDerWaalsContact O-CG2 3.31Å; L964-V968 WeakPolarHBondContact O-CG2 3.33Å; L964-V968 PolarHBondContact O-N 3.5Å; V968-A970 VanDerWaalsContact C-N 3.35Å; V968-A970 PolarHBondContact O-N 3.28Å; V968-V971 PolarHBondContact O-N 3.43Å; V968-W972 VanDerWaalsContact O-CB 3.31Å; V968-W972 WeakPolarHBondContact O-CB 3.01Å; V968-W972 PolarHBondContact O-N 2.93Å
969	H	92.4	Very high	88.3	Confident	82 Å²	82	72.5 Å²	72.5	38%	0.38	35%	0.346	S	S	.	.	H	α-helix	trans	-62.1	-41.1	177.7	-173.8	63.8	0	0	0	112.7	A965 Q966 K967 K973	A965-H969 WeakPolarHBondContact O-CB 3.34Å; A965-H969 PolarHBondContact O-N 3.26Å; Q966-H969 PolarHBondContact O-N 3.49Å; K967-H969 VanDerWaalsContact C-N 3.34Å; K967-H969 PolarHBondContact O-N 2.92Å; H969-K973 WeakPolarHBondContact O-CB 3.23Å; H969-K973 PolarHBondContact O-N 3.12Å
970	A	91.8	Very high	86.7	Confident	62 Å²	62	74.6 Å²	74.6	51%	0.512	36%	0.357	S	S	.	.	H	α-helix	trans	-64.2	-45.7	177.7	0	0	0	0	0	112.2	Q966 K967 V968 K973 K974	Q966-A970 PolarHBondContact O-N 3.36Å; K967-A970 PolarHBondContact O-N 3.05Å; V968-A970 VanDerWaalsContact C-N 3.35Å; V968-A970 PolarHBondContact O-N 3.28Å; A970-K973 PolarHBondContact O-N 3Å; A970-K974 PolarHBondContact O-N 2.97Å; A970-K974 VanDerWaalsContact O-N 3.14Å
971	V	90.4	Very high	85.1	Confident	50 Å²	50	72.3 Å²	72.3	30%	0.303	35%	0.349	S	S	.	.	H	α-helix	trans	-65.7	-41.8	177.6	175.1	0	0	0	0	111.3	V925 V929 K967 V968 K973 K974 R975	V925-V971 HydrophobicContact CG1-CB 4Å; V925-V971 HydrophobicContact CG1-CG1 4.49Å; V925-V971 HydrophobicContact CG1-CG2 3.7Å; V929-V971 HydrophobicContact CB-CG1 4.47Å; V929-V971 HydrophobicContact CG2-CB 4.16Å; V929-V971 HydrophobicContact CG2-CG1 4.05Å; K967-V971 WeakPolarHBondContact O-CG2 3.42Å; K967-V971 PolarHBondContact O-N 3.43Å; V968-V971 PolarHBondContact O-N 3.43Å; V971-K973 PolarHBondContact O-N 3.45Å; V971-K974 PolarHBondContact O-N 3.04Å; V971-R975 PolarHBondContact O-N 3.29Å
972	W	89.4	Confident	83.7	Confident	56 Å²	56	73.3 Å²	73.3	21%	0.212	35%	0.353	C	S	.	.	H	α-helix	trans	-60.5	-44.3	175.1	176.8	84.4	0	0	0	112.6	V929 Y935 P937 V968 K974 R975 K976	V929-W972 HydrophobicContact CG1-CB 3.84Å; V929-W972 HydrophobicContact CG1-CG 4.33Å; V929-W972 HydrophobicContact CG2-CB 3.96Å; Y935-W972 AromaticContact CD1-CD1 3.7Å; Y935-W972 HydrophobicContact CD1-CG 4.22Å; Y935-W972 HydrophobicContact CE1-CB 3.81Å; Y935-W972 AromaticContact CE1-CD1 3.47Å; Y935-W972 VanDerWaalsContact CE1-CD1 3.47Å; Y935-W972 HydrophobicContact CE1-CD2 4.15Å; Y935-W972 AromaticContact CE1-CG 3.53Å; Y935-W972 HydrophobicContact CE1-CG 3.53Å; P937-W972 HydrophobicContact CG-CE3 4.22Å; P937-W972 HydrophobicContact CG-CH2 3.72Å; P937-W972 HydrophobicContact CG-CZ2 4.19Å; P937-W972 HydrophobicContact CG-CZ3 3.75Å; V968-W972 VanDerWaalsContact O-CB 3.31Å; V968-W972 WeakPolarHBondContact O-CB 3.01Å; V968-W972 PolarHBondContact O-N 2.93Å; W972-K974 VanDerWaalsContact C-N 3.26Å; W972-K974 PolarHBondContact O-N 3.44Å; W972-R975 PolarHBondContact O-N 2.87Å; W972-K976 HydrophobicContact CH2-CD 3.77Å; W972-K976 HydrophobicContact CZ2-CD 3.77Å; W972-K976 HydrophobicContact CZ3-CD 4.39Å; W972-K976 WeakPolarHBondContact O-CB 3.34Å; W972-K976 PolarHBondContact O-N 3.5Å
973	K	86.7	Confident	82.3	Confident	143 Å²	143	75.3 Å²	75.3	62%	0.622	38%	0.375	S	S	*	.	H	α-helix	trans	-60.6	-39.3	177.4	-174.1	180	178.8	-177.2	0	111.4	H969 A970 V971 Q977	H969-K973 WeakPolarHBondContact O-CB 3.23Å; H969-K973 PolarHBondContact O-N 3.12Å; A970-K973 PolarHBondContact O-N 3Å; V971-K973 PolarHBondContact O-N 3.45Å; K973-Q977 PolarHBondContact O-N 2.91Å
974	K	85	Confident	81.3	Confident	134 Å²	134	74.7 Å²	74.7	58%	0.583	37%	0.373	S	S	*	.	H	α-helix	trans	-66.4	-49.9	176.6	-175.1	-177.5	172.3	-171.5	0	111.7	A970 V971 W972 K976 Q977 E978	A970-K974 PolarHBondContact O-N 2.97Å; A970-K974 VanDerWaalsContact O-N 3.14Å; V971-K974 PolarHBondContact O-N 3.04Å; W972-K974 VanDerWaalsContact C-N 3.26Å; W972-K974 PolarHBondContact O-N 3.44Å; K974-K976 PolarHBondContact O-N 3.1Å; K974-Q977 WeakPolarHBondContact O-CB 3.45Å; K974-Q977 PolarHBondContact O-N 3.05Å; K974-Q977 VanDerWaalsContact O-N 3.15Å; K974-E978 WeakPolarHBondContact CE-OE1 3.48Å; K974-E978 PolarHBondContact O-N 3.18Å; K974-E978 VanDerWaalsContact O-N 3.16Å
975	R	82.2	Confident	80.7	Confident	87 Å²	87	76.2 Å²	76.2	33%	0.328	38%	0.382	S	S	.	.	H	α-helix	trans	-60.5	-44.5	178.7	-81.1	-164.9	-178.6	157.7	-0.2	112.7	G926 V929 V971 W972 Q977 E978 D979	G926-R975 PolarHBondContact O-NH1 3.02Å; G926-R975 PolarHBondContact O-NH2 3.12Å; V929-R975 HydrophobicContact CG1-CB 4.45Å; V929-R975 HydrophobicContact CG1-CG 4.46Å; V971-R975 PolarHBondContact O-N 3.29Å; W972-R975 PolarHBondContact O-N 2.87Å; R975-Q977 PolarHBondContact O-N 3.34Å; R975-Q977 VanDerWaalsContact O-N 3.12Å; R975-E978 CarbonylContact O-C 3.53Å; R975-E978 WeakPolarHBondContact O-CA 3.49Å; R975-E978 WeakPolarHBondContact O-CB 3.39Å; R975-E978 PolarHBondContact O-N 3.18Å; R975-D979 PolarHBondContact O-N 3.15Å
976	K	77.7	Confident	80.2	Confident	114 Å²	114	77.9 Å²	77.9	50%	0.496	39%	0.391	S	S	.	.	H	α-helix	trans	-58.2	-31	177.1	-167.5	178.7	-177	-178.9	0	113	W972 K974	W972-K976 HydrophobicContact CH2-CD 3.77Å; W972-K976 HydrophobicContact CZ2-CD 3.77Å; W972-K976 HydrophobicContact CZ3-CD 4.39Å; W972-K976 WeakPolarHBondContact O-CB 3.34Å; W972-K976 PolarHBondContact O-N 3.5Å; K974-K976 PolarHBondContact O-N 3.1Å
977	Q	73.1	Confident	79.7	Confident	90 Å²	90	75.7 Å²	75.7	42%	0.421	39%	0.39	S	S	.	.	H	α-helix	trans	-75.7	-31.8	174.4	-171.2	167.7	26.9	0	0	112.3	K973 K974 R975 K1065	K973-Q977 PolarHBondContact O-N 2.91Å; K974-Q977 WeakPolarHBondContact O-CB 3.45Å; K974-Q977 PolarHBondContact O-N 3.05Å; K974-Q977 VanDerWaalsContact O-N 3.15Å; R975-Q977 PolarHBondContact O-N 3.34Å; R975-Q977 VanDerWaalsContact O-N 3.12Å; Q977-K1065 PolarHBondContact NE2-O 3.49Å; Q977-K1065 VanDerWaalsContact NE2-O 3.17Å
978	E	70.4	Confident	79.3	Confident	62 Å²	62	77.8 Å²	77.8	29%	0.29	41%	0.405	S	S	.	.	H	α-helix	trans	-72.4	-41.7	173.9	-68.5	170.7	-179.7	0	0	111.7	K974 R975 M980 V981 F982	K974-E978 WeakPolarHBondContact CE-OE1 3.48Å; K974-E978 PolarHBondContact O-N 3.18Å; K974-E978 VanDerWaalsContact O-N 3.16Å; R975-E978 CarbonylContact O-C 3.53Å; R975-E978 WeakPolarHBondContact O-CA 3.49Å; R975-E978 WeakPolarHBondContact O-CB 3.39Å; R975-E978 PolarHBondContact O-N 3.18Å; E978-M980 VanDerWaalsContact C-N 3.26Å; E978-M980 PolarHBondContact O-N 3.17Å; E978-V981 WeakPolarHBondContact O-CA 3.49Å; E978-V981 VanDerWaalsContact O-CB 3.22Å; E978-V981 WeakPolarHBondContact O-CB 3.33Å; E978-V981 PolarHBondContact O-N 2.97Å; E978-F982 HydrophobicContact CB-CE2 4.3Å; E978-F982 WeakPolarHBondContact O-CD2 3.47Å; E978-F982 PolarHBondContact O-N 3.37Å
979	D	68	Low	79.1	Confident	82 Å²	82	78.9 Å²	78.9	44%	0.439	41%	0.41	S	S	.	.	H	α-helix	trans	-63.4	-30.6	-179.5	-63.2	-36.2	0	0	0	112.9	R975 V981 F982	R975-D979 PolarHBondContact O-N 3.15Å; D979-V981 PolarHBondContact O-N 3.37Å; D979-F982 PolarHBondContact O-N 2.7Å
980	M	62.1	Low	79	Confident	139 Å²	139	78.4 Å²	78.4	69%	0.685	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-24.4	171.6	-75.1	-174	143	0	0	113	E978	E978-M980 VanDerWaalsContact C-N 3.26Å; E978-M980 PolarHBondContact O-N 3.17Å
981	V	62.4	Low	78.9	Confident	30 Å²	30	75.5 Å²	75.5	18%	0.182	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-33.4	178.7	176.5	0	0	0	0	111.9	E978 D979 A1058	E978-V981 WeakPolarHBondContact O-CA 3.49Å; E978-V981 VanDerWaalsContact O-CB 3.22Å; E978-V981 WeakPolarHBondContact O-CB 3.33Å; E978-V981 PolarHBondContact O-N 2.97Å; D979-V981 PolarHBondContact O-N 3.37Å; V981-A1058 HydrophobicContact CB-CB 4.35Å; V981-A1058 HydrophobicContact CG1-CB 3.52Å; V981-A1058 HydrophobicContact CG2-CB 3.83Å
982	F	66	Low	78.8	Confident	22 Å²	22	76.7 Å²	76.7	10%	0.096	39%	0.394	C	S	.	.			trans	-98	23.4	-171.8	-61	-67.9	0	0	0	114.3	E978 D979 D984 V985 W1050 I1051 K1054 M1055	E978-F982 HydrophobicContact CB-CE2 4.3Å; E978-F982 WeakPolarHBondContact O-CD2 3.47Å; E978-F982 PolarHBondContact O-N 3.37Å; D979-F982 PolarHBondContact O-N 2.7Å; F982-D984 PolarHBondContact O-N 3.46Å; F982-D984 VanDerWaalsContact O-N 3.1Å; F982-V985 WeakPolarHBondContact O-CG2 3.43Å; F982-W1050 HydrophobicContact CB-CH2 4.5Å; F982-W1050 AromaticContact CD1-CH2 3.83Å; F982-W1050 HydrophobicContact CD1-CH2 3.83Å; F982-W1050 AromaticContact CD1-CZ3 3.71Å; F982-W1050 HydrophobicContact CD1-CZ3 3.71Å; F982-W1050 HydrophobicContact CE1-CZ3 4.24Å; F982-I1051 HydrophobicContact CE1-CG2 4.41Å; F982-I1051 HydrophobicContact CZ-CG2 4.39Å; F982-K1054 HydrophobicContact CD1-CB 4.1Å; F982-K1054 HydrophobicContact CD1-CG 4.49Å; F982-K1054 HydrophobicContact CE1-CB 3.73Å; F982-M1055 HydrophobicContact CE2-CE 4Å; F982-M1055 HydrophobicContact CE2-SD 4.34Å; F982-M1055 HydrophobicContact CZ-CE 3.72Å; F982-M1055 HydrophobicContact CZ-CG 4Å; F982-M1055 HydrophobicContact CZ-SD 3.79Å
983	S	65	Low	78.5	Confident	107 Å²	107	77.7 Å²	77.7	75%	0.748	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.4	-177.2	65.5	0	0	0	0	115.5
984	D	75.9	Confident	78.3	Confident	85 Å²	85	75.6 Å²	75.6	46%	0.455	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	46.3	-174.4	66.7	-30.9	0	0	0	113.6	F982 P986 K1054	F982-D984 PolarHBondContact O-N 3.46Å; F982-D984 VanDerWaalsContact O-N 3.1Å; D984-P986 WeakPolarHBondContact O-CD 3.35Å; D984-K1054 WeakPolarHBondContact OD1-CE 3.2Å; D984-K1054 IonicContact OD1-NZ 3.76Å; D984-K1054 PolarHBondContact OD1-NZ 2.75Å; D984-K1054 IonicContact OD2-NZ 3.48Å; D984-K1054 PolarHBondContact OD2-NZ 3.2Å
985	V	80.1	Confident	78.2	Confident	31 Å²	31	71.5 Å²	71.5	19%	0.188	40%	0.395	C	S	.	.			trans	-64.7	126.9	173.7	176.5	0	0	0	0	110.5	F982 F989 M990 L997 W1050	F982-V985 WeakPolarHBondContact O-CG2 3.43Å; V985-F989 HydrophobicContact CG1-CB 4.06Å; V985-M990 HydrophobicContact CB-CG 4.43Å; V985-M990 HydrophobicContact CG1-CG 3.66Å; V985-M990 HydrophobicContact CG1-SD 4.48Å; V985-L997 HydrophobicContact CG1-CB 4.35Å; V985-L997 HydrophobicContact CG1-CD1 3.57Å; V985-L997 HydrophobicContact CG2-CB 4.35Å; V985-L997 HydrophobicContact CG2-CD1 4.25Å; V985-W1050 HydrophobicContact CB-CH2 4.18Å; V985-W1050 HydrophobicContact CG2-CH2 3.48Å; V985-W1050 VanDerWaalsContact CG2-CH2 3.48Å; V985-W1050 HydrophobicContact CG2-CZ2 4.29Å; V985-W1050 HydrophobicContact CG2-CZ3 4Å
986	P	84.2	Confident	78.3	Confident	50 Å²	50	70.7 Å²	70.7	33%	0.325	40%	0.4	S	S	.	.			trans	-58	142.1	171.3	-25.4	34.9	0	0	0	112.7	D984 D988 F989	D984-P986 WeakPolarHBondContact O-CD 3.35Å; P986-D988 PolarHBondContact O-N 3.13Å; P986-F989 HydrophobicContact CB-CD2 4.06Å; P986-F989 HydrophobicContact CB-CE2 4.36Å; P986-F989 HydrophobicContact CB-CG 4.21Å; P986-F989 HydrophobicContact CG-CD2 3.78Å; P986-F989 HydrophobicContact CG-CE2 3.88Å; P986-F989 HydrophobicContact CG-CG 4.42Å; P986-F989 PolarHBondContact O-N 3.48Å
987	S	82.6	Confident	78.7	Confident	84 Å²	84	66.8 Å²	66.8	59%	0.587	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-56.4	-35.9	-179.2	53.3	0	0	0	0	114.1	F989 M990	S987-F989 PolarHBondContact O-N 2.9Å; S987-M990 WeakPolarHBondContact O-CB 3.31Å; S987-M990 PolarHBondContact O-N 3.4Å; S987-M990 VanDerWaalsContact O-N 3.08Å
988	D	86.2	Confident	79.5	Confident	123 Å²	123	62.7 Å²	62.7	66%	0.658	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-71.9	-13.5	-177.9	-57.1	-14.4	0	0	0	112.5	P986 M998	P986-D988 PolarHBondContact O-N 3.13Å; D988-M998 VanDerWaalsContact O-CE 3.24Å; D988-M998 WeakPolarHBondContact O-CE 3.46Å
989	F	90.7	Very high	80.3	Confident	24 Å²	24	66 Å²	66	11%	0.105	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-96.7	-4.2	175.7	-60.1	-7.5	0	0	0	112	V985 P986 S987 L997 M998 L1043 Q1046 I1047 W1050	V985-F989 HydrophobicContact CG1-CB 4.06Å; P986-F989 HydrophobicContact CB-CD2 4.06Å; P986-F989 HydrophobicContact CB-CE2 4.36Å; P986-F989 HydrophobicContact CB-CG 4.21Å; P986-F989 HydrophobicContact CG-CD2 3.78Å; P986-F989 HydrophobicContact CG-CE2 3.88Å; P986-F989 HydrophobicContact CG-CG 4.42Å; P986-F989 PolarHBondContact O-N 3.48Å; S987-F989 PolarHBondContact O-N 2.9Å; F989-L997 HydrophobicContact CB-CD1 3.85Å; F989-M998 VanDerWaalsContact C-CE 3.48Å; F989-M998 PolarHBondContact O-N 2.99Å; F989-L1043 HydrophobicContact CD1-CD1 3.94Å; F989-L1043 HydrophobicContact CE1-CD1 3.96Å; F989-Q1046 HydrophobicContact CE1-CB 4.34Å; F989-Q1046 HydrophobicContact CZ-CB 4.2Å; F989-I1047 HydrophobicContact CB-CD1 4.3Å; F989-I1047 HydrophobicContact CB-CG1 3.97Å; F989-I1047 HydrophobicContact CD1-CD1 4.48Å; F989-I1047 HydrophobicContact CD1-CG1 3.82Å; F989-I1047 HydrophobicContact CD2-CG1 4.06Å; F989-I1047 HydrophobicContact CE1-CG1 4.33Å; F989-I1047 HydrophobicContact CG-CD1 4.44Å; F989-I1047 HydrophobicContact CG-CG1 3.69Å; F989-W1050 HydrophobicContact CD2-CB 4.42Å; F989-W1050 HydrophobicContact CD2-CD2 4.31Å; F989-W1050 HydrophobicContact CD2-CG 4.19Å; F989-W1050 HydrophobicContact CE2-CB 3.76Å; F989-W1050 AromaticContact CE2-CD1 3.97Å; F989-W1050 HydrophobicContact CE2-CD2 4.32Å; F989-W1050 AromaticContact CE2-CG 3.73Å; F989-W1050 HydrophobicContact CE2-CG 3.73Å
990	M	88.9	Confident	81.4	Confident	71 Å²	71	64 Å²	64	35%	0.35	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-91.7	140	179.4	-62.2	-164.1	-77.8	0	0	111.4	V985 S987 T996	V985-M990 HydrophobicContact CB-CG 4.43Å; V985-M990 HydrophobicContact CG1-CG 3.66Å; V985-M990 HydrophobicContact CG1-SD 4.48Å; S987-M990 WeakPolarHBondContact O-CB 3.31Å; S987-M990 PolarHBondContact O-N 3.4Å; S987-M990 VanDerWaalsContact O-N 3.08Å; M990-T996 CarbonylContact C-O 3.54Å; M990-T996 WeakPolarHBondContact CA-O 3.12Å
991	D	89.1	Confident	82.9	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.005	33%	0.332	C	S	.	.			trans	-64.5	128.7	172	-178.3	-88	0	0	0	109.3	V993 M994 G995 T996 M998 M1010 D1011	D991-V993 PolarHBondContact O-N 3.29Å; D991-V993 WeakPolarHBondContact OD1-CA 3.49Å; D991-V993 WeakPolarHBondContact OD1-CB 3.37Å; D991-V993 PolarHBondContact OD1-N 2.87Å; D991-M994 HydrophobicContact CB-CB 4.47Å; D991-M994 PolarHBondContact OD1-N 3.14Å; D991-G995 VanDerWaalsContact O-CA 3.25Å; D991-G995 WeakPolarHBondContact O-CA 3.42Å; D991-G995 PolarHBondContact O-N 3.06Å; D991-T996 PolarHBondContact N-O 2.82Å; D991-M998 HydrophobicContact CB-CG 3.96Å; D991-M1010 WeakPolarHBondContact OD2-CA 3.41Å; D991-M1010 WeakPolarHBondContact OD2-CB 3.31Å; D991-D1011 HydrophobicContact CB-CB 4.47Å; D991-D1011 PolarHBondContact OD2-N 3.28Å
992	P	88.3	Confident	84.4	Confident	76 Å²	76	56 Å²	56	49%	0.494	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-19.1	-175	26.1	-36.7	0	0	0	114.4	I1009 M1010 F1027	P992-I1009 WeakPolarHBondContact CD-O 3.5Å; P992-I1009 WeakPolarHBondContact CG-O 3.46Å; P992-M1010 HydrophobicContact CG-CG 3.85Å; P992-F1027 HydrophobicContact CB-CE1 4.38Å; P992-F1027 HydrophobicContact CB-CZ 4.11Å; P992-F1027 HydrophobicContact CG-CE1 4.43Å; P992-F1027 HydrophobicContact CG-CZ 3.69Å
993	V	85.1	Confident	85.7	Confident	76 Å²	76	60.2 Å²	60.2	46%	0.461	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-48.4	-179.7	176.4	0	0	0	0	110.9	D991 M1010 V1014 F1027	D991-V993 PolarHBondContact O-N 3.29Å; D991-V993 WeakPolarHBondContact OD1-CA 3.49Å; D991-V993 WeakPolarHBondContact OD1-CB 3.37Å; D991-V993 PolarHBondContact OD1-N 2.87Å; V993-M1010 HydrophobicContact CB-CE 3.93Å; V993-M1010 HydrophobicContact CG2-CE 3.43Å; V993-M1010 VanDerWaalsContact CG2-CE 3.43Å; V993-M1010 HydrophobicContact CG2-SD 4.27Å; V993-V1014 HydrophobicContact CB-CG1 4.35Å; V993-F1027 HydrophobicContact CG2-CE1 3.98Å; V993-F1027 HydrophobicContact CG2-CZ 3.74Å
994	M	82.4	Confident	87.1	Confident	100 Å²	100	55.3 Å²	55.3	49%	0.493	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-16.6	-175.1	-66.3	-61.9	-64.3	0	0	113.6	D991 T996 V1014	D991-M994 HydrophobicContact CB-CB 4.47Å; D991-M994 PolarHBondContact OD1-N 3.14Å; M994-T996 HydrophobicContact CB-CG2 4.17Å; M994-T996 PolarHBondContact O-N 2.89Å; M994-V1014 HydrophobicContact CB-CG2 4.32Å; M994-V1014 HydrophobicContact CG-CB 4.33Å; M994-V1014 HydrophobicContact CG-CG1 3.59Å; M994-V1014 HydrophobicContact CG-CG2 3.7Å
995	G	82.9	Confident	87.7	Confident	48 Å²	48	55 Å²	55	50%	0.495	31%	0.31	S	S	.	.			trans	66.2	18.6	-175.9	0	0	0	0	0	113.8	D991	D991-G995 VanDerWaalsContact O-CA 3.25Å; D991-G995 WeakPolarHBondContact O-CA 3.42Å; D991-G995 PolarHBondContact O-N 3.06Å
996	T	83.6	Confident	88.1	Confident	70 Å²	70	55.8 Å²	55.8	43%	0.429	32%	0.317	S	S	.	.	S	Bend	trans	-101.9	151.6	-177.7	52.6	0	0	0	0	111	M990 D991 M994 M998	M990-T996 CarbonylContact C-O 3.54Å; M990-T996 WeakPolarHBondContact CA-O 3.12Å; D991-T996 PolarHBondContact N-O 2.82Å; M994-T996 HydrophobicContact CB-CG2 4.17Å; M994-T996 PolarHBondContact O-N 2.89Å; T996-M998 PolarHBondContact O-N 3.48Å
997	L	86.2	Confident	88.3	Confident	31 Å²	31	55.3 Å²	55.3	16%	0.162	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-54.7	121.7	172.4	178.6	70	0	0	0	110.9	V985 F989 R999 I1047 W1050 I1051	V985-L997 HydrophobicContact CG1-CB 4.35Å; V985-L997 HydrophobicContact CG1-CD1 3.57Å; V985-L997 HydrophobicContact CG2-CB 4.35Å; V985-L997 HydrophobicContact CG2-CD1 4.25Å; F989-L997 HydrophobicContact CB-CD1 3.85Å; L997-R999 PolarHBondContact O-N 2.79Å; L997-I1047 HydrophobicContact CD1-CG2 4.1Å; L997-W1050 HydrophobicContact CD1-CZ3 4.34Å; L997-W1050 HydrophobicContact CD2-CZ3 4.17Å; L997-I1051 HydrophobicContact CD2-CD1 4.25Å; L997-I1051 HydrophobicContact CD2-CG1 4.16Å
998	M	89.9	Confident	88.8	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.02	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-66.9	129.6	174.8	-63.8	-176.8	-81.1	0	0	109.4	D988 F989 D991 T996 P1001 I1009 D1011 L1043 I1047	D988-M998 VanDerWaalsContact O-CE 3.24Å; D988-M998 WeakPolarHBondContact O-CE 3.46Å; F989-M998 VanDerWaalsContact C-CE 3.48Å; F989-M998 PolarHBondContact O-N 2.99Å; D991-M998 HydrophobicContact CB-CG 3.96Å; T996-M998 PolarHBondContact O-N 3.48Å; M998-P1001 HydrophobicContact CB-CB 4.32Å; M998-P1001 HydrophobicContact SD-CB 4.07Å; M998-I1009 HydrophobicContact CE-CG2 4.44Å; M998-I1009 HydrophobicContact SD-CG2 4Å; M998-D1011 HydrophobicContact CB-CB 4.31Å; M998-D1011 HydrophobicContact CG-CB 4.11Å; M998-L1043 HydrophobicContact CE-CD2 3.8Å; M998-I1047 HydrophobicContact CB-CD1 4.03Å; M998-I1047 WeakPolarHBondContact O-CG2 3.17Å
999	R	87.2	Confident	89.1	Confident	132 Å²	132	50.3 Å²	50.3	50%	0.498	29%	0.29	S	S	.	.	S	Bend	trans	-101.7	-31.3	174.9	-65.8	-66.9	-173.2	170.9	-2.2	111.6	L997 D1011	L997-R999 PolarHBondContact O-N 2.79Å; R999-D1011 PolarHBondContact N-OD2 2.98Å
1000	D	90.5	Very high	89.2	Confident	41 Å²	41	49.2 Å²	49.2	22%	0.219	29%	0.285	C	S	.	.	S	Bend	trans	-135	78.7	176.6	-165.6	46.2	0	0	0	110.1	D1011 R1012 K1044	D1000-D1011 PolarHBondContact N-OD2 3.01Å; D1000-R1012 HydrophobicContact CB-CB 4.14Å; D1000-R1012 WeakPolarHBondContact O-CB 3.39Å; D1000-R1012 PolarHBondContact O-N 3.12Å; D1000-R1012 VanDerWaalsContact OD2-CD 3.26Å; D1000-R1012 WeakPolarHBondContact OD2-CD 3.38Å; D1000-R1012 IonicContact OD2-CZ 2.64Å; D1000-R1012 IonicContact OD2-NE 3.79Å; D1000-R1012 PolarHBondContact OD2-NE 3.39Å; D1000-K1044 IonicContact OD1-NZ 3.27Å; D1000-K1044 PolarHBondContact OD1-NZ 3.03Å
1001	P	93.6	Very high	89.3	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	135	-175.5	29.2	-36.4	0	0	0	111.8	M998 I1009 M1010 A1040 L1043 K1044 I1047	M998-P1001 HydrophobicContact CB-CB 4.32Å; M998-P1001 HydrophobicContact SD-CB 4.07Å; P1001-I1009 HydrophobicContact CB-CG2 3.84Å; P1001-M1010 CarbonylContact C-O 3.55Å; P1001-M1010 WeakPolarHBondContact CA-O 3.37Å; P1001-A1040 HydrophobicContact CB-CB 4.1Å; P1001-A1040 HydrophobicContact CG-CB 4.3Å; P1001-A1040 WeakPolarHBondContact O-CB 3.04Å; P1001-A1040 PolarHBondContact O-N 2.94Å; P1001-L1043 HydrophobicContact CB-CD2 3.93Å; P1001-L1043 HydrophobicContact CB-CG 4.43Å; P1001-L1043 HydrophobicContact CG-CB 4.2Å; P1001-L1043 HydrophobicContact CG-CD2 4.34Å; P1001-L1043 HydrophobicContact CG-CG 4.3Å; P1001-K1044 HydrophobicContact CG-CB 3.8Å; P1001-I1047 HydrophobicContact CG-CD1 4.14Å
1002	V	94.4	Very high	89.4	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143.8	177.5	-63.5	0	0	0	0	110.7	I1009 M1010 R1012 I1015 L1037 V1038	V1002-I1009 VanDerWaalsContact O-CA 3.31Å; V1002-I1009 WeakPolarHBondContact O-CA 3.34Å; V1002-M1010 WeakPolarHBondContact CG2-O 3.32Å; V1002-M1010 PolarHBondContact N-O 2.67Å; V1002-M1010 PolarHBondContact O-N 3.42Å; V1002-R1012 HydrophobicContact CG1-CB 3.88Å; V1002-R1012 HydrophobicContact CG1-CG 4.32Å; V1002-R1012 HydrophobicContact CG2-CB 4.37Å; V1002-I1015 HydrophobicContact CG2-CG2 3.58Å; V1002-L1037 HydrophobicContact CB-CB 4.5Å; V1002-V1038 CarbonylContact C-O 3.52Å; V1002-V1038 WeakPolarHBondContact CA-O 3.36Å
1003	K	93.8	Very high	89.4	Confident	109 Å²	109	48.1 Å²	48.1	47%	0.474	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	128	179.7	-172	176.1	-177.7	178	0	110.4	I1009 V1038	K1003-I1009 HydrophobicContact CB-CG1 4.46Å; K1003-I1009 HydrophobicContact CG-CG1 4.45Å; K1003-V1038 PolarHBondContact N-O 3.34Å; K1003-V1038 PolarHBondContact O-N 2.75Å; K1003-V1038 VanDerWaalsContact O-N 3.08Å
1004	L	93.1	Very high	89.4	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.021	26%	0.257	C	S	.	.			trans	-84.4	157.7	173.8	-75.4	67.8	0	0	0	110.4	S1006 G1007 S1008 M1010 I1015 D1025 F1027 L1032 L1037	L1004-S1006 PolarHBondContact O-N 2.92Å; L1004-G1007 PolarHBondContact O-N 3.48Å; L1004-S1008 PolarHBondContact N-O 3.26Å; L1004-M1010 HydrophobicContact CD1-CB 4.07Å; L1004-M1010 HydrophobicContact CD1-CG 4.02Å; L1004-M1010 HydrophobicContact CD1-SD 4.26Å; L1004-M1010 HydrophobicContact CD2-SD 4.1Å; L1004-I1015 HydrophobicContact CD1-CG1 4.26Å; L1004-I1015 HydrophobicContact CD2-CD1 3.92Å; L1004-I1015 HydrophobicContact CD2-CG1 4.36Å; L1004-I1015 HydrophobicContact CG-CG1 4.46Å; L1004-D1025 WeakPolarHBondContact CD2-OD2 3.43Å; L1004-F1027 HydrophobicContact CD2-CD2 4.45Å; L1004-F1027 HydrophobicContact CD2-CE2 4.4Å; L1004-L1032 HydrophobicContact CD2-CD2 3.78Å; L1004-L1032 HydrophobicContact CG-CD2 4.01Å; L1004-L1037 HydrophobicContact CD1-CD2 4.26Å; L1004-L1037 HydrophobicContact CG-CD2 4.1Å
1005	P	89.1	Confident	89.8	Confident	80 Å²	80	40.5 Å²	40.5	52%	0.519	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-30.9	173	-25.1	33.4	0	0	0	114.2	G1007 L1032 M1036	P1005-G1007 PolarHBondContact O-N 3.45Å; P1005-L1032 HydrophobicContact CG-CD1 3.69Å; P1005-M1036 HydrophobicContact CG-CB 3.92Å; P1005-M1036 HydrophobicContact CG-CE 3.82Å
1006	S	89	Confident	90.1	Very high	47 Å²	47	38.5 Å²	38.5	33%	0.329	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-13.2	174.3	55.3	0	0	0	0	113.8	L1004 D1025	L1004-S1006 PolarHBondContact O-N 2.92Å; S1006-D1025 WeakPolarHBondContact CB-OD2 3.49Å; S1006-D1025 PolarHBondContact OG-OD2 3.35Å
1007	G	89	Confident	90.1	Very high	40 Å²	40	37.9 Å²	37.9	41%	0.412	20%	0.201	S	C	.	.	S	Bend	trans	95.7	-14.2	-176.9	0	0	0	0	0	114.2	L1004 P1005	L1004-G1007 PolarHBondContact O-N 3.48Å; P1005-G1007 PolarHBondContact O-N 3.45Å
1008	S	91.8	Very high	90.1	Very high	39 Å²	39	38.9 Å²	38.9	27%	0.273	21%	0.205	S	C	.	.			trans	-64.2	143.9	174.8	-63.2	0	0	0	0	111.5	L1004 F1027	L1004-S1008 PolarHBondContact N-O 3.26Å; S1008-F1027 WeakPolarHBondContact OG-CD2 3.31Å
1009	I	92.4	Very high	90	Very high	62 Å²	62	38.9 Å²	38.9	32%	0.318	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	131.3	173.2	-58.3	175.3	0	0	0	108	P992 M998 P1001 V1002 K1003 A1040 L1043	P992-I1009 WeakPolarHBondContact CD-O 3.5Å; P992-I1009 WeakPolarHBondContact CG-O 3.46Å; M998-I1009 HydrophobicContact CE-CG2 4.44Å; M998-I1009 HydrophobicContact SD-CG2 4Å; P1001-I1009 HydrophobicContact CB-CG2 3.84Å; V1002-I1009 VanDerWaalsContact O-CA 3.31Å; V1002-I1009 WeakPolarHBondContact O-CA 3.34Å; K1003-I1009 HydrophobicContact CB-CG1 4.46Å; K1003-I1009 HydrophobicContact CG-CG1 4.45Å; I1009-A1040 HydrophobicContact CG2-CB 4.35Å; I1009-L1043 HydrophobicContact CD1-CD2 4.11Å; I1009-L1043 HydrophobicContact CG2-CD2 3.82Å
1010	M	92.9	Very high	89.9	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	162.3	178.5	-67.6	-173.1	65.7	0	0	110	D991 P992 V993 P1001 V1002 L1004 V1014 I1015 P1026 F1027	D991-M1010 WeakPolarHBondContact OD2-CA 3.41Å; D991-M1010 WeakPolarHBondContact OD2-CB 3.31Å; P992-M1010 HydrophobicContact CG-CG 3.85Å; V993-M1010 HydrophobicContact CB-CE 3.93Å; V993-M1010 HydrophobicContact CG2-CE 3.43Å; V993-M1010 VanDerWaalsContact CG2-CE 3.43Å; V993-M1010 HydrophobicContact CG2-SD 4.27Å; P1001-M1010 CarbonylContact C-O 3.55Å; P1001-M1010 WeakPolarHBondContact CA-O 3.37Å; V1002-M1010 WeakPolarHBondContact CG2-O 3.32Å; V1002-M1010 PolarHBondContact N-O 2.67Å; V1002-M1010 PolarHBondContact O-N 3.42Å; L1004-M1010 HydrophobicContact CD1-CB 4.07Å; L1004-M1010 HydrophobicContact CD1-CG 4.02Å; L1004-M1010 HydrophobicContact CD1-SD 4.26Å; L1004-M1010 HydrophobicContact CD2-SD 4.1Å; M1010-V1014 HydrophobicContact CE-CB 4.31Å; M1010-V1014 HydrophobicContact CE-CG1 3.61Å; M1010-I1015 HydrophobicContact CB-CB 4.28Å; M1010-I1015 HydrophobicContact CE-CB 4.36Å; M1010-I1015 HydrophobicContact SD-CB 4.27Å; M1010-I1015 HydrophobicContact SD-CD1 3.94Å; M1010-I1015 HydrophobicContact SD-CG1 4.48Å; M1010-P1026 HydrophobicContact CE-CG 4.28Å; M1010-P1026 HydrophobicContact SD-CG 3.7Å; M1010-F1027 HydrophobicContact CG-CE2 3.98Å; M1010-F1027 HydrophobicContact CG-CZ 4.18Å; M1010-F1027 HydrophobicContact SD-CE2 3.46Å; M1010-F1027 WeakPolarHBondContact SD-CE2 3.46Å; M1010-F1027 HydrophobicContact SD-CZ 3.78Å
1011	D	92	Very high	89.4	Confident	6 Å²	6	34.4 Å²	34.4	3%	0.032	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	135.6	166.3	-172.5	-87.7	0	0	0	110.2	D991 M998 R999 D1000 T1013 V1014 I1015	D991-D1011 HydrophobicContact CB-CB 4.47Å; D991-D1011 PolarHBondContact OD2-N 3.28Å; M998-D1011 HydrophobicContact CB-CB 4.31Å; M998-D1011 HydrophobicContact CG-CB 4.11Å; R999-D1011 PolarHBondContact N-OD2 2.98Å; D1000-D1011 PolarHBondContact N-OD2 3.01Å; D1011-T1013 VanDerWaalsContact C-N 3.26Å; D1011-T1013 PolarHBondContact O-N 2.92Å; D1011-T1013 WeakPolarHBondContact OD1-CB 3.37Å; D1011-T1013 PolarHBondContact OD1-N 3.14Å; D1011-T1013 PolarHBondContact OD1-OG1 3.4Å; D1011-V1014 HydrophobicContact CB-CB 4.35Å; D1011-V1014 HydrophobicContact CB-CG2 3.98Å; D1011-V1014 PolarHBondContact O-N 3.21Å; D1011-V1014 VanDerWaalsContact O-N 3.07Å; D1011-I1015 PolarHBondContact O-N 3.41Å
1012	R	91	Very high	88.8	Confident	62 Å²	62	37.8 Å²	37.8	23%	0.234	21%	0.211	C	C	.	.	H	α-helix	trans	-51	-46.3	179.5	-176.2	178	-65.4	-81.9	-3.3	111.8	D1000 V1002 V1014 I1015 T1016	D1000-R1012 HydrophobicContact CB-CB 4.14Å; D1000-R1012 WeakPolarHBondContact O-CB 3.39Å; D1000-R1012 PolarHBondContact O-N 3.12Å; D1000-R1012 VanDerWaalsContact OD2-CD 3.26Å; D1000-R1012 WeakPolarHBondContact OD2-CD 3.38Å; D1000-R1012 IonicContact OD2-CZ 2.64Å; D1000-R1012 IonicContact OD2-NE 3.79Å; D1000-R1012 PolarHBondContact OD2-NE 3.39Å; V1002-R1012 HydrophobicContact CG1-CB 3.88Å; V1002-R1012 HydrophobicContact CG1-CG 4.32Å; V1002-R1012 HydrophobicContact CG2-CB 4.37Å; R1012-V1014 VanDerWaalsContact C-N 3.26Å; R1012-V1014 PolarHBondContact O-N 3.26Å; R1012-I1015 WeakPolarHBondContact O-CG2 3.29Å; R1012-I1015 PolarHBondContact O-N 3.4Å; R1012-T1016 WeakPolarHBondContact O-CB 3.41Å; R1012-T1016 PolarHBondContact O-N 3.5Å; R1012-T1016 PolarHBondContact O-OG1 2.95Å
1013	T	87.3	Confident	88.5	Confident	58 Å²	58	42.3 Å²	42.3	36%	0.356	23%	0.233	S	C	.	.	H	α-helix	trans	-65.4	-32.8	-176	65.6	0	0	0	0	112.3	D1011 R1017	D1011-T1013 VanDerWaalsContact C-N 3.26Å; D1011-T1013 PolarHBondContact O-N 2.92Å; D1011-T1013 WeakPolarHBondContact OD1-CB 3.37Å; D1011-T1013 PolarHBondContact OD1-N 3.14Å; D1011-T1013 PolarHBondContact OD1-OG1 3.4Å; T1013-R1017 WeakPolarHBondContact O-CB 3.34Å; T1013-R1017 PolarHBondContact O-N 3Å
1014	V	86.7	Confident	88.2	Confident	16 Å²	16	38.7 Å²	38.7	10%	0.097	22%	0.22	C	C	.	.	H	α-helix	trans	-73.5	-47	178.6	179.7	0	0	0	0	110.7	V993 M994 M1010 D1011 R1012 R1017 H1018	V993-V1014 HydrophobicContact CB-CG1 4.35Å; M994-V1014 HydrophobicContact CB-CG2 4.32Å; M994-V1014 HydrophobicContact CG-CB 4.33Å; M994-V1014 HydrophobicContact CG-CG1 3.59Å; M994-V1014 HydrophobicContact CG-CG2 3.7Å; M1010-V1014 HydrophobicContact CE-CB 4.31Å; M1010-V1014 HydrophobicContact CE-CG1 3.61Å; D1011-V1014 HydrophobicContact CB-CB 4.35Å; D1011-V1014 HydrophobicContact CB-CG2 3.98Å; D1011-V1014 PolarHBondContact O-N 3.21Å; D1011-V1014 VanDerWaalsContact O-N 3.07Å; R1012-V1014 VanDerWaalsContact C-N 3.26Å; R1012-V1014 PolarHBondContact O-N 3.26Å; V1014-R1017 WeakPolarHBondContact O-CB 3.44Å; V1014-R1017 PolarHBondContact O-N 3.38Å; V1014-H1018 PolarHBondContact O-N 3.01Å; V1014-H1018 VanDerWaalsContact O-N 3.13Å
1015	I	90.2	Very high	88	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-70.2	-42.1	179.6	-172.8	57.7	0	0	0	111.9	V1002 L1004 M1010 D1011 R1012 R1017 H1018 L1019 P1026 L1032 L1037	V1002-I1015 HydrophobicContact CG2-CG2 3.58Å; L1004-I1015 HydrophobicContact CD1-CG1 4.26Å; L1004-I1015 HydrophobicContact CD2-CD1 3.92Å; L1004-I1015 HydrophobicContact CD2-CG1 4.36Å; L1004-I1015 HydrophobicContact CG-CG1 4.46Å; M1010-I1015 HydrophobicContact CB-CB 4.28Å; M1010-I1015 HydrophobicContact CE-CB 4.36Å; M1010-I1015 HydrophobicContact SD-CB 4.27Å; M1010-I1015 HydrophobicContact SD-CD1 3.94Å; M1010-I1015 HydrophobicContact SD-CG1 4.48Å; D1011-I1015 PolarHBondContact O-N 3.41Å; R1012-I1015 WeakPolarHBondContact O-CG2 3.29Å; R1012-I1015 PolarHBondContact O-N 3.4Å; I1015-R1017 PolarHBondContact O-N 3.36Å; I1015-H1018 HydrophobicContact CD1-CB 4.35Å; I1015-H1018 WeakPolarHBondContact O-CB 3.13Å; I1015-H1018 PolarHBondContact O-N 2.56Å; I1015-L1019 HydrophobicContact CG1-CD1 4.39Å; I1015-L1019 HydrophobicContact CG1-CG 4.48Å; I1015-L1019 WeakPolarHBondContact O-CG 3.37Å; I1015-L1019 PolarHBondContact O-N 3.36Å; I1015-P1026 HydrophobicContact CD1-CG 4.07Å; I1015-L1032 HydrophobicContact CD1-CD2 3.94Å; I1015-L1032 HydrophobicContact CG1-CD2 4.28Å; I1015-L1037 HydrophobicContact CG1-CD1 4.39Å; I1015-L1037 HydrophobicContact CG1-CD2 4.05Å; I1015-L1037 HydrophobicContact CG2-CD1 3.77Å; I1015-L1037 HydrophobicContact CG2-CD2 4.4Å
1016	T	88	Confident	88	Confident	5 Å²	5	37 Å²	37	3%	0.031	21%	0.208	C	C	.	.	H	α-helix	trans	-62.3	-37.9	177.7	-46.1	0	0	0	0	110.4	E869 R1012 H1018 L1019 L1020	E869-T1016 HydrophobicContact CG-CG2 4.25Å; E869-T1016 WeakPolarHBondContact OE2-CG2 3.2Å; R1012-T1016 WeakPolarHBondContact O-CB 3.41Å; R1012-T1016 PolarHBondContact O-N 3.5Å; R1012-T1016 PolarHBondContact O-OG1 2.95Å; T1016-H1018 PolarHBondContact O-N 3.31Å; T1016-L1019 WeakPolarHBondContact O-CB 3.44Å; T1016-L1019 PolarHBondContact O-N 2.93Å; T1016-L1019 VanDerWaalsContact O-N 3.1Å; T1016-L1020 WeakPolarHBondContact O-CG 3.4Å; T1016-L1020 PolarHBondContact O-N 2.82Å
1017	R	83.9	Confident	88.1	Confident	57 Å²	57	39 Å²	39	22%	0.215	21%	0.211	C	C	.	.	H	α-helix	trans	-58.7	-42.1	171.8	-180	-177.2	-62.2	172.6	3.4	113.3	D872 T1013 V1014 I1015 L1019 L1020	D872-R1017 IonicContact OD2-NH2 2.82Å; T1013-R1017 WeakPolarHBondContact O-CB 3.34Å; T1013-R1017 PolarHBondContact O-N 3Å; V1014-R1017 WeakPolarHBondContact O-CB 3.44Å; V1014-R1017 PolarHBondContact O-N 3.38Å; I1015-R1017 PolarHBondContact O-N 3.36Å; R1017-L1019 VanDerWaalsContact C-N 3.33Å; R1017-L1020 PolarHBondContact O-N 2.92Å
1018	H	86.3	Confident	88	Confident	52 Å²	52	40 Å²	40	24%	0.241	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-45.8	174.2	176.5	76.1	0	0	0	110.7	V1014 I1015 T1016 L1020 N1021 T1022 T1024	V1014-H1018 PolarHBondContact O-N 3.01Å; V1014-H1018 VanDerWaalsContact O-N 3.13Å; I1015-H1018 HydrophobicContact CD1-CB 4.35Å; I1015-H1018 WeakPolarHBondContact O-CB 3.13Å; I1015-H1018 PolarHBondContact O-N 2.56Å; T1016-H1018 PolarHBondContact O-N 3.31Å; H1018-L1020 VanDerWaalsContact C-N 3.27Å; H1018-L1020 PolarHBondContact O-N 3.37Å; H1018-N1021 PolarHBondContact O-N 2.91Å; H1018-T1022 PolarHBondContact O-N 3.39Å; H1018-T1024 PolarHBondContact CD2-O 3.01Å; H1018-T1024 PolarHBondContact NE2-O 2.94Å; H1018-T1024 PolarHBondContact NE2-OG1 3.46Å
1019	L	88	Confident	87.7	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-27.8	179.9	-63.8	178	0	0	0	113.9	I1015 T1016 R1017 N1021 T1022 Q1023 L1032 E1034 L1037	I1015-L1019 HydrophobicContact CG1-CD1 4.39Å; I1015-L1019 HydrophobicContact CG1-CG 4.48Å; I1015-L1019 WeakPolarHBondContact O-CG 3.37Å; I1015-L1019 PolarHBondContact O-N 3.36Å; T1016-L1019 WeakPolarHBondContact O-CB 3.44Å; T1016-L1019 PolarHBondContact O-N 2.93Å; T1016-L1019 VanDerWaalsContact O-N 3.1Å; R1017-L1019 VanDerWaalsContact C-N 3.33Å; L1019-N1021 VanDerWaalsContact C-N 3.26Å; L1019-N1021 PolarHBondContact O-N 3.15Å; L1019-T1022 VanDerWaalsContact CA-O 3.32Å; L1019-T1022 WeakPolarHBondContact CA-O 3.26Å; L1019-Q1023 PolarHBondContact O-NE2 2.88Å; L1019-L1032 HydrophobicContact CD2-CB 4.08Å; L1019-L1032 HydrophobicContact CD2-CD2 4.17Å; L1019-L1032 HydrophobicContact CD2-CG 4.06Å; L1019-L1032 VanDerWaalsContact CD2-O 3.27Å; L1019-L1032 WeakPolarHBondContact CD2-O 3.49Å; L1019-E1034 HydrophobicContact CD1-CB 4.48Å; L1019-L1037 HydrophobicContact CD1-CD1 4.24Å
1020	L	84.4	Confident	87.5	Confident	16 Å²	16	51.4 Å²	51.4	8%	0.084	25%	0.248	C	C	.	.	H	α-helix	trans	-66.1	-26.6	173.6	-65.8	179.4	0	0	0	113.4	I781 N785 E869 L870 T1016 R1017 H1018	I781-L1020 HydrophobicContact CG2-CD1 4.15Å; I781-L1020 HydrophobicContact CG2-CD2 3.78Å; N785-L1020 HydrophobicContact CB-CB 4.18Å; N785-L1020 HydrophobicContact CB-CD1 4.14Å; N785-L1020 VanDerWaalsContact ND2-C 3.26Å; N785-L1020 VanDerWaalsContact ND2-CB 3.28Å; N785-L1020 WeakPolarHBondContact ND2-CB 3.36Å; N785-L1020 PolarHBondContact ND2-O 3.28Å; E869-L1020 HydrophobicContact CB-CD1 3.94Å; E869-L1020 WeakPolarHBondContact OE2-CD1 3.47Å; L870-L1020 HydrophobicContact CD2-CD1 4.2Å; T1016-L1020 WeakPolarHBondContact O-CG 3.4Å; T1016-L1020 PolarHBondContact O-N 2.82Å; R1017-L1020 PolarHBondContact O-N 2.92Å; H1018-L1020 VanDerWaalsContact C-N 3.27Å; H1018-L1020 PolarHBondContact O-N 3.37Å
1021	N	81.1	Confident	87.3	Confident	63 Å²	63	56.6 Å²	56.6	34%	0.337	28%	0.282	S	S	.	.	H	α-helix	trans	-95.6	-42.5	176.1	-67.1	-35.8	0	0	0	111.4	N785 M786 N789 H1018 L1019	N785-N1021 PolarHBondContact ND2-OD1 3.1Å; M786-N1021 WeakPolarHBondContact CE-OD1 3.49Å; N789-N1021 PolarHBondContact ND2-OD1 3.45Å; H1018-N1021 PolarHBondContact O-N 2.91Å; L1019-N1021 VanDerWaalsContact C-N 3.26Å; L1019-N1021 PolarHBondContact O-N 3.15Å
1022	T	81.4	Confident	87.2	Confident	71 Å²	71	56.5 Å²	56.5	44%	0.436	28%	0.281	S	S	.	.			trans	-147.4	125	-175.6	-47.1	0	0	0	0	110.2	H1018 L1019 T1024	H1018-T1022 PolarHBondContact O-N 3.39Å; L1019-T1022 VanDerWaalsContact CA-O 3.32Å; L1019-T1022 WeakPolarHBondContact CA-O 3.26Å; T1022-T1024 HydrophobicContact CG2-CG2 3.88Å; T1022-T1024 VanDerWaalsContact CG2-OG1 3.24Å; T1022-T1024 WeakPolarHBondContact CG2-OG1 3.49Å; T1022-T1024 PolarHBondContact O-N 3.26Å
1023	Q	86.5	Confident	87	Confident	96 Å²	96	56.8 Å²	56.8	45%	0.449	29%	0.287	S	S	.	.	S	Bend	trans	-79.1	57	-179.3	-67.3	-74	-35.7	0	0	111.6	L1019 P1031 L1032	L1019-Q1023 PolarHBondContact O-NE2 2.88Å; Q1023-P1031 WeakPolarHBondContact O-CA 3.47Å; Q1023-L1032 CarbonylContact C-O 3.59Å; Q1023-L1032 WeakPolarHBondContact CA-O 3.4Å; Q1023-L1032 PolarHBondContact O-N 3.27Å; Q1023-L1032 PolarHBondContact OE1-O 3.43Å
1024	T	88.5	Confident	86.9	Confident	32 Å²	32	58.3 Å²	58.3	20%	0.196	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-135.6	162	-177.2	53.8	0	0	0	0	111.7	H1018 T1022 Q1030	H1018-T1024 PolarHBondContact CD2-O 3.01Å; H1018-T1024 PolarHBondContact NE2-O 2.94Å; H1018-T1024 PolarHBondContact NE2-OG1 3.46Å; T1022-T1024 HydrophobicContact CG2-CG2 3.88Å; T1022-T1024 VanDerWaalsContact CG2-OG1 3.24Å; T1022-T1024 WeakPolarHBondContact CG2-OG1 3.49Å; T1022-T1024 PolarHBondContact O-N 3.26Å; T1024-Q1030 CarbonylContact C-O 3.57Å; T1024-Q1030 WeakPolarHBondContact CA-O 3.25Å
1025	D	88.9	Confident	86.9	Confident	5 Å²	5	65.1 Å²	65.1	3%	0.027	33%	0.326	C	S	.	.			trans	-77.1	128.2	167.3	179.4	-54.8	0	0	0	109.5	L1004 S1006 F1027 T1028 R1029 Q1030 L1032	L1004-D1025 WeakPolarHBondContact CD2-OD2 3.43Å; S1006-D1025 WeakPolarHBondContact CB-OD2 3.49Å; S1006-D1025 PolarHBondContact OG-OD2 3.35Å; D1025-F1027 PolarHBondContact O-N 2.97Å; D1025-F1027 WeakPolarHBondContact OD1-CA 3.32Å; D1025-F1027 WeakPolarHBondContact OD1-CB 3.41Å; D1025-F1027 WeakPolarHBondContact OD1-CD2 3.24Å; D1025-F1027 PolarHBondContact OD1-N 3.32Å; D1025-T1028 VanDerWaalsContact CB-OG1 3.3Å; D1025-T1028 WeakPolarHBondContact CB-OG1 3.49Å; D1025-T1028 PolarHBondContact O-N 3.06Å; D1025-T1028 PolarHBondContact OD1-N 2.85Å; D1025-R1029 VanDerWaalsContact O-CA 3.22Å; D1025-R1029 WeakPolarHBondContact O-CA 3.44Å; D1025-R1029 PolarHBondContact O-N 3.01Å; D1025-Q1030 PolarHBondContact N-O 3.39Å; D1025-L1032 HydrophobicContact CB-CB 4.3Å; D1025-L1032 HydrophobicContact CB-CD2 4.12Å
1026	P	88.2	Confident	86.9	Confident	43 Å²	43	68.9 Å²	68.9	28%	0.279	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-19	-175.5	25.5	-33.4	0	0	0	114	M1010 I1015	M1010-P1026 HydrophobicContact CE-CG 4.28Å; M1010-P1026 HydrophobicContact SD-CG 3.7Å; I1015-P1026 HydrophobicContact CD1-CG 4.07Å
1027	F	90.9	Very high	87.1	Confident	89 Å²	89	69.3 Å²	69.3	39%	0.39	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-38.1	-179.7	-50.3	-72.5	0	0	0	112.5	P992 V993 L1004 S1008 M1010 D1025	P992-F1027 HydrophobicContact CB-CE1 4.38Å; P992-F1027 HydrophobicContact CB-CZ 4.11Å; P992-F1027 HydrophobicContact CG-CE1 4.43Å; P992-F1027 HydrophobicContact CG-CZ 3.69Å; V993-F1027 HydrophobicContact CG2-CE1 3.98Å; V993-F1027 HydrophobicContact CG2-CZ 3.74Å; L1004-F1027 HydrophobicContact CD2-CD2 4.45Å; L1004-F1027 HydrophobicContact CD2-CE2 4.4Å; S1008-F1027 WeakPolarHBondContact OG-CD2 3.31Å; M1010-F1027 HydrophobicContact CG-CE2 3.98Å; M1010-F1027 HydrophobicContact CG-CZ 4.18Å; M1010-F1027 HydrophobicContact SD-CE2 3.46Å; M1010-F1027 WeakPolarHBondContact SD-CE2 3.46Å; M1010-F1027 HydrophobicContact SD-CZ 3.78Å; D1025-F1027 PolarHBondContact O-N 2.97Å; D1025-F1027 WeakPolarHBondContact OD1-CA 3.32Å; D1025-F1027 WeakPolarHBondContact OD1-CB 3.41Å; D1025-F1027 WeakPolarHBondContact OD1-CD2 3.24Å; D1025-F1027 PolarHBondContact OD1-N 3.32Å
1028	T	88.2	Confident	87.5	Confident	62 Å²	62	70.8 Å²	70.8	38%	0.38	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-15	-173.8	67.5	0	0	0	0	114.3	D1025 Q1030	D1025-T1028 VanDerWaalsContact CB-OG1 3.3Å; D1025-T1028 WeakPolarHBondContact CB-OG1 3.49Å; D1025-T1028 PolarHBondContact O-N 3.06Å; D1025-T1028 PolarHBondContact OD1-N 2.85Å; T1028-Q1030 PolarHBondContact O-N 3.22Å; T1028-Q1030 VanDerWaalsContact O-N 3.16Å; T1028-Q1030 PolarHBondContact OG1-N 3.18Å
1029	R	85.6	Confident	87.9	Confident	216 Å²	216	71.6 Å²	71.6	82%	0.815	37%	0.372	S	S	*	.			trans	58.9	11.5	-170.7	-56.5	-178.4	177.6	180	-1.8	114.8	D1025	D1025-R1029 VanDerWaalsContact O-CA 3.22Å; D1025-R1029 WeakPolarHBondContact O-CA 3.44Å; D1025-R1029 PolarHBondContact O-N 3.01Å
1030	Q	88	Confident	88.1	Confident	125 Å²	125	72.1 Å²	72.1	58%	0.584	38%	0.377	S	S	*	.			trans	-71.1	150.7	173.8	-67.3	-175.1	-9.7	0	0	110.3	T1024 D1025 T1028 L1032	T1024-Q1030 CarbonylContact C-O 3.57Å; T1024-Q1030 WeakPolarHBondContact CA-O 3.25Å; D1025-Q1030 PolarHBondContact N-O 3.39Å; T1028-Q1030 PolarHBondContact O-N 3.22Å; T1028-Q1030 VanDerWaalsContact O-N 3.16Å; T1028-Q1030 PolarHBondContact OG1-N 3.18Å; Q1030-L1032 PolarHBondContact O-N 3.18Å
1031	P	88.2	Confident	88.4	Confident	109 Å²	109	76 Å²	76	71%	0.708	40%	0.401	S	S	*	.	B	Isolated β-bridge	trans	-53.9	128.6	175.5	-25.6	34.5	0	0	0	111.7	Q1023	Q1023-P1031 WeakPolarHBondContact O-CA 3.47Å
1032	L	89.6	Confident	88.8	Confident	5 Å²	5	80.5 Å²	80.5	3%	0.026	42%	0.42	C	S	.	.			trans	-138.5	134.7	179.6	-177.2	65.6	0	0	0	108.6	L1004 P1005 I1015 L1019 Q1023 D1025 Q1030 M1036 L1037	L1004-L1032 HydrophobicContact CD2-CD2 3.78Å; L1004-L1032 HydrophobicContact CG-CD2 4.01Å; P1005-L1032 HydrophobicContact CG-CD1 3.69Å; I1015-L1032 HydrophobicContact CD1-CD2 3.94Å; I1015-L1032 HydrophobicContact CG1-CD2 4.28Å; L1019-L1032 HydrophobicContact CD2-CB 4.08Å; L1019-L1032 HydrophobicContact CD2-CD2 4.17Å; L1019-L1032 HydrophobicContact CD2-CG 4.06Å; L1019-L1032 VanDerWaalsContact CD2-O 3.27Å; L1019-L1032 WeakPolarHBondContact CD2-O 3.49Å; Q1023-L1032 CarbonylContact C-O 3.59Å; Q1023-L1032 WeakPolarHBondContact CA-O 3.4Å; Q1023-L1032 PolarHBondContact O-N 3.27Å; Q1023-L1032 PolarHBondContact OE1-O 3.43Å; D1025-L1032 HydrophobicContact CB-CB 4.3Å; D1025-L1032 HydrophobicContact CB-CD2 4.12Å; Q1030-L1032 PolarHBondContact O-N 3.18Å; L1032-M1036 HydrophobicContact CD1-CB 3.81Å; L1032-M1036 HydrophobicContact CD1-CE 4.48Å; L1032-M1036 HydrophobicContact CD1-SD 4.15Å; L1032-L1037 HydrophobicContact CD1-CD2 4.38Å; L1032-L1037 HydrophobicContact CD2-CD2 4.28Å
1033	N	86.5	Confident	89.3	Confident	67 Å²	67	78.3 Å²	78.3	36%	0.358	41%	0.406	S	S	.	.			trans	-126.2	165.8	171.3	65.1	48.3	0	0	0	110.3	N1035 M1036	N1033-N1035 PolarHBondContact O-N 3.46Å; N1033-N1035 WeakPolarHBondContact OD1-CB 3.43Å; N1033-N1035 PolarHBondContact OD1-N 3.37Å; N1033-M1036 WeakPolarHBondContact O-CB 3.26Å; N1033-M1036 PolarHBondContact O-N 3.41Å; N1033-M1036 VanDerWaalsContact O-N 3.08Å; N1033-M1036 VanDerWaalsContact OD1-CG 3.31Å; N1033-M1036 WeakPolarHBondContact OD1-CG 3.36Å; N1033-M1036 PolarHBondContact OD1-N 3.49Å
1034	E	84.8	Confident	89.6	Confident	91 Å²	91	77.3 Å²	77.3	43%	0.425	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-60.5	-31.8	-175.1	-170.5	174.4	-171.8	0	0	113.1	L1019 M1036 L1037	L1019-E1034 HydrophobicContact CD1-CB 4.48Å; E1034-M1036 PolarHBondContact O-N 2.84Å; E1034-L1037 HydrophobicContact CG-CD1 4.2Å; E1034-L1037 VanDerWaalsContact O-CB 3.32Å; E1034-L1037 WeakPolarHBondContact O-CB 3.49Å; E1034-L1037 WeakPolarHBondContact O-CG 3.49Å; E1034-L1037 PolarHBondContact O-N 3.4Å; E1034-L1037 VanDerWaalsContact O-N 3.11Å
1035	N	88.4	Confident	89.7	Confident	158 Å²	158	80 Å²	80	85%	0.845	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-69.3	-17.2	180	-61.4	-27.7	0	0	0	113.2	N1033 L1037	N1033-N1035 PolarHBondContact O-N 3.46Å; N1033-N1035 WeakPolarHBondContact OD1-CB 3.43Å; N1033-N1035 PolarHBondContact OD1-N 3.37Å; N1035-L1037 VanDerWaalsContact C-N 3.29Å
1036	M	90.1	Very high	89.7	Confident	79 Å²	79	84.9 Å²	84.9	39%	0.389	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-83.6	-6.5	176.2	-64.6	166.4	83.6	0	0	112.6	P1005 L1032 N1033 E1034	P1005-M1036 HydrophobicContact CG-CB 3.92Å; P1005-M1036 HydrophobicContact CG-CE 3.82Å; L1032-M1036 HydrophobicContact CD1-CB 3.81Å; L1032-M1036 HydrophobicContact CD1-CE 4.48Å; L1032-M1036 HydrophobicContact CD1-SD 4.15Å; N1033-M1036 WeakPolarHBondContact O-CB 3.26Å; N1033-M1036 PolarHBondContact O-N 3.41Å; N1033-M1036 VanDerWaalsContact O-N 3.08Å; N1033-M1036 VanDerWaalsContact OD1-CG 3.31Å; N1033-M1036 WeakPolarHBondContact OD1-CG 3.36Å; N1033-M1036 PolarHBondContact OD1-N 3.49Å; E1034-M1036 PolarHBondContact O-N 2.84Å
1037	L	91.7	Very high	89.8	Confident	14 Å²	14	82.9 Å²	82.9	7%	0.073	43%	0.426	C	S	.	.			trans	-83.1	124.1	-178.7	-56.1	178.6	0	0	0	111	V1002 L1004 I1015 L1019 L1032 E1034 N1035	V1002-L1037 HydrophobicContact CB-CB 4.5Å; L1004-L1037 HydrophobicContact CD1-CD2 4.26Å; L1004-L1037 HydrophobicContact CG-CD2 4.1Å; I1015-L1037 HydrophobicContact CG1-CD1 4.39Å; I1015-L1037 HydrophobicContact CG1-CD2 4.05Å; I1015-L1037 HydrophobicContact CG2-CD1 3.77Å; I1015-L1037 HydrophobicContact CG2-CD2 4.4Å; L1019-L1037 HydrophobicContact CD1-CD1 4.24Å; L1032-L1037 HydrophobicContact CD1-CD2 4.38Å; L1032-L1037 HydrophobicContact CD2-CD2 4.28Å; E1034-L1037 HydrophobicContact CG-CD1 4.2Å; E1034-L1037 VanDerWaalsContact O-CB 3.32Å; E1034-L1037 WeakPolarHBondContact O-CB 3.49Å; E1034-L1037 WeakPolarHBondContact O-CG 3.49Å; E1034-L1037 PolarHBondContact O-N 3.4Å; E1034-L1037 VanDerWaalsContact O-N 3.11Å; N1035-L1037 VanDerWaalsContact C-N 3.29Å
1038	V	92.5	Very high	89.7	Confident	89 Å²	89	82 Å²	82	54%	0.539	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	125.8	178.8	-177.8	0	0	0	0	109.9	V1002 K1003 A1040	V1002-V1038 CarbonylContact C-O 3.52Å; V1002-V1038 WeakPolarHBondContact CA-O 3.36Å; K1003-V1038 PolarHBondContact N-O 3.34Å; K1003-V1038 PolarHBondContact O-N 2.75Å; K1003-V1038 VanDerWaalsContact O-N 3.08Å; V1038-A1040 PolarHBondContact O-N 3.11Å
1039	P	93.7	Very high	89.7	Confident	68 Å²	68	81.7 Å²	81.7	44%	0.442	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	128.3	175.6	-22.4	31.6	0	0	0	112.7	V1041	P1039-V1041 VanDerWaalsContact C-N 3.31Å; P1039-V1041 HydrophobicContact CB-CG2 4.12Å; P1039-V1041 PolarHBondContact O-N 3.22Å; P1039-V1041 VanDerWaalsContact O-N 3.13Å
1040	A	91.9	Very high	89.8	Confident	17 Å²	17	72.9 Å²	72.9	14%	0.14	40%	0.396	C	S	.	.			trans	-88.3	68.2	175.9	0	0	0	0	0	110.5	P1001 I1009 V1038 E1042 L1043 K1044	P1001-A1040 HydrophobicContact CB-CB 4.1Å; P1001-A1040 HydrophobicContact CG-CB 4.3Å; P1001-A1040 WeakPolarHBondContact O-CB 3.04Å; P1001-A1040 PolarHBondContact O-N 2.94Å; I1009-A1040 HydrophobicContact CG2-CB 4.35Å; V1038-A1040 PolarHBondContact O-N 3.11Å; A1040-E1042 VanDerWaalsContact C-N 3.3Å; A1040-E1042 PolarHBondContact O-N 3.4Å; A1040-L1043 HydrophobicContact CB-CB 4.28Å; A1040-L1043 PolarHBondContact O-N 2.97Å; A1040-K1044 PolarHBondContact O-N 3.07Å
1041	V	91.9	Very high	89.6	Confident	96 Å²	96	67.8 Å²	67.8	58%	0.582	37%	0.373	S	S	*	.	H	α-helix	trans	-56.5	-39.6	-171	-175.5	0	0	0	0	113.1	P1039 K1044 T1045	P1039-V1041 VanDerWaalsContact C-N 3.31Å; P1039-V1041 HydrophobicContact CB-CG2 4.12Å; P1039-V1041 PolarHBondContact O-N 3.22Å; P1039-V1041 VanDerWaalsContact O-N 3.13Å; V1041-K1044 PolarHBondContact O-N 2.8Å; V1041-T1045 PolarHBondContact O-N 3.25Å; V1041-T1045 PolarHBondContact O-OG1 3.38Å
1042	E	90.2	Very high	89.4	Confident	159 Å²	159	69.6 Å²	69.6	74%	0.743	37%	0.372	S	S	*	.	H	α-helix	trans	-64.1	-47	179.1	-66.5	179.6	178.6	0	0	111.7	A1040 K1044 T1045 Q1046	A1040-E1042 VanDerWaalsContact C-N 3.3Å; A1040-E1042 PolarHBondContact O-N 3.4Å; E1042-K1044 VanDerWaalsContact C-N 3.34Å; E1042-K1044 PolarHBondContact O-N 3.28Å; E1042-T1045 PolarHBondContact O-N 3.46Å; E1042-Q1046 WeakPolarHBondContact O-CG 3.33Å; E1042-Q1046 PolarHBondContact O-N 3.25Å; E1042-Q1046 VanDerWaalsContact O-N 3.11Å
1043	L	90.7	Very high	89.2	Confident	25 Å²	25	74.9 Å²	74.9	13%	0.131	40%	0.396	C	S	.	.	H	α-helix	trans	-66	-39.6	178.5	-172.7	64.4	0	0	0	111.1	F989 M998 P1001 I1009 A1040 T1045 Q1046 I1047	F989-L1043 HydrophobicContact CD1-CD1 3.94Å; F989-L1043 HydrophobicContact CE1-CD1 3.96Å; M998-L1043 HydrophobicContact CE-CD2 3.8Å; P1001-L1043 HydrophobicContact CB-CD2 3.93Å; P1001-L1043 HydrophobicContact CB-CG 4.43Å; P1001-L1043 HydrophobicContact CG-CB 4.2Å; P1001-L1043 HydrophobicContact CG-CD2 4.34Å; P1001-L1043 HydrophobicContact CG-CG 4.3Å; I1009-L1043 HydrophobicContact CD1-CD2 4.11Å; I1009-L1043 HydrophobicContact CG2-CD2 3.82Å; A1040-L1043 HydrophobicContact CB-CB 4.28Å; A1040-L1043 PolarHBondContact O-N 2.97Å; L1043-T1045 VanDerWaalsContact C-N 3.32Å; L1043-T1045 PolarHBondContact O-N 2.99Å; L1043-Q1046 WeakPolarHBondContact O-CB 3.46Å; L1043-Q1046 PolarHBondContact O-N 3.31Å; L1043-I1047 HydrophobicContact CD2-CD1 4.45Å; L1043-I1047 HydrophobicContact CG-CD1 3.95Å; L1043-I1047 HydrophobicContact CG-CG1 4.45Å; L1043-I1047 VanDerWaalsContact O-CG1 3.3Å; L1043-I1047 WeakPolarHBondContact O-CG1 3.48Å; L1043-I1047 PolarHBondContact O-N 3.11Å
1044	K	92.1	Very high	88.9	Confident	74 Å²	74	73.3 Å²	73.3	32%	0.322	39%	0.386	S	S	.	.	H	α-helix	trans	-56.8	-46.8	174	-174.3	173.1	-174.9	164.9	0	111.8	D1000 P1001 A1040 V1041 E1042 Q1046 I1047 D1048	D1000-K1044 IonicContact OD1-NZ 3.27Å; D1000-K1044 PolarHBondContact OD1-NZ 3.03Å; P1001-K1044 HydrophobicContact CG-CB 3.8Å; A1040-K1044 PolarHBondContact O-N 3.07Å; V1041-K1044 PolarHBondContact O-N 2.8Å; E1042-K1044 VanDerWaalsContact C-N 3.34Å; E1042-K1044 PolarHBondContact O-N 3.28Å; K1044-Q1046 VanDerWaalsContact C-N 3.29Å; K1044-Q1046 PolarHBondContact O-N 3.13Å; K1044-I1047 PolarHBondContact O-N 3.33Å; K1044-D1048 WeakPolarHBondContact O-CB 3.05Å; K1044-D1048 PolarHBondContact O-N 3.42Å
1045	T	90.9	Very high	88.5	Confident	90 Å²	90	72.1 Å²	72.1	55%	0.552	38%	0.381	S	S	*	.	H	α-helix	trans	-61.5	-38.7	178.4	-50.8	0	0	0	0	111.7	V1041 E1042 L1043 A1049	V1041-T1045 PolarHBondContact O-N 3.25Å; V1041-T1045 PolarHBondContact O-OG1 3.38Å; E1042-T1045 PolarHBondContact O-N 3.46Å; L1043-T1045 VanDerWaalsContact C-N 3.32Å; L1043-T1045 PolarHBondContact O-N 2.99Å; T1045-A1049 WeakPolarHBondContact O-CB 3.44Å; T1045-A1049 PolarHBondContact O-N 3.02Å
1046	Q	90.6	Very high	88	Confident	106 Å²	106	69.4 Å²	69.4	50%	0.495	36%	0.363	S	S	.	.	H	α-helix	trans	-66.3	-42.6	175.5	-67.5	173.4	17.1	0	0	112	F989 E1042 L1043 K1044 W1050	F989-Q1046 HydrophobicContact CE1-CB 4.34Å; F989-Q1046 HydrophobicContact CZ-CB 4.2Å; E1042-Q1046 WeakPolarHBondContact O-CG 3.33Å; E1042-Q1046 PolarHBondContact O-N 3.25Å; E1042-Q1046 VanDerWaalsContact O-N 3.11Å; L1043-Q1046 WeakPolarHBondContact O-CB 3.46Å; L1043-Q1046 PolarHBondContact O-N 3.31Å; K1044-Q1046 VanDerWaalsContact C-N 3.29Å; K1044-Q1046 PolarHBondContact O-N 3.13Å; Q1046-W1050 WeakPolarHBondContact O-CB 3.31Å; Q1046-W1050 PolarHBondContact O-N 3.22Å
1047	I	89.6	Confident	87.3	Confident	1 Å²	1	69 Å²	69	1%	0.005	36%	0.363	C	S	.	.	H	α-helix	trans	-64.7	-45.9	177.7	-68.3	167.5	0	0	0	110.7	F989 L997 M998 P1001 L1043 K1044 W1050 I1051	F989-I1047 HydrophobicContact CB-CD1 4.3Å; F989-I1047 HydrophobicContact CB-CG1 3.97Å; F989-I1047 HydrophobicContact CD1-CD1 4.48Å; F989-I1047 HydrophobicContact CD1-CG1 3.82Å; F989-I1047 HydrophobicContact CD2-CG1 4.06Å; F989-I1047 HydrophobicContact CE1-CG1 4.33Å; F989-I1047 HydrophobicContact CG-CD1 4.44Å; F989-I1047 HydrophobicContact CG-CG1 3.69Å; L997-I1047 HydrophobicContact CD1-CG2 4.1Å; M998-I1047 HydrophobicContact CB-CD1 4.03Å; M998-I1047 WeakPolarHBondContact O-CG2 3.17Å; P1001-I1047 HydrophobicContact CG-CD1 4.14Å; L1043-I1047 HydrophobicContact CD2-CD1 4.45Å; L1043-I1047 HydrophobicContact CG-CD1 3.95Å; L1043-I1047 HydrophobicContact CG-CG1 4.45Å; L1043-I1047 VanDerWaalsContact O-CG1 3.3Å; L1043-I1047 WeakPolarHBondContact O-CG1 3.48Å; L1043-I1047 PolarHBondContact O-N 3.11Å; K1044-I1047 PolarHBondContact O-N 3.33Å; I1047-W1050 WeakPolarHBondContact O-CB 3.24Å; I1047-W1050 PolarHBondContact O-N 2.96Å; I1047-I1051 HydrophobicContact CG2-CD1 3.6Å; I1047-I1051 HydrophobicContact CG2-CG1 4.27Å; I1047-I1051 WeakPolarHBondContact O-CD1 3.32Å; I1047-I1051 VanDerWaalsContact O-CG1 3.24Å; I1047-I1051 WeakPolarHBondContact O-CG1 3.49Å; I1047-I1051 PolarHBondContact O-N 3.39Å
1048	D	89.1	Confident	86.2	Confident	70 Å²	70	68.9 Å²	68.9	37%	0.374	36%	0.364	S	S	.	.	H	α-helix	trans	-62.1	-44.8	179	-72.5	-25.5	0	0	0	111.4	K1044 W1050 I1051 E1052	K1044-D1048 WeakPolarHBondContact O-CB 3.05Å; K1044-D1048 PolarHBondContact O-N 3.42Å; D1048-W1050 VanDerWaalsContact C-N 3.32Å; D1048-W1050 PolarHBondContact O-N 3.35Å; D1048-I1051 PolarHBondContact O-N 2.96Å; D1048-E1052 PolarHBondContact O-N 2.92Å
1049	A	87.6	Confident	85.1	Confident	56 Å²	56	69.8 Å²	69.8	46%	0.463	37%	0.365	S	S	.	.	H	α-helix	trans	-61	-40.3	174.8	0	0	0	0	0	112.3	T1045 E1052 E1053	T1045-A1049 WeakPolarHBondContact O-CB 3.44Å; T1045-A1049 PolarHBondContact O-N 3.02Å; A1049-E1052 PolarHBondContact O-N 3.49Å; A1049-E1053 PolarHBondContact O-N 3.39Å
1050	W	87.7	Confident	83.8	Confident	31 Å²	31	73.3 Å²	73.3	12%	0.117	37%	0.374	C	S	.	.	H	α-helix	trans	-65.8	-42.2	176	179.9	90.2	0	0	0	112.1	F982 V985 F989 L997 Q1046 I1047 D1048 E1052 E1053 K1054	F982-W1050 HydrophobicContact CB-CH2 4.5Å; F982-W1050 AromaticContact CD1-CH2 3.83Å; F982-W1050 HydrophobicContact CD1-CH2 3.83Å; F982-W1050 AromaticContact CD1-CZ3 3.71Å; F982-W1050 HydrophobicContact CD1-CZ3 3.71Å; F982-W1050 HydrophobicContact CE1-CZ3 4.24Å; V985-W1050 HydrophobicContact CB-CH2 4.18Å; V985-W1050 HydrophobicContact CG2-CH2 3.48Å; V985-W1050 VanDerWaalsContact CG2-CH2 3.48Å; V985-W1050 HydrophobicContact CG2-CZ2 4.29Å; V985-W1050 HydrophobicContact CG2-CZ3 4Å; F989-W1050 HydrophobicContact CD2-CB 4.42Å; F989-W1050 HydrophobicContact CD2-CD2 4.31Å; F989-W1050 HydrophobicContact CD2-CG 4.19Å; F989-W1050 HydrophobicContact CE2-CB 3.76Å; F989-W1050 AromaticContact CE2-CD1 3.97Å; F989-W1050 HydrophobicContact CE2-CD2 4.32Å; F989-W1050 AromaticContact CE2-CG 3.73Å; F989-W1050 HydrophobicContact CE2-CG 3.73Å; L997-W1050 HydrophobicContact CD1-CZ3 4.34Å; L997-W1050 HydrophobicContact CD2-CZ3 4.17Å; Q1046-W1050 WeakPolarHBondContact O-CB 3.31Å; Q1046-W1050 PolarHBondContact O-N 3.22Å; I1047-W1050 WeakPolarHBondContact O-CB 3.24Å; I1047-W1050 PolarHBondContact O-N 2.96Å; D1048-W1050 VanDerWaalsContact C-N 3.32Å; D1048-W1050 PolarHBondContact O-N 3.35Å; W1050-E1052 VanDerWaalsContact C-N 3.34Å; W1050-E1052 PolarHBondContact O-N 3.2Å; W1050-E1053 PolarHBondContact O-N 3.4Å; W1050-K1054 HydrophobicContact CD2-CG 4.02Å; W1050-K1054 HydrophobicContact CE3-CG 4.26Å; W1050-K1054 HydrophobicContact CH2-CG 4Å; W1050-K1054 HydrophobicContact CZ2-CD 4.08Å; W1050-K1054 HydrophobicContact CZ2-CG 3.77Å; W1050-K1054 HydrophobicContact CZ3-CG 4.25Å; W1050-K1054 WeakPolarHBondContact O-CB 3.23Å; W1050-K1054 VanDerWaalsContact O-CG 3.28Å; W1050-K1054 WeakPolarHBondContact O-CG 3.49Å; W1050-K1054 PolarHBondContact O-N 2.95Å
1051	I	84.1	Confident	82.3	Confident	19 Å²	19	78.9 Å²	78.9	10%	0.097	39%	0.391	C	S	.	.	H	α-helix	trans	-60.1	-46.1	175	-68.3	157.2	0	0	0	110.1	F982 L997 I1047 D1048 K1054 M1055	F982-I1051 HydrophobicContact CE1-CG2 4.41Å; F982-I1051 HydrophobicContact CZ-CG2 4.39Å; L997-I1051 HydrophobicContact CD2-CD1 4.25Å; L997-I1051 HydrophobicContact CD2-CG1 4.16Å; I1047-I1051 HydrophobicContact CG2-CD1 3.6Å; I1047-I1051 HydrophobicContact CG2-CG1 4.27Å; I1047-I1051 WeakPolarHBondContact O-CD1 3.32Å; I1047-I1051 VanDerWaalsContact O-CG1 3.24Å; I1047-I1051 WeakPolarHBondContact O-CG1 3.49Å; I1047-I1051 PolarHBondContact O-N 3.39Å; D1048-I1051 PolarHBondContact O-N 2.96Å; I1051-K1054 PolarHBondContact O-N 3.41Å; I1051-M1055 HydrophobicContact CG2-CG 4.29Å; I1051-M1055 WeakPolarHBondContact O-CB 3.26Å; I1051-M1055 VanDerWaalsContact O-CG 3.29Å; I1051-M1055 WeakPolarHBondContact O-CG 3.49Å; I1051-M1055 PolarHBondContact O-N 2.83Å
1052	E	84.5	Confident	80.5	Confident	146 Å²	146	78.6 Å²	78.6	68%	0.682	39%	0.391	S	S	*	.	H	α-helix	trans	-61.4	-44.9	178	-77.2	-172.1	173.3	0	0	112.1	D1048 A1049 W1050 K1054 M1055 H1056	D1048-E1052 PolarHBondContact O-N 2.92Å; A1049-E1052 PolarHBondContact O-N 3.49Å; W1050-E1052 VanDerWaalsContact C-N 3.34Å; W1050-E1052 PolarHBondContact O-N 3.2Å; E1052-K1054 VanDerWaalsContact C-N 3.35Å; E1052-K1054 PolarHBondContact O-N 3.12Å; E1052-M1055 PolarHBondContact O-N 3.16Å; E1052-H1056 VanDerWaalsContact O-CB 3.27Å; E1052-H1056 WeakPolarHBondContact O-CB 3.46Å; E1052-H1056 PolarHBondContact O-N 3.11Å
1053	E	84.1	Confident	78.9	Confident	117 Å²	117	78.1 Å²	78.1	55%	0.547	39%	0.389	S	S	.	.	H	α-helix	trans	-59.3	-46.4	176.7	-175	-179.9	-171.1	0	0	111.2	A1049 W1050 H1056 L1057	A1049-E1053 PolarHBondContact O-N 3.39Å; W1050-E1053 PolarHBondContact O-N 3.4Å; E1053-H1056 PolarHBondContact O-N 3.2Å; E1053-L1057 HydrophobicContact CG-CD1 4.1Å; E1053-L1057 WeakPolarHBondContact O-CB 3.45Å; E1053-L1057 VanDerWaalsContact O-CG 3.32Å; E1053-L1057 WeakPolarHBondContact O-CG 3.34Å; E1053-L1057 PolarHBondContact O-N 3.31Å
1054	K	80.7	Confident	76.7	Confident	33 Å²	33	82.1 Å²	82.1	14%	0.143	41%	0.41	C	S	.	.	H	α-helix	trans	-64.1	-44.1	178.3	-72.5	-71.8	176.1	174.5	0	112.6	F982 D984 W1050 I1051 E1052 H1056 L1057 A1058	F982-K1054 HydrophobicContact CD1-CB 4.1Å; F982-K1054 HydrophobicContact CD1-CG 4.49Å; F982-K1054 HydrophobicContact CE1-CB 3.73Å; D984-K1054 WeakPolarHBondContact OD1-CE 3.2Å; D984-K1054 IonicContact OD1-NZ 3.76Å; D984-K1054 PolarHBondContact OD1-NZ 2.75Å; D984-K1054 IonicContact OD2-NZ 3.48Å; D984-K1054 PolarHBondContact OD2-NZ 3.2Å; W1050-K1054 HydrophobicContact CD2-CG 4.02Å; W1050-K1054 HydrophobicContact CE3-CG 4.26Å; W1050-K1054 HydrophobicContact CH2-CG 4Å; W1050-K1054 HydrophobicContact CZ2-CD 4.08Å; W1050-K1054 HydrophobicContact CZ2-CG 3.77Å; W1050-K1054 HydrophobicContact CZ3-CG 4.25Å; W1050-K1054 WeakPolarHBondContact O-CB 3.23Å; W1050-K1054 VanDerWaalsContact O-CG 3.28Å; W1050-K1054 WeakPolarHBondContact O-CG 3.49Å; W1050-K1054 PolarHBondContact O-N 2.95Å; I1051-K1054 PolarHBondContact O-N 3.41Å; E1052-K1054 VanDerWaalsContact C-N 3.35Å; E1052-K1054 PolarHBondContact O-N 3.12Å; K1054-H1056 VanDerWaalsContact C-N 3.34Å; K1054-H1056 PolarHBondContact O-N 3Å; K1054-L1057 PolarHBondContact O-N 3.2Å; K1054-A1058 WeakPolarHBondContact O-CB 3.46Å; K1054-A1058 PolarHBondContact O-N 2.69Å
1055	M	76.1	Confident	74.1	Confident	66 Å²	66	84.7 Å²	84.7	33%	0.325	42%	0.421	S	S	.	.	H	α-helix	trans	-62.9	-40.8	175.6	-75.6	-64.4	-153.4	0	0	111.9	F982 I1051 E1052 A1058 N1059	F982-M1055 HydrophobicContact CE2-CE 4Å; F982-M1055 HydrophobicContact CE2-SD 4.34Å; F982-M1055 HydrophobicContact CZ-CE 3.72Å; F982-M1055 HydrophobicContact CZ-CG 4Å; F982-M1055 HydrophobicContact CZ-SD 3.79Å; I1051-M1055 HydrophobicContact CG2-CG 4.29Å; I1051-M1055 WeakPolarHBondContact O-CB 3.26Å; I1051-M1055 VanDerWaalsContact O-CG 3.29Å; I1051-M1055 WeakPolarHBondContact O-CG 3.49Å; I1051-M1055 PolarHBondContact O-N 2.83Å; E1052-M1055 PolarHBondContact O-N 3.16Å; M1055-A1058 PolarHBondContact O-N 3.33Å; M1055-N1059 WeakPolarHBondContact O-CB 3.23Å; M1055-N1059 PolarHBondContact O-N 3.22Å; M1055-N1059 PolarHBondContact O-ND2 3.5Å
1056	H	77.8	Confident	73.2	Confident	101 Å²	101	84.5 Å²	84.5	47%	0.468	41%	0.414	S	S	.	.	H	α-helix	trans	-67	-41.5	176.8	176.2	-105.3	0	0	0	112.1	E1052 E1053 K1054 N1059 K1060	E1052-H1056 VanDerWaalsContact O-CB 3.27Å; E1052-H1056 WeakPolarHBondContact O-CB 3.46Å; E1052-H1056 PolarHBondContact O-N 3.11Å; E1053-H1056 PolarHBondContact O-N 3.2Å; K1054-H1056 VanDerWaalsContact C-N 3.34Å; K1054-H1056 PolarHBondContact O-N 3Å; H1056-N1059 PolarHBondContact O-N 3.39Å; H1056-K1060 WeakPolarHBondContact CE1-CE 3.43Å; H1056-K1060 PolarHBondContact CE1-NZ 3.31Å; H1056-K1060 WeakPolarHBondContact NE2-CE 3.2Å; H1056-K1060 PolarHBondContact NE2-NZ 3.42Å; H1056-K1060 PolarHBondContact O-N 3.42Å
1057	L	75.4	Confident	72.3	Confident	71 Å²	71	83.3 Å²	83.3	37%	0.372	41%	0.41	S	S	.	.	H	α-helix	trans	-62.4	-43	173.2	-75	168.6	0	0	0	112.1	E1053 K1054 N1059 K1060 R1061	E1053-L1057 HydrophobicContact CG-CD1 4.1Å; E1053-L1057 WeakPolarHBondContact O-CB 3.45Å; E1053-L1057 VanDerWaalsContact O-CG 3.32Å; E1053-L1057 WeakPolarHBondContact O-CG 3.34Å; E1053-L1057 PolarHBondContact O-N 3.31Å; K1054-L1057 PolarHBondContact O-N 3.2Å; L1057-N1059 PolarHBondContact O-N 3.36Å; L1057-K1060 PolarHBondContact O-N 2.94Å; L1057-R1061 PolarHBondContact O-N 3.18Å; L1057-R1061 VanDerWaalsContact O-N 3.11Å
1058	A	68.5	Low	71.3	Confident	12 Å²	12	87.9 Å²	87.9	10%	0.099	43%	0.433	C	S	.	.	H	α-helix	trans	-64.5	-37.8	177.3	0	0	0	0	0	112.8	V981 K1054 M1055 R1061	V981-A1058 HydrophobicContact CB-CB 4.35Å; V981-A1058 HydrophobicContact CG1-CB 3.52Å; V981-A1058 HydrophobicContact CG2-CB 3.83Å; K1054-A1058 WeakPolarHBondContact O-CB 3.46Å; K1054-A1058 PolarHBondContact O-N 2.69Å; M1055-A1058 PolarHBondContact O-N 3.33Å; A1058-R1061 CarbonylContact O-C 3.51Å; A1058-R1061 PolarHBondContact O-N 3.01Å
1059	N	69.3	Low	70.3	Confident	107 Å²	107	88.9 Å²	88.9	57%	0.572	44%	0.436	S	S	*	.	H	α-helix	trans	-72.1	-30.2	175.5	-76.2	-24.6	0	0	0	112.9	M1055 H1056 L1057 K1065	M1055-N1059 WeakPolarHBondContact O-CB 3.23Å; M1055-N1059 PolarHBondContact O-N 3.22Å; M1055-N1059 PolarHBondContact O-ND2 3.5Å; H1056-N1059 PolarHBondContact O-N 3.39Å; L1057-N1059 PolarHBondContact O-N 3.36Å; N1059-K1065 PolarHBondContact OD1-NZ 2.92Å
1060	K	67.1	Low	69.2	Low	143 Å²	143	91 Å²	91	62%	0.622	43%	0.434	S	S	*	.	H	α-helix	trans	-77	-17.9	174.1	-77.7	-174	173.6	179.5	0	114.1	H1056 L1057 P1062	H1056-K1060 WeakPolarHBondContact CE1-CE 3.43Å; H1056-K1060 PolarHBondContact CE1-NZ 3.31Å; H1056-K1060 WeakPolarHBondContact NE2-CE 3.2Å; H1056-K1060 PolarHBondContact NE2-NZ 3.42Å; H1056-K1060 PolarHBondContact O-N 3.42Å; L1057-K1060 PolarHBondContact O-N 2.94Å; K1060-P1062 VanDerWaalsContact C-CD 3.47Å; K1060-P1062 WeakPolarHBondContact O-CD 3.2Å
1061	R	61.4	Low	68	Low	134 Å²	134	95 Å²	95	51%	0.506	46%	0.456	S	S	.	.			trans	-121.1	73.7	179.3	-64.9	-174.7	179.8	177.1	0.3	111.2	L1057 A1058 H1063 L1064	L1057-R1061 PolarHBondContact O-N 3.18Å; L1057-R1061 VanDerWaalsContact O-N 3.11Å; A1058-R1061 CarbonylContact O-C 3.51Å; A1058-R1061 PolarHBondContact O-N 3.01Å; R1061-H1063 PolarHBondContact O-N 3.43Å; R1061-L1064 HydrophobicContact CB-CB 4.42Å; R1061-L1064 HydrophobicContact CB-CD1 3.84Å; R1061-L1064 HydrophobicContact CB-CG 4.35Å; R1061-L1064 VanDerWaalsContact CD-CD1 3.43Å; R1061-L1064 HydrophobicContact CG-CD1 4.3Å; R1061-L1064 PolarHBondContact O-N 2.72Å
1062	P	53.7	Low	66.8	Low	90 Å²	90	100.4 Å²	100.4	58%	0.584	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-14	-179.3	23.7	-32.8	0	0	0	114.4	K1060 L1064	K1060-P1062 VanDerWaalsContact C-CD 3.47Å; K1060-P1062 WeakPolarHBondContact O-CD 3.2Å; P1062-L1064 VanDerWaalsContact C-N 3.34Å
1063	H	56.8	Low	65.5	Low	149 Å²	149	96.9 Å²	96.9	69%	0.69	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-7.4	175.4	59.5	-86.5	0	0	0	114.2	R1061	R1061-H1063 PolarHBondContact O-N 3.43Å
1064	L	44	Very low	63.9	Low	109 Å²	109	95.3 Å²	95.3	57%	0.571	46%	0.459	S	S	*	.			trans	-97.2	-8.6	171.5	-74.5	167.6	0	0	0	112.7	R1061 P1062	R1061-L1064 HydrophobicContact CB-CB 4.42Å; R1061-L1064 HydrophobicContact CB-CD1 3.84Å; R1061-L1064 HydrophobicContact CB-CG 4.35Å; R1061-L1064 VanDerWaalsContact CD-CD1 3.43Å; R1061-L1064 HydrophobicContact CG-CD1 4.3Å; R1061-L1064 PolarHBondContact O-N 2.72Å; P1062-L1064 VanDerWaalsContact C-N 3.34Å
1065	K	36.4	Very low	62.4	Low	128 Å²	128	100.9 Å²	100.9	56%	0.557	49%	0.488	S	S	*	.			trans	-83.2	0	169.6	-88.1	-173	-174.9	176.1	0	111	Q977 N1059	Q977-K1065 PolarHBondContact NE2-O 3.49Å; Q977-K1065 VanDerWaalsContact NE2-O 3.17Å; N1059-K1065 PolarHBondContact OD1-NZ 2.92Å

Retrieved 1,065 of 1,065 residues in 823.8 ms (Link to these results)

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