A0A087Y5F9_POEFO Loading...

XK-related protein

AlphaFold DB , UniProt , Accession A0A087Y5F9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 574 aa.

Structure Viewer

Loading PAE data...

(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	32	Very low	28.4	Very low	245 Å²	245	126.3 Å²	126.3	100%	1.207	82%	0.824	S	S	*	*				0	155.1	0	-72.6	171.9	165.6	0	0	108.4
2	A	28.7	Very low	28.4	Very low	103 Å²	103	125.9 Å²	125.9	85%	0.851	82%	0.817	S	S	*	*			trans	25.1	139.8	155.8	0	0	0	0	0	120.5
3	A	29.4	Very low	28.2	Very low	87 Å²	87	130.7 Å²	130.7	72%	0.719	82%	0.822	S	S	*	*			cis	-162.2	173.8	-3.6	0	0	0	0	0	106.3
4	K	28	Very low	28.1	Very low	195 Å²	195	133 Å²	133	85%	0.848	83%	0.825	S	S	*	*			cis	57.6	128	42.9	-167.6	160.5	-175	177.8	0	111.7
5	S	30.8	Very low	28	Very low	72 Å²	72	132.4 Å²	132.4	50%	0.503	81%	0.814	S	S	.	*			cis	-155.9	175.8	13.3	-145.8	0	0	0	0	111.4
6	D	29.4	Very low	27.9	Very low	155 Å²	155	134.2 Å²	134.2	83%	0.829	82%	0.817	S	S	*	*			trans	66	160.9	152.4	-44.5	-26.4	0	0	0	117.7
7	G	28.3	Very low	27.9	Very low	77 Å²	77	133 Å²	133	79%	0.794	81%	0.81	S	S	*	*			cis	-162.9	170.2	-2.5	0	0	0	0	0	110.8
8	A	26.4	Very low	27.8	Very low	105 Å²	105	132.3 Å²	132.3	87%	0.868	81%	0.809	S	S	*	*			trans	-118.9	151	-164.5	0	0	0	0	0	116.1
9	A	27.8	Very low	27.6	Very low	95 Å²	95	138.2 Å²	138.2	79%	0.785	82%	0.815	S	S	*	*			trans	-154.1	106.3	155.5	0	0	0	0	0	106.9
10	V	27.1	Very low	27.5	Very low	133 Å²	133	137 Å²	137	81%	0.806	81%	0.814	S	S	*	*				69.5	102.7	74.4	179.3	0	0	0	0	113.2
11	S	24.6	Very low	27.5	Very low	122 Å²	122	138.6 Å²	138.6	85%	0.853	82%	0.818	S	S	*	*			trans	-138.6	152.1	141.2	48.6	0	0	0	0	107.3
12	V	28.3	Very low	27.2	Very low	122 Å²	122	132.5 Å²	132.5	74%	0.739	80%	0.799	S	S	*	*			trans	-132.6	133.1	-172.5	173.2	0	0	0	0	107.5
13	E	25.6	Very low	27.2	Very low	188 Å²	188	136 Å²	136	88%	0.879	80%	0.798	S	S	*	*			trans	-149.6	118.8	155.5	-153.4	116.5	125	0	0	110.2
14	D	26.6	Very low	27.2	Very low	163 Å²	163	138.2 Å²	138.2	87%	0.872	81%	0.805	S	S	*	*			trans	16.3	154.4	174.2	-81.3	-47.3	0	0	0	126.9
15	D	26.6	Very low	27.1	Very low	124 Å²	124	132.2 Å²	132.2	66%	0.663	80%	0.798	S	S	*	*			trans	-110.4	147.6	-177.1	177.6	18	0	0	0	111.6	T17	D15-T17 PolarHBondContact OD1-N 3.42Å; D15-T17 VanDerWaalsContact OD1-N 3.15Å
16	N	26.3	Very low	26.9	Very low	161 Å²	161	134.3 Å²	134.3	86%	0.861	80%	0.804	S	S	*	*			trans	-167.8	81.4	147.8	-109.5	-67.2	0	0	0	111
17	T	27.7	Very low	26.8	Very low	114 Å²	114	132.5 Å²	132.5	70%	0.699	80%	0.8	S	S	*	*			trans	-124.9	117	163.3	-54	0	0	0	0	111.2	D15 R19	D15-T17 PolarHBondContact OD1-N 3.42Å; D15-T17 VanDerWaalsContact OD1-N 3.15Å; T17-R19 PolarHBondContact O-N 3.3Å
18	P	27	Very low	27.1	Very low	121 Å²	121	134.4 Å²	134.4	79%	0.786	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-68.5	117.5	-179.2	27.3	-33.5	0	0	0	111.2	S20	P18-S20 PolarHBondContact O-N 3.06Å
19	R	24.8	Very low	27.3	Very low	244 Å²	244	133.5 Å²	133.5	92%	0.921	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-67.8	125.9	172.5	-70.6	178.8	176.9	158	0.5	110.9	T17	T17-R19 PolarHBondContact O-N 3.3Å
20	S	24.7	Very low	27.3	Very low	113 Å²	113	140.4 Å²	140.4	79%	0.79	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-102.7	136.7	152.1	56.1	0	0	0	0	109.1	P18	P18-S20 PolarHBondContact O-N 3.06Å
21	L	27	Very low	27.3	Very low	172 Å²	172	138.9 Å²	138.9	90%	0.901	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-71.8	137.6	-176.5	-70.6	94.7	0	0	0	112
22	S	26.2	Very low	27.7	Very low	116 Å²	116	144 Å²	144	81%	0.811	79%	0.79	S	S	*	*			trans	-95.5	99.2	173.3	57.8	0	0	0	0	110.9
23	E	29.8	Very low	28	Very low	178 Å²	178	144.5 Å²	144.5	83%	0.832	80%	0.798	S	S	*	*			trans	-71	146.9	162.8	-71	-165.1	113.1	0	0	111	G25	E23-G25 VanDerWaalsContact C-N 3.32Å; E23-G25 PolarHBondContact O-N 3.49Å
24	P	28.4	Very low	28.1	Very low	132 Å²	132	141.2 Å²	141.2	86%	0.857	79%	0.791	S	S	*	*			trans	-75.3	80.8	179.4	31.3	-35.1	0	0	0	111.5	N26	P24-N26 PolarHBondContact O-N 3.45Å
25	G	26.7	Very low	28.5	Very low	69 Å²	69	138.1 Å²	138.1	71%	0.711	79%	0.788	S	S	*	*			trans	-56.3	117.7	-179.1	0	0	0	0	0	113.8	E23	E23-G25 VanDerWaalsContact C-N 3.32Å; E23-G25 PolarHBondContact O-N 3.49Å
26	N	26.2	Very low	29	Very low	116 Å²	116	136.4 Å²	136.4	62%	0.62	79%	0.791	S	S	*	*			trans	-53.6	122.5	-178.1	-177	-17.1	0	0	0	112.2	P24 V28	P24-N26 PolarHBondContact O-N 3.45Å; N26-V28 PolarHBondContact O-N 3.35Å; N26-V28 WeakPolarHBondContact OD1-CG2 3.39Å; N26-V28 PolarHBondContact OD1-N 3.11Å
27	P	27.8	Very low	29.7	Very low	117 Å²	117	132 Å²	132	76%	0.76	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-67.8	-12.1	-169.5	26.3	-36	0	0	0	115.1	A29	P27-A29 VanDerWaalsContact C-N 3.29Å; P27-A29 PolarHBondContact O-N 3.33Å
28	V	33.4	Very low	30.8	Very low	118 Å²	118	128.9 Å²	128.9	72%	0.715	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-67.1	-26	-174.5	178.8	0	0	0	0	113.2	N26	N26-V28 PolarHBondContact O-N 3.35Å; N26-V28 WeakPolarHBondContact OD1-CG2 3.39Å; N26-V28 PolarHBondContact OD1-N 3.11Å
29	A	31.1	Very low	32.3	Very low	86 Å²	86	129.4 Å²	129.4	71%	0.711	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-77	-28.9	-169.7	0	0	0	0	0	115.6	P27 S31	P27-A29 VanDerWaalsContact C-N 3.29Å; P27-A29 PolarHBondContact O-N 3.33Å; A29-S31 PolarHBondContact O-N 3.11Å
30	R	26.8	Very low	34.2	Very low	240 Å²	240	121.8 Å²	121.8	91%	0.906	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-88.7	6.6	-169.5	-92.8	-178.5	175.9	157	0.9	116.2
31	S	28.6	Very low	36.5	Very low	101 Å²	101	117.4 Å²	117.4	71%	0.706	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-90	-14.2	-177.1	-166.6	0	0	0	0	114.4	A29	A29-S31 PolarHBondContact O-N 3.11Å
32	R	32.9	Very low	39.1	Very low	228 Å²	228	111.6 Å²	111.6	86%	0.86	68%	0.684	S	S	*	*	S	Bend	trans	-91.6	143.7	178	-68.3	-180	177.7	162.3	1.1	110.8
33	C	33.6	Very low	41.8	Very low	133 Å²	133	112.2 Å²	112.2	90%	0.899	68%	0.678	S	S	*	*	S	Bend	trans	75.3	31.2	177.8	-58.4	0	0	0	0	118.6
34	T	27.8	Very low	44.3	Very low	119 Å²	119	108.1 Å²	108.1	73%	0.73	66%	0.661	S	S	*	*			trans	-110.9	11.3	158.3	52	0	0	0	0	113.9	A36	T34-A36 PolarHBondContact O-N 2.77Å
35	A	35.1	Very low	47	Very low	99 Å²	99	103.4 Å²	103.4	82%	0.818	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	28.3	-179.5	0	0	0	0	0	115.2	G37	A35-G37 VanDerWaalsContact C-N 3.29Å
36	A	37.4	Very low	49.8	Very low	87 Å²	87	101.7 Å²	101.7	72%	0.719	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-15.8	175.6	0	0	0	0	0	113.1	T34	T34-A36 PolarHBondContact O-N 2.77Å
37	G	40	Very low	52.8	Low	69 Å²	69	99.4 Å²	99.4	71%	0.711	60%	0.598	S	S	*	*	S	Bend	trans	-92.3	98.7	172	0	0	0	0	0	111.7	A35	A35-G37 VanDerWaalsContact C-N 3.29Å
38	G	51.9	Low	55.6	Low	49 Å²	49	95.5 Å²	95.5	51%	0.505	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-55.3	140.5	170.6	0	0	0	0	0	111.5
39	K	58.1	Low	58.2	Low	132 Å²	132	90.9 Å²	90.9	57%	0.574	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-57.6	126.1	-172.7	-168.2	-178.5	-178.8	-174.2	0	110.3	Y41	K39-Y41 PolarHBondContact O-N 3.35Å
40	P	64.1	Low	60.9	Low	83 Å²	83	91 Å²	91	54%	0.539	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-66.2	135.8	-174	26.4	-34.7	0	0	0	111.1	T42	P40-T42 WeakPolarHBondContact O-CG2 3.33Å; P40-T42 PolarHBondContact O-N 2.95Å
41	Y	73.1	Confident	63.9	Low	22 Å²	22	81.7 Å²	81.7	9%	0.086	50%	0.5	C	S	.	.			trans	-60.9	108	-178.9	-177.1	-108.6	0	0	0	111.6	K39 D45 C46 G174 R178 L192	K39-Y41 PolarHBondContact O-N 3.35Å; Y41-D45 HydrophobicContact CD2-CB 3.67Å; Y41-D45 HydrophobicContact CE2-CB 3.53Å; Y41-C46 HydrophobicContact CE1-CB 3.78Å; Y41-C46 VanDerWaalsContact OH-CA 3.31Å; Y41-C46 WeakPolarHBondContact OH-CA 3.31Å; Y41-G174 VanDerWaalsContact CD1-C 3.5Å; Y41-G174 WeakPolarHBondContact CD1-O 3.28Å; Y41-R178 PolarHBondContact O-NE 2.94Å; Y41-L192 HydrophobicContact CD2-CD2 3.54Å; Y41-L192 HydrophobicContact CE2-CD2 3.71Å; Y41-L192 HydrophobicContact CG-CD2 4.21Å
42	T	81.3	Confident	66.8	Low	49 Å²	49	77.1 Å²	77.1	30%	0.301	47%	0.468	S	S	.	.			trans	-80.3	174.1	-171.4	72.8	0	0	0	0	111.7	P40 L44 D45 C46 R178	P40-T42 WeakPolarHBondContact O-CG2 3.33Å; P40-T42 PolarHBondContact O-N 2.95Å; T42-L44 VanDerWaalsContact C-N 3.25Å; T42-L44 PolarHBondContact OG1-N 3.45Å; T42-L44 VanDerWaalsContact OG1-N 3.13Å; T42-D45 WeakPolarHBondContact CA-OD2 3.4Å; T42-D45 VanDerWaalsContact CB-OD2 3.23Å; T42-D45 WeakPolarHBondContact CB-OD2 3.26Å; T42-D45 WeakPolarHBondContact CG2-OD2 3.36Å; T42-D45 PolarHBondContact N-OD2 2.82Å; T42-D45 PolarHBondContact OG1-N 3Å; T42-D45 PolarHBondContact OG1-OD2 3.48Å; T42-C46 PolarHBondContact O-N 3.25Å; T42-R178 PolarHBondContact O-NH2 3.34Å
43	L	82.8	Confident	69.4	Low	130 Å²	130	67.1 Å²	67.1	68%	0.681	43%	0.431	S	S	*	.	H	α-helix	trans	-68.5	-27.1	167	-75.2	165	0	0	0	112	C46 C47	L43-C46 WeakPolarHBondContact O-CB 3.49Å; L43-C46 PolarHBondContact O-N 2.87Å; L43-C47 WeakPolarHBondContact O-CB 3.32Å; L43-C47 PolarHBondContact O-N 2.86Å
44	L	84.3	Confident	72.1	Confident	92 Å²	92	65.8 Å²	65.8	48%	0.482	42%	0.415	S	S	.	.	H	α-helix	trans	-76.9	-38	-178.4	-159	154	0	0	0	111.4	T42 C46 C47 W48 Y266	T42-L44 VanDerWaalsContact C-N 3.25Å; T42-L44 PolarHBondContact OG1-N 3.45Å; T42-L44 VanDerWaalsContact OG1-N 3.13Å; L44-C46 VanDerWaalsContact C-N 3.27Å; L44-C46 PolarHBondContact O-N 3.04Å; L44-C47 WeakPolarHBondContact O-CB 3.39Å; L44-C47 PolarHBondContact O-N 2.97Å; L44-W48 WeakPolarHBondContact O-CB 3.4Å; L44-W48 PolarHBondContact O-N 3.17Å; L44-Y266 HydrophobicContact CD2-CD1 3.95Å; L44-Y266 HydrophobicContact CD2-CD2 4.09Å; L44-Y266 HydrophobicContact CD2-CE1 3.52Å; L44-Y266 HydrophobicContact CD2-CE2 3.68Å; L44-Y266 HydrophobicContact CD2-CG 4.21Å
45	D	84.3	Confident	75	Confident	32 Å²	32	61.9 Å²	61.9	17%	0.171	39%	0.39	C	S	.	.	H	α-helix	trans	-61.3	-38.8	170.4	-50.2	-60.4	0	0	0	110.8	Y41 T42 W48 V49 Y266	Y41-D45 HydrophobicContact CD2-CB 3.67Å; Y41-D45 HydrophobicContact CE2-CB 3.53Å; T42-D45 WeakPolarHBondContact CA-OD2 3.4Å; T42-D45 VanDerWaalsContact CB-OD2 3.23Å; T42-D45 WeakPolarHBondContact CB-OD2 3.26Å; T42-D45 WeakPolarHBondContact CG2-OD2 3.36Å; T42-D45 PolarHBondContact N-OD2 2.82Å; T42-D45 PolarHBondContact OG1-N 3Å; T42-D45 PolarHBondContact OG1-OD2 3.48Å; D45-W48 WeakPolarHBondContact O-CB 3.09Å; D45-W48 PolarHBondContact O-N 3.29Å; D45-V49 WeakPolarHBondContact O-CG2 3.21Å; D45-V49 PolarHBondContact O-N 3.26Å; D45-V49 VanDerWaalsContact O-N 3.12Å; D45-Y266 PolarHBondContact OD1-OH 3.04Å
46	C	85.8	Confident	77.4	Confident	33 Å²	33	58.7 Å²	58.7	22%	0.223	36%	0.358	C	S	.	.	H	α-helix	trans	-68	-39.5	175.7	-165.3	0	0	0	0	113	Y41 T42 L43 L44 W48 L50	Y41-C46 HydrophobicContact CE1-CB 3.78Å; Y41-C46 VanDerWaalsContact OH-CA 3.31Å; Y41-C46 WeakPolarHBondContact OH-CA 3.31Å; T42-C46 PolarHBondContact O-N 3.25Å; L43-C46 WeakPolarHBondContact O-CB 3.49Å; L43-C46 PolarHBondContact O-N 2.87Å; L44-C46 VanDerWaalsContact C-N 3.27Å; L44-C46 PolarHBondContact O-N 3.04Å; C46-W48 VanDerWaalsContact C-N 3.35Å; C46-L50 WeakPolarHBondContact O-CB 3.25Å; C46-L50 PolarHBondContact O-N 3.22Å; C46-L50 VanDerWaalsContact O-N 3.09Å
47	C	87.9	Confident	79.9	Confident	68 Å²	68	59.3 Å²	59.3	46%	0.459	35%	0.345	S	S	.	.	H	α-helix	trans	-62.7	-42.6	172.1	-169.2	0	0	0	0	110.7	L43 L44 V49 L50 C51	L43-C47 WeakPolarHBondContact O-CB 3.32Å; L43-C47 PolarHBondContact O-N 2.86Å; L44-C47 WeakPolarHBondContact O-CB 3.39Å; L44-C47 PolarHBondContact O-N 2.97Å; C47-V49 PolarHBondContact O-N 3.17Å; C47-L50 PolarHBondContact O-N 2.93Å; C47-C51 WeakPolarHBondContact O-CB 3.25Å; C47-C51 PolarHBondContact O-N 3.45Å; C47-C51 PolarHBondContact O-SG 2.95Å; C47-C51 VanDerWaalsContact O-SG 3.34Å
48	W	87.6	Confident	82.1	Confident	36 Å²	36	59.1 Å²	59.1	14%	0.136	33%	0.332	C	S	.	.	H	α-helix	trans	-57.9	-46.6	177.3	-167.5	-82.6	0	0	0	112.7	L44 D45 C46 A52 W245 S249 Y266 V269 M273	L44-W48 WeakPolarHBondContact O-CB 3.4Å; L44-W48 PolarHBondContact O-N 3.17Å; D45-W48 WeakPolarHBondContact O-CB 3.09Å; D45-W48 PolarHBondContact O-N 3.29Å; C46-W48 VanDerWaalsContact C-N 3.35Å; W48-A52 VanDerWaalsContact O-CB 3.28Å; W48-A52 WeakPolarHBondContact O-CB 3.34Å; W48-A52 PolarHBondContact O-N 3.24Å; W48-W245 AromaticContact CD2-CH2 3.85Å; W48-W245 HydrophobicContact CD2-CH2 3.85Å; W48-W245 AromaticContact CD2-CZ2 3.45Å; W48-W245 HydrophobicContact CD2-CZ2 3.45Å; W48-W245 VanDerWaalsContact CD2-CZ2 3.45Å; W48-W245 AromaticContact CE2-CE2 3.83Å; W48-W245 AromaticContact CE2-CZ2 3.49Å; W48-W245 VanDerWaalsContact CE2-CZ2 3.49Å; W48-W245 AromaticContact CE3-CH2 3.62Å; W48-W245 HydrophobicContact CE3-CH2 3.62Å; W48-W245 AromaticContact CE3-CZ2 3.75Å; W48-W245 HydrophobicContact CE3-CZ2 3.75Å; W48-W245 AromaticContact CG-CZ2 3.89Å; W48-W245 HydrophobicContact CG-CZ2 3.89Å; W48-W245 HydrophobicContact CH2-CH2 4.11Å; W48-W245 HydrophobicContact CH2-CZ2 4.17Å; W48-W245 HydrophobicContact CH2-CZ3 4.38Å; W48-W245 HydrophobicContact CZ2-CD2 4.44Å; W48-W245 AromaticContact CZ2-CE2 3.95Å; W48-W245 HydrophobicContact CZ2-CH2 4.29Å; W48-W245 AromaticContact CZ2-CZ2 3.87Å; W48-W245 HydrophobicContact CZ2-CZ2 3.87Å; W48-W245 AromaticContact CZ3-CH2 3.76Å; W48-W245 HydrophobicContact CZ3-CH2 3.76Å; W48-W245 HydrophobicContact CZ3-CZ2 4.1Å; W48-W245 HydrophobicContact CZ3-CZ3 4.24Å; W48-W245 AromaticContact NE1-CZ2 3.84Å; W48-W245 AromaticContact NE1-NE1 3.91Å; W48-S249 PolarHBondContact NE1-OG 3.47Å; W48-Y266 HydrophobicContact CD2-CE1 4.25Å; W48-Y266 HydrophobicContact CE3-CD1 4.19Å; W48-Y266 AromaticContact CE3-CE1 3.6Å; W48-Y266 HydrophobicContact CE3-CE1 3.6Å; W48-Y266 AromaticContact CZ3-CD1 3.94Å; W48-Y266 HydrophobicContact CZ3-CD1 3.94Å; W48-Y266 AromaticContact CZ3-CE1 3.8Å; W48-Y266 HydrophobicContact CZ3-CE1 3.8Å; W48-V269 HydrophobicContact CH2-CB 4.48Å; W48-V269 HydrophobicContact CH2-CG1 3.49Å; W48-V269 VanDerWaalsContact CH2-CG1 3.49Å; W48-V269 HydrophobicContact CZ2-CG1 3.87Å; W48-V269 HydrophobicContact CZ3-CG1 4.49Å; W48-M273 HydrophobicContact CH2-CE 3.3Å; W48-M273 HydrophobicContact CH2-SD 4.06Å; W48-M273 HydrophobicContact CZ2-CE 3.66Å; W48-M273 HydrophobicContact CZ3-CE 4.26Å
49	V	87.4	Confident	83.7	Confident	21 Å²	21	57.7 Å²	57.7	13%	0.127	31%	0.313	C	S	.	.	H	α-helix	trans	-67.6	-37.1	178.2	178.5	0	0	0	0	111.5	D45 C47 L53 Y167 L171	D45-V49 WeakPolarHBondContact O-CG2 3.21Å; D45-V49 PolarHBondContact O-N 3.26Å; D45-V49 VanDerWaalsContact O-N 3.12Å; C47-V49 PolarHBondContact O-N 3.17Å; V49-L53 PolarHBondContact O-N 3.32Å; V49-Y167 HydrophobicContact CG1-CD1 3.76Å; V49-Y167 HydrophobicContact CG1-CE1 4.08Å; V49-L171 HydrophobicContact CB-CD2 3.87Å; V49-L171 HydrophobicContact CG1-CD1 4.42Å; V49-L171 HydrophobicContact CG1-CD2 3.62Å; V49-L171 HydrophobicContact CG1-CG 3.72Å
50	L	88.7	Confident	85	Confident	87 Å²	87	52.9 Å²	52.9	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-68.3	-46.3	176	-176.4	63.7	0	0	0	112.3	C46 C47 A52 L53 L54	C46-L50 WeakPolarHBondContact O-CB 3.25Å; C46-L50 PolarHBondContact O-N 3.22Å; C46-L50 VanDerWaalsContact O-N 3.09Å; C47-L50 PolarHBondContact O-N 2.93Å; L50-A52 VanDerWaalsContact C-N 3.32Å; L50-A52 PolarHBondContact O-N 2.75Å; L50-L53 WeakPolarHBondContact O-CB 3.23Å; L50-L53 PolarHBondContact O-N 2.88Å; L50-L53 VanDerWaalsContact O-N 3.16Å; L50-L54 HydrophobicContact CG-CD1 4.45Å; L50-L54 WeakPolarHBondContact O-CG 3.49Å; L50-L54 PolarHBondContact O-N 2.85Å
51	C	89.8	Confident	86.1	Confident	46 Å²	46	51.8 Å²	51.8	31%	0.311	30%	0.299	S	S	.	.	H	α-helix	trans	-59.4	-43.8	173.6	-70.6	0	0	0	0	111.1	C47 L53 L54 V55 W245	C47-C51 WeakPolarHBondContact O-CB 3.25Å; C47-C51 PolarHBondContact O-N 3.45Å; C47-C51 PolarHBondContact O-SG 2.95Å; C47-C51 VanDerWaalsContact O-SG 3.34Å; C51-L53 VanDerWaalsContact C-N 3.34Å; C51-L53 PolarHBondContact O-N 3.48Å; C51-L54 PolarHBondContact O-N 3.3Å; C51-V55 WeakPolarHBondContact O-CG2 3.45Å; C51-V55 PolarHBondContact O-N 3.37Å; C51-W245 HydrophobicContact CB-CH2 4.13Å; C51-W245 HydrophobicContact CB-CZ2 4.1Å
52	A	88.1	Confident	86.6	Confident	4 Å²	4	53 Å²	53	3%	0.033	31%	0.309	C	S	.	.	H	α-helix	trans	-58.7	-44.5	174	0	0	0	0	0	111.6	W48 L50 V55 F56 Y167 R203	W48-A52 VanDerWaalsContact O-CB 3.28Å; W48-A52 WeakPolarHBondContact O-CB 3.34Å; W48-A52 PolarHBondContact O-N 3.24Å; L50-A52 VanDerWaalsContact C-N 3.32Å; L50-A52 PolarHBondContact O-N 2.75Å; A52-V55 PolarHBondContact O-N 3.39Å; A52-F56 PolarHBondContact O-N 3.06Å; A52-Y167 HydrophobicContact CB-CE1 3.92Å; A52-R203 PolarHBondContact O-NH1 2.89Å; A52-R203 PolarHBondContact O-NH2 2.88Å
53	L	89.6	Confident	86.8	Confident	18 Å²	18	51.2 Å²	51.2	9%	0.094	30%	0.298	C	S	.	.	H	α-helix	trans	-60.9	-46	176.5	-180	57.5	0	0	0	112.2	V49 L50 C51 V55 F56 F57 V164 Y167 L171	V49-L53 PolarHBondContact O-N 3.32Å; L50-L53 WeakPolarHBondContact O-CB 3.23Å; L50-L53 PolarHBondContact O-N 2.88Å; L50-L53 VanDerWaalsContact O-N 3.16Å; C51-L53 VanDerWaalsContact C-N 3.34Å; C51-L53 PolarHBondContact O-N 3.48Å; L53-V55 VanDerWaalsContact C-N 3.33Å; L53-V55 PolarHBondContact O-N 2.94Å; L53-F56 PolarHBondContact O-N 3.45Å; L53-F57 HydrophobicContact CD1-CD2 4.05Å; L53-F57 HydrophobicContact CD1-CE2 3.58Å; L53-F57 HydrophobicContact CD1-CZ 4.41Å; L53-F57 HydrophobicContact CD2-CE2 4.44Å; L53-F57 HydrophobicContact CG-CD2 4.15Å; L53-F57 HydrophobicContact CG-CE2 3.85Å; L53-F57 WeakPolarHBondContact O-CD2 3.28Å; L53-F57 PolarHBondContact O-N 2.91Å; L53-V164 HydrophobicContact CD1-CG1 4.46Å; L53-Y167 HydrophobicContact CB-CD1 3.95Å; L53-Y167 HydrophobicContact CB-CE1 4.46Å; L53-Y167 HydrophobicContact CB-CG 4.3Å; L53-Y167 HydrophobicContact CD1-CD1 4.43Å; L53-Y167 HydrophobicContact CD1-CD2 4.27Å; L53-Y167 HydrophobicContact CD1-CG 3.92Å; L53-L171 HydrophobicContact CD2-CD1 4.34Å
54	L	89.6	Confident	87	Confident	106 Å²	106	50.6 Å²	50.6	56%	0.555	29%	0.294	S	S	*	.	H	α-helix	trans	-59.7	-41.1	176.4	-70.1	170.6	0	0	0	112.3	L50 C51 F56 F57 S58	L50-L54 HydrophobicContact CG-CD1 4.45Å; L50-L54 WeakPolarHBondContact O-CG 3.49Å; L50-L54 PolarHBondContact O-N 2.85Å; C51-L54 PolarHBondContact O-N 3.3Å; L54-F56 VanDerWaalsContact C-N 3.33Å; L54-F56 PolarHBondContact O-N 3.04Å; L54-F57 PolarHBondContact O-N 3.34Å; L54-S58 WeakPolarHBondContact O-CB 3.23Å; L54-S58 PolarHBondContact O-N 2.86Å
55	V	88.5	Confident	87.2	Confident	36 Å²	36	55.6 Å²	55.6	22%	0.218	31%	0.307	C	S	.	.	H	α-helix	trans	-59.5	-40	177.5	165.2	0	0	0	0	112.2	C51 A52 L53 S58 D59 S242	C51-V55 WeakPolarHBondContact O-CG2 3.45Å; C51-V55 PolarHBondContact O-N 3.37Å; A52-V55 PolarHBondContact O-N 3.39Å; L53-V55 VanDerWaalsContact C-N 3.33Å; L53-V55 PolarHBondContact O-N 2.94Å; V55-S58 WeakPolarHBondContact O-CB 3.33Å; V55-S58 PolarHBondContact O-N 3.15Å; V55-D59 VanDerWaalsContact O-CG 3.27Å; V55-D59 PolarHBondContact O-N 3.44Å; V55-S242 WeakPolarHBondContact CG1-OG 3.25Å
56	F	86.4	Confident	87.1	Confident	33 Å²	33	54.9 Å²	54.9	15%	0.145	30%	0.303	C	S	.	.	H	α-helix	trans	-68.8	-39.2	177.6	162.5	-90.3	0	0	0	113.5	A52 L53 L54 S58 G60 Q163 V164	A52-F56 PolarHBondContact O-N 3.06Å; L53-F56 PolarHBondContact O-N 3.45Å; L54-F56 VanDerWaalsContact C-N 3.33Å; L54-F56 PolarHBondContact O-N 3.04Å; F56-S58 VanDerWaalsContact C-N 3.29Å; F56-G60 PolarHBondContact O-N 3Å; F56-G60 VanDerWaalsContact O-N 3.08Å; F56-Q163 HydrophobicContact CE2-CB 4.33Å; F56-Q163 HydrophobicContact CZ-CB 4.08Å; F56-V164 HydrophobicContact CD1-CG2 4.41Å; F56-V164 HydrophobicContact CE1-CG2 3.7Å
57	F	87.9	Confident	87.1	Confident	100 Å²	100	53.5 Å²	53.5	44%	0.439	29%	0.294	S	S	.	.	H	α-helix	trans	-64.9	-37.1	171.3	-75.3	-62.7	0	0	0	111.4	L53 L54 A61 V164	L53-F57 HydrophobicContact CD1-CD2 4.05Å; L53-F57 HydrophobicContact CD1-CE2 3.58Å; L53-F57 HydrophobicContact CD1-CZ 4.41Å; L53-F57 HydrophobicContact CD2-CE2 4.44Å; L53-F57 HydrophobicContact CG-CD2 4.15Å; L53-F57 HydrophobicContact CG-CE2 3.85Å; L53-F57 WeakPolarHBondContact O-CD2 3.28Å; L53-F57 PolarHBondContact O-N 2.91Å; L54-F57 PolarHBondContact O-N 3.34Å; F57-A61 WeakPolarHBondContact O-CB 3.45Å; F57-A61 PolarHBondContact O-N 2.87Å; F57-V164 HydrophobicContact CE1-CG2 3.96Å; F57-V164 HydrophobicContact CE2-CG1 4.38Å; F57-V164 HydrophobicContact CE2-CG2 4.4Å; F57-V164 HydrophobicContact CZ-CB 4.39Å; F57-V164 HydrophobicContact CZ-CG1 3.81Å; F57-V164 HydrophobicContact CZ-CG2 3.6Å
58	S	86.6	Confident	87.1	Confident	64 Å²	64	52.5 Å²	52.5	45%	0.448	29%	0.29	S	S	.	.	H	α-helix	trans	-62.7	-53.3	174.3	-169.7	0	0	0	0	111.4	L54 V55 F56 A61 T62	L54-S58 WeakPolarHBondContact O-CB 3.23Å; L54-S58 PolarHBondContact O-N 2.86Å; V55-S58 WeakPolarHBondContact O-CB 3.33Å; V55-S58 PolarHBondContact O-N 3.15Å; F56-S58 VanDerWaalsContact C-N 3.29Å; S58-A61 PolarHBondContact O-N 3.14Å; S58-T62 WeakPolarHBondContact O-CG2 3.34Å; S58-T62 PolarHBondContact O-N 3Å; S58-T62 PolarHBondContact O-OG1 3.27Å
59	D	86.4	Confident	87	Confident	19 Å²	19	52.5 Å²	52.5	10%	0.102	29%	0.293	C	S	.	.	H	α-helix	trans	-55.3	-57.1	-179.1	-70.3	-18.4	0	0	0	110.3	V55 A61 T62 D63 S242	V55-D59 VanDerWaalsContact O-CG 3.27Å; V55-D59 PolarHBondContact O-N 3.44Å; D59-A61 VanDerWaalsContact C-N 3.31Å; D59-A61 PolarHBondContact O-N 3.14Å; D59-T62 WeakPolarHBondContact CA-OG1 3.22Å; D59-T62 PolarHBondContact O-N 3.42Å; D59-T62 VanDerWaalsContact O-N 3.09Å; D59-T62 PolarHBondContact O-OG1 2.99Å; D59-D63 VanDerWaalsContact O-CG 3.23Å; D59-D63 PolarHBondContact O-N 3.36Å; D59-D63 VanDerWaalsContact O-OD2 3.05Å; D59-S242 WeakPolarHBondContact OD1-CB 3.22Å; D59-S242 PolarHBondContact OD1-OG 2.92Å; D59-S242 WeakPolarHBondContact OD2-CB 3.47Å; D59-S242 PolarHBondContact OD2-OG 3.46Å
60	G	84.6	Confident	86.9	Confident	31 Å²	31	52.1 Å²	52.1	32%	0.32	29%	0.29	S	S	.	.	H	α-helix	trans	-61.5	-33.6	-179.9	0	0	0	0	0	114.3	F56 L64	F56-G60 PolarHBondContact O-N 3Å; F56-G60 VanDerWaalsContact O-N 3.08Å; G60-L64 WeakPolarHBondContact O-CB 3.34Å; G60-L64 PolarHBondContact O-N 2.93Å
61	A	86.6	Confident	86.9	Confident	61 Å²	61	53.8 Å²	53.8	50%	0.504	29%	0.291	S	S	.	.	H	α-helix	trans	-70.8	-40.5	173.4	0	0	0	0	0	112.1	F57 S58 D59 W65	F57-A61 WeakPolarHBondContact O-CB 3.45Å; F57-A61 PolarHBondContact O-N 2.87Å; S58-A61 PolarHBondContact O-N 3.14Å; D59-A61 VanDerWaalsContact C-N 3.31Å; D59-A61 PolarHBondContact O-N 3.14Å; A61-W65 VanDerWaalsContact O-CB 3.23Å; A61-W65 WeakPolarHBondContact O-CB 3.44Å; A61-W65 PolarHBondContact O-N 3.27Å
62	T	85.6	Confident	86.9	Confident	46 Å²	46	58.6 Å²	58.6	28%	0.282	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-39.1	176.3	48.6	0	0	0	0	112.3	S58 D59 W65 L66	S58-T62 WeakPolarHBondContact O-CG2 3.34Å; S58-T62 PolarHBondContact O-N 3Å; S58-T62 PolarHBondContact O-OG1 3.27Å; D59-T62 WeakPolarHBondContact CA-OG1 3.22Å; D59-T62 PolarHBondContact O-N 3.42Å; D59-T62 VanDerWaalsContact O-N 3.09Å; D59-T62 PolarHBondContact O-OG1 2.99Å; T62-W65 PolarHBondContact O-N 3.33Å; T62-L66 VanDerWaalsContact O-CB 3.29Å; T62-L66 WeakPolarHBondContact O-CB 3.41Å; T62-L66 PolarHBondContact O-N 3.08Å
63	D	84.9	Confident	86.8	Confident	12 Å²	12	65.2 Å²	65.2	6%	0.064	34%	0.337	C	S	.	.	H	α-helix	trans	-63.7	-46.5	176.4	-62.2	-46.4	0	0	0	111.6	D59 L66 A67 V86 K210	D59-D63 VanDerWaalsContact O-CG 3.23Å; D59-D63 PolarHBondContact O-N 3.36Å; D59-D63 VanDerWaalsContact O-OD2 3.05Å; D63-L66 PolarHBondContact O-N 2.89Å; D63-A67 WeakPolarHBondContact O-CB 3.47Å; D63-A67 PolarHBondContact O-N 3.39Å; D63-V86 HydrophobicContact CB-CG2 3.61Å; D63-K210 WeakPolarHBondContact OD2-CE 3.33Å; D63-K210 IonicContact OD2-NZ 2.81Å; D63-K210 PolarHBondContact OD2-NZ 2.98Å
64	L	86.6	Confident	86.7	Confident	117 Å²	117	66 Å²	66	61%	0.613	35%	0.349	S	S	*	.	H	α-helix	trans	-68.9	-37.1	-180	-176.5	61.3	0	0	0	112	G60 A67 A68	G60-L64 WeakPolarHBondContact O-CB 3.34Å; G60-L64 PolarHBondContact O-N 2.93Å; L64-A67 PolarHBondContact O-N 2.89Å; L64-A68 WeakPolarHBondContact O-CB 3.21Å; L64-A68 PolarHBondContact O-N 3.26Å
65	W	88.2	Confident	86.5	Confident	198 Å²	198	64.1 Å²	64.1	75%	0.75	34%	0.34	S	S	*	.	H	α-helix	trans	-62.6	-44.7	172.4	-179.7	-82.3	0	0	0	111.5	A61 T62 A68 D69	A61-W65 VanDerWaalsContact O-CB 3.23Å; A61-W65 WeakPolarHBondContact O-CB 3.44Å; A61-W65 PolarHBondContact O-N 3.27Å; T62-W65 PolarHBondContact O-N 3.33Å; W65-A68 PolarHBondContact O-N 3.3Å; W65-D69 PolarHBondContact O-N 2.74Å
66	L	83.1	Confident	86.5	Confident	17 Å²	17	69.4 Å²	69.4	9%	0.089	36%	0.357	C	S	.	.	H	α-helix	trans	-66.1	-39.3	178.8	-170.3	69.1	0	0	0	111.7	T62 D63 D69 Y70 Q218	T62-L66 VanDerWaalsContact O-CB 3.29Å; T62-L66 WeakPolarHBondContact O-CB 3.41Å; T62-L66 PolarHBondContact O-N 3.08Å; D63-L66 PolarHBondContact O-N 2.89Å; L66-D69 PolarHBondContact O-N 3.03Å; L66-Y70 HydrophobicContact CD1-CE2 4.09Å; L66-Y70 HydrophobicContact CD2-CE2 3.95Å; L66-Y70 HydrophobicContact CG-CD2 4.25Å; L66-Y70 HydrophobicContact CG-CE2 3.57Å; L66-Y70 VanDerWaalsContact O-CD2 3.28Å; L66-Y70 WeakPolarHBondContact O-CD2 3.48Å; L66-Y70 PolarHBondContact O-N 3.14Å; L66-Q218 HydrophobicContact CD2-CG 4.44Å
67	A	85.4	Confident	86.5	Confident	4 Å²	4	77.1 Å²	77.1	3%	0.033	39%	0.385	C	S	.	.	H	α-helix	trans	-60.3	-44.2	171.7	0	0	0	0	0	111.8	D63 L64 Y70 Y71 F79 T82	D63-A67 WeakPolarHBondContact O-CB 3.47Å; D63-A67 PolarHBondContact O-N 3.39Å; L64-A67 PolarHBondContact O-N 2.89Å; A67-Y70 PolarHBondContact O-N 3.09Å; A67-Y71 PolarHBondContact O-N 3.28Å; A67-F79 HydrophobicContact CB-CD2 4.1Å; A67-F79 HydrophobicContact CB-CE2 4.32Å; A67-F79 VanDerWaalsContact O-CD2 3.27Å; A67-F79 WeakPolarHBondContact O-CD2 3.39Å; A67-T82 HydrophobicContact CB-CG2 4.02Å
68	A	87.4	Confident	86.4	Confident	46 Å²	46	75.2 Å²	75.2	38%	0.38	38%	0.375	S	S	.	.	H	α-helix	trans	-64.2	-39.3	176.2	0	0	0	0	0	112.5	L64 W65 Y71 L72	L64-A68 WeakPolarHBondContact O-CB 3.21Å; L64-A68 PolarHBondContact O-N 3.26Å; W65-A68 PolarHBondContact O-N 3.3Å; A68-Y71 PolarHBondContact O-N 3.08Å; A68-L72 WeakPolarHBondContact O-CB 3.3Å; A68-L72 VanDerWaalsContact O-CG 3.28Å; A68-L72 WeakPolarHBondContact O-CG 3.4Å; A68-L72 PolarHBondContact O-N 3.37Å
69	D	85.8	Confident	86.4	Confident	37 Å²	37	74.6 Å²	74.6	20%	0.198	36%	0.364	C	S	.	.	H	α-helix	trans	-61.5	-44.3	175.4	-174.3	40.2	0	0	0	111.9	W65 L66 L72 R73	W65-D69 PolarHBondContact O-N 2.74Å; L66-D69 PolarHBondContact O-N 3.03Å; D69-L72 PolarHBondContact O-N 3.24Å; D69-R73 WeakPolarHBondContact O-CD 3.49Å; D69-R73 VanDerWaalsContact O-CG 3.25Å; D69-R73 WeakPolarHBondContact O-CG 3.36Å; D69-R73 PolarHBondContact O-N 3.36Å; D69-R73 VanDerWaalsContact O-N 3.14Å; D69-R73 IonicContact OD1-CZ 3.33Å; D69-R73 IonicContact OD1-NE 3.26Å; D69-R73 PolarHBondContact OD1-NE 3.45Å; D69-R73 IonicContact OD1-NH2 2.76Å; D69-R73 PolarHBondContact OD1-NH2 3.5Å; D69-R73 IonicContact OD2-CZ 3.96Å; D69-R73 IonicContact OD2-NE 3.98Å; D69-R73 PolarHBondContact OD2-NE 3.16Å; D69-R73 IonicContact OD2-NH2 3.24Å; D69-R73 PolarHBondContact OD2-NH2 3.44Å
70	Y	84.9	Confident	86.5	Confident	13 Å²	13	75 Å²	75	5%	0.051	37%	0.373	C	S	.	.	H	α-helix	trans	-65.5	-40.1	173.6	-65.1	-43.2	0	0	0	112.8	L66 A67 R73 G74 D75 W78 I221	L66-Y70 HydrophobicContact CD1-CE2 4.09Å; L66-Y70 HydrophobicContact CD2-CE2 3.95Å; L66-Y70 HydrophobicContact CG-CD2 4.25Å; L66-Y70 HydrophobicContact CG-CE2 3.57Å; L66-Y70 VanDerWaalsContact O-CD2 3.28Å; L66-Y70 WeakPolarHBondContact O-CD2 3.48Å; L66-Y70 PolarHBondContact O-N 3.14Å; A67-Y70 PolarHBondContact O-N 3.09Å; Y70-R73 PolarHBondContact O-N 2.78Å; Y70-G74 PolarHBondContact O-N 3.32Å; Y70-D75 HydrophobicContact CD1-CB 4.42Å; Y70-D75 PolarHBondContact O-N 3.15Å; Y70-W78 HydrophobicContact CD1-CB 4.19Å; Y70-W78 HydrophobicContact CD2-CB 4.05Å; Y70-W78 HydrophobicContact CE1-CB 4.48Å; Y70-W78 HydrophobicContact CE2-CB 4.32Å; Y70-W78 HydrophobicContact CG-CB 4Å; Y70-I221 HydrophobicContact CE1-CD1 4.43Å; Y70-I221 HydrophobicContact CE1-CG2 4.28Å; Y70-I221 HydrophobicContact CE2-CD1 4.23Å; Y70-I221 VanDerWaalsContact OH-CD1 3.31Å; Y70-I221 WeakPolarHBondContact OH-CD1 3.44Å
71	Y	89.1	Confident	86.6	Confident	121 Å²	121	76.1 Å²	76.1	48%	0.475	37%	0.371	S	S	.	.	H	α-helix	trans	-62.2	-44.6	176.4	-175.5	-90	0	0	0	111.8	A67 A68 R73 G74 Y76 F79	A67-Y71 PolarHBondContact O-N 3.28Å; A68-Y71 PolarHBondContact O-N 3.08Å; Y71-R73 VanDerWaalsContact C-N 3.26Å; Y71-R73 PolarHBondContact O-N 2.88Å; Y71-G74 PolarHBondContact O-N 2.84Å; Y71-G74 VanDerWaalsContact O-N 3.09Å; Y71-Y76 HydrophobicContact CD2-CD1 4.28Å; Y71-Y76 HydrophobicContact CD2-CE1 4.06Å; Y71-Y76 HydrophobicContact CE2-CD1 4.34Å; Y71-Y76 AromaticContact CE2-CE1 3.84Å; Y71-Y76 HydrophobicContact CE2-CE1 3.84Å; Y71-F79 AromaticContact CD2-CD1 3.98Å; Y71-F79 HydrophobicContact CD2-CD1 3.98Å; Y71-F79 HydrophobicContact CD2-CD2 4.47Å; Y71-F79 AromaticContact CD2-CE1 3.83Å; Y71-F79 HydrophobicContact CD2-CE1 3.83Å; Y71-F79 HydrophobicContact CD2-CE2 4.33Å; Y71-F79 HydrophobicContact CD2-CG 4.3Å; Y71-F79 AromaticContact CD2-CZ 4Å; Y71-F79 HydrophobicContact CD2-CZ 4Å; Y71-F79 HydrophobicContact CE2-CE1 4.43Å
72	L	90	Very high	86.6	Confident	147 Å²	147	73.2 Å²	73.2	77%	0.77	35%	0.347	S	S	*	.	H	α-helix	trans	-67.6	-23.6	178.7	-70.7	171.3	0	0	0	113.5	A68 D69	A68-L72 WeakPolarHBondContact O-CB 3.3Å; A68-L72 VanDerWaalsContact O-CG 3.28Å; A68-L72 WeakPolarHBondContact O-CG 3.4Å; A68-L72 PolarHBondContact O-N 3.37Å; D69-L72 PolarHBondContact O-N 3.24Å
73	R	86.1	Confident	86.7	Confident	144 Å²	144	74.2 Å²	74.2	54%	0.543	35%	0.351	S	S	.	.	H	α-helix	trans	-82.2	-11.9	172.5	-69.1	168.2	-162.4	-130.3	5.1	113.8	D69 Y70 Y71 D75	D69-R73 WeakPolarHBondContact O-CD 3.49Å; D69-R73 VanDerWaalsContact O-CG 3.25Å; D69-R73 WeakPolarHBondContact O-CG 3.36Å; D69-R73 PolarHBondContact O-N 3.36Å; D69-R73 VanDerWaalsContact O-N 3.14Å; D69-R73 IonicContact OD1-CZ 3.33Å; D69-R73 IonicContact OD1-NE 3.26Å; D69-R73 PolarHBondContact OD1-NE 3.45Å; D69-R73 IonicContact OD1-NH2 2.76Å; D69-R73 PolarHBondContact OD1-NH2 3.5Å; D69-R73 IonicContact OD2-CZ 3.96Å; D69-R73 IonicContact OD2-NE 3.98Å; D69-R73 PolarHBondContact OD2-NE 3.16Å; D69-R73 IonicContact OD2-NH2 3.24Å; D69-R73 PolarHBondContact OD2-NH2 3.44Å; Y70-R73 PolarHBondContact O-N 2.78Å; Y71-R73 VanDerWaalsContact C-N 3.26Å; Y71-R73 PolarHBondContact O-N 2.88Å; R73-D75 VanDerWaalsContact C-N 3.32Å
74	G	86.8	Confident	87	Confident	35 Å²	35	77.8 Å²	77.8	36%	0.361	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	10.3	-172	0	0	0	0	0	114.2	Y70 Y71 Y76	Y70-G74 PolarHBondContact O-N 3.32Å; Y71-G74 PolarHBondContact O-N 2.84Å; Y71-G74 VanDerWaalsContact O-N 3.09Å; G74-Y76 WeakPolarHBondContact O-CD2 3.33Å; G74-Y76 PolarHBondContact O-N 2.9Å
75	D	85.4	Confident	87.1	Confident	66 Å²	66	75.3 Å²	75.3	35%	0.353	36%	0.357	S	S	.	.			trans	-78.8	56.8	179.7	-79.9	-50.7	0	0	0	111.5	Y70 R73 W77 W78 F79	Y70-D75 HydrophobicContact CD1-CB 4.42Å; Y70-D75 PolarHBondContact O-N 3.15Å; R73-D75 VanDerWaalsContact C-N 3.32Å; D75-W77 PolarHBondContact O-N 3.34Å; D75-W78 HydrophobicContact CB-CB 4.39Å; D75-W78 PolarHBondContact O-N 2.9Å; D75-F79 PolarHBondContact O-N 2.91Å
76	Y	88.4	Confident	87.1	Confident	146 Å²	146	67.1 Å²	67.1	57%	0.573	33%	0.329	S	S	*	.	H	α-helix	trans	-55.6	-28.4	-171.2	-62.2	-68.7	0	0	0	114.3	Y71 G74 G80	Y71-Y76 HydrophobicContact CD2-CD1 4.28Å; Y71-Y76 HydrophobicContact CD2-CE1 4.06Å; Y71-Y76 HydrophobicContact CE2-CD1 4.34Å; Y71-Y76 AromaticContact CE2-CE1 3.84Å; Y71-Y76 HydrophobicContact CE2-CE1 3.84Å; G74-Y76 WeakPolarHBondContact O-CD2 3.33Å; G74-Y76 PolarHBondContact O-N 2.9Å; Y76-G80 PolarHBondContact O-N 3.43Å
77	W	87.3	Confident	87.4	Confident	196 Å²	196	69.4 Å²	69.4	74%	0.742	34%	0.344	S	S	*	.	H	α-helix	trans	-68.9	-50	175.2	-173.5	-101.8	0	0	0	112.3	D75 G80 L81	D75-W77 PolarHBondContact O-N 3.34Å; W77-G80 PolarHBondContact O-N 3.07Å; W77-L81 VanDerWaalsContact O-CB 3.25Å; W77-L81 WeakPolarHBondContact O-CB 3.49Å; W77-L81 PolarHBondContact O-N 2.68Å
78	W	84.4	Confident	87.6	Confident	59 Å²	59	73.1 Å²	73.1	22%	0.223	37%	0.366	C	S	.	.	H	α-helix	trans	-68.8	-34.9	178	-60.4	124.6	0	0	0	112.1	Y70 D75 T82 L217 I221	Y70-W78 HydrophobicContact CD1-CB 4.19Å; Y70-W78 HydrophobicContact CD2-CB 4.05Å; Y70-W78 HydrophobicContact CE1-CB 4.48Å; Y70-W78 HydrophobicContact CE2-CB 4.32Å; Y70-W78 HydrophobicContact CG-CB 4Å; D75-W78 HydrophobicContact CB-CB 4.39Å; D75-W78 PolarHBondContact O-N 2.9Å; W78-T82 VanDerWaalsContact O-CB 3.23Å; W78-T82 WeakPolarHBondContact O-CB 3.16Å; W78-T82 PolarHBondContact O-N 3.46Å; W78-T82 PolarHBondContact O-OG1 2.82Å; W78-L217 HydrophobicContact CE3-CD1 3.84Å; W78-L217 HydrophobicContact CZ3-CD1 3.65Å; W78-I221 HydrophobicContact CB-CD1 4.31Å; W78-I221 HydrophobicContact CD2-CD1 3.8Å; W78-I221 HydrophobicContact CD2-CG1 4.09Å; W78-I221 HydrophobicContact CE3-CD1 3.66Å; W78-I221 HydrophobicContact CE3-CG1 4.02Å; W78-I221 HydrophobicContact CG-CD1 4.11Å; W78-I221 HydrophobicContact CH2-CG1 4.33Å; W78-I221 HydrophobicContact CZ2-CG1 4.41Å; W78-I221 HydrophobicContact CZ3-CD1 4.22Å; W78-I221 HydrophobicContact CZ3-CG1 4.14Å
79	F	87.6	Confident	87.8	Confident	52 Å²	52	71.3 Å²	71.3	23%	0.228	35%	0.35	C	S	.	.	H	α-helix	trans	-57.8	-56.2	168.5	164.6	-113.2	0	0	0	111.9	A67 Y71 D75 L81 T82 L83	A67-F79 HydrophobicContact CB-CD2 4.1Å; A67-F79 HydrophobicContact CB-CE2 4.32Å; A67-F79 VanDerWaalsContact O-CD2 3.27Å; A67-F79 WeakPolarHBondContact O-CD2 3.39Å; Y71-F79 AromaticContact CD2-CD1 3.98Å; Y71-F79 HydrophobicContact CD2-CD1 3.98Å; Y71-F79 HydrophobicContact CD2-CD2 4.47Å; Y71-F79 AromaticContact CD2-CE1 3.83Å; Y71-F79 HydrophobicContact CD2-CE1 3.83Å; Y71-F79 HydrophobicContact CD2-CE2 4.33Å; Y71-F79 HydrophobicContact CD2-CG 4.3Å; Y71-F79 AromaticContact CD2-CZ 4Å; Y71-F79 HydrophobicContact CD2-CZ 4Å; Y71-F79 HydrophobicContact CE2-CE1 4.43Å; D75-F79 PolarHBondContact O-N 2.91Å; F79-L81 PolarHBondContact O-N 3.24Å; F79-T82 PolarHBondContact O-N 3.02Å; F79-L83 HydrophobicContact CE2-CD2 4.41Å; F79-L83 HydrophobicContact CZ-CD2 4.01Å; F79-L83 WeakPolarHBondContact O-CB 3.47Å; F79-L83 PolarHBondContact O-N 2.96Å
80	G	88.7	Confident	88	Confident	28 Å²	28	70 Å²	70	29%	0.289	34%	0.344	S	S	.	.	H	α-helix	trans	-62.8	-41	-177.3	0	0	0	0	0	112.8	Y76 W77 L83 V84	Y76-G80 PolarHBondContact O-N 3.43Å; W77-G80 PolarHBondContact O-N 3.07Å; G80-L83 PolarHBondContact O-N 2.87Å; G80-V84 WeakPolarHBondContact O-CG2 3.11Å; G80-V84 PolarHBondContact O-N 3.1Å
81	L	86.2	Confident	88.2	Confident	53 Å²	53	71.6 Å²	71.6	28%	0.277	36%	0.36	S	S	.	.	H	α-helix	trans	-68.9	-40.4	179.6	-166	155.5	0	0	0	111.7	W77 F79 V84 F85 L217	W77-L81 VanDerWaalsContact O-CB 3.25Å; W77-L81 WeakPolarHBondContact O-CB 3.49Å; W77-L81 PolarHBondContact O-N 2.68Å; F79-L81 PolarHBondContact O-N 3.24Å; L81-V84 PolarHBondContact O-N 3.37Å; L81-F85 HydrophobicContact CD2-CD2 3.91Å; L81-F85 HydrophobicContact CD2-CE2 3.69Å; L81-F85 WeakPolarHBondContact O-CD2 3.39Å; L81-F85 PolarHBondContact O-N 2.94Å; L81-L217 HydrophobicContact CD2-CD1 3.63Å; L81-L217 HydrophobicContact CD2-CD2 3.43Å; L81-L217 VanDerWaalsContact CD2-CD2 3.43Å; L81-L217 HydrophobicContact CD2-CG 4.13Å
82	T	86.1	Confident	88.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-60.2	-48.3	169.2	-65.7	0	0	0	0	111.2	A67 W78 F79 V84 F85 V86 Q214	A67-T82 HydrophobicContact CB-CG2 4.02Å; W78-T82 VanDerWaalsContact O-CB 3.23Å; W78-T82 WeakPolarHBondContact O-CB 3.16Å; W78-T82 PolarHBondContact O-N 3.46Å; W78-T82 PolarHBondContact O-OG1 2.82Å; F79-T82 PolarHBondContact O-N 3.02Å; T82-V84 VanDerWaalsContact C-N 3.28Å; T82-V84 PolarHBondContact O-N 3.32Å; T82-F85 PolarHBondContact O-N 3.49Å; T82-F85 VanDerWaalsContact O-N 3.12Å; T82-V86 HydrophobicContact CG2-CG2 4.47Å; T82-V86 WeakPolarHBondContact O-CG2 3.4Å; T82-V86 PolarHBondContact O-N 3.43Å; T82-Q214 PolarHBondContact OG1-NE2 2.89Å
83	L	89.3	Confident	88.2	Confident	68 Å²	68	61.7 Å²	61.7	36%	0.356	32%	0.318	S	S	.	.	H	α-helix	trans	-61.4	-36	-177.8	-173.8	65.8	0	0	0	112.2	F79 G80 V86 V87	F79-L83 HydrophobicContact CE2-CD2 4.41Å; F79-L83 HydrophobicContact CZ-CD2 4.01Å; F79-L83 WeakPolarHBondContact O-CB 3.47Å; F79-L83 PolarHBondContact O-N 2.96Å; G80-L83 PolarHBondContact O-N 2.87Å; L83-V86 PolarHBondContact O-N 2.97Å; L83-V87 HydrophobicContact CD1-CG2 3.82Å; L83-V87 HydrophobicContact CG-CG2 4.13Å; L83-V87 WeakPolarHBondContact O-CB 3.23Å; L83-V87 VanDerWaalsContact O-CG2 3.31Å; L83-V87 WeakPolarHBondContact O-CG2 3.48Å; L83-V87 PolarHBondContact O-N 2.99Å
84	V	90.4	Very high	88.4	Confident	86 Å²	86	55.5 Å²	55.5	52%	0.521	30%	0.295	S	S	.	.	H	α-helix	trans	-63	-45.7	173.7	167.2	0	0	0	0	111.7	G80 L81 T82 V86 V87 V88	G80-V84 WeakPolarHBondContact O-CG2 3.11Å; G80-V84 PolarHBondContact O-N 3.1Å; L81-V84 PolarHBondContact O-N 3.37Å; T82-V84 VanDerWaalsContact C-N 3.28Å; T82-V84 PolarHBondContact O-N 3.32Å; V84-V86 VanDerWaalsContact C-N 3.27Å; V84-V86 PolarHBondContact O-N 3.32Å; V84-V87 PolarHBondContact O-N 2.94Å; V84-V88 HydrophobicContact CG1-CG2 4.15Å; V84-V88 WeakPolarHBondContact O-CB 3.31Å; V84-V88 PolarHBondContact O-N 3.04Å
85	F	88.3	Confident	88.6	Confident	65 Å²	65	58.6 Å²	58.6	29%	0.285	31%	0.306	S	S	.	.	H	α-helix	trans	-67.1	-24.2	176	-79.1	-61.2	0	0	0	113.6	L81 T82 P89 K210 P213	L81-F85 HydrophobicContact CD2-CD2 3.91Å; L81-F85 HydrophobicContact CD2-CE2 3.69Å; L81-F85 WeakPolarHBondContact O-CD2 3.39Å; L81-F85 PolarHBondContact O-N 2.94Å; T82-F85 PolarHBondContact O-N 3.49Å; T82-F85 VanDerWaalsContact O-N 3.12Å; F85-P89 WeakPolarHBondContact O-CD 3.23Å; F85-P89 VanDerWaalsContact O-CG 3.23Å; F85-P89 WeakPolarHBondContact O-CG 3.22Å; F85-K210 WeakPolarHBondContact O-CB 3.38Å; F85-K210 WeakPolarHBondContact O-CD 3.25Å; F85-K210 VanDerWaalsContact O-CG 3.24Å; F85-K210 WeakPolarHBondContact O-CG 3.38Å; F85-P213 HydrophobicContact CD1-CB 3.79Å; F85-P213 HydrophobicContact CD1-CG 4.43Å; F85-P213 HydrophobicContact CE1-CB 3.41Å; F85-P213 VanDerWaalsContact CE1-CB 3.41Å; F85-P213 HydrophobicContact CE1-CG 4.06Å; F85-P213 HydrophobicContact CE2-CB 4.41Å; F85-P213 HydrophobicContact CG-CB 4.46Å; F85-P213 HydrophobicContact CZ-CB 3.77Å
86	V	88.2	Confident	88.7	Confident	26 Å²	26	57.4 Å²	57.4	16%	0.158	30%	0.3	C	S	.	.	H	α-helix	trans	-76.8	-53.2	171	176.4	0	0	0	0	111.4	D63 T82 L83 V84 S90	D63-V86 HydrophobicContact CB-CG2 3.61Å; T82-V86 HydrophobicContact CG2-CG2 4.47Å; T82-V86 WeakPolarHBondContact O-CG2 3.4Å; T82-V86 PolarHBondContact O-N 3.43Å; L83-V86 PolarHBondContact O-N 2.97Å; V84-V86 VanDerWaalsContact C-N 3.27Å; V84-V86 PolarHBondContact O-N 3.32Å; V86-S90 VanDerWaalsContact O-CB 3.23Å; V86-S90 WeakPolarHBondContact O-CB 3.29Å; V86-S90 PolarHBondContact O-N 3.06Å
87	V	89.4	Confident	88.8	Confident	66 Å²	66	50.4 Å²	50.4	40%	0.4	27%	0.273	S	S	.	.	H	α-helix	trans	-78.4	-43.7	-166.3	174.4	0	0	0	0	112.7	L83 V84 S90 A91	L83-V87 HydrophobicContact CD1-CG2 3.82Å; L83-V87 HydrophobicContact CG-CG2 4.13Å; L83-V87 WeakPolarHBondContact O-CB 3.23Å; L83-V87 VanDerWaalsContact O-CG2 3.31Å; L83-V87 WeakPolarHBondContact O-CG2 3.48Å; L83-V87 PolarHBondContact O-N 2.99Å; V84-V87 PolarHBondContact O-N 2.94Å; V87-S90 PolarHBondContact O-N 2.84Å; V87-A91 WeakPolarHBondContact O-CB 3.4Å; V87-A91 PolarHBondContact O-N 2.98Å
88	V	90.8	Very high	88.9	Confident	82 Å²	82	44.1 Å²	44.1	50%	0.497	25%	0.25	S	S	.	.	H	α-helix	trans	-68.2	-47.9	-173.4	177.1	0	0	0	0	111.9	V84 A91 V92	V84-V88 HydrophobicContact CG1-CG2 4.15Å; V84-V88 WeakPolarHBondContact O-CB 3.31Å; V84-V88 PolarHBondContact O-N 3.04Å; V88-A91 PolarHBondContact O-N 3.46Å; V88-V92 WeakPolarHBondContact O-CG2 3.4Å; V88-V92 PolarHBondContact O-N 3.17Å
89	P	90.3	Very high	89.1	Confident	7 Å²	7	48.2 Å²	48.2	5%	0.045	27%	0.266	C	S	.	.	H	α-helix	trans	-63.1	-41.7	174.3	-27.5	40.6	0	0	0	113.2	F85 A91 V92 V93 L209 K210	F85-P89 WeakPolarHBondContact O-CD 3.23Å; F85-P89 VanDerWaalsContact O-CG 3.23Å; F85-P89 WeakPolarHBondContact O-CG 3.22Å; P89-A91 VanDerWaalsContact C-N 3.34Å; P89-A91 PolarHBondContact O-N 3.38Å; P89-V92 PolarHBondContact O-N 3.24Å; P89-V93 VanDerWaalsContact O-CG2 3.3Å; P89-V93 WeakPolarHBondContact O-CG2 3.41Å; P89-V93 PolarHBondContact O-N 3.28Å; P89-L209 HydrophobicContact CB-CB 3.7Å; P89-L209 HydrophobicContact CG-CB 3.87Å; P89-L209 WeakPolarHBondContact CG-O 3.44Å; P89-K210 HydrophobicContact CB-CB 3.79Å; P89-K210 HydrophobicContact CG-CB 3.89Å
90	S	89.6	Confident	89	Confident	10 Å²	10	47.3 Å²	47.3	7%	0.07	26%	0.261	C	S	.	.	H	α-helix	trans	-56.5	-49.2	175.1	178.9	0	0	0	0	110.6	V86 V87 V92 V93 Q94 Q160	V86-S90 VanDerWaalsContact O-CB 3.23Å; V86-S90 WeakPolarHBondContact O-CB 3.29Å; V86-S90 PolarHBondContact O-N 3.06Å; V87-S90 PolarHBondContact O-N 2.84Å; S90-V92 PolarHBondContact O-N 2.97Å; S90-V93 PolarHBondContact O-N 3.35Å; S90-Q94 VanDerWaalsContact O-CB 3.23Å; S90-Q94 WeakPolarHBondContact O-CB 3.4Å; S90-Q94 PolarHBondContact O-N 3.06Å; S90-Q160 PolarHBondContact OG-OE1 2.87Å
91	A	89.6	Confident	88.8	Confident	47 Å²	47	46.7 Å²	46.7	39%	0.388	25%	0.25	S	S	.	.	H	α-helix	trans	-59.5	-42.8	176.7	0	0	0	0	0	113.1	V87 V88 P89 Q94 V95	V87-A91 WeakPolarHBondContact O-CB 3.4Å; V87-A91 PolarHBondContact O-N 2.98Å; V88-A91 PolarHBondContact O-N 3.46Å; P89-A91 VanDerWaalsContact C-N 3.34Å; P89-A91 PolarHBondContact O-N 3.38Å; A91-Q94 PolarHBondContact O-N 3.47Å; A91-V95 WeakPolarHBondContact O-CB 3.44Å; A91-V95 VanDerWaalsContact O-CG2 3.29Å; A91-V95 WeakPolarHBondContact O-CG2 3.31Å; A91-V95 PolarHBondContact O-N 2.91Å
92	V	89.8	Confident	88.8	Confident	60 Å²	60	46.1 Å²	46.1	36%	0.364	25%	0.249	S	C	.	.	H	α-helix	trans	-60.9	-48.5	176.3	168.4	0	0	0	0	111.4	V88 P89 S90 Q94 V95 L96 L205 L209	V88-V92 WeakPolarHBondContact O-CG2 3.4Å; V88-V92 PolarHBondContact O-N 3.17Å; P89-V92 PolarHBondContact O-N 3.24Å; S90-V92 PolarHBondContact O-N 2.97Å; V92-Q94 VanDerWaalsContact C-N 3.33Å; V92-Q94 PolarHBondContact O-N 2.87Å; V92-V95 PolarHBondContact O-N 3.44Å; V92-L96 HydrophobicContact CG1-CD1 4.12Å; V92-L96 WeakPolarHBondContact O-CG 3.4Å; V92-L96 PolarHBondContact O-N 3.22Å; V92-L205 HydrophobicContact CG1-CD2 4.43Å; V92-L209 HydrophobicContact CG1-CD1 4.16Å
93	V	90.6	Very high	88.6	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.1	-36.5	-179.8	177.9	0	0	0	0	110.8	P89 S90 L96 S97 Q163 L202 L205 E206	P89-V93 VanDerWaalsContact O-CG2 3.3Å; P89-V93 WeakPolarHBondContact O-CG2 3.41Å; P89-V93 PolarHBondContact O-N 3.28Å; S90-V93 PolarHBondContact O-N 3.35Å; V93-L96 PolarHBondContact O-N 3.42Å; V93-S97 PolarHBondContact O-N 3.47Å; V93-Q163 HydrophobicContact CG1-CG 4.49Å; V93-L202 HydrophobicContact CG1-CB 3.84Å; V93-L202 HydrophobicContact CG1-CD2 3.84Å; V93-L202 HydrophobicContact CG1-CG 4.34Å; V93-L205 HydrophobicContact CG2-CD2 4.23Å; V93-L205 HydrophobicContact CG2-CG 4.3Å; V93-E206 HydrophobicContact CG2-CB 4.06Å
94	Q	90.3	Very high	88.2	Confident	14 Å²	14	49.1 Å²	49.1	7%	0.065	26%	0.26	C	S	.	.	H	α-helix	trans	-68	-42.2	176.5	-154.8	64.1	52.3	0	0	112.2	S90 A91 V92 L96 S97 F98 H157	S90-Q94 VanDerWaalsContact O-CB 3.23Å; S90-Q94 WeakPolarHBondContact O-CB 3.4Å; S90-Q94 PolarHBondContact O-N 3.06Å; A91-Q94 PolarHBondContact O-N 3.47Å; V92-Q94 VanDerWaalsContact C-N 3.33Å; V92-Q94 PolarHBondContact O-N 2.87Å; Q94-L96 VanDerWaalsContact C-N 3.35Å; Q94-S97 PolarHBondContact O-N 2.74Å; Q94-F98 WeakPolarHBondContact O-CB 3.38Å; Q94-F98 PolarHBondContact O-N 3.38Å; Q94-H157 HydrophobicContact CG-CB 4.16Å; Q94-H157 VanDerWaalsContact CG-O 3.23Å; Q94-H157 WeakPolarHBondContact CG-O 3.4Å; Q94-H157 PolarHBondContact NE2-CD2 3.4Å; Q94-H157 VanDerWaalsContact NE2-CG 3.32Å; Q94-H157 PolarHBondContact NE2-NE2 3.48Å; Q94-H157 PolarHBondContact O-CD2 3.02Å
95	V	89.8	Confident	87.5	Confident	99 Å²	99	49 Å²	49	60%	0.6	25%	0.251	S	S	*	.	H	α-helix	trans	-63.3	-40	173.7	166.7	0	0	0	0	111.2	A91 V92 F98 R99	A91-V95 WeakPolarHBondContact O-CB 3.44Å; A91-V95 VanDerWaalsContact O-CG2 3.29Å; A91-V95 WeakPolarHBondContact O-CG2 3.31Å; A91-V95 PolarHBondContact O-N 2.91Å; V92-V95 PolarHBondContact O-N 3.44Å; V95-F98 PolarHBondContact O-N 3.03Å; V95-R99 WeakPolarHBondContact O-CB 3.48Å; V95-R99 PolarHBondContact O-N 3.43Å
96	L	88.8	Confident	86.9	Confident	41 Å²	41	49 Å²	49	22%	0.215	26%	0.259	C	S	.	.	H	α-helix	trans	-65.1	-45.5	175	-72.9	169.4	0	0	0	112.1	V92 V93 Q94 F98 R99 W100 L202 L205	V92-L96 HydrophobicContact CG1-CD1 4.12Å; V92-L96 WeakPolarHBondContact O-CG 3.4Å; V92-L96 PolarHBondContact O-N 3.22Å; V93-L96 PolarHBondContact O-N 3.42Å; Q94-L96 VanDerWaalsContact C-N 3.35Å; L96-F98 VanDerWaalsContact C-N 3.33Å; L96-F98 PolarHBondContact O-N 3.36Å; L96-R99 PolarHBondContact O-N 2.87Å; L96-W100 VanDerWaalsContact O-CG 3.25Å; L96-W100 PolarHBondContact O-N 2.97Å; L96-L202 HydrophobicContact CB-CD2 4.03Å; L96-L205 HydrophobicContact CD1-CD2 3.38Å
97	S	89.9	Confident	85.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-39	174.7	179.4	0	0	0	0	112.4	V93 Q94 W100 F101 H157 R166	V93-S97 PolarHBondContact O-N 3.47Å; Q94-S97 PolarHBondContact O-N 2.74Å; S97-W100 PolarHBondContact O-N 3.27Å; S97-F101 PolarHBondContact O-N 3.27Å; S97-H157 PolarHBondContact OG-NE2 2.92Å; S97-R166 PolarHBondContact OG-NE 3.47Å; S97-R166 VanDerWaalsContact OG-NE 3.13Å
98	F	88.2	Confident	84	Confident	63 Å²	63	49.3 Å²	49.3	28%	0.276	26%	0.264	S	S	.	.	H	α-helix	trans	-67.9	-45.9	176.6	-168.9	-108.9	0	0	0	111.6	Q94 V95 L96 W100 F101 V102 H157	Q94-F98 WeakPolarHBondContact O-CB 3.38Å; Q94-F98 PolarHBondContact O-N 3.38Å; V95-F98 PolarHBondContact O-N 3.03Å; L96-F98 VanDerWaalsContact C-N 3.33Å; L96-F98 PolarHBondContact O-N 3.36Å; F98-W100 PolarHBondContact O-N 3.27Å; F98-F101 HydrophobicContact CD2-CD1 4.25Å; F98-F101 HydrophobicContact CE2-CD1 4.07Å; F98-F101 HydrophobicContact CE2-CE1 4.38Å; F98-F101 WeakPolarHBondContact O-CB 3.43Å; F98-F101 PolarHBondContact O-N 2.96Å; F98-F101 VanDerWaalsContact O-N 3.08Å; F98-V102 HydrophobicContact CD1-CG2 3.86Å; F98-V102 HydrophobicContact CE1-CG2 3.52Å; F98-V102 HydrophobicContact CE2-CG2 4.45Å; F98-V102 HydrophobicContact CG-CG2 4.46Å; F98-V102 HydrophobicContact CZ-CG2 3.86Å; F98-V102 WeakPolarHBondContact O-CG2 3.37Å; F98-V102 PolarHBondContact O-N 2.93Å; F98-H157 HydrophobicContact CD2-CB 4.2Å; F98-H157 AromaticContact CD2-CD2 3.95Å; F98-H157 AromaticContact CD2-CG 3.88Å; F98-H157 PolarHBondContact N-CD2 3.22Å; F98-H157 PolarHBondContact N-NE2 3.44Å
99	R	88.7	Confident	82.1	Confident	146 Å²	146	47.4 Å²	47.4	55%	0.551	26%	0.261	S	S	*	.	H	α-helix	trans	-57	-39	176.1	-175	175.7	69.1	125.4	-3.1	111.5	V95 L96 Y103	V95-R99 WeakPolarHBondContact O-CB 3.48Å; V95-R99 PolarHBondContact O-N 3.43Å; L96-R99 PolarHBondContact O-N 2.87Å; R99-Y103 WeakPolarHBondContact O-CB 3.33Å; R99-Y103 PolarHBondContact O-N 3.44Å
100	W	86.2	Confident	80.1	Confident	33 Å²	33	49.7 Å²	49.7	13%	0.125	28%	0.281	C	S	.	.	H	α-helix	trans	-65.4	-45.7	173.8	-69.6	-7.5	0	0	0	112.6	L96 S97 F98 Y103 D104 D198 M201 L202	L96-W100 VanDerWaalsContact O-CG 3.25Å; L96-W100 PolarHBondContact O-N 2.97Å; S97-W100 PolarHBondContact O-N 3.27Å; F98-W100 PolarHBondContact O-N 3.27Å; W100-Y103 WeakPolarHBondContact O-CB 3.3Å; W100-Y103 PolarHBondContact O-N 3.47Å; W100-D104 PolarHBondContact O-N 3.27Å; W100-D198 HydrophobicContact CE3-CB 4.24Å; W100-D198 HydrophobicContact CZ3-CB 3.81Å; W100-M201 HydrophobicContact CH2-CE 3.46Å; W100-M201 VanDerWaalsContact CH2-CE 3.46Å; W100-M201 HydrophobicContact CZ2-CE 3.57Å; W100-L202 HydrophobicContact CE3-CD1 4.09Å; W100-L202 HydrophobicContact CE3-CD2 4.24Å; W100-L202 HydrophobicContact CE3-CG 4.24Å; W100-L202 HydrophobicContact CH2-CD1 4.38Å; W100-L202 HydrophobicContact CH2-CD2 3.69Å; W100-L202 HydrophobicContact CH2-CG 3.67Å; W100-L202 HydrophobicContact CZ2-CD2 4.36Å; W100-L202 HydrophobicContact CZ3-CD1 3.59Å; W100-L202 HydrophobicContact CZ3-CD2 3.66Å; W100-L202 HydrophobicContact CZ3-CG 3.38Å
101	F	85.1	Confident	78	Confident	14 Å²	14	54 Å²	54	6%	0.061	30%	0.303	C	S	.	.	H	α-helix	trans	-60.5	-45.8	175	161.8	-97.3	0	0	0	112.7	S97 F98 Y103 D104 Y105 M149 W150 Q153	S97-F101 PolarHBondContact O-N 3.27Å; F98-F101 HydrophobicContact CD2-CD1 4.25Å; F98-F101 HydrophobicContact CE2-CD1 4.07Å; F98-F101 HydrophobicContact CE2-CE1 4.38Å; F98-F101 WeakPolarHBondContact O-CB 3.43Å; F98-F101 PolarHBondContact O-N 2.96Å; F98-F101 VanDerWaalsContact O-N 3.08Å; F101-Y103 VanDerWaalsContact C-N 3.29Å; F101-Y103 PolarHBondContact O-N 3.49Å; F101-D104 PolarHBondContact O-N 3.37Å; F101-Y105 AromaticContact CE2-CD2 3.85Å; F101-Y105 HydrophobicContact CE2-CD2 3.85Å; F101-Y105 HydrophobicContact CE2-CG 4.31Å; F101-Y105 HydrophobicContact CZ-CD2 4.41Å; F101-Y105 HydrophobicContact CZ-CG 4.46Å; F101-Y105 PolarHBondContact O-N 3.23Å; F101-M149 HydrophobicContact CE2-CE 3.45Å; F101-M149 VanDerWaalsContact CE2-CE 3.45Å; F101-M149 HydrophobicContact CE2-SD 4.4Å; F101-M149 HydrophobicContact CZ-CE 3.44Å; F101-M149 VanDerWaalsContact CZ-CE 3.44Å; F101-W150 AromaticContact CE1-CD2 3.91Å; F101-W150 HydrophobicContact CE1-CD2 3.91Å; F101-W150 HydrophobicContact CE1-CE3 4.01Å; F101-W150 HydrophobicContact CE1-CG 4.35Å; F101-W150 HydrophobicContact CE1-CZ2 4.5Å; F101-W150 HydrophobicContact CE1-CZ3 4.36Å; F101-W150 HydrophobicContact CZ-CD2 4.13Å; F101-W150 HydrophobicContact CZ-CG 4.16Å; F101-Q153 HydrophobicContact CB-CG 4.37Å; F101-Q153 HydrophobicContact CD1-CB 4.39Å; F101-Q153 HydrophobicContact CD1-CG 3.65Å; F101-Q153 HydrophobicContact CD2-CB 4.4Å; F101-Q153 HydrophobicContact CD2-CG 3.61Å; F101-Q153 HydrophobicContact CE1-CB 3.99Å; F101-Q153 HydrophobicContact CE1-CG 3.75Å; F101-Q153 HydrophobicContact CE2-CB 3.97Å; F101-Q153 HydrophobicContact CE2-CG 3.69Å; F101-Q153 HydrophobicContact CG-CG 3.58Å; F101-Q153 HydrophobicContact CZ-CB 3.76Å; F101-Q153 HydrophobicContact CZ-CG 3.77Å
102	V	85.6	Confident	75.9	Confident	42 Å²	42	55 Å²	55	26%	0.255	31%	0.311	S	S	.	.	H	α-helix	trans	-55.9	-48	174.9	167.3	0	0	0	0	109.8	F98 D104 Y105 S106 W150	F98-V102 HydrophobicContact CD1-CG2 3.86Å; F98-V102 HydrophobicContact CE1-CG2 3.52Å; F98-V102 HydrophobicContact CE2-CG2 4.45Å; F98-V102 HydrophobicContact CG-CG2 4.46Å; F98-V102 HydrophobicContact CZ-CG2 3.86Å; F98-V102 WeakPolarHBondContact O-CG2 3.37Å; F98-V102 PolarHBondContact O-N 2.93Å; V102-D104 PolarHBondContact O-N 2.84Å; V102-Y105 PolarHBondContact O-N 3.42Å; V102-S106 VanDerWaalsContact O-CB 3.31Å; V102-S106 WeakPolarHBondContact O-CB 3.25Å; V102-S106 PolarHBondContact O-N 3.25Å; V102-S106 PolarHBondContact O-OG 3.27Å; V102-S106 VanDerWaalsContact O-OG 3.09Å; V102-W150 HydrophobicContact CB-CH2 4.28Å; V102-W150 HydrophobicContact CG1-CH2 4.15Å; V102-W150 HydrophobicContact CG2-CH2 3.91Å; V102-W150 HydrophobicContact CG2-CZ3 3.93Å
103	Y	81.3	Confident	73.5	Confident	81 Å²	81	57.1 Å²	57.1	32%	0.318	32%	0.324	S	S	.	.	H	α-helix	trans	-60.7	-43.7	176.9	-163.5	-82.5	0	0	0	112.5	R99 W100 F101 Y105 R536 R537 K540	R99-Y103 WeakPolarHBondContact O-CB 3.33Å; R99-Y103 PolarHBondContact O-N 3.44Å; W100-Y103 WeakPolarHBondContact O-CB 3.3Å; W100-Y103 PolarHBondContact O-N 3.47Å; F101-Y103 VanDerWaalsContact C-N 3.29Å; F101-Y103 PolarHBondContact O-N 3.49Å; Y103-Y105 VanDerWaalsContact C-N 3.33Å; Y103-Y105 PolarHBondContact O-N 2.85Å; Y103-R536 HydrophobicContact CD1-CB 3.58Å; Y103-R536 HydrophobicContact CD1-CG 4.35Å; Y103-R536 HydrophobicContact CE1-CB 3.59Å; Y103-R537 HydrophobicContact CE1-CG 4.01Å; Y103-R537 WeakPolarHBondContact OH-CD 3.26Å; Y103-R537 WeakPolarHBondContact OH-CG 3.49Å; Y103-R537 PolarHBondContact OH-NE 3.33Å; Y103-K540 PolarHBondContact O-NZ 3.49Å
104	D	80.4	Confident	71	Confident	50 Å²	50	59.6 Å²	59.6	27%	0.267	35%	0.345	S	S	.	.	H	α-helix	trans	-61.6	-42.2	179.2	-66.4	-25.2	0	0	0	111.1	W100 F101 V102 R536 K540	W100-D104 PolarHBondContact O-N 3.27Å; F101-D104 PolarHBondContact O-N 3.37Å; V102-D104 PolarHBondContact O-N 2.84Å; D104-R536 WeakPolarHBondContact OD1-CD 3.42Å; D104-R536 IonicContact OD1-CZ 3Å; D104-R536 IonicContact OD1-NE 2.69Å; D104-R536 IonicContact OD1-NH1 3.33Å; D104-R536 PolarHBondContact OD1-NH1 3.25Å; D104-R536 IonicContact OD2-CZ 2.82Å; D104-R536 IonicContact OD2-NH1 2.79Å; D104-R536 PolarHBondContact OD2-NH1 3.1Å; D104-K540 VanDerWaalsContact O-CE 3.29Å; D104-K540 WeakPolarHBondContact O-CE 3.48Å; D104-K540 PolarHBondContact O-NZ 3.22Å
105	Y	77.1	Confident	68.5	Low	83 Å²	83	61.5 Å²	61.5	33%	0.325	37%	0.368	S	S	.	.	H	α-helix	trans	-89.7	-25.8	-173.7	-123.5	-87.2	0	0	0	116	F101 V102 Y103 A108 G109 T146 M149 W150	F101-Y105 AromaticContact CE2-CD2 3.85Å; F101-Y105 HydrophobicContact CE2-CD2 3.85Å; F101-Y105 HydrophobicContact CE2-CG 4.31Å; F101-Y105 HydrophobicContact CZ-CD2 4.41Å; F101-Y105 HydrophobicContact CZ-CG 4.46Å; F101-Y105 PolarHBondContact O-N 3.23Å; V102-Y105 PolarHBondContact O-N 3.42Å; Y103-Y105 VanDerWaalsContact C-N 3.33Å; Y103-Y105 PolarHBondContact O-N 2.85Å; Y105-A108 PolarHBondContact O-N 2.92Å; Y105-G109 PolarHBondContact O-N 3.18Å; Y105-T146 HydrophobicContact CD1-CG2 4.36Å; Y105-T146 HydrophobicContact CE1-CG2 4.07Å; Y105-M149 HydrophobicContact CD1-CE 4.13Å; Y105-M149 HydrophobicContact CD2-CE 3.66Å; Y105-M149 HydrophobicContact CD2-SD 4.18Å; Y105-M149 HydrophobicContact CE1-CE 3.83Å; Y105-M149 HydrophobicContact CE1-SD 4.42Å; Y105-M149 HydrophobicContact CE2-CE 3.34Å; Y105-M149 HydrophobicContact CE2-SD 3.34Å; Y105-M149 WeakPolarHBondContact CE2-SD 3.39Å; Y105-M149 HydrophobicContact CG-CE 4.03Å; Y105-M149 VanDerWaalsContact CZ-CE 3.41Å; Y105-M149 PolarHBondContact OH-SD 3.47Å; Y105-M149 VanDerWaalsContact OH-SD 3.36Å; Y105-W150 AromaticContact CD1-NE1 3.43Å; Y105-W150 AromaticContact CG-NE1 3.8Å
106	S	75.2	Confident	66.1	Low	65 Å²	65	63.9 Å²	63.9	46%	0.455	38%	0.378	S	S	.	.	H	α-helix	trans	-68.8	-47.4	-177.9	-73.3	0	0	0	0	113	V102 A108 G109	V102-S106 VanDerWaalsContact O-CB 3.31Å; V102-S106 WeakPolarHBondContact O-CB 3.25Å; V102-S106 PolarHBondContact O-N 3.25Å; V102-S106 PolarHBondContact O-OG 3.27Å; V102-S106 VanDerWaalsContact O-OG 3.09Å; S106-A108 PolarHBondContact O-N 3.39Å; S106-G109 PolarHBondContact O-N 3.26Å
107	D	59.6	Low	63.6	Low	50 Å²	50	66.2 Å²	66.2	27%	0.267	40%	0.397	S	S	.	.	H	α-helix	trans	-63.9	-32.5	176.1	-55	-43.5	0	0	0	111.6	G109 A110 D111 K540	D107-G109 PolarHBondContact O-N 3.4Å; D107-A110 WeakPolarHBondContact O-CA 3.34Å; D107-A110 WeakPolarHBondContact O-CB 3.47Å; D107-A110 PolarHBondContact O-N 3.33Å; D107-D111 PolarHBondContact O-N 2.93Å; D107-D111 VanDerWaalsContact O-N 3.12Å; D107-K540 IonicContact OD2-NZ 3.21Å; D107-K540 PolarHBondContact OD2-NZ 3.4Å
108	A	56.8	Low	61	Low	48 Å²	48	71.6 Å²	71.6	40%	0.397	43%	0.43	S	S	.	.	H	α-helix	trans	-64.3	-24.6	-178.6	0	0	0	0	0	112.7	Y105 S106 A112	Y105-A108 PolarHBondContact O-N 2.92Å; S106-A108 PolarHBondContact O-N 3.39Å; A108-A112 WeakPolarHBondContact O-CB 3.33Å
109	G	50.8	Low	58.4	Low	43 Å²	43	76.1 Å²	76.1	44%	0.443	46%	0.456	S	S	.	.	H	α-helix	trans	-73.8	-31.2	169.5	0	0	0	0	0	113.6	Y105 S106 D107 T113	Y105-G109 PolarHBondContact O-N 3.18Å; S106-G109 PolarHBondContact O-N 3.26Å; D107-G109 PolarHBondContact O-N 3.4Å; G109-T113 PolarHBondContact O-N 2.76Å; G109-T113 PolarHBondContact O-OG1 2.92Å
110	A	48.3	Very low	55.7	Low	55 Å²	55	74.5 Å²	74.5	46%	0.455	47%	0.467	S	S	.	.	H	α-helix	trans	-73.5	-49.9	179.8	0	0	0	0	0	111.6	D107 A112 T113 A114	D107-A110 WeakPolarHBondContact O-CA 3.34Å; D107-A110 WeakPolarHBondContact O-CB 3.47Å; D107-A110 PolarHBondContact O-N 3.33Å; A110-A112 PolarHBondContact O-N 3.41Å; A110-T113 PolarHBondContact O-N 3Å; A110-T113 PolarHBondContact O-OG1 3.2Å; A110-A114 PolarHBondContact O-N 3.28Å
111	D	45.5	Very low	53.2	Low	101 Å²	101	79 Å²	79	54%	0.54	50%	0.499	S	S	.	.	H	α-helix	trans	-57.3	-39.8	176.9	-71.9	-26.2	0	0	0	111.5	D107 T113 A114 G115	D107-D111 PolarHBondContact O-N 2.93Å; D107-D111 VanDerWaalsContact O-N 3.12Å; D111-T113 PolarHBondContact O-N 3.25Å; D111-A114 PolarHBondContact O-N 2.71Å; D111-G115 PolarHBondContact O-N 2.67Å
112	A	45	Very low	50.8	Low	67 Å²	67	87.2 Å²	87.2	55%	0.554	54%	0.535	S	S	*	.	H	α-helix	trans	-66.8	-18.5	177.1	0	0	0	0	0	114.3	A108 A110	A108-A112 WeakPolarHBondContact O-CB 3.33Å; A110-A112 PolarHBondContact O-N 3.41Å
113	T	39.6	Very low	48.4	Very low	105 Å²	105	92.3 Å²	92.3	64%	0.644	56%	0.56	S	S	*	*	H	α-helix	trans	-95.4	-26.3	171.5	51.6	0	0	0	0	113.4	G109 A110 D111	G109-T113 PolarHBondContact O-N 2.76Å; G109-T113 PolarHBondContact O-OG1 2.92Å; A110-T113 PolarHBondContact O-N 3Å; A110-T113 PolarHBondContact O-OG1 3.2Å; D111-T113 PolarHBondContact O-N 3.25Å
114	A	38.9	Very low	46.3	Very low	52 Å²	52	94.6 Å²	94.6	43%	0.43	59%	0.588	S	S	.	*	H	α-helix	trans	-72.7	-42.1	174.5	0	0	0	0	0	111.7	A110 D111 D116 S117	A110-A114 PolarHBondContact O-N 3.28Å; D111-A114 PolarHBondContact O-N 2.71Å; A114-D116 PolarHBondContact O-N 3.29Å; A114-S117 PolarHBondContact O-N 2.72Å; A114-S117 VanDerWaalsContact O-N 3.16Å; A114-S117 PolarHBondContact O-OG 2.96Å
115	G	38.1	Very low	44.2	Very low	54 Å²	54	99.8 Å²	99.8	56%	0.557	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-21.6	-176.6	0	0	0	0	0	115.5	D111	D111-G115 PolarHBondContact O-N 2.67Å
116	D	38.3	Very low	42.2	Very low	149 Å²	149	103.8 Å²	103.8	80%	0.797	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-8.8	-179.8	-130.8	27.4	0	0	0	112.9	A114	A114-D116 PolarHBondContact O-N 3.29Å
117	S	36	Very low	40	Very low	89 Å²	89	109.8 Å²	109.8	62%	0.622	66%	0.658	S	S	*	*	S	Bend	trans	-107.1	-1.5	-174.3	62.6	0	0	0	0	115.2	A114	A114-S117 PolarHBondContact O-N 2.72Å; A114-S117 VanDerWaalsContact O-N 3.16Å; A114-S117 PolarHBondContact O-OG 2.96Å
118	T	35.5	Very low	39	Very low	114 Å²	114	111.4 Å²	111.4	70%	0.699	69%	0.687	S	S	*	*	S	Bend	trans	-118.7	16.9	-171.3	50.2	0	0	0	0	115.4
119	L	35.3	Very low	37.7	Very low	157 Å²	157	112.4 Å²	112.4	82%	0.822	70%	0.701	S	S	*	*			trans	-122.6	56.7	169.9	-159.9	73.9	0	0	0	113
120	S	31.9	Very low	37.2	Very low	112 Å²	112	119 Å²	119	78%	0.783	73%	0.726	S	S	*	*			trans	-122.3	77.5	162.3	-163.3	0	0	0	0	109.5	K122	S120-K122 PolarHBondContact O-N 3.36Å
121	T	32.3	Very low	36.4	Very low	129 Å²	129	120.7 Å²	120.7	79%	0.791	74%	0.74	S	S	*	*			trans	-71.1	94.4	168.8	46.9	0	0	0	0	108.7	D123	T121-D123 PolarHBondContact O-N 3.38Å; T121-D123 VanDerWaalsContact O-N 3.14Å
122	K	36.1	Very low	35.9	Very low	186 Å²	186	121.5 Å²	121.5	81%	0.809	75%	0.751	S	S	*	*			trans	-57.5	109.7	166.7	172.8	-168.2	172.6	-175.4	0	109.3	S120	S120-K122 PolarHBondContact O-N 3.36Å
123	D	34.9	Very low	35.5	Very low	148 Å²	148	122.6 Å²	122.6	79%	0.791	76%	0.76	S	S	*	*			trans	-175.2	108	149.8	-93	-23.2	0	0	0	110.7	T121	T121-D123 PolarHBondContact O-N 3.38Å; T121-D123 VanDerWaalsContact O-N 3.14Å
124	S	37.1	Very low	35.4	Very low	129 Å²	129	124.3 Å²	124.3	90%	0.902	77%	0.77	S	S	*	*			trans	169.6	126.5	154	-79.8	0	0	0	0	109.7
125	D	35.6	Very low	35.2	Very low	159 Å²	159	128 Å²	128	85%	0.85	78%	0.783	S	S	*	*			trans	-86.1	131.6	177.1	-96.5	-55.6	0	0	0	113
126	Q	35.1	Very low	35.3	Very low	168 Å²	168	129.7 Å²	129.7	79%	0.785	79%	0.791	S	S	*	*			trans	54.8	95.4	139.3	-161	175	116.2	0	0	119.4
127	H	29.9	Very low	35.3	Very low	191 Å²	191	125.2 Å²	125.2	88%	0.884	78%	0.775	S	S	*	*			trans	-147.6	146.6	130.8	-113	65.6	0	0	0	111.1
128	G	39	Very low	35.3	Very low	84 Å²	84	127.2 Å²	127.2	87%	0.866	78%	0.779	S	S	*	*			trans	-85.9	135.5	-173.4	0	0	0	0	0	113.8
129	G	28.8	Very low	35.9	Very low	68 Å²	68	125.3 Å²	125.3	70%	0.701	77%	0.767	S	S	*	*			trans	-169.5	133	171.8	0	0	0	0	0	111.8	A131	G129-A131 PolarHBondContact O-N 3.01Å
130	N	40.7	Very low	36.5	Very low	182 Å²	182	122.2 Å²	122.2	97%	0.973	76%	0.755	S	S	*	*			trans	-72.6	107.4	-178.6	-72.9	-11.4	0	0	0	111
131	A	30.3	Very low	37.3	Very low	90 Å²	90	120.6 Å²	120.6	74%	0.744	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-95.1	140.1	165.1	0	0	0	0	0	110.3	G129	G129-A131 PolarHBondContact O-N 3.01Å
132	P	36.5	Very low	38.6	Very low	119 Å²	119	123.7 Å²	123.7	77%	0.773	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-71.7	146.9	-177.8	29.8	-35.1	0	0	0	111.8	V134	P132-V134 PolarHBondContact O-N 2.71Å
133	A	35.2	Very low	39.8	Very low	89 Å²	89	123.2 Å²	123.2	74%	0.736	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-60.7	120.9	175.4	0	0	0	0	0	111	N135	A133-N135 PolarHBondContact O-N 3.13Å; A133-N135 VanDerWaalsContact O-N 3.12Å
134	V	37.6	Very low	41.3	Very low	141 Å²	141	119.7 Å²	119.7	86%	0.855	72%	0.718	S	S	*	*			trans	-69.4	109.9	174.3	177.3	0	0	0	0	108.4	P132 A136	P132-V134 PolarHBondContact O-N 2.71Å; V134-A136 PolarHBondContact O-N 2.71Å
135	N	35.3	Very low	43.2	Very low	131 Å²	131	117.5 Å²	117.5	70%	0.701	70%	0.702	S	S	*	*			trans	-57.1	128.8	-174.6	-74.9	-53.4	0	0	0	112.5	A133 A137	A133-N135 PolarHBondContact O-N 3.13Å; A133-N135 VanDerWaalsContact O-N 3.12Å; N135-A137 HydrophobicContact CB-CB 4.44Å; N135-A137 PolarHBondContact O-N 3.02Å
136	A	39	Very low	45.3	Very low	89 Å²	89	112.5 Å²	112.5	74%	0.736	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-66.1	9.3	176.8	0	0	0	0	0	115	V134 N138	V134-A136 PolarHBondContact O-N 2.71Å; A136-N138 VanDerWaalsContact C-N 3.34Å; A136-N138 PolarHBondContact O-N 2.91Å
137	A	38.9	Very low	47.6	Very low	55 Å²	55	109.8 Å²	109.8	46%	0.455	67%	0.667	S	S	.	*	G	3₁₀ helix	trans	-64.9	-32.1	-177.8	0	0	0	0	0	113.4	N135 V139 T140 P141	N135-A137 HydrophobicContact CB-CB 4.44Å; N135-A137 PolarHBondContact O-N 3.02Å; A137-V139 PolarHBondContact O-N 3.18Å; A137-V139 VanDerWaalsContact O-N 3.14Å; A137-T140 PolarHBondContact O-N 2.98Å; A137-T140 VanDerWaalsContact O-N 3.16Å; A137-T140 PolarHBondContact O-OG1 3.49Å; A137-P141 WeakPolarHBondContact O-CD 3.48Å
138	N	37.3	Very low	50.3	Low	130 Å²	130	104.3 Å²	104.3	70%	0.695	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-71.3	-8.3	-171.8	-72.6	-7.3	0	0	0	115.1	A136 P141	A136-N138 VanDerWaalsContact C-N 3.34Å; A136-N138 PolarHBondContact O-N 2.91Å; N138-P141 WeakPolarHBondContact O-CD 3.37Å
139	V	47.9	Very low	52.4	Low	75 Å²	75	102.7 Å²	102.7	46%	0.455	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-80.2	-26.7	174	-176.7	0	0	0	0	111.8	A137 R143	A137-V139 PolarHBondContact O-N 3.18Å; A137-V139 VanDerWaalsContact O-N 3.14Å; V139-R143 PolarHBondContact O-N 2.85Å
140	T	47.9	Very low	55.3	Low	92 Å²	92	103.1 Å²	103.1	56%	0.564	60%	0.6	S	S	*	*	H	α-helix	trans	-66.3	-43.1	-176.8	65.4	0	0	0	0	115.8	A137 R142 R143 C144	A137-T140 PolarHBondContact O-N 2.98Å; A137-T140 VanDerWaalsContact O-N 3.16Å; A137-T140 PolarHBondContact O-OG1 3.49Å; T140-R142 VanDerWaalsContact C-N 3.32Å; T140-R142 PolarHBondContact O-N 2.92Å; T140-R143 PolarHBondContact O-N 2.91Å; T140-C144 PolarHBondContact O-N 2.68Å
141	P	47.7	Very low	57.5	Low	78 Å²	78	98.4 Å²	98.4	51%	0.506	58%	0.578	S	S	.	*	H	α-helix	trans	-65.7	-33.4	-178.7	25.1	-35.5	0	0	0	112.7	A137 N138 C145	A137-P141 WeakPolarHBondContact O-CD 3.48Å; N138-P141 WeakPolarHBondContact O-CD 3.37Å; P141-C145 VanDerWaalsContact O-CB 3.32Å; P141-C145 WeakPolarHBondContact O-CB 3.07Å; P141-C145 PolarHBondContact O-N 3.16Å
142	R	58.9	Low	60.3	Low	194 Å²	194	98.5 Å²	98.5	73%	0.732	56%	0.561	S	S	*	*	H	α-helix	trans	-62.4	-50.3	174.2	-73.2	-177	173.7	174.2	-1.1	110.9	T140 C144 C145 T146	T140-R142 VanDerWaalsContact C-N 3.32Å; T140-R142 PolarHBondContact O-N 2.92Å; R142-C144 PolarHBondContact O-N 3.3Å; R142-C145 PolarHBondContact O-N 3Å; R142-T146 PolarHBondContact O-N 3.31Å; R142-T146 PolarHBondContact O-OG1 3.22Å; R142-T146 VanDerWaalsContact O-OG1 3.08Å
143	R	62.7	Low	62.7	Low	175 Å²	175	93.4 Å²	93.4	66%	0.66	53%	0.527	S	S	*	.	H	α-helix	trans	-61.1	-42.6	178.2	-70.1	-176	178	-177.3	0.2	112.6	V139 T140 T146 I147	V139-R143 PolarHBondContact O-N 2.85Å; T140-R143 PolarHBondContact O-N 2.91Å; R143-T146 PolarHBondContact O-N 3.44Å; R143-I147 VanDerWaalsContact O-CG1 3.31Å; R143-I147 WeakPolarHBondContact O-CG1 3.49Å; R143-I147 PolarHBondContact O-N 3.48Å
144	C	66.4	Low	65.2	Low	74 Å²	74	91.8 Å²	91.8	50%	0.5	51%	0.508	S	S	.	.	H	α-helix	trans	-60.7	-48.9	176.1	-170.8	0	0	0	0	111.4	T140 R142 T146 I147 C148	T140-C144 PolarHBondContact O-N 2.68Å; R142-C144 PolarHBondContact O-N 3.3Å; C144-T146 PolarHBondContact O-N 3.46Å; C144-I147 PolarHBondContact O-N 2.87Å; C144-C148 WeakPolarHBondContact O-CB 3.34Å; C144-C148 PolarHBondContact O-N 2.91Å; C144-C148 PolarHBondContact O-SG 3.28Å; C144-C148 VanDerWaalsContact O-SG 3.34Å
145	C	77.6	Confident	67.7	Low	84 Å²	84	88.6 Å²	88.6	57%	0.568	49%	0.489	S	S	*	.	H	α-helix	trans	-57.9	-44.5	176.6	-172.5	0	0	0	0	112.4	P141 R142 C148 M149	P141-C145 VanDerWaalsContact O-CB 3.32Å; P141-C145 WeakPolarHBondContact O-CB 3.07Å; P141-C145 PolarHBondContact O-N 3.16Å; R142-C145 PolarHBondContact O-N 3Å; C145-C148 PolarHBondContact O-N 3.32Å; C145-M149 WeakPolarHBondContact O-CB 3.24Å; C145-M149 PolarHBondContact O-N 3.14Å
146	T	79.5	Confident	70.3	Confident	54 Å²	54	83.4 Å²	83.4	33%	0.331	46%	0.461	S	S	.	.	H	α-helix	trans	-59.1	-49.1	174.6	-56.2	0	0	0	0	111.8	Y105 R142 R143 C144 M149 W150	Y105-T146 HydrophobicContact CD1-CG2 4.36Å; Y105-T146 HydrophobicContact CE1-CG2 4.07Å; R142-T146 PolarHBondContact O-N 3.31Å; R142-T146 PolarHBondContact O-OG1 3.22Å; R142-T146 VanDerWaalsContact O-OG1 3.08Å; R143-T146 PolarHBondContact O-N 3.44Å; C144-T146 PolarHBondContact O-N 3.46Å; T146-M149 PolarHBondContact O-N 2.99Å; T146-W150 VanDerWaalsContact O-CD1 3.27Å; T146-W150 PolarHBondContact O-N 3.35Å
147	I	82.6	Confident	72.6	Confident	111 Å²	111	79.8 Å²	79.8	57%	0.569	43%	0.429	S	S	*	.	H	α-helix	trans	-61.3	-48.5	179.5	-68	164.2	0	0	0	110.6	R143 C144 M149 W150 V151	R143-I147 VanDerWaalsContact O-CG1 3.31Å; R143-I147 WeakPolarHBondContact O-CG1 3.49Å; R143-I147 PolarHBondContact O-N 3.48Å; C144-I147 PolarHBondContact O-N 2.87Å; I147-M149 VanDerWaalsContact C-N 3.3Å; I147-M149 PolarHBondContact O-N 3.14Å; I147-W150 PolarHBondContact O-N 2.93Å; I147-V151 HydrophobicContact CG2-CG2 4.42Å; I147-V151 WeakPolarHBondContact O-CG2 3.08Å; I147-V151 PolarHBondContact O-N 3.35Å
148	C	85.8	Confident	74.9	Confident	75 Å²	75	82.7 Å²	82.7	51%	0.507	44%	0.441	S	S	.	.	H	α-helix	trans	-58.2	-41.3	177.7	-70	0	0	0	0	112.3	C144 C145 V151 F152	C144-C148 WeakPolarHBondContact O-CB 3.34Å; C144-C148 PolarHBondContact O-N 2.91Å; C144-C148 PolarHBondContact O-SG 3.28Å; C144-C148 VanDerWaalsContact O-SG 3.34Å; C145-C148 PolarHBondContact O-N 3.32Å; C148-V151 PolarHBondContact O-N 3.23Å; C148-F152 VanDerWaalsContact O-CB 3.27Å; C148-F152 WeakPolarHBondContact O-CB 3.37Å; C148-F152 PolarHBondContact O-N 2.98Å
149	M	84.8	Confident	77.2	Confident	51 Å²	51	81.6 Å²	81.6	25%	0.251	43%	0.434	S	S	.	.	H	α-helix	trans	-75	-32.9	-180	-169.7	-127.9	55.9	0	0	112.5	F101 Y105 C145 T146 I147 Q153	F101-M149 HydrophobicContact CE2-CE 3.45Å; F101-M149 VanDerWaalsContact CE2-CE 3.45Å; F101-M149 HydrophobicContact CE2-SD 4.4Å; F101-M149 HydrophobicContact CZ-CE 3.44Å; F101-M149 VanDerWaalsContact CZ-CE 3.44Å; Y105-M149 HydrophobicContact CD1-CE 4.13Å; Y105-M149 HydrophobicContact CD2-CE 3.66Å; Y105-M149 HydrophobicContact CD2-SD 4.18Å; Y105-M149 HydrophobicContact CE1-CE 3.83Å; Y105-M149 HydrophobicContact CE1-SD 4.42Å; Y105-M149 HydrophobicContact CE2-CE 3.34Å; Y105-M149 HydrophobicContact CE2-SD 3.34Å; Y105-M149 WeakPolarHBondContact CE2-SD 3.39Å; Y105-M149 HydrophobicContact CG-CE 4.03Å; Y105-M149 VanDerWaalsContact CZ-CE 3.41Å; Y105-M149 PolarHBondContact OH-SD 3.47Å; Y105-M149 VanDerWaalsContact OH-SD 3.36Å; C145-M149 WeakPolarHBondContact O-CB 3.24Å; C145-M149 PolarHBondContact O-N 3.14Å; T146-M149 PolarHBondContact O-N 2.99Å; I147-M149 VanDerWaalsContact C-N 3.3Å; I147-M149 PolarHBondContact O-N 3.14Å; M149-Q153 WeakPolarHBondContact O-CB 3.45Å; M149-Q153 PolarHBondContact O-N 2.84Å
150	W	87.8	Confident	79	Confident	76 Å²	76	82.2 Å²	82.2	29%	0.288	43%	0.432	S	S	.	.	H	α-helix	trans	-65	-42.9	169.3	-90	74.6	0	0	0	112.1	F101 V102 Y105 T146 I147 T154	F101-W150 AromaticContact CE1-CD2 3.91Å; F101-W150 HydrophobicContact CE1-CD2 3.91Å; F101-W150 HydrophobicContact CE1-CE3 4.01Å; F101-W150 HydrophobicContact CE1-CG 4.35Å; F101-W150 HydrophobicContact CE1-CZ2 4.5Å; F101-W150 HydrophobicContact CE1-CZ3 4.36Å; F101-W150 HydrophobicContact CZ-CD2 4.13Å; F101-W150 HydrophobicContact CZ-CG 4.16Å; V102-W150 HydrophobicContact CB-CH2 4.28Å; V102-W150 HydrophobicContact CG1-CH2 4.15Å; V102-W150 HydrophobicContact CG2-CH2 3.91Å; V102-W150 HydrophobicContact CG2-CZ3 3.93Å; Y105-W150 AromaticContact CD1-NE1 3.43Å; Y105-W150 AromaticContact CG-NE1 3.8Å; T146-W150 VanDerWaalsContact O-CD1 3.27Å; T146-W150 PolarHBondContact O-N 3.35Å; I147-W150 PolarHBondContact O-N 2.93Å; W150-T154 VanDerWaalsContact O-CB 3.32Å; W150-T154 WeakPolarHBondContact O-CB 3.5Å; W150-T154 PolarHBondContact O-N 2.9Å; W150-T154 PolarHBondContact O-OG1 3.27Å
151	V	87.9	Confident	80.9	Confident	84 Å²	84	81.2 Å²	81.2	51%	0.509	42%	0.423	S	S	.	.	H	α-helix	trans	-62.3	-49.2	174.3	170.1	0	0	0	0	110.4	I147 C148 Q153 T154 V155	I147-V151 HydrophobicContact CG2-CG2 4.42Å; I147-V151 WeakPolarHBondContact O-CG2 3.08Å; I147-V151 PolarHBondContact O-N 3.35Å; C148-V151 PolarHBondContact O-N 3.23Å; V151-Q153 PolarHBondContact O-N 2.97Å; V151-T154 PolarHBondContact O-N 2.99Å; V151-V155 HydrophobicContact CG1-CG2 4.42Å; V151-V155 WeakPolarHBondContact O-CG2 3.41Å; V151-V155 PolarHBondContact O-N 3.35Å
152	F	88.2	Confident	82.7	Confident	91 Å²	91	77.5 Å²	77.5	40%	0.399	40%	0.399	S	S	.	.	H	α-helix	trans	-55.4	-49.3	176.8	173.4	-105.8	0	0	0	112.2	C148 T154 V155 L156 W165	C148-F152 VanDerWaalsContact O-CB 3.27Å; C148-F152 WeakPolarHBondContact O-CB 3.37Å; C148-F152 PolarHBondContact O-N 2.98Å; F152-T154 PolarHBondContact O-N 3.3Å; F152-V155 PolarHBondContact O-N 3.3Å; F152-L156 HydrophobicContact CD1-CD1 3.92Å; F152-L156 HydrophobicContact CE1-CD1 3.38Å; F152-L156 HydrophobicContact CE1-CG 4.32Å; F152-L156 HydrophobicContact CE2-CD1 4.2Å; F152-L156 HydrophobicContact CE2-CG 4.35Å; F152-L156 HydrophobicContact CZ-CD1 3.55Å; F152-L156 HydrophobicContact CZ-CG 4.18Å; F152-L156 WeakPolarHBondContact O-CG 3.34Å; F152-L156 PolarHBondContact O-N 3.14Å; F152-W165 HydrophobicContact CE1-CD2 4.29Å; F152-W165 HydrophobicContact CE1-CE3 4.11Å; F152-W165 AromaticContact CE1-CH2 3.79Å; F152-W165 HydrophobicContact CE1-CH2 3.79Å; F152-W165 AromaticContact CE1-CZ2 3.96Å; F152-W165 HydrophobicContact CE1-CZ2 3.96Å; F152-W165 AromaticContact CE1-CZ3 3.87Å; F152-W165 HydrophobicContact CE1-CZ3 3.87Å; F152-W165 HydrophobicContact CZ-CE3 4.06Å; F152-W165 HydrophobicContact CZ-CH2 4.07Å; F152-W165 AromaticContact CZ-CZ3 3.75Å; F152-W165 HydrophobicContact CZ-CZ3 3.75Å
153	Q	87.5	Confident	84.1	Confident	13 Å²	13	68.7 Å²	68.7	6%	0.061	37%	0.366	C	S	.	.	H	α-helix	trans	-66	-38	178.9	-172.8	78.2	-32.5	0	0	112.2	F101 M149 V151 L156 H157	F101-Q153 HydrophobicContact CB-CG 4.37Å; F101-Q153 HydrophobicContact CD1-CB 4.39Å; F101-Q153 HydrophobicContact CD1-CG 3.65Å; F101-Q153 HydrophobicContact CD2-CB 4.4Å; F101-Q153 HydrophobicContact CD2-CG 3.61Å; F101-Q153 HydrophobicContact CE1-CB 3.99Å; F101-Q153 HydrophobicContact CE1-CG 3.75Å; F101-Q153 HydrophobicContact CE2-CB 3.97Å; F101-Q153 HydrophobicContact CE2-CG 3.69Å; F101-Q153 HydrophobicContact CG-CG 3.58Å; F101-Q153 HydrophobicContact CZ-CB 3.76Å; F101-Q153 HydrophobicContact CZ-CG 3.77Å; M149-Q153 WeakPolarHBondContact O-CB 3.45Å; M149-Q153 PolarHBondContact O-N 2.84Å; V151-Q153 PolarHBondContact O-N 2.97Å; Q153-L156 PolarHBondContact O-N 2.92Å; Q153-H157 PolarHBondContact NE2-CE1 3.01Å; Q153-H157 PolarHBondContact O-N 3.49Å; Q153-H157 PolarHBondContact O-ND1 3.36Å
154	T	87.6	Confident	85.3	Confident	54 Å²	54	61.4 Å²	61.4	33%	0.331	34%	0.341	S	S	.	.	H	α-helix	trans	-64	-44.6	175.6	-57.1	0	0	0	0	110.7	W150 V151 F152 H157 V158	W150-T154 VanDerWaalsContact O-CB 3.32Å; W150-T154 WeakPolarHBondContact O-CB 3.5Å; W150-T154 PolarHBondContact O-N 2.9Å; W150-T154 PolarHBondContact O-OG1 3.27Å; V151-T154 PolarHBondContact O-N 2.99Å; F152-T154 PolarHBondContact O-N 3.3Å; T154-H157 PolarHBondContact O-N 3.41Å; T154-H157 VanDerWaalsContact O-N 3.1Å; T154-V158 WeakPolarHBondContact O-CG2 3.34Å; T154-V158 PolarHBondContact O-N 3.09Å
155	V	89.6	Confident	86.4	Confident	75 Å²	75	62.6 Å²	62.6	46%	0.455	34%	0.335	S	S	.	.	H	α-helix	trans	-60.3	-45.6	174	169.6	0	0	0	0	111	V151 F152 H157 V158 L159	V151-V155 HydrophobicContact CG1-CG2 4.42Å; V151-V155 WeakPolarHBondContact O-CG2 3.41Å; V151-V155 PolarHBondContact O-N 3.35Å; F152-V155 PolarHBondContact O-N 3.3Å; V155-H157 PolarHBondContact O-N 3.14Å; V155-V158 PolarHBondContact O-N 2.87Å; V155-L159 HydrophobicContact CG1-CD1 3.75Å; V155-L159 HydrophobicContact CG1-CG 4.34Å; V155-L159 WeakPolarHBondContact O-CB 3.22Å; V155-L159 VanDerWaalsContact O-CG 3.29Å; V155-L159 WeakPolarHBondContact O-CG 3.18Å; V155-L159 PolarHBondContact O-N 3.31Å
156	L	90.1	Very high	87	Confident	21 Å²	21	59.2 Å²	59.2	11%	0.11	31%	0.31	C	S	.	.	H	α-helix	trans	-58.6	-34.8	173.6	-75.5	175.2	0	0	0	112.8	F152 Q153 Q160 L161 G162 W165	F152-L156 HydrophobicContact CD1-CD1 3.92Å; F152-L156 HydrophobicContact CE1-CD1 3.38Å; F152-L156 HydrophobicContact CE1-CG 4.32Å; F152-L156 HydrophobicContact CE2-CD1 4.2Å; F152-L156 HydrophobicContact CE2-CG 4.35Å; F152-L156 HydrophobicContact CZ-CD1 3.55Å; F152-L156 HydrophobicContact CZ-CG 4.18Å; F152-L156 WeakPolarHBondContact O-CG 3.34Å; F152-L156 PolarHBondContact O-N 3.14Å; Q153-L156 PolarHBondContact O-N 2.92Å; L156-Q160 PolarHBondContact O-N 3.12Å; L156-L161 HydrophobicContact CD2-CB 3.8Å; L156-L161 HydrophobicContact CD2-CD1 4.23Å; L156-L161 CarbonylContact O-C 3.59Å; L156-L161 WeakPolarHBondContact O-CA 3.27Å; L156-L161 PolarHBondContact O-N 3.5Å; L156-G162 PolarHBondContact O-N 3.47Å; L156-G162 VanDerWaalsContact O-N 3.13Å; L156-W165 HydrophobicContact CD1-CB 3.91Å; L156-W165 HydrophobicContact CD1-CD2 3.8Å; L156-W165 HydrophobicContact CD1-CE3 4Å; L156-W165 HydrophobicContact CD1-CG 3.75Å
157	H	87.7	Confident	87.5	Confident	14 Å²	14	57 Å²	57	7%	0.065	30%	0.296	C	S	.	.	H	α-helix	trans	-78	-37.7	178.2	-74.8	59.4	0	0	0	112.3	Q94 S97 F98 Q153 T154 V155 L159 Q160	Q94-H157 HydrophobicContact CG-CB 4.16Å; Q94-H157 VanDerWaalsContact CG-O 3.23Å; Q94-H157 WeakPolarHBondContact CG-O 3.4Å; Q94-H157 PolarHBondContact NE2-CD2 3.4Å; Q94-H157 VanDerWaalsContact NE2-CG 3.32Å; Q94-H157 PolarHBondContact NE2-NE2 3.48Å; Q94-H157 PolarHBondContact O-CD2 3.02Å; S97-H157 PolarHBondContact OG-NE2 2.92Å; F98-H157 HydrophobicContact CD2-CB 4.2Å; F98-H157 AromaticContact CD2-CD2 3.95Å; F98-H157 AromaticContact CD2-CG 3.88Å; F98-H157 PolarHBondContact N-CD2 3.22Å; F98-H157 PolarHBondContact N-NE2 3.44Å; Q153-H157 PolarHBondContact NE2-CE1 3.01Å; Q153-H157 PolarHBondContact O-N 3.49Å; Q153-H157 PolarHBondContact O-ND1 3.36Å; T154-H157 PolarHBondContact O-N 3.41Å; T154-H157 VanDerWaalsContact O-N 3.1Å; V155-H157 PolarHBondContact O-N 3.14Å; H157-L159 VanDerWaalsContact C-N 3.3Å; H157-L159 PolarHBondContact O-N 3.02Å; H157-Q160 PolarHBondContact O-N 3.3Å; H157-Q160 VanDerWaalsContact O-N 3.17Å
158	V	86.6	Confident	87.8	Confident	115 Å²	115	55.1 Å²	55.1	70%	0.697	29%	0.29	S	S	*	.	H	α-helix	trans	-63	-37.2	172.3	170.7	0	0	0	0	111.5	T154 V155 Q160	T154-V158 WeakPolarHBondContact O-CG2 3.34Å; T154-V158 PolarHBondContact O-N 3.09Å; V155-V158 PolarHBondContact O-N 2.87Å; V158-Q160 VanDerWaalsContact C-N 3.25Å; V158-Q160 PolarHBondContact O-N 3.38Å
159	L	87.4	Confident	87.9	Confident	108 Å²	108	54.6 Å²	54.6	57%	0.565	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	6	176.3	-63.8	175	0	0	0	114.2	V155 H157 L161	V155-L159 HydrophobicContact CG1-CD1 3.75Å; V155-L159 HydrophobicContact CG1-CG 4.34Å; V155-L159 WeakPolarHBondContact O-CB 3.22Å; V155-L159 VanDerWaalsContact O-CG 3.29Å; V155-L159 WeakPolarHBondContact O-CG 3.18Å; V155-L159 PolarHBondContact O-N 3.31Å; H157-L159 VanDerWaalsContact C-N 3.3Å; H157-L159 PolarHBondContact O-N 3.02Å; L159-L161 HydrophobicContact CB-CD1 4.13Å; L159-L161 HydrophobicContact CB-CG 4.07Å; L159-L161 HydrophobicContact CD1-CD1 4.39Å; L159-L161 PolarHBondContact O-N 3.37Å
160	Q	85.7	Confident	88	Confident	88 Å²	88	52.2 Å²	52.2	41%	0.411	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	12.5	-174.4	-53.4	-173	8.8	0	0	115.2	S90 L156 H157 V158 G162	S90-Q160 PolarHBondContact OG-OE1 2.87Å; L156-Q160 PolarHBondContact O-N 3.12Å; H157-Q160 PolarHBondContact O-N 3.3Å; H157-Q160 VanDerWaalsContact O-N 3.17Å; V158-Q160 VanDerWaalsContact C-N 3.25Å; V158-Q160 PolarHBondContact O-N 3.38Å; Q160-G162 VanDerWaalsContact C-N 3.33Å; Q160-G162 PolarHBondContact O-N 3.26Å
161	L	86.9	Confident	88	Confident	70 Å²	70	50.3 Å²	50.3	37%	0.366	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-2	179.5	-64.3	178.5	0	0	0	113.7	L156 L159 Q163 V164 W165	L156-L161 HydrophobicContact CD2-CB 3.8Å; L156-L161 HydrophobicContact CD2-CD1 4.23Å; L156-L161 CarbonylContact O-C 3.59Å; L156-L161 WeakPolarHBondContact O-CA 3.27Å; L156-L161 PolarHBondContact O-N 3.5Å; L159-L161 HydrophobicContact CB-CD1 4.13Å; L159-L161 HydrophobicContact CB-CG 4.07Å; L159-L161 HydrophobicContact CD1-CD1 4.39Å; L159-L161 PolarHBondContact O-N 3.37Å; L161-Q163 VanDerWaalsContact C-N 3.26Å; L161-Q163 PolarHBondContact O-N 2.81Å; L161-V164 HydrophobicContact CD2-CG2 4.14Å; L161-V164 WeakPolarHBondContact O-CA 3.5Å; L161-V164 WeakPolarHBondContact O-CB 3.39Å; L161-V164 PolarHBondContact O-N 3.3Å; L161-W165 PolarHBondContact O-N 3.21Å
162	G	86.4	Confident	88	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.9	-30	-177.9	0	0	0	0	0	114.3	L156 Q160 R166	L156-G162 PolarHBondContact O-N 3.47Å; L156-G162 VanDerWaalsContact O-N 3.13Å; Q160-G162 VanDerWaalsContact C-N 3.33Å; Q160-G162 PolarHBondContact O-N 3.26Å; G162-R166 PolarHBondContact O-N 3.18Å
163	Q	86.6	Confident	87.8	Confident	9 Å²	9	48.6 Å²	48.6	4%	0.042	25%	0.246	C	C	.	.	H	α-helix	trans	-68.3	-45.4	169.9	-71.5	-159.7	54.7	0	0	112	F56 V93 L161 W165 R166 Y167 E206	F56-Q163 HydrophobicContact CE2-CB 4.33Å; F56-Q163 HydrophobicContact CZ-CB 4.08Å; V93-Q163 HydrophobicContact CG1-CG 4.49Å; L161-Q163 VanDerWaalsContact C-N 3.26Å; L161-Q163 PolarHBondContact O-N 2.81Å; Q163-W165 VanDerWaalsContact C-N 3.26Å; Q163-W165 PolarHBondContact O-N 3.03Å; Q163-R166 PolarHBondContact O-N 3.39Å; Q163-R166 VanDerWaalsContact O-N 3.14Å; Q163-Y167 WeakPolarHBondContact O-CD2 3.35Å; Q163-Y167 PolarHBondContact O-N 3.03Å; Q163-E206 PolarHBondContact NE2-OE2 3.37Å
164	V	88.8	Confident	87.7	Confident	22 Å²	22	48 Å²	48	13%	0.133	24%	0.243	C	C	.	.	H	α-helix	trans	-58.1	-41.8	177.7	-178.5	0	0	0	0	110.4	L53 F56 F57 L161 R166 Y167 V168	L53-V164 HydrophobicContact CD1-CG1 4.46Å; F56-V164 HydrophobicContact CD1-CG2 4.41Å; F56-V164 HydrophobicContact CE1-CG2 3.7Å; F57-V164 HydrophobicContact CE1-CG2 3.96Å; F57-V164 HydrophobicContact CE2-CG1 4.38Å; F57-V164 HydrophobicContact CE2-CG2 4.4Å; F57-V164 HydrophobicContact CZ-CB 4.39Å; F57-V164 HydrophobicContact CZ-CG1 3.81Å; F57-V164 HydrophobicContact CZ-CG2 3.6Å; L161-V164 HydrophobicContact CD2-CG2 4.14Å; L161-V164 WeakPolarHBondContact O-CA 3.5Å; L161-V164 WeakPolarHBondContact O-CB 3.39Å; L161-V164 PolarHBondContact O-N 3.3Å; V164-R166 PolarHBondContact O-N 3.38Å; V164-Y167 WeakPolarHBondContact O-CB 3.23Å; V164-Y167 PolarHBondContact O-N 2.82Å; V164-V168 HydrophobicContact CG1-CG2 4.45Å; V164-V168 WeakPolarHBondContact O-CG2 3.31Å; V164-V168 PolarHBondContact O-N 3Å
165	W	90	Very high	87.5	Confident	100 Å²	100	47.8 Å²	47.8	38%	0.379	25%	0.247	S	C	.	.	H	α-helix	trans	-59	-44.3	175.7	180	-106.1	0	0	0	112.9	F152 L156 L161 Q163 Y167 V168 H169	F152-W165 HydrophobicContact CE1-CD2 4.29Å; F152-W165 HydrophobicContact CE1-CE3 4.11Å; F152-W165 AromaticContact CE1-CH2 3.79Å; F152-W165 HydrophobicContact CE1-CH2 3.79Å; F152-W165 AromaticContact CE1-CZ2 3.96Å; F152-W165 HydrophobicContact CE1-CZ2 3.96Å; F152-W165 AromaticContact CE1-CZ3 3.87Å; F152-W165 HydrophobicContact CE1-CZ3 3.87Å; F152-W165 HydrophobicContact CZ-CE3 4.06Å; F152-W165 HydrophobicContact CZ-CH2 4.07Å; F152-W165 AromaticContact CZ-CZ3 3.75Å; F152-W165 HydrophobicContact CZ-CZ3 3.75Å; L156-W165 HydrophobicContact CD1-CB 3.91Å; L156-W165 HydrophobicContact CD1-CD2 3.8Å; L156-W165 HydrophobicContact CD1-CE3 4Å; L156-W165 HydrophobicContact CD1-CG 3.75Å; L161-W165 PolarHBondContact O-N 3.21Å; Q163-W165 VanDerWaalsContact C-N 3.26Å; Q163-W165 PolarHBondContact O-N 3.03Å; W165-Y167 PolarHBondContact O-N 3.48Å; W165-V168 PolarHBondContact O-N 2.9Å; W165-H169 WeakPolarHBondContact O-CB 3.35Å; W165-H169 PolarHBondContact O-N 2.89Å
166	R	89.3	Confident	87.2	Confident	12 Å²	12	46.2 Å²	46.2	5%	0.045	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-42.7	174.6	-67.7	179.7	173.5	-89.6	4.5	111.7	S97 G162 Q163 V164 V168 H169 A170 E195 D198 I199	S97-R166 PolarHBondContact OG-NE 3.47Å; S97-R166 VanDerWaalsContact OG-NE 3.13Å; G162-R166 PolarHBondContact O-N 3.18Å; Q163-R166 PolarHBondContact O-N 3.39Å; Q163-R166 VanDerWaalsContact O-N 3.14Å; V164-R166 PolarHBondContact O-N 3.38Å; R166-V168 PolarHBondContact O-N 3.5Å; R166-H169 PolarHBondContact O-N 3.48Å; R166-A170 WeakPolarHBondContact O-CB 3.27Å; R166-A170 PolarHBondContact O-N 3.07Å; R166-E195 WeakPolarHBondContact CG-OE1 3.32Å; R166-E195 IonicContact CZ-OE1 3.38Å; R166-E195 IonicContact NH1-OE1 3.95Å; R166-E195 PolarHBondContact NH1-OE1 3.37Å; R166-D198 IonicContact CZ-OD2 2.71Å; R166-D198 IonicContact NH1-OD2 2.88Å; R166-D198 PolarHBondContact NH1-OD2 3Å; R166-I199 HydrophobicContact CB-CD1 4.03Å; R166-I199 HydrophobicContact CB-CG1 3.72Å
167	Y	89.3	Confident	86.6	Confident	9 Å²	9	45.7 Å²	45.7	4%	0.035	23%	0.233	C	C	.	.	H	α-helix	trans	-59.9	-43.6	174	-92.1	-81.2	0	0	0	112.9	V49 A52 L53 Q163 V164 W165 A170 L171 I199 R203	V49-Y167 HydrophobicContact CG1-CD1 3.76Å; V49-Y167 HydrophobicContact CG1-CE1 4.08Å; A52-Y167 HydrophobicContact CB-CE1 3.92Å; L53-Y167 HydrophobicContact CB-CD1 3.95Å; L53-Y167 HydrophobicContact CB-CE1 4.46Å; L53-Y167 HydrophobicContact CB-CG 4.3Å; L53-Y167 HydrophobicContact CD1-CD1 4.43Å; L53-Y167 HydrophobicContact CD1-CD2 4.27Å; L53-Y167 HydrophobicContact CD1-CG 3.92Å; Q163-Y167 WeakPolarHBondContact O-CD2 3.35Å; Q163-Y167 PolarHBondContact O-N 3.03Å; V164-Y167 WeakPolarHBondContact O-CB 3.23Å; V164-Y167 PolarHBondContact O-N 2.82Å; W165-Y167 PolarHBondContact O-N 3.48Å; Y167-A170 PolarHBondContact O-N 2.92Å; Y167-L171 WeakPolarHBondContact O-CB 3.29Å; Y167-L171 WeakPolarHBondContact O-CG 3.35Å; Y167-L171 PolarHBondContact O-N 2.94Å; Y167-I199 HydrophobicContact CD2-CG2 4.13Å; Y167-I199 HydrophobicContact CE1-CG2 3.95Å; Y167-I199 HydrophobicContact CE2-CG2 3.36Å; Y167-I199 WeakPolarHBondContact OH-CG2 3.3Å; Y167-R203 VanDerWaalsContact CZ-CZ 3.45Å; Y167-R203 WeakPolarHBondContact OH-CD 3.37Å; Y167-R203 PolarHBondContact OH-NE 3.41Å; Y167-R203 PolarHBondContact OH-NH1 3.23Å; Y167-R203 PolarHBondContact OH-NH2 3.48Å
168	V	89.6	Confident	86.1	Confident	71 Å²	71	49.7 Å²	49.7	43%	0.43	25%	0.247	S	C	.	.	H	α-helix	trans	-64.3	-41.2	175.2	171.7	0	0	0	0	111	V164 W165 R166 L171 Y172	V164-V168 HydrophobicContact CG1-CG2 4.45Å; V164-V168 WeakPolarHBondContact O-CG2 3.31Å; V164-V168 PolarHBondContact O-N 3Å; W165-V168 PolarHBondContact O-N 2.9Å; R166-V168 PolarHBondContact O-N 3.5Å; V168-L171 PolarHBondContact O-N 3.45Å; V168-Y172 WeakPolarHBondContact O-CB 3.14Å; V168-Y172 PolarHBondContact O-N 2.92Å
169	H	88.6	Confident	85.5	Confident	64 Å²	64	54.8 Å²	54.8	30%	0.296	25%	0.254	S	S	.	.	H	α-helix	trans	-64.3	-42.5	176.5	-171.5	-132.9	0	0	0	112.2	W165 R166 Y172 L173 E195	W165-H169 WeakPolarHBondContact O-CB 3.35Å; W165-H169 PolarHBondContact O-N 2.89Å; R166-H169 PolarHBondContact O-N 3.48Å; H169-Y172 PolarHBondContact O-N 2.97Å; H169-L173 WeakPolarHBondContact O-CB 3.45Å; H169-L173 VanDerWaalsContact O-CG 3.32Å; H169-L173 WeakPolarHBondContact O-CG 3.46Å; H169-L173 PolarHBondContact O-N 2.79Å; H169-E195 IonicContact CE1-OE2 3.04Å; H169-E195 IonicContact CG-OE2 3.48Å; H169-E195 IonicContact ND1-OE2 3.79Å; H169-E195 PolarHBondContact ND1-OE2 2.99Å
170	A	87.3	Confident	84.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.5	-44	174	0	0	0	0	0	112.1	R166 Y167 Y172 L173 G174 L192 E195 I199	R166-A170 WeakPolarHBondContact O-CB 3.27Å; R166-A170 PolarHBondContact O-N 3.07Å; Y167-A170 PolarHBondContact O-N 2.92Å; A170-Y172 VanDerWaalsContact C-N 3.35Å; A170-Y172 PolarHBondContact O-N 3.33Å; A170-L173 PolarHBondContact O-N 2.91Å; A170-G174 PolarHBondContact O-N 3.37Å; A170-L192 HydrophobicContact CB-CD1 4.01Å; A170-L192 VanDerWaalsContact O-CD1 3.28Å; A170-L192 WeakPolarHBondContact O-CD1 3.42Å; A170-E195 HydrophobicContact CB-CG 4.15Å; A170-I199 HydrophobicContact CB-CD1 3.77Å
171	L	87.2	Confident	83.2	Confident	36 Å²	36	58.5 Å²	58.5	19%	0.188	26%	0.26	C	S	.	.	H	α-helix	trans	-62.4	-40.6	174.7	-74.4	170.9	0	0	0	112	V49 L53 Y167 V168 G174 A175	V49-L171 HydrophobicContact CB-CD2 3.87Å; V49-L171 HydrophobicContact CG1-CD1 4.42Å; V49-L171 HydrophobicContact CG1-CD2 3.62Å; V49-L171 HydrophobicContact CG1-CG 3.72Å; L53-L171 HydrophobicContact CD2-CD1 4.34Å; Y167-L171 WeakPolarHBondContact O-CB 3.29Å; Y167-L171 WeakPolarHBondContact O-CG 3.35Å; Y167-L171 PolarHBondContact O-N 2.94Å; V168-L171 PolarHBondContact O-N 3.45Å; L171-G174 PolarHBondContact O-N 3.5Å; L171-A175 WeakPolarHBondContact O-CB 3.41Å; L171-A175 PolarHBondContact O-N 2.98Å
172	Y	88.1	Confident	81.6	Confident	134 Å²	134	62.7 Å²	62.7	53%	0.525	28%	0.283	S	S	.	.	H	α-helix	trans	-61.4	-50.3	174.6	173.8	-94.7	0	0	0	111.8	V168 H169 A170 G174 A175 Q176	V168-Y172 WeakPolarHBondContact O-CB 3.14Å; V168-Y172 PolarHBondContact O-N 2.92Å; H169-Y172 PolarHBondContact O-N 2.97Å; A170-Y172 VanDerWaalsContact C-N 3.35Å; A170-Y172 PolarHBondContact O-N 3.33Å; Y172-G174 VanDerWaalsContact C-N 3.32Å; Y172-G174 PolarHBondContact O-N 3Å; Y172-A175 PolarHBondContact O-N 2.96Å; Y172-Q176 VanDerWaalsContact CE1-OE1 3.29Å; Y172-Q176 WeakPolarHBondContact O-CB 3.25Å; Y172-Q176 PolarHBondContact O-N 3.24Å
173	L	84.6	Confident	80.3	Confident	5 Å²	5	64.1 Å²	64.1	3%	0.026	30%	0.298	C	S	.	.	H	α-helix	trans	-60.5	-40.3	177.2	-72.8	167.7	0	0	0	112.1	H169 A170 Q176 S177 F188 R191 L192	H169-L173 WeakPolarHBondContact O-CB 3.45Å; H169-L173 VanDerWaalsContact O-CG 3.32Å; H169-L173 WeakPolarHBondContact O-CG 3.46Å; H169-L173 PolarHBondContact O-N 2.79Å; A170-L173 PolarHBondContact O-N 2.91Å; L173-Q176 PolarHBondContact O-N 3.14Å; L173-S177 VanDerWaalsContact O-CB 3.27Å; L173-S177 WeakPolarHBondContact O-CB 3.33Å; L173-S177 PolarHBondContact O-N 3.04Å; L173-F188 HydrophobicContact CD2-CD1 4.25Å; L173-R191 HydrophobicContact CD1-CB 3.88Å; L173-R191 HydrophobicContact CD2-CB 3.99Å; L173-L192 HydrophobicContact CB-CB 4.36Å
174	G	83.4	Confident	79	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-65	-42.8	174.7	0	0	0	0	0	113.2	Y41 A170 L171 Y172 R178	Y41-G174 VanDerWaalsContact CD1-C 3.5Å; Y41-G174 WeakPolarHBondContact CD1-O 3.28Å; A170-G174 PolarHBondContact O-N 3.37Å; L171-G174 PolarHBondContact O-N 3.5Å; Y172-G174 VanDerWaalsContact C-N 3.32Å; Y172-G174 PolarHBondContact O-N 3Å; G174-R178 PolarHBondContact O-N 3.09Å
175	A	84	Confident	77.8	Confident	50 Å²	50	72.9 Å²	72.9	41%	0.413	34%	0.341	S	S	.	.	H	α-helix	trans	-63.9	-45.1	174.3	0	0	0	0	0	111.6	L171 Y172 S177 R178 W179	L171-A175 WeakPolarHBondContact O-CB 3.41Å; L171-A175 PolarHBondContact O-N 2.98Å; Y172-A175 PolarHBondContact O-N 2.96Å; A175-S177 PolarHBondContact O-N 3.02Å; A175-R178 PolarHBondContact O-N 3.35Å; A175-R178 VanDerWaalsContact O-N 3.13Å; A175-W179 WeakPolarHBondContact O-CB 3.45Å; A175-W179 PolarHBondContact O-N 2.96Å
176	Q	83.3	Confident	76.7	Confident	42 Å²	42	72.9 Å²	72.9	20%	0.196	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-42	177.7	-166.3	172.3	29.7	0	0	111.9	Y172 L173 R178 W179 H180 F188	Y172-Q176 VanDerWaalsContact CE1-OE1 3.29Å; Y172-Q176 WeakPolarHBondContact O-CB 3.25Å; Y172-Q176 PolarHBondContact O-N 3.24Å; L173-Q176 PolarHBondContact O-N 3.14Å; Q176-R178 PolarHBondContact O-N 3.31Å; Q176-W179 PolarHBondContact O-N 2.72Å; Q176-H180 PolarHBondContact O-CD2 3.48Å; Q176-H180 PolarHBondContact O-N 3.02Å; Q176-F188 HydrophobicContact CB-CD1 4.4Å; Q176-F188 HydrophobicContact CG-CD1 4.03Å; Q176-F188 HydrophobicContact CG-CE1 3.76Å; Q176-F188 HydrophobicContact CG-CZ 4.07Å
177	S	77.6	Confident	76	Confident	10 Å²	10	73.1 Å²	73.1	7%	0.07	34%	0.342	C	S	.	.	H	α-helix	trans	-59.2	-32.1	173.6	-172.9	0	0	0	0	113.3	L173 A175	L173-S177 VanDerWaalsContact O-CB 3.27Å; L173-S177 WeakPolarHBondContact O-CB 3.33Å; L173-S177 PolarHBondContact O-N 3.04Å; A175-S177 PolarHBondContact O-N 3.02Å
178	R	77	Confident	75.2	Confident	99 Å²	99	74.1 Å²	74.1	37%	0.374	35%	0.347	S	S	.	.	H	α-helix	trans	-82	-37.6	175.1	-160.8	-170.7	-62	142.1	0.9	112.6	Y41 T42 G174 A175 Q176	Y41-R178 PolarHBondContact O-NE 2.94Å; T42-R178 PolarHBondContact O-NH2 3.34Å; G174-R178 PolarHBondContact O-N 3.09Å; A175-R178 PolarHBondContact O-N 3.35Å; A175-R178 VanDerWaalsContact O-N 3.13Å; Q176-R178 PolarHBondContact O-N 3.31Å
179	W	74.2	Confident	74.5	Confident	222 Å²	222	73.1 Å²	73.1	84%	0.841	34%	0.337	S	S	*	.	H	α-helix	trans	-71.9	-43.1	-177	-164.5	-91.6	0	0	0	112.5	A175 Q176 R181	A175-W179 WeakPolarHBondContact O-CB 3.45Å; A175-W179 PolarHBondContact O-N 2.96Å; Q176-W179 PolarHBondContact O-N 2.72Å; W179-R181 PolarHBondContact O-N 2.79Å
180	H	67.8	Low	73.9	Confident	87 Å²	87	71.2 Å²	71.2	40%	0.403	33%	0.327	S	S	.	.			trans	-78.8	60.3	176	-70.2	-90.9	0	0	0	111.7	Q176 N182 G183	Q176-H180 PolarHBondContact O-CD2 3.48Å; Q176-H180 PolarHBondContact O-N 3.02Å; H180-N182 PolarHBondContact O-N 2.99Å; H180-G183 PolarHBondContact O-N 3.45Å
181	R	56.3	Low	73.5	Confident	186 Å²	186	75.6 Å²	75.6	70%	0.702	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-27.4	-178.9	-175.9	161	164.9	147.3	-10.5	113.4	W179 R185	W179-R181 PolarHBondContact O-N 2.79Å; R181-R185 VanDerWaalsContact O-CZ 3.29Å; R181-R185 PolarHBondContact O-NE 3.39Å; R181-R185 PolarHBondContact O-NH2 3.14Å
182	N	54.6	Low	73.4	Confident	159 Å²	159	74 Å²	74	85%	0.85	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	6.1	-179.7	-58.8	0.7	0	0	0	113.9	H180	H180-N182 PolarHBondContact O-N 2.99Å
183	G	58.1	Low	73	Confident	30 Å²	30	69 Å²	69	31%	0.309	32%	0.317	S	S	.	.	S	Bend	trans	-94	-176.6	179.9	0	0	0	0	0	113.8	H180 R185	H180-G183 PolarHBondContact O-N 3.45Å; G183-R185 PolarHBondContact O-N 3.21Å
184	P	59.5	Low	73	Confident	94 Å²	94	69 Å²	69	61%	0.61	32%	0.317	S	S	*	.			trans	-71.2	74.9	175.6	30.8	-35.8	0	0	0	111.3	R186 H187	P184-R186 PolarHBondContact O-N 3.06Å; P184-H187 WeakPolarHBondContact O-CB 3.23Å; P184-H187 PolarHBondContact O-N 2.78Å
185	R	65.1	Low	73.1	Confident	121 Å²	121	70.2 Å²	70.2	46%	0.457	32%	0.323	S	S	.	.	H	α-helix	trans	-53.2	-31.4	-176.4	-57.3	-172.6	-166.8	168.7	4.1	113.3	R181 G183 H187 F188 H189	R181-R185 VanDerWaalsContact O-CZ 3.29Å; R181-R185 PolarHBondContact O-NE 3.39Å; R181-R185 PolarHBondContact O-NH2 3.14Å; G183-R185 PolarHBondContact O-N 3.21Å; R185-H187 VanDerWaalsContact C-N 3.28Å; R185-H187 PolarHBondContact O-N 3.39Å; R185-F188 PolarHBondContact O-N 3.02Å; R185-H189 WeakPolarHBondContact O-CB 3.47Å; R185-H189 PolarHBondContact O-N 3.32Å
186	R	66.3	Low	73.3	Confident	100 Å²	100	68.5 Å²	68.5	38%	0.377	31%	0.308	S	S	.	.	H	α-helix	trans	-59.7	-36.4	179.4	-162.1	-178.3	-172	-176.4	0.2	112.5	P184 H189 W190 S552	P184-R186 PolarHBondContact O-N 3.06Å; R186-H189 WeakPolarHBondContact O-CB 3.41Å; R186-H189 PolarHBondContact O-N 3.08Å; R186-W190 PolarHBondContact O-N 2.68Å; R186-S552 WeakPolarHBondContact CD-OG 3.5Å; R186-S552 PolarHBondContact NH1-OG 3.02Å
187	H	73.6	Confident	73.4	Confident	16 Å²	16	66.7 Å²	66.7	7%	0.074	30%	0.3	C	S	.	.	H	α-helix	trans	-67.7	-46.7	-179.1	-171.3	62.1	0	0	0	112.7	P184 R185 H189 W190 R191 L543 E546	P184-H187 WeakPolarHBondContact O-CB 3.23Å; P184-H187 PolarHBondContact O-N 2.78Å; R185-H187 VanDerWaalsContact C-N 3.28Å; R185-H187 PolarHBondContact O-N 3.39Å; H187-H189 VanDerWaalsContact C-N 3.28Å; H187-H189 PolarHBondContact O-N 3.43Å; H187-W190 PolarHBondContact O-N 2.95Å; H187-R191 VanDerWaalsContact NE2-CZ 3.32Å; H187-R191 PolarHBondContact NE2-NE 2.86Å; H187-R191 PolarHBondContact NE2-NH2 3.45Å; H187-R191 WeakPolarHBondContact O-CG 3.24Å; H187-R191 PolarHBondContact O-N 3.24Å; H187-L543 PolarHBondContact CE1-O 3.21Å; H187-E546 VanDerWaalsContact CA-OE2 3.29Å; H187-E546 WeakPolarHBondContact CA-OE2 3.43Å; H187-E546 HydrophobicContact CB-CG 4.26Å; H187-E546 IonicContact CE1-OE2 2.72Å; H187-E546 IonicContact CG-OE2 3.55Å; H187-E546 PolarHBondContact N-OE1 3.05Å; H187-E546 IonicContact ND1-OE2 2.78Å; H187-E546 PolarHBondContact ND1-OE2 2.89Å
188	F	73.6	Confident	74	Confident	31 Å²	31	66.4 Å²	66.4	14%	0.136	30%	0.297	C	S	.	.	H	α-helix	trans	-65.7	-33.1	174.3	-60.8	-71	0	0	0	111.7	L173 Q176 R185 L192	L173-F188 HydrophobicContact CD2-CD1 4.25Å; Q176-F188 HydrophobicContact CB-CD1 4.4Å; Q176-F188 HydrophobicContact CG-CD1 4.03Å; Q176-F188 HydrophobicContact CG-CE1 3.76Å; Q176-F188 HydrophobicContact CG-CZ 4.07Å; R185-F188 PolarHBondContact O-N 3.02Å; F188-L192 WeakPolarHBondContact O-CB 3.45Å; F188-L192 PolarHBondContact O-N 3.38Å
189	H	74.9	Confident	74.6	Confident	50 Å²	50	62.1 Å²	62.1	23%	0.231	28%	0.282	C	S	.	.	H	α-helix	trans	-66.1	-46	173.4	-177	79.9	0	0	0	112.5	R185 R186 H187 L192 M193	R185-H189 WeakPolarHBondContact O-CB 3.47Å; R185-H189 PolarHBondContact O-N 3.32Å; R186-H189 WeakPolarHBondContact O-CB 3.41Å; R186-H189 PolarHBondContact O-N 3.08Å; H187-H189 VanDerWaalsContact C-N 3.28Å; H187-H189 PolarHBondContact O-N 3.43Å; H189-L192 WeakPolarHBondContact O-CB 3.17Å; H189-L192 PolarHBondContact O-N 3.08Å; H189-M193 WeakPolarHBondContact O-CG 3.37Å; H189-M193 PolarHBondContact O-N 3.34Å
190	W	74.5	Confident	75.3	Confident	23 Å²	23	52 Å²	52	9%	0.087	24%	0.244	C	C	.	.	H	α-helix	trans	-60.7	-48.6	174.5	-82	123	0	0	0	112.2	R186 H187 L192 M193 F194 H532 F533	R186-W190 PolarHBondContact O-N 2.68Å; H187-W190 PolarHBondContact O-N 2.95Å; W190-L192 VanDerWaalsContact C-N 3.3Å; W190-L192 PolarHBondContact O-N 3.38Å; W190-M193 PolarHBondContact O-N 2.76Å; W190-M193 VanDerWaalsContact O-N 3.17Å; W190-F194 HydrophobicContact CB-CE2 4.14Å; W190-F194 HydrophobicContact CE3-CE1 4.28Å; W190-F194 HydrophobicContact CE3-CE2 4.38Å; W190-F194 AromaticContact CE3-CZ 3.89Å; W190-F194 HydrophobicContact CE3-CZ 3.89Å; W190-F194 HydrophobicContact CZ3-CZ 4.47Å; W190-F194 WeakPolarHBondContact O-CD2 3.34Å; W190-F194 WeakPolarHBondContact O-CG 3.37Å; W190-F194 PolarHBondContact O-N 2.92Å; W190-H532 AromaticContact CH2-NE2 3.74Å; W190-H532 AromaticContact CZ3-CD2 3.93Å; W190-H532 AromaticContact CZ3-NE2 3.57Å; W190-F533 HydrophobicContact CE3-CZ 4.12Å; W190-F533 AromaticContact CZ3-CE2 3.76Å; W190-F533 HydrophobicContact CZ3-CE2 3.76Å; W190-F533 AromaticContact CZ3-CZ 3.67Å; W190-F533 HydrophobicContact CZ3-CZ 3.67Å
191	R	80.8	Confident	76.2	Confident	93 Å²	93	51.1 Å²	51.1	35%	0.351	24%	0.241	S	C	.	.	H	α-helix	trans	-56	-44.9	174.8	-69.9	-175.6	-174.6	-127.7	4.5	111.7	L173 H187 F194 E195 L543	L173-R191 HydrophobicContact CD1-CB 3.88Å; L173-R191 HydrophobicContact CD2-CB 3.99Å; H187-R191 VanDerWaalsContact NE2-CZ 3.32Å; H187-R191 PolarHBondContact NE2-NE 2.86Å; H187-R191 PolarHBondContact NE2-NH2 3.45Å; H187-R191 WeakPolarHBondContact O-CG 3.24Å; H187-R191 PolarHBondContact O-N 3.24Å; R191-F194 PolarHBondContact O-N 3.3Å; R191-E195 PolarHBondContact O-N 3.47Å; R191-L543 HydrophobicContact CG-CD1 4.21Å; R191-L543 HydrophobicContact CG-CD2 3.55Å
192	L	83.4	Confident	77.8	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-42.1	176.9	175.7	64.6	0	0	0	112.3	Y41 A170 L173 F188 H189 W190 S196	Y41-L192 HydrophobicContact CD2-CD2 3.54Å; Y41-L192 HydrophobicContact CE2-CD2 3.71Å; Y41-L192 HydrophobicContact CG-CD2 4.21Å; A170-L192 HydrophobicContact CB-CD1 4.01Å; A170-L192 VanDerWaalsContact O-CD1 3.28Å; A170-L192 WeakPolarHBondContact O-CD1 3.42Å; L173-L192 HydrophobicContact CB-CB 4.36Å; F188-L192 WeakPolarHBondContact O-CB 3.45Å; F188-L192 PolarHBondContact O-N 3.38Å; H189-L192 WeakPolarHBondContact O-CB 3.17Å; H189-L192 PolarHBondContact O-N 3.08Å; W190-L192 VanDerWaalsContact C-N 3.3Å; W190-L192 PolarHBondContact O-N 3.38Å; L192-S196 VanDerWaalsContact O-CB 3.23Å; L192-S196 WeakPolarHBondContact O-CB 3.45Å; L192-S196 PolarHBondContact O-N 3.35Å; L192-S196 PolarHBondContact O-OG 3Å
193	M	81.1	Confident	79.6	Confident	29 Å²	29	35.2 Å²	35.2	14%	0.143	17%	0.17	C	C	.	.	H	α-helix	trans	-68.7	-39.5	178.1	-68.7	-64.2	96.3	0	0	112	H189 W190 S196 A197 F533	H189-M193 WeakPolarHBondContact O-CG 3.37Å; H189-M193 PolarHBondContact O-N 3.34Å; W190-M193 PolarHBondContact O-N 2.76Å; W190-M193 VanDerWaalsContact O-N 3.17Å; M193-S196 PolarHBondContact O-N 3.19Å; M193-A197 WeakPolarHBondContact O-CB 3.25Å; M193-A197 PolarHBondContact O-N 2.82Å; M193-F533 HydrophobicContact CB-CE1 3.89Å; M193-F533 HydrophobicContact CB-CZ 4.11Å
194	F	84.4	Confident	81.1	Confident	6 Å²	6	34.1 Å²	34.1	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-62.7	-43.3	173.7	-66.1	-42.1	0	0	0	112.6	W190 R191 A197 D198 H532 F533 R539 L543	W190-F194 HydrophobicContact CB-CE2 4.14Å; W190-F194 HydrophobicContact CE3-CE1 4.28Å; W190-F194 HydrophobicContact CE3-CE2 4.38Å; W190-F194 AromaticContact CE3-CZ 3.89Å; W190-F194 HydrophobicContact CE3-CZ 3.89Å; W190-F194 HydrophobicContact CZ3-CZ 4.47Å; W190-F194 WeakPolarHBondContact O-CD2 3.34Å; W190-F194 WeakPolarHBondContact O-CG 3.37Å; W190-F194 PolarHBondContact O-N 2.92Å; R191-F194 PolarHBondContact O-N 3.3Å; F194-A197 PolarHBondContact O-N 3.37Å; F194-D198 PolarHBondContact O-N 2.85Å; F194-D198 VanDerWaalsContact O-N 3.16Å; F194-H532 AromaticContact CE1-CD2 3.99Å; F194-H532 WeakPolarHBondContact CE1-O 3.32Å; F194-F533 AromaticContact CD1-CD1 3.56Å; F194-F533 HydrophobicContact CD1-CD1 3.56Å; F194-F533 AromaticContact CD1-CE1 3.54Å; F194-F533 HydrophobicContact CD1-CE1 3.54Å; F194-F533 HydrophobicContact CD1-CG 4.24Å; F194-F533 HydrophobicContact CD1-CZ 4.22Å; F194-F533 AromaticContact CE1-CD1 3.89Å; F194-F533 HydrophobicContact CE1-CD1 3.89Å; F194-F533 HydrophobicContact CE1-CD2 4.41Å; F194-F533 AromaticContact CE1-CE1 3.81Å; F194-F533 HydrophobicContact CE1-CE1 3.81Å; F194-F533 HydrophobicContact CE1-CE2 4.36Å; F194-F533 HydrophobicContact CE1-CG 4.18Å; F194-F533 HydrophobicContact CE1-CZ 4.04Å; F194-R539 HydrophobicContact CD1-CG 3.88Å; F194-R539 HydrophobicContact CD2-CG 4.33Å; F194-R539 HydrophobicContact CE1-CG 3.92Å; F194-R539 HydrophobicContact CE2-CG 4.36Å; F194-R539 HydrophobicContact CG-CG 4.12Å; F194-R539 HydrophobicContact CZ-CG 4.17Å; F194-R539 PolarHBondContact O-NH1 3.12Å; F194-L543 HydrophobicContact CD2-CD1 4.35Å; F194-L543 HydrophobicContact CD2-CD2 4.49Å; F194-L543 HydrophobicContact CE2-CD2 4.27Å; F194-L543 HydrophobicContact CE2-CG 4.28Å
195	E	86	Confident	82.6	Confident	25 Å²	25	30.9 Å²	30.9	12%	0.117	13%	0.134	C	C	.	.	H	α-helix	trans	-69	-38.6	175.7	-163.5	72	-110.1	0	0	111.6	R166 H169 A170 R191 A197 D198 I199	R166-E195 WeakPolarHBondContact CG-OE1 3.32Å; R166-E195 IonicContact CZ-OE1 3.38Å; R166-E195 IonicContact NH1-OE1 3.95Å; R166-E195 PolarHBondContact NH1-OE1 3.37Å; H169-E195 IonicContact CE1-OE2 3.04Å; H169-E195 IonicContact CG-OE2 3.48Å; H169-E195 IonicContact ND1-OE2 3.79Å; H169-E195 PolarHBondContact ND1-OE2 2.99Å; A170-E195 HydrophobicContact CB-CG 4.15Å; R191-E195 PolarHBondContact O-N 3.47Å; E195-A197 VanDerWaalsContact C-N 3.3Å; E195-A197 PolarHBondContact O-N 3.05Å; E195-D198 PolarHBondContact O-N 2.76Å; E195-I199 HydrophobicContact CG-CD1 3.95Å; E195-I199 WeakPolarHBondContact O-CB 3.38Å; E195-I199 WeakPolarHBondContact O-CD1 3.32Å; E195-I199 WeakPolarHBondContact O-CG1 3.38Å; E195-I199 PolarHBondContact O-N 3.49Å
196	S	86.7	Confident	83.8	Confident	14 Å²	14	25.9 Å²	25.9	10%	0.098	12%	0.116	C	C	.	.	H	α-helix	trans	-64.4	-34.1	176.1	-60.2	0	0	0	0	112.5	L192 M193 T200	L192-S196 VanDerWaalsContact O-CB 3.23Å; L192-S196 WeakPolarHBondContact O-CB 3.45Å; L192-S196 PolarHBondContact O-N 3.35Å; L192-S196 PolarHBondContact O-OG 3Å; M193-S196 PolarHBondContact O-N 3.19Å; S196-T200 WeakPolarHBondContact O-CB 3.48Å; S196-T200 WeakPolarHBondContact O-CG2 3.44Å; S196-T200 PolarHBondContact O-N 3.01Å; S196-T200 PolarHBondContact O-OG1 3.4Å
197	A	86.4	Confident	85	Confident	3 Å²	3	21.3 Å²	21.3	3%	0.025	10%	0.099	C	C	.	.	H	α-helix	trans	-66.1	-47.8	172.8	0	0	0	0	0	111.6	M193 F194 E195 I199 T200 M201 W529 F533	M193-A197 WeakPolarHBondContact O-CB 3.25Å; M193-A197 PolarHBondContact O-N 2.82Å; F194-A197 PolarHBondContact O-N 3.37Å; E195-A197 VanDerWaalsContact C-N 3.3Å; E195-A197 PolarHBondContact O-N 3.05Å; A197-I199 PolarHBondContact O-N 3.31Å; A197-T200 PolarHBondContact O-N 3.32Å; A197-T200 PolarHBondContact O-OG1 2.9Å; A197-M201 VanDerWaalsContact O-CB 3.28Å; A197-M201 WeakPolarHBondContact O-CB 3.49Å; A197-M201 PolarHBondContact O-N 3.37Å; A197-W529 HydrophobicContact CB-CD2 4.45Å; A197-W529 HydrophobicContact CB-CE3 3.98Å; A197-W529 HydrophobicContact CB-CH2 3.41Å; A197-W529 VanDerWaalsContact CB-CH2 3.41Å; A197-W529 HydrophobicContact CB-CZ2 3.94Å; A197-W529 HydrophobicContact CB-CZ3 3.43Å; A197-W529 VanDerWaalsContact CB-CZ3 3.43Å; A197-F533 HydrophobicContact CB-CD1 4.02Å
198	D	88.8	Confident	85.8	Confident	4 Å²	4	20.7 Å²	20.7	2%	0.021	10%	0.097	C	C	.	.	H	α-helix	trans	-56.9	-50.9	175.6	-74.9	5	0	0	0	111.5	W100 R166 F194 E195 M201 L202 R536 R539	W100-D198 HydrophobicContact CE3-CB 4.24Å; W100-D198 HydrophobicContact CZ3-CB 3.81Å; R166-D198 IonicContact CZ-OD2 2.71Å; R166-D198 IonicContact NH1-OD2 2.88Å; R166-D198 PolarHBondContact NH1-OD2 3Å; F194-D198 PolarHBondContact O-N 2.85Å; F194-D198 VanDerWaalsContact O-N 3.16Å; E195-D198 PolarHBondContact O-N 2.76Å; D198-M201 PolarHBondContact O-N 2.88Å; D198-L202 WeakPolarHBondContact O-CB 3.38Å; D198-L202 WeakPolarHBondContact O-CG 3.29Å; D198-L202 PolarHBondContact O-N 2.91Å; D198-R536 IonicContact OD1-NH2 3.29Å; D198-R536 PolarHBondContact OD1-NH2 3.44Å; D198-R536 IonicContact OD2-CZ 3.2Å; D198-R536 IonicContact OD2-NH1 2.66Å; D198-R536 PolarHBondContact OD2-NH1 3.44Å; D198-R536 IonicContact OD2-NH2 2.74Å; D198-R536 PolarHBondContact OD2-NH2 3.43Å; D198-R539 VanDerWaalsContact CG-NH1 3.3Å; D198-R539 IonicContact OD1-CZ 3.2Å; D198-R539 IonicContact OD1-NH1 2.82Å; D198-R539 PolarHBondContact OD1-NH1 3.32Å; D198-R539 IonicContact OD1-NH2 3.88Å; D198-R539 PolarHBondContact OD1-NH2 2.9Å; D198-R539 IonicContact OD2-NH1 3.18Å; D198-R539 PolarHBondContact OD2-NH1 3.24Å
199	I	90.1	Very high	86.6	Confident	10 Å²	10	21 Å²	21	5%	0.051	10%	0.1	C	C	.	.	H	α-helix	trans	-57.7	-53.7	179.7	-74.5	167.1	0	0	0	111	R166 Y167 A170 E195 A197 M201 R203	R166-I199 HydrophobicContact CB-CD1 4.03Å; R166-I199 HydrophobicContact CB-CG1 3.72Å; Y167-I199 HydrophobicContact CD2-CG2 4.13Å; Y167-I199 HydrophobicContact CE1-CG2 3.95Å; Y167-I199 HydrophobicContact CE2-CG2 3.36Å; Y167-I199 WeakPolarHBondContact OH-CG2 3.3Å; A170-I199 HydrophobicContact CB-CD1 3.77Å; E195-I199 HydrophobicContact CG-CD1 3.95Å; E195-I199 WeakPolarHBondContact O-CB 3.38Å; E195-I199 WeakPolarHBondContact O-CD1 3.32Å; E195-I199 WeakPolarHBondContact O-CG1 3.38Å; E195-I199 PolarHBondContact O-N 3.49Å; A197-I199 PolarHBondContact O-N 3.31Å; I199-M201 VanDerWaalsContact C-N 3.3Å; I199-M201 PolarHBondContact O-N 3.02Å; I199-R203 WeakPolarHBondContact O-CB 3.36Å; I199-R203 PolarHBondContact O-N 3.41Å
200	T	89.9	Confident	87.3	Confident	8 Å²	8	19 Å²	19	5%	0.049	9%	0.09	C	C	.	.	H	α-helix	trans	-67.7	-31.5	-176.3	51.4	0	0	0	0	112.3	S196 A197 L204 V253	S196-T200 WeakPolarHBondContact O-CB 3.48Å; S196-T200 WeakPolarHBondContact O-CG2 3.44Å; S196-T200 PolarHBondContact O-N 3.01Å; S196-T200 PolarHBondContact O-OG1 3.4Å; A197-T200 PolarHBondContact O-N 3.32Å; A197-T200 PolarHBondContact O-OG1 2.9Å; T200-L204 VanDerWaalsContact O-CB 3.22Å; T200-L204 WeakPolarHBondContact O-CB 3.38Å; T200-L204 PolarHBondContact O-N 3.39Å; T200-V253 HydrophobicContact CG2-CG2 3.97Å
201	M	87.1	Confident	88.1	Confident	69 Å²	69	18.6 Å²	18.6	34%	0.34	9%	0.091	S	C	.	.	H	α-helix	trans	-74.1	-44.2	177.8	-169.8	166.4	67.6	0	0	113.2	W100 A197 D198 I199 R203 L205 Y250	W100-M201 HydrophobicContact CH2-CE 3.46Å; W100-M201 VanDerWaalsContact CH2-CE 3.46Å; W100-M201 HydrophobicContact CZ2-CE 3.57Å; A197-M201 VanDerWaalsContact O-CB 3.28Å; A197-M201 WeakPolarHBondContact O-CB 3.49Å; A197-M201 PolarHBondContact O-N 3.37Å; D198-M201 PolarHBondContact O-N 2.88Å; I199-M201 VanDerWaalsContact C-N 3.3Å; I199-M201 PolarHBondContact O-N 3.02Å; M201-R203 PolarHBondContact O-N 3.44Å; M201-L205 PolarHBondContact O-N 3.38Å; M201-L205 VanDerWaalsContact O-N 3.15Å; M201-Y250 HydrophobicContact CB-CE2 4.29Å; M201-Y250 HydrophobicContact CG-CE2 4.48Å
202	L	90.1	Very high	88.6	Confident	3 Å²	3	14.1 Å²	14.1	2%	0.016	7%	0.074	C	C	.	.	H	α-helix	trans	-57.7	-38.3	174.3	-75.2	168.3	0	0	0	111.9	V93 L96 W100 D198 L205 E206	V93-L202 HydrophobicContact CG1-CB 3.84Å; V93-L202 HydrophobicContact CG1-CD2 3.84Å; V93-L202 HydrophobicContact CG1-CG 4.34Å; L96-L202 HydrophobicContact CB-CD2 4.03Å; W100-L202 HydrophobicContact CE3-CD1 4.09Å; W100-L202 HydrophobicContact CE3-CD2 4.24Å; W100-L202 HydrophobicContact CE3-CG 4.24Å; W100-L202 HydrophobicContact CH2-CD1 4.38Å; W100-L202 HydrophobicContact CH2-CD2 3.69Å; W100-L202 HydrophobicContact CH2-CG 3.67Å; W100-L202 HydrophobicContact CZ2-CD2 4.36Å; W100-L202 HydrophobicContact CZ3-CD1 3.59Å; W100-L202 HydrophobicContact CZ3-CD2 3.66Å; W100-L202 HydrophobicContact CZ3-CG 3.38Å; D198-L202 WeakPolarHBondContact O-CB 3.38Å; D198-L202 WeakPolarHBondContact O-CG 3.29Å; D198-L202 PolarHBondContact O-N 2.91Å; L202-L205 WeakPolarHBondContact O-CB 3.16Å; L202-L205 PolarHBondContact O-N 3.4Å; L202-E206 PolarHBondContact O-N 3Å
203	R	90.6	Very high	89	Confident	8 Å²	8	15.3 Å²	15.3	3%	0.03	8%	0.082	C	C	.	.	H	α-helix	trans	-90.9	-24	-170.2	-157.9	177.2	-148.3	-133.6	41.9	113.2	A52 Y167 I199 M201 L205 A207 M246	A52-R203 PolarHBondContact O-NH1 2.89Å; A52-R203 PolarHBondContact O-NH2 2.88Å; Y167-R203 VanDerWaalsContact CZ-CZ 3.45Å; Y167-R203 WeakPolarHBondContact OH-CD 3.37Å; Y167-R203 PolarHBondContact OH-NE 3.41Å; Y167-R203 PolarHBondContact OH-NH1 3.23Å; Y167-R203 PolarHBondContact OH-NH2 3.48Å; I199-R203 WeakPolarHBondContact O-CB 3.36Å; I199-R203 PolarHBondContact O-N 3.41Å; M201-R203 PolarHBondContact O-N 3.44Å; R203-L205 VanDerWaalsContact C-N 3.34Å; R203-A207 VanDerWaalsContact O-CB 3.31Å; R203-A207 WeakPolarHBondContact O-CB 3.27Å; R203-A207 PolarHBondContact O-N 3.43Å; R203-M246 HydrophobicContact CB-CE 3.55Å; R203-M246 HydrophobicContact CB-SD 4.48Å; R203-M246 VanDerWaalsContact CD-SD 3.57Å; R203-M246 HydrophobicContact CG-CE 3.55Å; R203-M246 HydrophobicContact CG-SD 3.81Å; R203-M246 PolarHBondContact NH1-SD 3.47Å; R203-M246 VanDerWaalsContact NH1-SD 3.38Å
204	L	91.1	Very high	89.5	Confident	8 Å²	8	14 Å²	14	4%	0.042	8%	0.076	C	C	.	.	H	α-helix	trans	-61.6	-45.3	160.2	-173.4	80.7	0	0	0	110.1	T200 A207 F208 I247 Y250 I337 F343	T200-L204 VanDerWaalsContact O-CB 3.22Å; T200-L204 WeakPolarHBondContact O-CB 3.38Å; T200-L204 PolarHBondContact O-N 3.39Å; L204-A207 PolarHBondContact O-N 2.83Å; L204-F208 HydrophobicContact CD1-CD2 4.28Å; L204-F208 HydrophobicContact CD1-CE2 3.78Å; L204-F208 HydrophobicContact CG-CD2 4.28Å; L204-F208 HydrophobicContact CG-CE2 4.25Å; L204-F208 VanDerWaalsContact O-CD2 3.32Å; L204-F208 WeakPolarHBondContact O-CD2 3.47Å; L204-F208 PolarHBondContact O-N 3.29Å; L204-I247 HydrophobicContact CD1-CG1 4.25Å; L204-Y250 HydrophobicContact CB-CD2 4.36Å; L204-Y250 HydrophobicContact CD1-CG 4.31Å; L204-Y250 HydrophobicContact CD2-CD1 4.08Å; L204-Y250 HydrophobicContact CD2-CD2 3.95Å; L204-Y250 HydrophobicContact CD2-CE1 4.21Å; L204-Y250 HydrophobicContact CD2-CE2 4.06Å; L204-Y250 HydrophobicContact CD2-CG 3.96Å; L204-I337 HydrophobicContact CD2-CD1 4.09Å; L204-I337 HydrophobicContact CG-CD1 4.44Å; L204-F343 HydrophobicContact CD2-CD2 4.43Å; L204-F343 HydrophobicContact CD2-CE2 3.52Å; L204-F343 HydrophobicContact CD2-CZ 3.76Å
205	L	89.4	Confident	89.9	Confident	26 Å²	26	14 Å²	14	14%	0.136	8%	0.075	C	C	.	.	H	α-helix	trans	-62.2	-46	176.7	-179.6	65.7	0	0	0	111.7	V92 V93 L96 M201 L202 R203 F208 L209 V333	V92-L205 HydrophobicContact CG1-CD2 4.43Å; V93-L205 HydrophobicContact CG2-CD2 4.23Å; V93-L205 HydrophobicContact CG2-CG 4.3Å; L96-L205 HydrophobicContact CD1-CD2 3.38Å; M201-L205 PolarHBondContact O-N 3.38Å; M201-L205 VanDerWaalsContact O-N 3.15Å; L202-L205 WeakPolarHBondContact O-CB 3.16Å; L202-L205 PolarHBondContact O-N 3.4Å; R203-L205 VanDerWaalsContact C-N 3.34Å; L205-F208 PolarHBondContact O-N 2.94Å; L205-L209 HydrophobicContact CD1-CD1 3.68Å; L205-L209 HydrophobicContact CD1-CG 3.96Å; L205-L209 HydrophobicContact CD2-CD1 4.48Å; L205-L209 HydrophobicContact CG-CD1 3.81Å; L205-L209 HydrophobicContact CG-CG 4.36Å; L205-L209 WeakPolarHBondContact O-CB 3.28Å; L205-L209 WeakPolarHBondContact O-CG 3.19Å; L205-L209 PolarHBondContact O-N 2.92Å; L205-V333 HydrophobicContact CD1-CG1 3.6Å; L205-V333 HydrophobicContact CD1-CG2 4.37Å
206	E	90.6	Very high	90.2	Very high	15 Å²	15	13.1 Å²	13.1	7%	0.07	7%	0.072	C	C	.	.	H	α-helix	trans	-57.8	-49.4	173.8	-165.6	-177.4	164.2	0	0	111.4	V93 Q163 L202 F208 L209 K210	V93-E206 HydrophobicContact CG2-CB 4.06Å; Q163-E206 PolarHBondContact NE2-OE2 3.37Å; L202-E206 PolarHBondContact O-N 3Å; E206-F208 PolarHBondContact O-N 3.36Å; E206-F208 VanDerWaalsContact O-N 3.15Å; E206-L209 PolarHBondContact O-N 2.69Å; E206-K210 HydrophobicContact CG-CB 4.29Å; E206-K210 HydrophobicContact CG-CD 4.23Å; E206-K210 VanDerWaalsContact O-CB 3.31Å; E206-K210 WeakPolarHBondContact O-CB 3.46Å; E206-K210 PolarHBondContact O-N 2.74Å; E206-K210 IonicContact OE1-NZ 3.89Å; E206-K210 PolarHBondContact OE1-NZ 3.44Å
207	A	91.6	Very high	90.3	Very high	4 Å²	4	13.2 Å²	13.2	3%	0.033	7%	0.071	C	C	.	.	I	π-helix	trans	-57.9	-33	-176.1	0	0	0	0	0	113.8	R203 L204 S211 A212 M246	R203-A207 VanDerWaalsContact O-CB 3.31Å; R203-A207 WeakPolarHBondContact O-CB 3.27Å; R203-A207 PolarHBondContact O-N 3.43Å; L204-A207 PolarHBondContact O-N 2.83Å; A207-S211 CarbonylContact O-C 3.57Å; A207-S211 WeakPolarHBondContact O-CB 3.42Å; A207-S211 PolarHBondContact O-N 3.18Å; A207-A212 PolarHBondContact O-N 2.93Å; A207-M246 HydrophobicContact CB-CB 4.45Å
208	F	91.4	Very high	90.5	Very high	3 Å²	3	13.5 Å²	13.5	1%	0.013	7%	0.072	C	C	.	.	I	π-helix	trans	-92.3	-24.7	177.8	-72.1	-70.4	0	0	0	114.9	L204 L205 E206 A212 P213 L243 I247 I337 F340 C341	L204-F208 HydrophobicContact CD1-CD2 4.28Å; L204-F208 HydrophobicContact CD1-CE2 3.78Å; L204-F208 HydrophobicContact CG-CD2 4.28Å; L204-F208 HydrophobicContact CG-CE2 4.25Å; L204-F208 VanDerWaalsContact O-CD2 3.32Å; L204-F208 WeakPolarHBondContact O-CD2 3.47Å; L204-F208 PolarHBondContact O-N 3.29Å; L205-F208 PolarHBondContact O-N 2.94Å; E206-F208 PolarHBondContact O-N 3.36Å; E206-F208 VanDerWaalsContact O-N 3.15Å; F208-A212 HydrophobicContact CD1-CB 4.22Å; F208-P213 WeakPolarHBondContact O-CD 3.4Å; F208-L243 HydrophobicContact CE1-CD2 4.45Å; F208-L243 HydrophobicContact CZ-CD2 4.45Å; F208-I247 HydrophobicContact CE2-CD1 4.36Å; F208-I247 HydrophobicContact CE2-CG1 4.01Å; F208-I247 HydrophobicContact CZ-CD1 3.7Å; F208-I247 HydrophobicContact CZ-CG1 3.87Å; F208-I337 HydrophobicContact CB-CG1 4.15Å; F208-I337 HydrophobicContact CD1-CG2 4.33Å; F208-I337 HydrophobicContact CD2-CB 4.27Å; F208-I337 HydrophobicContact CD2-CD1 4.13Å; F208-I337 HydrophobicContact CD2-CG1 3.71Å; F208-I337 HydrophobicContact CD2-CG2 3.93Å; F208-I337 HydrophobicContact CE1-CG2 4.08Å; F208-I337 HydrophobicContact CE2-CB 4.49Å; F208-I337 HydrophobicContact CE2-CG1 4.29Å; F208-I337 HydrophobicContact CE2-CG2 3.66Å; F208-I337 HydrophobicContact CG-CB 4.32Å; F208-I337 HydrophobicContact CG-CG1 3.91Å; F208-I337 HydrophobicContact CG-CG2 4.26Å; F208-I337 HydrophobicContact CZ-CG2 3.73Å; F208-F340 HydrophobicContact CD1-CB 4.14Å; F208-F340 AromaticContact CD1-CD2 3.99Å; F208-F340 HydrophobicContact CD1-CD2 3.99Å; F208-F340 HydrophobicContact CD1-CG 4.33Å; F208-F340 HydrophobicContact CE1-CB 3.84Å; F208-F340 HydrophobicContact CE1-CG 4.48Å; F208-C341 VanDerWaalsContact CZ-SG 3.51Å
209	L	89.8	Confident	90.6	Very high	39 Å²	39	14.7 Å²	14.7	20%	0.204	8%	0.078	C	C	.	.	I	π-helix	trans	-81.7	-28	172.9	-69.7	-177.7	0	0	0	113.2	P89 V92 L205 E206 I336	P89-L209 HydrophobicContact CB-CB 3.7Å; P89-L209 HydrophobicContact CG-CB 3.87Å; P89-L209 WeakPolarHBondContact CG-O 3.44Å; V92-L209 HydrophobicContact CG1-CD1 4.16Å; L205-L209 HydrophobicContact CD1-CD1 3.68Å; L205-L209 HydrophobicContact CD1-CG 3.96Å; L205-L209 HydrophobicContact CD2-CD1 4.48Å; L205-L209 HydrophobicContact CG-CD1 3.81Å; L205-L209 HydrophobicContact CG-CG 4.36Å; L205-L209 WeakPolarHBondContact O-CB 3.28Å; L205-L209 WeakPolarHBondContact O-CG 3.19Å; L205-L209 PolarHBondContact O-N 2.92Å; E206-L209 PolarHBondContact O-N 2.69Å; L209-I336 HydrophobicContact CD2-CD1 3.73Å; L209-I336 HydrophobicContact CD2-CG2 4.45Å
210	K	90.3	Very high	90.5	Very high	6 Å²	6	15 Å²	15	3%	0.026	8%	0.081	C	C	.	.	I	π-helix	trans	-116.4	-69.7	-175.4	172.9	165.9	171.6	-98	0	112.1	D63 F85 P89 E206 A212 P213 Q214	D63-K210 WeakPolarHBondContact OD2-CE 3.33Å; D63-K210 IonicContact OD2-NZ 2.81Å; D63-K210 PolarHBondContact OD2-NZ 2.98Å; F85-K210 WeakPolarHBondContact O-CB 3.38Å; F85-K210 WeakPolarHBondContact O-CD 3.25Å; F85-K210 VanDerWaalsContact O-CG 3.24Å; F85-K210 WeakPolarHBondContact O-CG 3.38Å; P89-K210 HydrophobicContact CB-CB 3.79Å; P89-K210 HydrophobicContact CG-CB 3.89Å; E206-K210 HydrophobicContact CG-CB 4.29Å; E206-K210 HydrophobicContact CG-CD 4.23Å; E206-K210 VanDerWaalsContact O-CB 3.31Å; E206-K210 WeakPolarHBondContact O-CB 3.46Å; E206-K210 PolarHBondContact O-N 2.74Å; E206-K210 IonicContact OE1-NZ 3.89Å; E206-K210 PolarHBondContact OE1-NZ 3.44Å; K210-A212 PolarHBondContact O-N 3.06Å; K210-P213 WeakPolarHBondContact O-CD 3.29Å; K210-Q214 WeakPolarHBondContact O-CB 3.43Å; K210-Q214 PolarHBondContact O-N 2.66Å
211	S	90.3	Very high	90.3	Very high	15 Å²	15	15.9 Å²	15.9	11%	0.105	9%	0.085	C	C	.	.	I	π-helix	trans	-67.2	-37.9	-163.2	-46.6	0	0	0	0	113.9	A207 L215	A207-S211 CarbonylContact O-C 3.57Å; A207-S211 WeakPolarHBondContact O-CB 3.42Å; A207-S211 PolarHBondContact O-N 3.18Å; S211-L215 VanDerWaalsContact O-CB 3.22Å; S211-L215 WeakPolarHBondContact O-CB 3.33Å; S211-L215 PolarHBondContact O-N 3.15Å
212	A	92.5	Very high	90.2	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-66.9	-51.8	176.2	0	0	0	0	0	113.2	A207 F208 K210 Q214 L215 V216 L243 F340	A207-A212 PolarHBondContact O-N 2.93Å; F208-A212 HydrophobicContact CD1-CB 4.22Å; K210-A212 PolarHBondContact O-N 3.06Å; A212-Q214 PolarHBondContact O-N 3.16Å; A212-L215 PolarHBondContact O-N 3.43Å; A212-V216 WeakPolarHBondContact O-CG2 3.13Å; A212-V216 PolarHBondContact O-N 3.29Å; A212-L243 HydrophobicContact CB-CD1 3.57Å; A212-F340 HydrophobicContact CB-CD1 3.81Å; A212-F340 HydrophobicContact CB-CD2 3.96Å; A212-F340 HydrophobicContact CB-CE1 3.72Å; A212-F340 HydrophobicContact CB-CE2 3.87Å; A212-F340 HydrophobicContact CB-CG 3.94Å; A212-F340 HydrophobicContact CB-CZ 3.75Å
213	P	91.6	Very high	89.9	Confident	26 Å²	26	15.6 Å²	15.6	17%	0.169	8%	0.084	C	C	.	.	H	α-helix	trans	-58	-43.2	171.5	-27.3	34.8	0	0	0	113.6	F85 F208 K210 L215 V216 L217 F340	F85-P213 HydrophobicContact CD1-CB 3.79Å; F85-P213 HydrophobicContact CD1-CG 4.43Å; F85-P213 HydrophobicContact CE1-CB 3.41Å; F85-P213 VanDerWaalsContact CE1-CB 3.41Å; F85-P213 HydrophobicContact CE1-CG 4.06Å; F85-P213 HydrophobicContact CE2-CB 4.41Å; F85-P213 HydrophobicContact CG-CB 4.46Å; F85-P213 HydrophobicContact CZ-CB 3.77Å; F208-P213 WeakPolarHBondContact O-CD 3.4Å; K210-P213 WeakPolarHBondContact O-CD 3.29Å; P213-L215 VanDerWaalsContact C-N 3.34Å; P213-L215 PolarHBondContact O-N 3.44Å; P213-V216 PolarHBondContact O-N 3.15Å; P213-L217 PolarHBondContact O-N 2.87Å; P213-F340 HydrophobicContact CG-CE2 4.46Å; P213-F340 HydrophobicContact CG-CZ 4.17Å
214	Q	90.9	Very high	89.5	Confident	3 Å²	3	21.2 Å²	21.2	1%	0.014	11%	0.111	C	C	.	.	H	α-helix	trans	-64.5	-36.7	179.8	-173.5	62.2	21.7	0	0	112.3	T82 K210 A212 L217 Q218	T82-Q214 PolarHBondContact OG1-NE2 2.89Å; K210-Q214 WeakPolarHBondContact O-CB 3.43Å; K210-Q214 PolarHBondContact O-N 2.66Å; A212-Q214 PolarHBondContact O-N 3.16Å; Q214-L217 WeakPolarHBondContact O-CB 3.44Å; Q214-L217 PolarHBondContact O-N 3.19Å; Q214-Q218 WeakPolarHBondContact O-CB 3.22Å; Q214-Q218 PolarHBondContact O-N 3.31Å
215	L	92.6	Very high	88.6	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-65.1	-42.2	173.6	176.5	59.8	0	0	0	112.1	S211 A212 P213 L217 Q218 L219 A236 L240 T284	S211-L215 VanDerWaalsContact O-CB 3.22Å; S211-L215 WeakPolarHBondContact O-CB 3.33Å; S211-L215 PolarHBondContact O-N 3.15Å; A212-L215 PolarHBondContact O-N 3.43Å; P213-L215 VanDerWaalsContact C-N 3.34Å; P213-L215 PolarHBondContact O-N 3.44Å; L215-L217 VanDerWaalsContact C-N 3.34Å; L215-Q218 PolarHBondContact O-N 3.28Å; L215-L219 HydrophobicContact CD1-CD1 3.98Å; L215-L219 HydrophobicContact CD1-CG 4.13Å; L215-L219 HydrophobicContact CG-CD1 4.06Å; L215-L219 WeakPolarHBondContact O-CB 3.35Å; L215-L219 VanDerWaalsContact O-CG 3.25Å; L215-L219 WeakPolarHBondContact O-CG 3.21Å; L215-L219 PolarHBondContact O-N 3.35Å; L215-A236 HydrophobicContact CD1-CB 3.76Å; L215-A236 VanDerWaalsContact CD1-O 3.25Å; L215-A236 WeakPolarHBondContact CD1-O 3.29Å; L215-L240 HydrophobicContact CD2-CB 3.82Å; L215-L240 HydrophobicContact CD2-CD1 3.86Å; L215-L240 HydrophobicContact CD2-CG 4.35Å; L215-T284 HydrophobicContact CD2-CG2 4.25Å
216	V	93.5	Very high	87.4	Confident	8 Å²	8	27.7 Å²	27.7	5%	0.048	16%	0.16	C	C	.	.	H	α-helix	trans	-62.4	-43.4	174.3	174.9	0	0	0	0	110.8	A212 P213 L219 S220 T284 F287 A288 F298 F340	A212-V216 WeakPolarHBondContact O-CG2 3.13Å; A212-V216 PolarHBondContact O-N 3.29Å; P213-V216 PolarHBondContact O-N 3.15Å; V216-L219 PolarHBondContact O-N 2.93Å; V216-S220 WeakPolarHBondContact O-CB 3.48Å; V216-S220 PolarHBondContact O-N 2.94Å; V216-S220 PolarHBondContact O-OG 3.11Å; V216-T284 HydrophobicContact CG2-CG2 3.79Å; V216-F287 HydrophobicContact CG1-CB 3.79Å; V216-F287 HydrophobicContact CG2-CB 4.08Å; V216-F287 HydrophobicContact CG2-CD2 4.07Å; V216-A288 HydrophobicContact CG1-CB 4.44Å; V216-F298 HydrophobicContact CG1-CE1 4.31Å; V216-F298 HydrophobicContact CG1-CZ 3.93Å; V216-F340 HydrophobicContact CG2-CE1 4.06Å
217	L	88.6	Confident	86.1	Confident	15 Å²	15	28.8 Å²	28.8	8%	0.079	18%	0.176	C	C	.	.	H	α-helix	trans	-58	-55.4	175.9	177.8	67	0	0	0	111.2	W78 L81 P213 Q214 L215 L219 S220 I221	W78-L217 HydrophobicContact CE3-CD1 3.84Å; W78-L217 HydrophobicContact CZ3-CD1 3.65Å; L81-L217 HydrophobicContact CD2-CD1 3.63Å; L81-L217 HydrophobicContact CD2-CD2 3.43Å; L81-L217 VanDerWaalsContact CD2-CD2 3.43Å; L81-L217 HydrophobicContact CD2-CG 4.13Å; P213-L217 PolarHBondContact O-N 2.87Å; Q214-L217 WeakPolarHBondContact O-CB 3.44Å; Q214-L217 PolarHBondContact O-N 3.19Å; L215-L217 VanDerWaalsContact C-N 3.34Å; L217-L219 VanDerWaalsContact C-N 3.34Å; L217-L219 PolarHBondContact O-N 3.38Å; L217-S220 PolarHBondContact O-N 3.22Å; L217-S220 PolarHBondContact O-OG 3.03Å; L217-I221 HydrophobicContact CD1-CD1 3.91Å; L217-I221 HydrophobicContact CD1-CG1 4.39Å; L217-I221 HydrophobicContact CG-CD1 3.9Å; L217-I221 WeakPolarHBondContact O-CG1 3.28Å; L217-I221 PolarHBondContact O-N 3.06Å
218	Q	89	Confident	84.7	Confident	10 Å²	10	33.9 Å²	33.9	5%	0.047	21%	0.206	C	C	.	.	H	α-helix	trans	-55.8	-46.9	-179.9	-177.9	178.2	4.1	0	0	111.6	L66 Q214 L215 S220 I221 M222 Q232 S235	L66-Q218 HydrophobicContact CD2-CG 4.44Å; Q214-Q218 WeakPolarHBondContact O-CB 3.22Å; Q214-Q218 PolarHBondContact O-N 3.31Å; L215-Q218 PolarHBondContact O-N 3.28Å; Q218-S220 PolarHBondContact O-N 3.49Å; Q218-I221 PolarHBondContact O-N 3.25Å; Q218-M222 HydrophobicContact CG-SD 4.23Å; Q218-M222 VanDerWaalsContact O-CG 3.3Å; Q218-M222 WeakPolarHBondContact O-CG 3.23Å; Q218-M222 PolarHBondContact O-N 2.99Å; Q218-Q232 PolarHBondContact NE2-O 2.84Å; Q218-S235 PolarHBondContact NE2-OG 3.47Å
219	L	90.8	Very high	83.7	Confident	29 Å²	29	38.4 Å²	38.4	15%	0.152	23%	0.23	C	C	.	.	H	α-helix	trans	-62	-41.4	176	-71.8	170	0	0	0	112	L215 V216 L217 I221 M222 I223 A236 V285 A288	L215-L219 HydrophobicContact CD1-CD1 3.98Å; L215-L219 HydrophobicContact CD1-CG 4.13Å; L215-L219 HydrophobicContact CG-CD1 4.06Å; L215-L219 WeakPolarHBondContact O-CB 3.35Å; L215-L219 VanDerWaalsContact O-CG 3.25Å; L215-L219 WeakPolarHBondContact O-CG 3.21Å; L215-L219 PolarHBondContact O-N 3.35Å; V216-L219 PolarHBondContact O-N 2.93Å; L217-L219 VanDerWaalsContact C-N 3.34Å; L217-L219 PolarHBondContact O-N 3.38Å; L219-I221 VanDerWaalsContact C-N 3.35Å; L219-I221 PolarHBondContact O-N 3.05Å; L219-M222 PolarHBondContact O-N 3.46Å; L219-I223 WeakPolarHBondContact O-CD1 3.33Å; L219-I223 VanDerWaalsContact O-CG1 3.25Å; L219-I223 WeakPolarHBondContact O-CG1 3.36Å; L219-I223 PolarHBondContact O-N 3.48Å; L219-A236 HydrophobicContact CD2-CB 4.06Å; L219-A236 HydrophobicContact CG-CB 4.49Å; L219-V285 HydrophobicContact CD1-CG2 4.07Å; L219-A288 HydrophobicContact CB-CB 3.48Å; L219-A288 VanDerWaalsContact CB-CB 3.48Å
220	S	89	Confident	83	Confident	15 Å²	15	41.7 Å²	41.7	11%	0.105	25%	0.253	C	S	.	.	H	α-helix	trans	-65.9	-36.7	179.3	75.3	0	0	0	0	112.5	V216 L217 Q218 I223 H224	V216-S220 WeakPolarHBondContact O-CB 3.48Å; V216-S220 PolarHBondContact O-N 2.94Å; V216-S220 PolarHBondContact O-OG 3.11Å; L217-S220 PolarHBondContact O-N 3.22Å; L217-S220 PolarHBondContact O-OG 3.03Å; Q218-S220 PolarHBondContact O-N 3.49Å; S220-I223 PolarHBondContact O-N 2.92Å; S220-H224 WeakPolarHBondContact O-CB 3.35Å; S220-H224 PolarHBondContact O-N 3.39Å
221	I	84.8	Confident	82.2	Confident	28 Å²	28	47.9 Å²	47.9	14%	0.144	29%	0.286	C	S	.	.	H	α-helix	trans	-69.1	-42	175.4	-64.9	168.1	0	0	0	110.4	Y70 W78 L217 Q218 L219 I223 H224 G225	Y70-I221 HydrophobicContact CE1-CD1 4.43Å; Y70-I221 HydrophobicContact CE1-CG2 4.28Å; Y70-I221 HydrophobicContact CE2-CD1 4.23Å; Y70-I221 VanDerWaalsContact OH-CD1 3.31Å; Y70-I221 WeakPolarHBondContact OH-CD1 3.44Å; W78-I221 HydrophobicContact CB-CD1 4.31Å; W78-I221 HydrophobicContact CD2-CD1 3.8Å; W78-I221 HydrophobicContact CD2-CG1 4.09Å; W78-I221 HydrophobicContact CE3-CD1 3.66Å; W78-I221 HydrophobicContact CE3-CG1 4.02Å; W78-I221 HydrophobicContact CG-CD1 4.11Å; W78-I221 HydrophobicContact CH2-CG1 4.33Å; W78-I221 HydrophobicContact CZ2-CG1 4.41Å; W78-I221 HydrophobicContact CZ3-CD1 4.22Å; W78-I221 HydrophobicContact CZ3-CG1 4.14Å; L217-I221 HydrophobicContact CD1-CD1 3.91Å; L217-I221 HydrophobicContact CD1-CG1 4.39Å; L217-I221 HydrophobicContact CG-CD1 3.9Å; L217-I221 WeakPolarHBondContact O-CG1 3.28Å; L217-I221 PolarHBondContact O-N 3.06Å; Q218-I221 PolarHBondContact O-N 3.25Å; L219-I221 VanDerWaalsContact C-N 3.35Å; L219-I221 PolarHBondContact O-N 3.05Å; I221-I223 VanDerWaalsContact C-N 3.32Å; I221-I223 PolarHBondContact O-N 2.72Å; I221-H224 PolarHBondContact O-N 2.88Å; I221-G225 PolarHBondContact O-N 2.88Å
222	M	85.6	Confident	81.6	Confident	18 Å²	18	49.2 Å²	49.2	9%	0.089	29%	0.29	C	S	.	.	H	α-helix	trans	-60.9	-39.3	174.6	-71.9	170.4	60.4	0	0	112.6	Q218 L219 V228 Q232 A236	Q218-M222 HydrophobicContact CG-SD 4.23Å; Q218-M222 VanDerWaalsContact O-CG 3.3Å; Q218-M222 WeakPolarHBondContact O-CG 3.23Å; Q218-M222 PolarHBondContact O-N 2.99Å; L219-M222 PolarHBondContact O-N 3.46Å; M222-V228 HydrophobicContact CE-CG1 3.88Å; M222-Q232 HydrophobicContact CE-CB 4.01Å; M222-Q232 HydrophobicContact CG-CB 4.11Å; M222-Q232 HydrophobicContact SD-CB 3.79Å; M222-A236 HydrophobicContact SD-CB 4.41Å
223	I	84.6	Confident	81	Confident	48 Å²	48	50.3 Å²	50.3	25%	0.246	30%	0.302	C	S	.	.	H	α-helix	trans	-66.6	-45.5	175.3	-68.5	159.7	0	0	0	110.3	L219 S220 I221 G225 N226 A288 L289	L219-I223 WeakPolarHBondContact O-CD1 3.33Å; L219-I223 VanDerWaalsContact O-CG1 3.25Å; L219-I223 WeakPolarHBondContact O-CG1 3.36Å; L219-I223 PolarHBondContact O-N 3.48Å; S220-I223 PolarHBondContact O-N 2.92Å; I221-I223 VanDerWaalsContact C-N 3.32Å; I221-I223 PolarHBondContact O-N 2.72Å; I223-G225 PolarHBondContact O-N 2.97Å; I223-N226 PolarHBondContact O-N 3.39Å; I223-A288 HydrophobicContact CD1-CB 3.94Å; I223-L289 HydrophobicContact CD1-CD2 3.78Å; I223-L289 HydrophobicContact CD1-CG 4.14Å
224	H	80.9	Confident	80.6	Confident	126 Å²	126	54.9 Å²	54.9	58%	0.583	32%	0.324	S	S	*	.	H	α-helix	trans	-69	-32.9	-178.4	-159.9	88.7	0	0	0	113.1	S220 I221 N226	S220-H224 WeakPolarHBondContact O-CB 3.35Å; S220-H224 PolarHBondContact O-N 3.39Å; I221-H224 PolarHBondContact O-N 2.88Å; H224-N226 PolarHBondContact O-N 3.15Å
225	G	72.9	Confident	80.2	Confident	61 Å²	61	56.3 Å²	56.3	63%	0.629	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-6	175.6	0	0	0	0	0	114.9	I221 I223 G227	I221-G225 PolarHBondContact O-N 2.88Å; I223-G225 PolarHBondContact O-N 2.97Å; G225-G227 PolarHBondContact O-N 3.26Å
226	N	65.1	Low	80	Confident	108 Å²	108	56.3 Å²	56.3	58%	0.578	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	18.8	175.5	-137.3	24.6	0	0	0	115.4	I223 H224	I223-N226 PolarHBondContact O-N 3.39Å; H224-N226 PolarHBondContact O-N 3.15Å
227	G	61.4	Low	79.8	Confident	39 Å²	39	58.2 Å²	58.2	40%	0.402	35%	0.349	S	S	.	.			trans	-147.4	99.9	-174.3	0	0	0	0	0	111.5	G225 L229	G225-G227 PolarHBondContact O-N 3.26Å; G227-L229 PolarHBondContact O-N 3.07Å
228	V	62.8	Low	79.8	Confident	110 Å²	110	60 Å²	60	67%	0.667	37%	0.366	S	S	*	.			trans	-79.7	86.5	-175.2	-167.2	0	0	0	0	110.3	M222 P230	M222-V228 HydrophobicContact CE-CG1 3.88Å; V228-P230 WeakPolarHBondContact O-CD 3.23Å
229	L	71.4	Confident	79.9	Confident	99 Å²	99	60.1 Å²	60.1	52%	0.518	37%	0.368	S	S	.	.			trans	-61.4	126.1	173.4	-113.2	71.6	0	0	0	109.8	G227 L231 Q232 G233	G227-L229 PolarHBondContact O-N 3.07Å; L229-L231 PolarHBondContact O-N 2.76Å; L229-L231 VanDerWaalsContact O-N 3.11Å; L229-Q232 HydrophobicContact CB-CB 4.34Å; L229-Q232 HydrophobicContact CB-CG 4.08Å; L229-Q232 PolarHBondContact O-N 3.03Å; L229-G233 PolarHBondContact O-N 2.98Å
230	P	74.6	Confident	80	Confident	108 Å²	108	59.6 Å²	59.6	70%	0.701	37%	0.365	S	S	*	.	H	α-helix	trans	-56.2	-34	-175.8	-29.8	36.4	0	0	0	114.1	V228 G233 L234	V228-P230 WeakPolarHBondContact O-CD 3.23Å; P230-G233 PolarHBondContact O-N 3.39Å; P230-L234 WeakPolarHBondContact O-CB 3.23Å; P230-L234 PolarHBondContact O-N 3.02Å
231	L	72.3	Confident	80.2	Confident	135 Å²	135	62.5 Å²	62.5	71%	0.707	38%	0.382	S	S	*	.	H	α-helix	trans	-67.3	-34.5	175.7	-74	89.7	0	0	0	113.1	L229 L234 S235	L229-L231 PolarHBondContact O-N 2.76Å; L229-L231 VanDerWaalsContact O-N 3.11Å; L231-L234 PolarHBondContact O-N 3.19Å; L231-S235 WeakPolarHBondContact O-CB 3.47Å; L231-S235 PolarHBondContact O-N 3.31Å
232	Q	77.9	Confident	80.5	Confident	43 Å²	43	61.4 Å²	61.4	20%	0.201	38%	0.377	C	S	.	.	H	α-helix	trans	-71.3	-39.6	177.9	-68.3	-179.3	-21.6	0	0	110.9	Q218 M222 L229 S235 A236	Q218-Q232 PolarHBondContact NE2-O 2.84Å; M222-Q232 HydrophobicContact CE-CB 4.01Å; M222-Q232 HydrophobicContact CG-CB 4.11Å; M222-Q232 HydrophobicContact SD-CB 3.79Å; L229-Q232 HydrophobicContact CB-CB 4.34Å; L229-Q232 HydrophobicContact CB-CG 4.08Å; L229-Q232 PolarHBondContact O-N 3.03Å; Q232-S235 PolarHBondContact O-N 3.24Å; Q232-A236 WeakPolarHBondContact O-CB 3.3Å; Q232-A236 PolarHBondContact O-N 2.94Å
233	G	81	Confident	80.9	Confident	24 Å²	24	60.7 Å²	60.7	25%	0.247	37%	0.373	C	S	.	.	H	α-helix	trans	-65.1	-37.8	171.3	0	0	0	0	0	113.3	L229 P230 S237	L229-G233 PolarHBondContact O-N 2.98Å; P230-G233 PolarHBondContact O-N 3.39Å; G233-S237 WeakPolarHBondContact O-CB 3.35Å; G233-S237 PolarHBondContact O-N 3.49Å; G233-S237 PolarHBondContact O-OG 3.11Å
234	L	81.9	Confident	81.3	Confident	121 Å²	121	58.5 Å²	58.5	63%	0.634	36%	0.363	S	S	*	.	H	α-helix	trans	-66.2	-39.8	174.2	-172.7	63.1	0	0	0	111.9	P230 L231 S237 A238	P230-L234 WeakPolarHBondContact O-CB 3.23Å; P230-L234 PolarHBondContact O-N 3.02Å; L231-L234 PolarHBondContact O-N 3.19Å; L234-S237 WeakPolarHBondContact CA-OG 3.41Å; L234-S237 PolarHBondContact O-OG 3.38Å; L234-S237 VanDerWaalsContact O-OG 3.12Å; L234-A238 VanDerWaalsContact O-CB 3.31Å; L234-A238 WeakPolarHBondContact O-CB 3.31Å; L234-A238 PolarHBondContact O-N 2.89Å
235	S	83.9	Confident	81.8	Confident	33 Å²	33	54.9 Å²	54.9	23%	0.231	34%	0.344	C	S	.	.	H	α-helix	trans	-62.5	-54	172.8	162.5	0	0	0	0	111.7	Q218 L231 Q232 S237 A238 S239	Q218-S235 PolarHBondContact NE2-OG 3.47Å; L231-S235 WeakPolarHBondContact O-CB 3.47Å; L231-S235 PolarHBondContact O-N 3.31Å; Q232-S235 PolarHBondContact O-N 3.24Å; S235-S237 VanDerWaalsContact C-N 3.29Å; S235-S237 PolarHBondContact O-N 2.89Å; S235-A238 WeakPolarHBondContact O-CB 2.98Å; S235-A238 PolarHBondContact O-N 2.86Å; S235-A238 VanDerWaalsContact O-N 3.07Å; S235-S239 PolarHBondContact O-N 2.71Å; S235-S239 PolarHBondContact O-OG 3.33Å
236	A	88.1	Confident	82.8	Confident	4 Å²	4	52.2 Å²	52.2	3%	0.033	32%	0.315	C	S	.	.	H	α-helix	trans	-59.6	-39.2	-179.2	0	0	0	0	0	112.4	L215 L219 M222 Q232 L240	L215-A236 HydrophobicContact CD1-CB 3.76Å; L215-A236 VanDerWaalsContact CD1-O 3.25Å; L215-A236 WeakPolarHBondContact CD1-O 3.29Å; L219-A236 HydrophobicContact CD2-CB 4.06Å; L219-A236 HydrophobicContact CG-CB 4.49Å; M222-A236 HydrophobicContact SD-CB 4.41Å; Q232-A236 WeakPolarHBondContact O-CB 3.3Å; Q232-A236 PolarHBondContact O-N 2.94Å; A236-L240 PolarHBondContact O-N 3.44Å
237	S	89.1	Confident	84	Confident	48 Å²	48	47.2 Å²	47.2	34%	0.336	29%	0.288	S	S	.	.	H	α-helix	trans	-70.9	-34.5	175	53.8	0	0	0	0	113.2	G233 L234 S235 L240 V241	G233-S237 WeakPolarHBondContact O-CB 3.35Å; G233-S237 PolarHBondContact O-N 3.49Å; G233-S237 PolarHBondContact O-OG 3.11Å; L234-S237 WeakPolarHBondContact CA-OG 3.41Å; L234-S237 PolarHBondContact O-OG 3.38Å; L234-S237 VanDerWaalsContact O-OG 3.12Å; S235-S237 VanDerWaalsContact C-N 3.29Å; S235-S237 PolarHBondContact O-N 2.89Å; S237-L240 PolarHBondContact O-N 2.85Å; S237-V241 WeakPolarHBondContact O-CG2 3.45Å; S237-V241 PolarHBondContact O-N 2.85Å
238	A	88.1	Confident	85.4	Confident	53 Å²	53	45.3 Å²	45.3	44%	0.438	27%	0.269	S	S	.	.	H	α-helix	trans	-63.8	-43.2	171.7	0	0	0	0	0	112.1	L234 S235 L240 V241 S242	L234-A238 VanDerWaalsContact O-CB 3.31Å; L234-A238 WeakPolarHBondContact O-CB 3.31Å; L234-A238 PolarHBondContact O-N 2.89Å; S235-A238 WeakPolarHBondContact O-CB 2.98Å; S235-A238 PolarHBondContact O-N 2.86Å; S235-A238 VanDerWaalsContact O-N 3.07Å; A238-L240 VanDerWaalsContact C-N 3.33Å; A238-L240 PolarHBondContact O-N 3.1Å; A238-V241 WeakPolarHBondContact O-CB 3.32Å; A238-V241 PolarHBondContact O-N 3.47Å; A238-V241 VanDerWaalsContact O-N 3.14Å; A238-S242 PolarHBondContact O-N 3.21Å
239	S	91.1	Very high	86.7	Confident	13 Å²	13	40.3 Å²	40.3	9%	0.091	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-35.9	175.1	-55	0	0	0	0	112.3	S235 S242 L243	S235-S239 PolarHBondContact O-N 2.71Å; S235-S239 PolarHBondContact O-OG 3.33Å; S239-S242 WeakPolarHBondContact O-CB 3.38Å; S239-S242 PolarHBondContact O-N 2.92Å; S239-L243 WeakPolarHBondContact O-CB 3.17Å; S239-L243 PolarHBondContact O-N 3.37Å
240	L	93.4	Very high	87.5	Confident	17 Å²	17	36 Å²	36	9%	0.089	22%	0.216	C	C	.	.	H	α-helix	trans	-66.9	-36.7	172.2	-176.4	61.5	0	0	0	112.4	L215 A236 S237 A238 L243 A244 F277 I280	L215-L240 HydrophobicContact CD2-CB 3.82Å; L215-L240 HydrophobicContact CD2-CD1 3.86Å; L215-L240 HydrophobicContact CD2-CG 4.35Å; A236-L240 PolarHBondContact O-N 3.44Å; S237-L240 PolarHBondContact O-N 2.85Å; A238-L240 VanDerWaalsContact C-N 3.33Å; A238-L240 PolarHBondContact O-N 3.1Å; L240-L243 PolarHBondContact O-N 3.28Å; L240-A244 WeakPolarHBondContact O-CB 3.45Å; L240-A244 PolarHBondContact O-N 3.27Å; L240-F277 HydrophobicContact CB-CD2 4.31Å; L240-F277 HydrophobicContact CB-CE2 4.08Å; L240-F277 HydrophobicContact CD2-CD2 3.84Å; L240-F277 HydrophobicContact CD2-CE2 3.58Å; L240-F277 HydrophobicContact CD2-CG 4.44Å; L240-F277 HydrophobicContact CD2-CZ 4Å; L240-F277 HydrophobicContact CG-CD2 3.61Å; L240-F277 HydrophobicContact CG-CE2 3.69Å; L240-F277 HydrophobicContact CG-CG 4.44Å; L240-I280 HydrophobicContact CD1-CB 4.25Å; L240-I280 HydrophobicContact CD1-CG2 4.04Å
241	V	92.9	Very high	88.2	Confident	77 Å²	77	32.5 Å²	32.5	47%	0.467	19%	0.19	S	C	.	.	H	α-helix	trans	-65.5	-41.9	171.3	171.5	0	0	0	0	111.2	S237 A238 L243 A244 W245 F277	S237-V241 WeakPolarHBondContact O-CG2 3.45Å; S237-V241 PolarHBondContact O-N 2.85Å; A238-V241 WeakPolarHBondContact O-CB 3.32Å; A238-V241 PolarHBondContact O-N 3.47Å; A238-V241 VanDerWaalsContact O-N 3.14Å; V241-L243 PolarHBondContact O-N 3.29Å; V241-A244 PolarHBondContact O-N 3.33Å; V241-W245 VanDerWaalsContact O-CB 3.23Å; V241-W245 WeakPolarHBondContact O-CB 3.31Å; V241-W245 PolarHBondContact O-N 3.32Å; V241-F277 HydrophobicContact CG2-CD2 3.88Å; V241-F277 HydrophobicContact CG2-CE2 3.62Å
242	S	91.8	Very high	88.9	Confident	5 Å²	5	26.8 Å²	26.8	4%	0.035	16%	0.16	C	C	.	.	H	α-helix	trans	-56	-50.7	173.5	174.1	0	0	0	0	111.2	V55 D59 A238 S239 A244 W245 M246	V55-S242 WeakPolarHBondContact CG1-OG 3.25Å; D59-S242 WeakPolarHBondContact OD1-CB 3.22Å; D59-S242 PolarHBondContact OD1-OG 2.92Å; D59-S242 WeakPolarHBondContact OD2-CB 3.47Å; D59-S242 PolarHBondContact OD2-OG 3.46Å; A238-S242 PolarHBondContact O-N 3.21Å; S239-S242 WeakPolarHBondContact O-CB 3.38Å; S239-S242 PolarHBondContact O-N 2.92Å; S242-A244 PolarHBondContact O-N 2.87Å; S242-W245 WeakPolarHBondContact O-CB 3.49Å; S242-W245 PolarHBondContact O-N 3.46Å; S242-M246 WeakPolarHBondContact O-CG 3.44Å; S242-M246 PolarHBondContact O-N 3.17Å
243	L	93	Very high	89.4	Confident	2 Å²	2	25.8 Å²	25.8	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-62.1	-45.2	-179	-170.5	150.6	0	0	0	112.1	F208 A212 S239 L240 V241 W245 M246 I247 I280	F208-L243 HydrophobicContact CE1-CD2 4.45Å; F208-L243 HydrophobicContact CZ-CD2 4.45Å; A212-L243 HydrophobicContact CB-CD1 3.57Å; S239-L243 WeakPolarHBondContact O-CB 3.17Å; S239-L243 PolarHBondContact O-N 3.37Å; L240-L243 PolarHBondContact O-N 3.28Å; V241-L243 PolarHBondContact O-N 3.29Å; L243-W245 PolarHBondContact O-N 3.09Å; L243-M246 PolarHBondContact O-N 3.42Å; L243-I247 HydrophobicContact CD2-CD1 3.7Å; L243-I247 WeakPolarHBondContact O-CG1 3.21Å; L243-I247 PolarHBondContact O-N 3Å; L243-I247 VanDerWaalsContact O-N 3.15Å; L243-I280 HydrophobicContact CD2-CD1 3.53Å; L243-I280 HydrophobicContact CD2-CG2 4.02Å
244	A	93.9	Very high	89.5	Confident	3 Å²	3	25 Å²	25	3%	0.025	15%	0.146	C	C	.	.	H	α-helix	trans	-64.3	-38.3	175.3	0	0	0	0	0	112.6	L240 V241 S242 M246 A248 H276 F277	L240-A244 WeakPolarHBondContact O-CB 3.45Å; L240-A244 PolarHBondContact O-N 3.27Å; V241-A244 PolarHBondContact O-N 3.33Å; S242-A244 PolarHBondContact O-N 2.87Å; A244-M246 VanDerWaalsContact C-N 3.31Å; A244-M246 PolarHBondContact O-N 2.85Å; A244-A248 WeakPolarHBondContact O-CB 3.19Å; A244-A248 PolarHBondContact O-N 3.48Å; A244-A248 VanDerWaalsContact O-N 3.15Å; A244-H276 HydrophobicContact CB-CB 4.43Å; A244-F277 HydrophobicContact CB-CB 3.86Å
245	W	92	Very high	89.5	Confident	50 Å²	50	20.5 Å²	20.5	19%	0.189	12%	0.121	C	C	.	.	H	α-helix	trans	-62.2	-38.4	173	178.1	-70.9	0	0	0	111.7	W48 C51 V241 S242 L243 S249 M273	W48-W245 AromaticContact CD2-CH2 3.85Å; W48-W245 HydrophobicContact CD2-CH2 3.85Å; W48-W245 AromaticContact CD2-CZ2 3.45Å; W48-W245 HydrophobicContact CD2-CZ2 3.45Å; W48-W245 VanDerWaalsContact CD2-CZ2 3.45Å; W48-W245 AromaticContact CE2-CE2 3.83Å; W48-W245 AromaticContact CE2-CZ2 3.49Å; W48-W245 VanDerWaalsContact CE2-CZ2 3.49Å; W48-W245 AromaticContact CE3-CH2 3.62Å; W48-W245 HydrophobicContact CE3-CH2 3.62Å; W48-W245 AromaticContact CE3-CZ2 3.75Å; W48-W245 HydrophobicContact CE3-CZ2 3.75Å; W48-W245 AromaticContact CG-CZ2 3.89Å; W48-W245 HydrophobicContact CG-CZ2 3.89Å; W48-W245 HydrophobicContact CH2-CH2 4.11Å; W48-W245 HydrophobicContact CH2-CZ2 4.17Å; W48-W245 HydrophobicContact CH2-CZ3 4.38Å; W48-W245 HydrophobicContact CZ2-CD2 4.44Å; W48-W245 AromaticContact CZ2-CE2 3.95Å; W48-W245 HydrophobicContact CZ2-CH2 4.29Å; W48-W245 AromaticContact CZ2-CZ2 3.87Å; W48-W245 HydrophobicContact CZ2-CZ2 3.87Å; W48-W245 AromaticContact CZ3-CH2 3.76Å; W48-W245 HydrophobicContact CZ3-CH2 3.76Å; W48-W245 HydrophobicContact CZ3-CZ2 4.1Å; W48-W245 HydrophobicContact CZ3-CZ3 4.24Å; W48-W245 AromaticContact NE1-CZ2 3.84Å; W48-W245 AromaticContact NE1-NE1 3.91Å; C51-W245 HydrophobicContact CB-CH2 4.13Å; C51-W245 HydrophobicContact CB-CZ2 4.1Å; V241-W245 VanDerWaalsContact O-CB 3.23Å; V241-W245 WeakPolarHBondContact O-CB 3.31Å; V241-W245 PolarHBondContact O-N 3.32Å; S242-W245 WeakPolarHBondContact O-CB 3.49Å; S242-W245 PolarHBondContact O-N 3.46Å; L243-W245 PolarHBondContact O-N 3.09Å; W245-S249 PolarHBondContact NE1-OG 2.95Å; W245-S249 VanDerWaalsContact O-CB 3.23Å; W245-S249 WeakPolarHBondContact O-CB 3.47Å; W245-S249 PolarHBondContact O-N 2.96Å; W245-S249 PolarHBondContact O-OG 3.01Å; W245-M273 HydrophobicContact CB-CE 3.85Å; W245-M273 HydrophobicContact CD2-CE 3.36Å; W245-M273 HydrophobicContact CE3-CE 3.17Å; W245-M273 HydrophobicContact CE3-SD 4.49Å; W245-M273 HydrophobicContact CG-CE 3.69Å; W245-M273 HydrophobicContact CZ3-CE 3.8Å
246	M	92.1	Very high	89.4	Confident	5 Å²	5	21.1 Å²	21.1	3%	0.025	12%	0.122	C	C	.	.	H	α-helix	trans	-68.1	-44.4	179.8	-78	-49.1	-44.6	0	0	113.1	R203 A207 S242 L243 A244 S249 Y250	R203-M246 HydrophobicContact CB-CE 3.55Å; R203-M246 HydrophobicContact CB-SD 4.48Å; R203-M246 VanDerWaalsContact CD-SD 3.57Å; R203-M246 HydrophobicContact CG-CE 3.55Å; R203-M246 HydrophobicContact CG-SD 3.81Å; R203-M246 PolarHBondContact NH1-SD 3.47Å; R203-M246 VanDerWaalsContact NH1-SD 3.38Å; A207-M246 HydrophobicContact CB-CB 4.45Å; S242-M246 WeakPolarHBondContact O-CG 3.44Å; S242-M246 PolarHBondContact O-N 3.17Å; L243-M246 PolarHBondContact O-N 3.42Å; A244-M246 VanDerWaalsContact C-N 3.31Å; A244-M246 PolarHBondContact O-N 2.85Å; M246-S249 PolarHBondContact O-N 3.08Å; M246-Y250 PolarHBondContact O-N 3.29Å
247	I	91.3	Very high	88.9	Confident	2 Å²	2	21.2 Å²	21.2	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-62	-47.1	175.9	-58.7	161.1	0	0	0	110.3	L204 F208 L243 S249 Y250 Q251 H276 I280	L204-I247 HydrophobicContact CD1-CG1 4.25Å; F208-I247 HydrophobicContact CE2-CD1 4.36Å; F208-I247 HydrophobicContact CE2-CG1 4.01Å; F208-I247 HydrophobicContact CZ-CD1 3.7Å; F208-I247 HydrophobicContact CZ-CG1 3.87Å; L243-I247 HydrophobicContact CD2-CD1 3.7Å; L243-I247 WeakPolarHBondContact O-CG1 3.21Å; L243-I247 PolarHBondContact O-N 3Å; L243-I247 VanDerWaalsContact O-N 3.15Å; I247-S249 VanDerWaalsContact C-N 3.34Å; I247-S249 PolarHBondContact O-N 3.5Å; I247-Y250 PolarHBondContact O-N 2.83Å; I247-Q251 HydrophobicContact CG2-CG 4.31Å; I247-Q251 WeakPolarHBondContact O-CB 3.36Å; I247-Q251 VanDerWaalsContact O-CG 3.27Å; I247-Q251 WeakPolarHBondContact O-CG 3.46Å; I247-Q251 PolarHBondContact O-N 2.7Å; I247-H276 HydrophobicContact CD1-CB 4.11Å; I247-H276 VanDerWaalsContact CG2-CD2 3.49Å; I247-H276 WeakPolarHBondContact CG2-CD2 3.33Å; I247-H276 WeakPolarHBondContact CG2-NE2 3.32Å; I247-I280 HydrophobicContact CD1-CD1 3.28Å
248	A	90.8	Very high	88.1	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-66.5	-34.6	179.5	0	0	0	0	0	112.6	A244 K252 V269 Q272 M273	A244-A248 WeakPolarHBondContact O-CB 3.19Å; A244-A248 PolarHBondContact O-N 3.48Å; A244-A248 VanDerWaalsContact O-N 3.15Å; A248-K252 VanDerWaalsContact O-CB 3.23Å; A248-K252 WeakPolarHBondContact O-CB 3.44Å; A248-K252 PolarHBondContact O-N 2.74Å; A248-V269 HydrophobicContact CB-CG1 3.98Å; A248-Q272 HydrophobicContact CB-CG 4.46Å; A248-M273 HydrophobicContact CB-CB 4.45Å; A248-M273 HydrophobicContact CB-CE 4.31Å; A248-M273 HydrophobicContact CB-CG 3.35Å; A248-M273 HydrophobicContact CB-SD 4.47Å
249	S	89.3	Confident	87.2	Confident	4 Å²	4	22.9 Å²	22.9	3%	0.028	12%	0.119	C	C	.	.	H	α-helix	trans	-64.9	-45.8	172.8	-67.6	0	0	0	0	111.9	W48 W245 M246 I247 K252 V253	W48-S249 PolarHBondContact NE1-OG 3.47Å; W245-S249 PolarHBondContact NE1-OG 2.95Å; W245-S249 VanDerWaalsContact O-CB 3.23Å; W245-S249 WeakPolarHBondContact O-CB 3.47Å; W245-S249 PolarHBondContact O-N 2.96Å; W245-S249 PolarHBondContact O-OG 3.01Å; M246-S249 PolarHBondContact O-N 3.08Å; I247-S249 VanDerWaalsContact C-N 3.34Å; I247-S249 PolarHBondContact O-N 3.5Å; S249-K252 PolarHBondContact O-N 2.81Å; S249-V253 WeakPolarHBondContact O-CG2 3.39Å; S249-V253 PolarHBondContact O-N 3.49Å
250	Y	90.1	Very high	86	Confident	9 Å²	9	26.1 Å²	26.1	4%	0.035	14%	0.135	C	C	.	.	H	α-helix	trans	-60.7	-49.6	175.6	173.9	-90.1	0	0	0	111.6	M201 L204 M246 I247 K252 V253 L254 F343 W529	M201-Y250 HydrophobicContact CB-CE2 4.29Å; M201-Y250 HydrophobicContact CG-CE2 4.48Å; L204-Y250 HydrophobicContact CB-CD2 4.36Å; L204-Y250 HydrophobicContact CD1-CG 4.31Å; L204-Y250 HydrophobicContact CD2-CD1 4.08Å; L204-Y250 HydrophobicContact CD2-CD2 3.95Å; L204-Y250 HydrophobicContact CD2-CE1 4.21Å; L204-Y250 HydrophobicContact CD2-CE2 4.06Å; L204-Y250 HydrophobicContact CD2-CG 3.96Å; M246-Y250 PolarHBondContact O-N 3.29Å; I247-Y250 PolarHBondContact O-N 2.83Å; Y250-K252 VanDerWaalsContact C-N 3.29Å; Y250-K252 PolarHBondContact O-N 3.06Å; Y250-V253 PolarHBondContact O-N 3.17Å; Y250-L254 HydrophobicContact CD1-CD2 4.41Å; Y250-L254 HydrophobicContact CE1-CB 4.4Å; Y250-L254 HydrophobicContact CE1-CD2 3.61Å; Y250-L254 WeakPolarHBondContact O-CB 3.43Å; Y250-L254 PolarHBondContact O-N 3.41Å; Y250-F343 AromaticContact CD1-CE2 3.82Å; Y250-F343 HydrophobicContact CD1-CE2 3.82Å; Y250-F343 HydrophobicContact CD1-CZ 4.24Å; Y250-F343 AromaticContact CE1-CE2 3.46Å; Y250-F343 HydrophobicContact CE1-CE2 3.46Å; Y250-F343 VanDerWaalsContact CE1-CE2 3.46Å; Y250-F343 AromaticContact CE1-CZ 3.44Å; Y250-F343 HydrophobicContact CE1-CZ 3.44Å; Y250-F343 VanDerWaalsContact CE1-CZ 3.44Å; Y250-F343 AromaticContact CZ-CZ 3.81Å; Y250-W529 HydrophobicContact CD2-CZ2 4.25Å; Y250-W529 AromaticContact CE2-CE2 3.98Å; Y250-W529 AromaticContact CE2-CZ2 3.81Å; Y250-W529 HydrophobicContact CE2-CZ2 3.81Å; Y250-W529 AromaticContact CE2-NE1 3.51Å; Y250-W529 AromaticContact CZ-NE1 3.57Å; Y250-W529 PolarHBondContact OH-NE1 3.13Å
251	Q	88.1	Confident	84.9	Confident	35 Å²	35	27.6 Å²	27.6	16%	0.164	14%	0.141	C	C	.	.	H	α-helix	trans	-63.6	-34.5	179.5	-69.1	-71.7	-32.3	0	0	112.1	I247 R255	I247-Q251 HydrophobicContact CG2-CG 4.31Å; I247-Q251 WeakPolarHBondContact O-CB 3.36Å; I247-Q251 VanDerWaalsContact O-CG 3.27Å; I247-Q251 WeakPolarHBondContact O-CG 3.46Å; I247-Q251 PolarHBondContact O-N 2.7Å; Q251-R255 WeakPolarHBondContact O-CB 3.45Å; Q251-R255 PolarHBondContact O-N 3.45Å
252	K	88.3	Confident	84	Confident	15 Å²	15	29.9 Å²	29.9	7%	0.065	15%	0.15	C	C	.	.	H	α-helix	trans	-61.7	-55.7	171.2	178.4	175.6	177.8	46.9	0	111.8	A248 S249 Y250 R255 D256 M264 Y266 V269	A248-K252 VanDerWaalsContact O-CB 3.23Å; A248-K252 WeakPolarHBondContact O-CB 3.44Å; A248-K252 PolarHBondContact O-N 2.74Å; S249-K252 PolarHBondContact O-N 2.81Å; Y250-K252 VanDerWaalsContact C-N 3.29Å; Y250-K252 PolarHBondContact O-N 3.06Å; K252-R255 PolarHBondContact O-N 2.85Å; K252-D256 WeakPolarHBondContact CE-OD2 3.39Å; K252-D256 WeakPolarHBondContact CG-OD2 3.35Å; K252-D256 IonicContact NZ-OD2 3.89Å; K252-D256 PolarHBondContact NZ-OD2 3.29Å; K252-D256 WeakPolarHBondContact O-CB 3.08Å; K252-D256 PolarHBondContact O-N 3.47Å; K252-M264 PolarHBondContact NZ-O 3.02Å; K252-Y266 HydrophobicContact CD-CE1 4.45Å; K252-Y266 WeakPolarHBondContact CE-OH 3.32Å; K252-V269 HydrophobicContact CB-CG2 4.38Å; K252-V269 HydrophobicContact CD-CG2 4.02Å; K252-V269 HydrophobicContact CG-CG2 4.35Å
253	V	87.2	Confident	83.3	Confident	21 Å²	21	33 Å²	33	13%	0.127	17%	0.17	C	C	.	.	H	α-helix	trans	-66.8	-40.5	-176.2	-173.5	0	0	0	0	110.8	T200 S249 Y250 R255 D256 S257 W529	T200-V253 HydrophobicContact CG2-CG2 3.97Å; S249-V253 WeakPolarHBondContact O-CG2 3.39Å; S249-V253 PolarHBondContact O-N 3.49Å; Y250-V253 PolarHBondContact O-N 3.17Å; V253-R255 PolarHBondContact O-N 3.26Å; V253-D256 PolarHBondContact O-N 3.13Å; V253-S257 WeakPolarHBondContact O-CB 3.32Å; V253-S257 PolarHBondContact O-N 3.26Å; V253-S257 PolarHBondContact O-OG 3.5Å; V253-W529 HydrophobicContact CB-CH2 4.06Å; V253-W529 HydrophobicContact CG1-CH2 3.76Å; V253-W529 HydrophobicContact CG1-CZ3 4.22Å
254	L	84.2	Confident	82.5	Confident	7 Å²	7	33.1 Å²	33.1	4%	0.037	17%	0.171	C	C	.	.	H	α-helix	trans	-57.5	-28.8	174.3	173.5	63.8	0	0	0	113.4	Y250 S257 R258 W529	Y250-L254 HydrophobicContact CD1-CD2 4.41Å; Y250-L254 HydrophobicContact CE1-CB 4.4Å; Y250-L254 HydrophobicContact CE1-CD2 3.61Å; Y250-L254 WeakPolarHBondContact O-CB 3.43Å; Y250-L254 PolarHBondContact O-N 3.41Å; L254-S257 PolarHBondContact O-OG 2.82Å; L254-S257 VanDerWaalsContact O-OG 3.14Å; L254-R258 WeakPolarHBondContact O-CG 3.29Å; L254-W529 HydrophobicContact CB-CH2 4.13Å; L254-W529 HydrophobicContact CB-CZ2 4.01Å; L254-W529 HydrophobicContact CD1-CD2 3.71Å; L254-W529 HydrophobicContact CD1-CE3 4.13Å; L254-W529 HydrophobicContact CD1-CG 3.9Å; L254-W529 HydrophobicContact CD1-CZ2 4.38Å
255	R	81.7	Confident	82.1	Confident	27 Å²	27	36.3 Å²	36.3	10%	0.102	19%	0.193	C	C	.	.	H	α-helix	trans	-90.9	-44.2	175.8	-177.8	165.5	176.8	113	4.9	112.7	Q251 K252 V253 S257 R258 L262 D413	Q251-R255 WeakPolarHBondContact O-CB 3.45Å; Q251-R255 PolarHBondContact O-N 3.45Å; K252-R255 PolarHBondContact O-N 2.85Å; V253-R255 PolarHBondContact O-N 3.26Å; R255-S257 PolarHBondContact O-N 3.02Å; R255-R258 PolarHBondContact O-N 3.4Å; R255-R258 VanDerWaalsContact O-N 3.15Å; R255-L262 VanDerWaalsContact CZ-O 3.31Å; R255-L262 PolarHBondContact NE-O 3.05Å; R255-L262 PolarHBondContact NH2-O 2.74Å; R255-D413 IonicContact CZ-OD1 3.67Å; R255-D413 IonicContact CZ-OD2 3.88Å; R255-D413 VanDerWaalsContact NH1-CG 3.26Å; R255-D413 IonicContact NH1-OD1 2.75Å; R255-D413 PolarHBondContact NH1-OD1 2.96Å; R255-D413 IonicContact NH1-OD2 2.65Å; R255-D413 PolarHBondContact NH1-OD2 3.46Å; R255-D413 IonicContact NH2-OD1 3.72Å; R255-D413 PolarHBondContact NH2-OD1 3.43Å; R255-D413 IonicContact NH2-OD2 2.76Å
256	D	81.4	Confident	81.8	Confident	47 Å²	47	36.2 Å²	36.2	25%	0.251	19%	0.193	S	C	.	.	H	α-helix	trans	-64.5	-19.3	179.3	-71.5	-6.4	0	0	0	112.1	K252 V253 R258 P263 M264	K252-D256 WeakPolarHBondContact CE-OD2 3.39Å; K252-D256 WeakPolarHBondContact CG-OD2 3.35Å; K252-D256 IonicContact NZ-OD2 3.89Å; K252-D256 PolarHBondContact NZ-OD2 3.29Å; K252-D256 WeakPolarHBondContact O-CB 3.08Å; K252-D256 PolarHBondContact O-N 3.47Å; V253-D256 PolarHBondContact O-N 3.13Å; D256-R258 VanDerWaalsContact C-N 3.29Å; D256-R258 PolarHBondContact O-N 2.86Å; D256-P263 VanDerWaalsContact OD1-CA 3.24Å; D256-P263 WeakPolarHBondContact OD1-CA 3.44Å; D256-P263 VanDerWaalsContact OD1-CB 3.24Å; D256-P263 WeakPolarHBondContact OD1-CB 3.23Å; D256-M264 PolarHBondContact OD1-N 2.92Å
257	S	77.7	Confident	81.6	Confident	6 Å²	6	43.4 Å²	43.4	4%	0.042	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	4.6	173.9	71.9	0	0	0	0	115.4	V253 L254 R255 W529 F533	V253-S257 WeakPolarHBondContact O-CB 3.32Å; V253-S257 PolarHBondContact O-N 3.26Å; V253-S257 PolarHBondContact O-OG 3.5Å; L254-S257 PolarHBondContact O-OG 2.82Å; L254-S257 VanDerWaalsContact O-OG 3.14Å; R255-S257 PolarHBondContact O-N 3.02Å; S257-W529 WeakPolarHBondContact OG-CZ3 3.47Å; S257-F533 VanDerWaalsContact CB-CZ 3.5Å; S257-F533 VanDerWaalsContact O-CE2 3.29Å; S257-F533 WeakPolarHBondContact O-CE2 3.37Å
258	R	72.8	Confident	81.5	Confident	10 Å²	10	43.4 Å²	43.4	4%	0.038	22%	0.224	C	C	.	.			trans	-118.3	105.1	-171.7	-52.9	-162.8	80.9	-163.2	9.5	112.6	L254 R255 D256 D260 K261 K524 R525 Y526 D530	L254-R258 WeakPolarHBondContact O-CG 3.29Å; R255-R258 PolarHBondContact O-N 3.4Å; R255-R258 VanDerWaalsContact O-N 3.15Å; D256-R258 VanDerWaalsContact C-N 3.29Å; D256-R258 PolarHBondContact O-N 2.86Å; R258-D260 PolarHBondContact O-N 3.04Å; R258-K261 HydrophobicContact CB-CB 4.47Å; R258-K261 PolarHBondContact O-N 3.48Å; R258-K524 PolarHBondContact NH2-O 3.48Å; R258-R525 PolarHBondContact NH1-O 2.9Å; R258-Y526 VanDerWaalsContact CZ-O 3.28Å; R258-Y526 PolarHBondContact NH1-O 2.64Å; R258-Y526 PolarHBondContact NH2-O 2.71Å; R258-D530 IonicContact CZ-OD1 3.77Å; R258-D530 IonicContact NE-OD1 3.83Å; R258-D530 PolarHBondContact NE-OD1 2.78Å; R258-D530 IonicContact NH2-OD1 2.73Å; R258-D530 PolarHBondContact NH2-OD1 3.37Å
259	D	69.3	Low	81.4	Confident	126 Å²	126	43.4 Å²	43.4	67%	0.674	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-19.6	-179.4	-69.2	-31.4	0	0	0	115.1
260	D	65.4	Low	81.5	Confident	80 Å²	80	47.6 Å²	47.6	43%	0.428	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-11.7	176.9	59.3	-65.9	0	0	0	115	R258 R523	R258-D260 PolarHBondContact O-N 3.04Å; D260-R523 VanDerWaalsContact CG-NH1 3.26Å; D260-R523 IonicContact OD1-CZ 3.56Å; D260-R523 IonicContact OD1-NH1 2.86Å; D260-R523 PolarHBondContact OD1-NH1 3.4Å; D260-R523 IonicContact OD1-NH2 2.71Å; D260-R523 PolarHBondContact OD1-NH2 2.9Å
261	K	69.9	Low	81.6	Confident	49 Å²	49	47.5 Å²	47.5	21%	0.213	25%	0.246	C	C	.	.	S	Bend	trans	-122.2	139.2	-172.6	-56.6	-149.9	179.9	-173.2	0	111.2	R258 E347	R258-K261 HydrophobicContact CB-CB 4.47Å; R258-K261 PolarHBondContact O-N 3.48Å; K261-E347 IonicContact NZ-OE1 3.23Å; K261-E347 PolarHBondContact NZ-OE1 3.4Å
262	L	73.1	Confident	81.8	Confident	124 Å²	124	46 Å²	46	65%	0.649	24%	0.239	S	C	*	.			trans	-63.6	134.2	178.2	-69.9	174.5	0	0	0	110.7	R255	R255-L262 VanDerWaalsContact CZ-O 3.31Å; R255-L262 PolarHBondContact NE-O 3.05Å; R255-L262 PolarHBondContact NH2-O 2.74Å
263	P	77.7	Confident	82	Confident	70 Å²	70	46.6 Å²	46.6	46%	0.455	24%	0.243	S	C	.	.			trans	-65.6	152.2	-175.4	26.5	-35.3	0	0	0	112.4	D256 S265	D256-P263 VanDerWaalsContact OD1-CA 3.24Å; D256-P263 WeakPolarHBondContact OD1-CA 3.44Å; D256-P263 VanDerWaalsContact OD1-CB 3.24Å; D256-P263 WeakPolarHBondContact OD1-CB 3.23Å; P263-S265 PolarHBondContact O-N 3.08Å
264	M	76.9	Confident	82.4	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.03	25%	0.251	C	S	.	.			trans	-77.9	113.9	-169.6	-163.1	168	-177.5	0	0	112	K252 D256 A268 V269 Q272 Y406	K252-M264 PolarHBondContact NZ-O 3.02Å; D256-M264 PolarHBondContact OD1-N 2.92Å; M264-A268 HydrophobicContact CE-CB 4.04Å; M264-A268 HydrophobicContact CG-CB 4.22Å; M264-V269 HydrophobicContact CB-CG2 4.35Å; M264-V269 HydrophobicContact CE-CG2 4.33Å; M264-V269 HydrophobicContact CG-CG2 3.77Å; M264-V269 HydrophobicContact SD-CG2 4.07Å; M264-Q272 HydrophobicContact CE-CB 4.21Å; M264-Q272 VanDerWaalsContact CE-OE1 3.23Å; M264-Y406 HydrophobicContact CE-CE2 3.59Å
265	S	85.1	Confident	82.9	Confident	70 Å²	70	48.2 Å²	48.2	49%	0.49	25%	0.25	S	C	.	.			trans	-61.7	138.4	175.7	179.3	0	0	0	0	111.6	P263 K267 A268 V269	P263-S265 PolarHBondContact O-N 3.08Å; S265-K267 PolarHBondContact O-N 2.82Å; S265-K267 VanDerWaalsContact O-N 3.11Å; S265-A268 WeakPolarHBondContact O-CA 3.4Å; S265-A268 VanDerWaalsContact O-CB 3.28Å; S265-A268 WeakPolarHBondContact O-CB 3.37Å; S265-A268 PolarHBondContact O-N 2.9Å; S265-V269 PolarHBondContact O-N 3.09Å; S265-V269 VanDerWaalsContact O-N 3.12Å
266	Y	85.9	Confident	83.5	Confident	48 Å²	48	47.1 Å²	47.1	19%	0.188	25%	0.246	C	C	.	.	H	α-helix	trans	-56.6	-30	-179.3	-80.3	-75.5	0	0	0	114.2	L44 D45 W48 K252 A268 V269 I270	L44-Y266 HydrophobicContact CD2-CD1 3.95Å; L44-Y266 HydrophobicContact CD2-CD2 4.09Å; L44-Y266 HydrophobicContact CD2-CE1 3.52Å; L44-Y266 HydrophobicContact CD2-CE2 3.68Å; L44-Y266 HydrophobicContact CD2-CG 4.21Å; D45-Y266 PolarHBondContact OD1-OH 3.04Å; W48-Y266 HydrophobicContact CD2-CE1 4.25Å; W48-Y266 HydrophobicContact CE3-CD1 4.19Å; W48-Y266 AromaticContact CE3-CE1 3.6Å; W48-Y266 HydrophobicContact CE3-CE1 3.6Å; W48-Y266 AromaticContact CZ3-CD1 3.94Å; W48-Y266 HydrophobicContact CZ3-CD1 3.94Å; W48-Y266 AromaticContact CZ3-CE1 3.8Å; W48-Y266 HydrophobicContact CZ3-CE1 3.8Å; K252-Y266 HydrophobicContact CD-CE1 4.45Å; K252-Y266 WeakPolarHBondContact CE-OH 3.32Å; Y266-A268 VanDerWaalsContact C-N 3.32Å; Y266-A268 PolarHBondContact O-N 2.77Å; Y266-V269 PolarHBondContact O-N 2.85Å; Y266-I270 WeakPolarHBondContact O-CG1 3.31Å; Y266-I270 PolarHBondContact O-N 3.29Å
267	K	88.4	Confident	84.1	Confident	156 Å²	156	47.2 Å²	47.2	68%	0.678	24%	0.244	S	C	*	.	H	α-helix	trans	-61.7	-39.8	171.5	-68	-174.2	176.3	-174.5	0	112.4	S265 A271 L410	S265-K267 PolarHBondContact O-N 2.82Å; S265-K267 VanDerWaalsContact O-N 3.11Å; K267-A271 PolarHBondContact O-N 3.03Å; K267-A271 VanDerWaalsContact O-N 3.09Å; K267-L410 HydrophobicContact CB-CD2 4.2Å
268	A	87.8	Confident	85	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-71.6	-36.5	178.5	0	0	0	0	0	111.8	M264 S265 Y266 A271 Q272 Y406 L410	M264-A268 HydrophobicContact CE-CB 4.04Å; M264-A268 HydrophobicContact CG-CB 4.22Å; S265-A268 WeakPolarHBondContact O-CA 3.4Å; S265-A268 VanDerWaalsContact O-CB 3.28Å; S265-A268 WeakPolarHBondContact O-CB 3.37Å; S265-A268 PolarHBondContact O-N 2.9Å; Y266-A268 VanDerWaalsContact C-N 3.32Å; Y266-A268 PolarHBondContact O-N 2.77Å; A268-A271 PolarHBondContact O-N 3.31Å; A268-Q272 WeakPolarHBondContact O-CB 3.4Å; A268-Q272 PolarHBondContact O-N 2.85Å; A268-Y406 HydrophobicContact CB-CD2 4.38Å; A268-Y406 HydrophobicContact CB-CE2 4.1Å; A268-L410 HydrophobicContact CB-CB 3.99Å; A268-L410 VanDerWaalsContact CB-O 3.27Å; A268-L410 WeakPolarHBondContact CB-O 3.42Å
269	V	90.1	Very high	86.1	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.2	-44.6	173.9	-171.3	0	0	0	0	110.8	W48 A248 K252 M264 S265 Y266 Q272 M273	W48-V269 HydrophobicContact CH2-CB 4.48Å; W48-V269 HydrophobicContact CH2-CG1 3.49Å; W48-V269 VanDerWaalsContact CH2-CG1 3.49Å; W48-V269 HydrophobicContact CZ2-CG1 3.87Å; W48-V269 HydrophobicContact CZ3-CG1 4.49Å; A248-V269 HydrophobicContact CB-CG1 3.98Å; K252-V269 HydrophobicContact CB-CG2 4.38Å; K252-V269 HydrophobicContact CD-CG2 4.02Å; K252-V269 HydrophobicContact CG-CG2 4.35Å; M264-V269 HydrophobicContact CB-CG2 4.35Å; M264-V269 HydrophobicContact CE-CG2 4.33Å; M264-V269 HydrophobicContact CG-CG2 3.77Å; M264-V269 HydrophobicContact SD-CG2 4.07Å; S265-V269 PolarHBondContact O-N 3.09Å; S265-V269 VanDerWaalsContact O-N 3.12Å; Y266-V269 PolarHBondContact O-N 2.85Å; V269-Q272 PolarHBondContact O-N 3.14Å; V269-M273 HydrophobicContact CG1-SD 4.41Å; V269-M273 VanDerWaalsContact O-CG 3.31Å; V269-M273 WeakPolarHBondContact O-CG 3.44Å; V269-M273 PolarHBondContact O-N 2.99Å
270	I	91.5	Very high	87.4	Confident	93 Å²	93	42.8 Å²	42.8	48%	0.477	22%	0.219	S	C	.	.	H	α-helix	trans	-63.2	-42.6	176.3	-67.3	163.9	0	0	0	111.3	Y266 Q272 M273 L274	Y266-I270 WeakPolarHBondContact O-CG1 3.31Å; Y266-I270 PolarHBondContact O-N 3.29Å; I270-Q272 VanDerWaalsContact C-N 3.32Å; I270-Q272 PolarHBondContact O-N 2.73Å; I270-M273 WeakPolarHBondContact O-CB 3.49Å; I270-M273 PolarHBondContact O-N 3.4Å; I270-L274 HydrophobicContact CG2-CD1 4.25Å; I270-L274 WeakPolarHBondContact O-CG 3.41Å; I270-L274 PolarHBondContact O-N 3.4Å
271	A	91.8	Very high	88.8	Confident	7 Å²	7	39.3 Å²	39.3	6%	0.058	20%	0.203	C	C	.	.	H	α-helix	trans	-63	-37.9	175	0	0	0	0	0	112.5	K267 A268 L274 W275 L410	K267-A271 PolarHBondContact O-N 3.03Å; K267-A271 VanDerWaalsContact O-N 3.09Å; A268-A271 PolarHBondContact O-N 3.31Å; A271-L274 PolarHBondContact O-N 3.47Å; A271-W275 WeakPolarHBondContact O-CB 3.23Å; A271-W275 PolarHBondContact O-N 3.48Å; A271-L410 HydrophobicContact CB-CD1 3.45Å; A271-L410 VanDerWaalsContact CB-CD1 3.45Å
272	Q	91.2	Very high	90.1	Very high	4 Å²	4	37 Å²	37	2%	0.019	19%	0.193	C	C	.	.	H	α-helix	trans	-67.8	-37.5	174.1	-177.8	169.1	46.5	0	0	112.5	A248 M264 A268 V269 I270 W275 H276	A248-Q272 HydrophobicContact CB-CG 4.46Å; M264-Q272 HydrophobicContact CE-CB 4.21Å; M264-Q272 VanDerWaalsContact CE-OE1 3.23Å; A268-Q272 WeakPolarHBondContact O-CB 3.4Å; A268-Q272 PolarHBondContact O-N 2.85Å; V269-Q272 PolarHBondContact O-N 3.14Å; I270-Q272 VanDerWaalsContact C-N 3.32Å; I270-Q272 PolarHBondContact O-N 2.73Å; Q272-W275 HydrophobicContact CG-CE3 4.28Å; Q272-H276 VanDerWaalsContact CG-NE2 3.35Å; Q272-H276 WeakPolarHBondContact CG-NE2 3.39Å; Q272-H276 PolarHBondContact NE2-NE2 2.8Å; Q272-H276 PolarHBondContact O-CD2 2.61Å; Q272-H276 PolarHBondContact O-N 2.72Å
273	M	93.4	Very high	91.2	Very high	27 Å²	27	31.1 Å²	31.1	13%	0.133	16%	0.162	C	C	.	.	H	α-helix	trans	-59.6	-47.8	171.8	-71.2	163.9	143.7	0	0	111.2	W48 W245 A248 V269 I270 H276 F277	W48-M273 HydrophobicContact CH2-CE 3.3Å; W48-M273 HydrophobicContact CH2-SD 4.06Å; W48-M273 HydrophobicContact CZ2-CE 3.66Å; W48-M273 HydrophobicContact CZ3-CE 4.26Å; W245-M273 HydrophobicContact CB-CE 3.85Å; W245-M273 HydrophobicContact CD2-CE 3.36Å; W245-M273 HydrophobicContact CE3-CE 3.17Å; W245-M273 HydrophobicContact CE3-SD 4.49Å; W245-M273 HydrophobicContact CG-CE 3.69Å; W245-M273 HydrophobicContact CZ3-CE 3.8Å; A248-M273 HydrophobicContact CB-CB 4.45Å; A248-M273 HydrophobicContact CB-CE 4.31Å; A248-M273 HydrophobicContact CB-CG 3.35Å; A248-M273 HydrophobicContact CB-SD 4.47Å; V269-M273 HydrophobicContact CG1-SD 4.41Å; V269-M273 VanDerWaalsContact O-CG 3.31Å; V269-M273 WeakPolarHBondContact O-CG 3.44Å; V269-M273 PolarHBondContact O-N 2.99Å; I270-M273 WeakPolarHBondContact O-CB 3.49Å; I270-M273 PolarHBondContact O-N 3.4Å; M273-H276 PolarHBondContact O-N 3Å; M273-F277 WeakPolarHBondContact O-CB 3.34Å; M273-F277 PolarHBondContact O-N 3.5Å
274	L	94.8	Very high	92.1	Very high	58 Å²	58	27.9 Å²	27.9	30%	0.304	14%	0.141	S	C	.	.	H	α-helix	trans	-64.9	-43.5	179.7	-66.7	170.3	0	0	0	111.8	I270 A271 H276 F277 F278 F402	I270-L274 HydrophobicContact CG2-CD1 4.25Å; I270-L274 WeakPolarHBondContact O-CG 3.41Å; I270-L274 PolarHBondContact O-N 3.4Å; A271-L274 PolarHBondContact O-N 3.47Å; L274-H276 PolarHBondContact O-N 3.34Å; L274-F277 PolarHBondContact O-N 3.22Å; L274-F278 HydrophobicContact CB-CD2 4.45Å; L274-F278 HydrophobicContact CB-CE2 4.46Å; L274-F278 HydrophobicContact CD2-CE2 4.15Å; L274-F278 WeakPolarHBondContact O-CD2 3.43Å; L274-F278 PolarHBondContact O-N 2.95Å; L274-F402 HydrophobicContact CB-CB 4.35Å; L274-F402 HydrophobicContact CB-CD1 4.04Å; L274-F402 HydrophobicContact CB-CD2 3.83Å; L274-F402 HydrophobicContact CB-CE1 4.31Å; L274-F402 HydrophobicContact CB-CE2 4.09Å; L274-F402 HydrophobicContact CB-CG 3.81Å; L274-F402 HydrophobicContact CB-CZ 4.34Å; L274-F402 HydrophobicContact CD1-CD1 4.13Å; L274-F402 HydrophobicContact CD1-CE1 3.69Å; L274-F402 HydrophobicContact CD1-CE2 4.38Å; L274-F402 HydrophobicContact CD1-CZ 3.84Å
275	W	94.5	Very high	93	Very high	3 Å²	3	29 Å²	29	1%	0.011	15%	0.148	C	C	.	.	H	α-helix	trans	-54.5	-51.7	173.3	166	24.7	0	0	0	111.9	A271 Q272 T279 M354 Y358 G399 F402 M403 Y406 Y407	A271-W275 WeakPolarHBondContact O-CB 3.23Å; A271-W275 PolarHBondContact O-N 3.48Å; Q272-W275 HydrophobicContact CG-CE3 4.28Å; W275-T279 WeakPolarHBondContact O-CB 3.46Å; W275-T279 WeakPolarHBondContact O-CG2 3.49Å; W275-T279 PolarHBondContact O-N 3.07Å; W275-T279 PolarHBondContact O-OG1 3.3Å; W275-M354 HydrophobicContact CH2-CE 3.97Å; W275-M354 HydrophobicContact CZ2-CE 3.75Å; W275-Y358 HydrophobicContact CZ2-CE2 4.2Å; W275-Y358 WeakPolarHBondContact CZ2-OH 3.45Å; W275-Y358 AromaticContact NE1-CZ 3.7Å; W275-Y358 PolarHBondContact NE1-OH 2.85Å; W275-G399 VanDerWaalsContact CD1-O 3.29Å; W275-F402 HydrophobicContact CB-CB 3.93Å; W275-M403 HydrophobicContact CD2-CB 3.84Å; W275-M403 HydrophobicContact CD2-CG 3.98Å; W275-M403 HydrophobicContact CG-CB 3.8Å; W275-M403 HydrophobicContact CG-CG 4.44Å; W275-M403 HydrophobicContact CH2-CG 4.34Å; W275-M403 HydrophobicContact CZ2-CB 4.48Å; W275-M403 HydrophobicContact CZ2-CG 3.76Å; W275-M403 HydrophobicContact CZ2-SD 4.19Å; W275-Y406 AromaticContact CE3-CD1 3.95Å; W275-Y406 HydrophobicContact CE3-CD1 3.95Å; W275-Y406 HydrophobicContact CE3-CG 4.43Å; W275-Y406 AromaticContact CZ3-CD1 3.64Å; W275-Y406 HydrophobicContact CZ3-CD1 3.64Å; W275-Y406 AromaticContact CZ3-CE1 3.99Å; W275-Y406 HydrophobicContact CZ3-CE1 3.99Å; W275-Y407 AromaticContact CH2-CE2 3.58Å; W275-Y407 HydrophobicContact CH2-CE2 3.58Å; W275-Y407 HydrophobicContact CZ2-CE2 4.4Å; W275-Y407 AromaticContact CZ3-CE2 3.72Å; W275-Y407 HydrophobicContact CZ3-CE2 3.72Å
276	H	94.4	Very high	93.5	Very high	5 Å²	5	25.7 Å²	25.7	2%	0.023	13%	0.125	C	C	.	.	H	α-helix	trans	-69.2	-41.7	179.4	-71.6	-53.2	0	0	0	112.6	A244 I247 Q272 M273 L274 F278 T279 I280 W342	A244-H276 HydrophobicContact CB-CB 4.43Å; I247-H276 HydrophobicContact CD1-CB 4.11Å; I247-H276 VanDerWaalsContact CG2-CD2 3.49Å; I247-H276 WeakPolarHBondContact CG2-CD2 3.33Å; I247-H276 WeakPolarHBondContact CG2-NE2 3.32Å; Q272-H276 VanDerWaalsContact CG-NE2 3.35Å; Q272-H276 WeakPolarHBondContact CG-NE2 3.39Å; Q272-H276 PolarHBondContact NE2-NE2 2.8Å; Q272-H276 PolarHBondContact O-CD2 2.61Å; Q272-H276 PolarHBondContact O-N 2.72Å; M273-H276 PolarHBondContact O-N 3Å; L274-H276 PolarHBondContact O-N 3.34Å; H276-F278 PolarHBondContact O-N 2.94Å; H276-T279 PolarHBondContact O-N 3.19Å; H276-T279 PolarHBondContact O-OG1 3.38Å; H276-I280 HydrophobicContact CB-CD1 4.05Å; H276-I280 WeakPolarHBondContact O-CB 3.38Å; H276-I280 WeakPolarHBondContact O-CG1 3.28Å; H276-I280 PolarHBondContact O-N 2.89Å; H276-W342 PolarHBondContact CE1-O 2.72Å; H276-W342 VanDerWaalsContact CE1-O 3.26Å
277	F	95.4	Very high	94	Very high	48 Å²	48	23.4 Å²	23.4	21%	0.211	12%	0.116	C	C	.	.	H	α-helix	trans	-53.4	-50.9	175.6	175.5	-94	0	0	0	111.7	L240 V241 A244 M273 L274 G281	L240-F277 HydrophobicContact CB-CD2 4.31Å; L240-F277 HydrophobicContact CB-CE2 4.08Å; L240-F277 HydrophobicContact CD2-CD2 3.84Å; L240-F277 HydrophobicContact CD2-CE2 3.58Å; L240-F277 HydrophobicContact CD2-CG 4.44Å; L240-F277 HydrophobicContact CD2-CZ 4Å; L240-F277 HydrophobicContact CG-CD2 3.61Å; L240-F277 HydrophobicContact CG-CE2 3.69Å; L240-F277 HydrophobicContact CG-CG 4.44Å; V241-F277 HydrophobicContact CG2-CD2 3.88Å; V241-F277 HydrophobicContact CG2-CE2 3.62Å; A244-F277 HydrophobicContact CB-CB 3.86Å; M273-F277 WeakPolarHBondContact O-CB 3.34Å; M273-F277 PolarHBondContact O-N 3.5Å; L274-F277 PolarHBondContact O-N 3.22Å; F277-G281 WeakPolarHBondContact O-CA 3.16Å; F277-G281 PolarHBondContact O-N 2.96Å
278	F	96.4	Very high	94.3	Very high	42 Å²	42	16 Å²	16	18%	0.184	8%	0.084	C	C	.	.	H	α-helix	trans	-76.1	-38	-176.6	-74.6	-60	0	0	0	113.6	L274 H276 A282 S395 L398 F402	L274-F278 HydrophobicContact CB-CD2 4.45Å; L274-F278 HydrophobicContact CB-CE2 4.46Å; L274-F278 HydrophobicContact CD2-CE2 4.15Å; L274-F278 WeakPolarHBondContact O-CD2 3.43Å; L274-F278 PolarHBondContact O-N 2.95Å; H276-F278 PolarHBondContact O-N 2.94Å; F278-A282 WeakPolarHBondContact O-CB 3.06Å; F278-A282 PolarHBondContact O-N 3.12Å; F278-A282 VanDerWaalsContact O-N 3.14Å; F278-S395 WeakPolarHBondContact CB-O 3.49Å; F278-L398 HydrophobicContact CD1-CD2 4.01Å; F278-L398 HydrophobicContact CD1-CG 4.41Å; F278-L398 HydrophobicContact CD2-CD2 4.01Å; F278-L398 HydrophobicContact CD2-CG 3.88Å; F278-L398 HydrophobicContact CE1-CD2 3.67Å; F278-L398 HydrophobicContact CE1-CG 4.49Å; F278-L398 HydrophobicContact CE2-CD2 3.68Å; F278-L398 HydrophobicContact CE2-CG 3.98Å; F278-L398 HydrophobicContact CG-CB 4.39Å; F278-L398 HydrophobicContact CG-CD2 4.19Å; F278-L398 HydrophobicContact CG-CG 4.14Å; F278-L398 HydrophobicContact CZ-CD2 3.51Å; F278-L398 HydrophobicContact CZ-CG 4.29Å; F278-F402 AromaticContact CD2-CD2 3.75Å; F278-F402 HydrophobicContact CD2-CD2 3.75Å; F278-F402 AromaticContact CD2-CE2 3.85Å; F278-F402 HydrophobicContact CD2-CE2 3.85Å; F278-F402 HydrophobicContact CE2-CD2 4.02Å; F278-F402 AromaticContact CE2-CE2 3.62Å; F278-F402 HydrophobicContact CE2-CE2 3.62Å
279	T	95.8	Very high	94.6	Very high	7 Å²	7	16.1 Å²	16.1	4%	0.043	8%	0.084	C	C	.	.	H	α-helix	trans	-70.3	-41.7	177	50.9	0	0	0	0	112.6	W275 H276 R283 Y358	W275-T279 WeakPolarHBondContact O-CB 3.46Å; W275-T279 WeakPolarHBondContact O-CG2 3.49Å; W275-T279 PolarHBondContact O-N 3.07Å; W275-T279 PolarHBondContact O-OG1 3.3Å; H276-T279 PolarHBondContact O-N 3.19Å; H276-T279 PolarHBondContact O-OG1 3.38Å; T279-R283 PolarHBondContact O-N 2.93Å; T279-Y358 HydrophobicContact CG2-CE1 3.94Å
280	I	95.6	Very high	94.8	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-74.6	-39.5	178.7	-60.2	170.2	0	0	0	110.3	L240 L243 I247 H276 A282 R283 T284 C341	L240-I280 HydrophobicContact CD1-CB 4.25Å; L240-I280 HydrophobicContact CD1-CG2 4.04Å; L243-I280 HydrophobicContact CD2-CD1 3.53Å; L243-I280 HydrophobicContact CD2-CG2 4.02Å; I247-I280 HydrophobicContact CD1-CD1 3.28Å; H276-I280 HydrophobicContact CB-CD1 4.05Å; H276-I280 WeakPolarHBondContact O-CB 3.38Å; H276-I280 WeakPolarHBondContact O-CG1 3.28Å; H276-I280 PolarHBondContact O-N 2.89Å; I280-A282 VanDerWaalsContact C-N 3.33Å; I280-A282 PolarHBondContact O-N 3.43Å; I280-R283 CarbonylContact O-C 3.54Å; I280-R283 WeakPolarHBondContact O-CA 3.46Å; I280-R283 WeakPolarHBondContact O-CB 3.47Å; I280-R283 PolarHBondContact O-N 3.01Å; I280-T284 HydrophobicContact CG2-CG2 3.99Å; I280-T284 PolarHBondContact O-N 2.78Å; I280-T284 PolarHBondContact O-OG1 2.94Å; I280-C341 HydrophobicContact CD1-CB 3.7Å; I280-C341 HydrophobicContact CG1-CB 3.77Å
281	G	95.6	Very high	94.9	Very high	8 Å²	8	13.3 Å²	13.3	8%	0.082	7%	0.07	C	C	.	.	H	α-helix	trans	-57.3	-44.6	174.4	0	0	0	0	0	112.7	F277 R283 T284 V285	F277-G281 WeakPolarHBondContact O-CA 3.16Å; F277-G281 PolarHBondContact O-N 2.96Å; G281-R283 VanDerWaalsContact C-N 3.33Å; G281-R283 PolarHBondContact O-N 3.24Å; G281-T284 PolarHBondContact O-N 3Å; G281-T284 PolarHBondContact O-OG1 3.35Å; G281-V285 WeakPolarHBondContact O-CB 3.22Å; G281-V285 VanDerWaalsContact O-CG2 3.27Å; G281-V285 WeakPolarHBondContact O-CG2 3.42Å; G281-V285 PolarHBondContact O-N 3.15Å
282	A	96.8	Very high	94.8	Very high	1 Å²	1	14 Å²	14	1%	0.008	7%	0.074	C	C	.	.	H	α-helix	trans	-60.5	-41.8	173.5	0	0	0	0	0	112.3	F278 I280 A286 V392 F396	F278-A282 WeakPolarHBondContact O-CB 3.06Å; F278-A282 PolarHBondContact O-N 3.12Å; F278-A282 VanDerWaalsContact O-N 3.14Å; I280-A282 VanDerWaalsContact C-N 3.33Å; I280-A282 PolarHBondContact O-N 3.43Å; A282-A286 WeakPolarHBondContact O-CB 3.45Å; A282-A286 PolarHBondContact O-N 3.21Å; A282-V392 HydrophobicContact CB-CG1 4.49Å; A282-F396 HydrophobicContact CB-CB 3.85Å; A282-F396 HydrophobicContact CB-CD2 4.24Å
283	R	96.8	Very high	94.7	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-65	-47.7	178	-174	61.3	159.3	-177	0.8	112.2	T279 I280 G281 A286 F287 H305 I339 E364 N365	T279-R283 PolarHBondContact O-N 2.93Å; I280-R283 CarbonylContact O-C 3.54Å; I280-R283 WeakPolarHBondContact O-CA 3.46Å; I280-R283 WeakPolarHBondContact O-CB 3.47Å; I280-R283 PolarHBondContact O-N 3.01Å; G281-R283 VanDerWaalsContact C-N 3.33Å; G281-R283 PolarHBondContact O-N 3.24Å; R283-A286 PolarHBondContact O-N 3.49Å; R283-F287 HydrophobicContact CG-CE1 4.33Å; R283-F287 HydrophobicContact CG-CE2 4.07Å; R283-F287 HydrophobicContact CG-CZ 4.01Å; R283-F287 WeakPolarHBondContact O-CB 3.31Å; R283-F287 VanDerWaalsContact O-CG 3.3Å; R283-F287 WeakPolarHBondContact O-CG 3.4Å; R283-F287 PolarHBondContact O-N 2.85Å; R283-H305 PolarHBondContact NH2-CE1 3.48Å; R283-H305 PolarHBondContact NH2-NE2 2.83Å; R283-I339 PolarHBondContact NE-O 3.48Å; R283-I339 PolarHBondContact NH2-O 3.38Å; R283-E364 IonicContact CZ-OE2 2.68Å; R283-E364 IonicContact NH1-OE2 2.8Å; R283-E364 PolarHBondContact NH1-OE2 3.41Å; R283-E364 IonicContact NH2-OE2 3.2Å; R283-E364 PolarHBondContact NH2-OE2 3.37Å; R283-N365 WeakPolarHBondContact CD-OD1 3.44Å; R283-N365 PolarHBondContact NH1-OD1 3.39Å
284	T	95.6	Very high	94.5	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.006	9%	0.092	C	C	.	.	H	α-helix	trans	-70.4	-33.6	-178.6	55	0	0	0	0	112.4	L215 V216 I280 G281 A288 F340	L215-T284 HydrophobicContact CD2-CG2 4.25Å; V216-T284 HydrophobicContact CG2-CG2 3.79Å; I280-T284 HydrophobicContact CG2-CG2 3.99Å; I280-T284 PolarHBondContact O-N 2.78Å; I280-T284 PolarHBondContact O-OG1 2.94Å; G281-T284 PolarHBondContact O-N 3Å; G281-T284 PolarHBondContact O-OG1 3.35Å; T284-A288 VanDerWaalsContact O-CB 3.26Å; T284-A288 WeakPolarHBondContact O-CB 3.34Å; T284-A288 PolarHBondContact O-N 3.45Å; T284-F340 HydrophobicContact CG2-CD1 4.16Å; T284-F340 HydrophobicContact CG2-CE1 4.38Å
285	V	95.4	Very high	94.2	Very high	31 Å²	31	20.2 Å²	20.2	19%	0.188	10%	0.104	C	C	.	.	H	α-helix	trans	-69.1	-44.8	172.1	175	0	0	0	0	110.9	L219 G281 F287 A288 L289 V392	L219-V285 HydrophobicContact CD1-CG2 4.07Å; G281-V285 WeakPolarHBondContact O-CB 3.22Å; G281-V285 VanDerWaalsContact O-CG2 3.27Å; G281-V285 WeakPolarHBondContact O-CG2 3.42Å; G281-V285 PolarHBondContact O-N 3.15Å; V285-F287 VanDerWaalsContact C-N 3.3Å; V285-F287 PolarHBondContact O-N 3.49Å; V285-A288 PolarHBondContact O-N 3.43Å; V285-L289 HydrophobicContact CG1-CD1 3.84Å; V285-L289 HydrophobicContact CG1-CG 4.28Å; V285-L289 WeakPolarHBondContact O-CB 3.45Å; V285-L289 VanDerWaalsContact O-CG 3.24Å; V285-L289 WeakPolarHBondContact O-CG 3.45Å; V285-L289 PolarHBondContact O-N 3.01Å; V285-V392 HydrophobicContact CB-CG2 4.09Å; V285-V392 HydrophobicContact CG1-CG2 3.52Å
286	A	96.7	Very high	93.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.2	-40.2	175.4	0	0	0	0	0	112.5	A282 R283 F290 N365 V392	A282-A286 WeakPolarHBondContact O-CB 3.45Å; A282-A286 PolarHBondContact O-N 3.21Å; R283-A286 PolarHBondContact O-N 3.49Å; A286-F290 PolarHBondContact O-N 3.5Å; A286-F290 VanDerWaalsContact O-N 3.14Å; A286-N365 HydrophobicContact CB-CB 4.23Å; A286-V392 HydrophobicContact CB-CG1 4.33Å
287	F	96.4	Very high	93.8	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.4	-48.1	172.2	-73.3	-3.9	0	0	0	112.6	V216 R283 V285 L289 F290 A291 F298 F301 I302 I339 F340 L368	V216-F287 HydrophobicContact CG1-CB 3.79Å; V216-F287 HydrophobicContact CG2-CB 4.08Å; V216-F287 HydrophobicContact CG2-CD2 4.07Å; R283-F287 HydrophobicContact CG-CE1 4.33Å; R283-F287 HydrophobicContact CG-CE2 4.07Å; R283-F287 HydrophobicContact CG-CZ 4.01Å; R283-F287 WeakPolarHBondContact O-CB 3.31Å; R283-F287 VanDerWaalsContact O-CG 3.3Å; R283-F287 WeakPolarHBondContact O-CG 3.4Å; R283-F287 PolarHBondContact O-N 2.85Å; V285-F287 VanDerWaalsContact C-N 3.3Å; V285-F287 PolarHBondContact O-N 3.49Å; F287-L289 VanDerWaalsContact C-N 3.32Å; F287-L289 PolarHBondContact O-N 3.19Å; F287-F290 PolarHBondContact O-N 2.84Å; F287-A291 VanDerWaalsContact O-CB 3.23Å; F287-A291 WeakPolarHBondContact O-CB 3.42Å; F287-A291 PolarHBondContact O-N 2.98Å; F287-F298 HydrophobicContact CB-CE2 3.74Å; F287-F298 HydrophobicContact CB-CZ 4.01Å; F287-F298 HydrophobicContact CD1-CE2 4.2Å; F287-F298 HydrophobicContact CD2-CE2 4.31Å; F287-F298 HydrophobicContact CD2-CZ 4.36Å; F287-F298 AromaticContact CG-CE2 3.85Å; F287-F298 HydrophobicContact CG-CE2 3.85Å; F287-F298 HydrophobicContact CG-CZ 4.26Å; F287-F301 HydrophobicContact CD1-CE1 4.45Å; F287-F301 AromaticContact CE1-CE1 3.66Å; F287-F301 HydrophobicContact CE1-CE1 3.66Å; F287-F301 HydrophobicContact CE1-CZ 4.39Å; F287-F301 HydrophobicContact CZ-CE1 4.15Å; F287-I302 HydrophobicContact CD2-CD1 4.23Å; F287-I302 HydrophobicContact CE2-CD1 3.8Å; F287-I302 HydrophobicContact CZ-CD1 3.92Å; F287-I339 HydrophobicContact CE2-CG2 3.85Å; F287-I339 HydrophobicContact CZ-CG2 3.89Å; F287-F340 HydrophobicContact CD2-CD1 4.46Å; F287-F340 HydrophobicContact CD2-CE1 4.05Å; F287-F340 HydrophobicContact CE2-CD1 4.1Å; F287-F340 AromaticContact CE2-CE1 3.92Å; F287-F340 HydrophobicContact CE2-CE1 3.92Å; F287-L368 HydrophobicContact CD1-CD1 3.81Å; F287-L368 HydrophobicContact CE1-CD1 3.89Å
288	A	94.4	Very high	93.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63	-37.4	-178.7	0	0	0	0	0	112.7	V216 L219 I223 T284 V285 S292	V216-A288 HydrophobicContact CG1-CB 4.44Å; L219-A288 HydrophobicContact CB-CB 3.48Å; L219-A288 VanDerWaalsContact CB-CB 3.48Å; I223-A288 HydrophobicContact CD1-CB 3.94Å; T284-A288 VanDerWaalsContact O-CB 3.26Å; T284-A288 WeakPolarHBondContact O-CB 3.34Å; T284-A288 PolarHBondContact O-N 3.45Å; V285-A288 PolarHBondContact O-N 3.43Å; A288-S292 WeakPolarHBondContact O-CB 3.47Å; A288-S292 PolarHBondContact O-N 3.14Å
289	L	93.3	Very high	93.4	Very high	3 Å²	3	32.2 Å²	32.2	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-63.5	-54.3	173.3	-68.9	165.4	0	0	0	111	I223 V285 F287 A291 S292 T369 W372 V388 V392	I223-L289 HydrophobicContact CD1-CD2 3.78Å; I223-L289 HydrophobicContact CD1-CG 4.14Å; V285-L289 HydrophobicContact CG1-CD1 3.84Å; V285-L289 HydrophobicContact CG1-CG 4.28Å; V285-L289 WeakPolarHBondContact O-CB 3.45Å; V285-L289 VanDerWaalsContact O-CG 3.24Å; V285-L289 WeakPolarHBondContact O-CG 3.45Å; V285-L289 PolarHBondContact O-N 3.01Å; F287-L289 VanDerWaalsContact C-N 3.32Å; F287-L289 PolarHBondContact O-N 3.19Å; L289-A291 VanDerWaalsContact C-N 3.31Å; L289-A291 PolarHBondContact O-N 3.34Å; L289-S292 PolarHBondContact O-N 2.97Å; L289-S292 PolarHBondContact O-OG 3.49Å; L289-T369 HydrophobicContact CD1-CG2 4.45Å; L289-W372 HydrophobicContact CB-CB 4.09Å; L289-W372 HydrophobicContact CB-CD2 4.05Å; L289-W372 HydrophobicContact CB-CG 3.75Å; L289-W372 HydrophobicContact CD2-CD2 3.73Å; L289-W372 VanDerWaalsContact CD2-CE2 3.48Å; L289-W372 HydrophobicContact CD2-CE3 4.07Å; L289-W372 HydrophobicContact CD2-CG 4.28Å; L289-W372 HydrophobicContact CD2-CH2 4.01Å; L289-W372 HydrophobicContact CD2-CZ2 3.65Å; L289-W372 HydrophobicContact CD2-CZ3 4.2Å; L289-W372 HydrophobicContact CG-CD2 4.34Å; L289-V388 HydrophobicContact CD1-CG1 3.59Å; L289-V388 HydrophobicContact CD2-CG1 3.64Å; L289-V388 HydrophobicContact CG-CG1 4.21Å; L289-V392 HydrophobicContact CD1-CG2 4.1Å
290	F	94.8	Very high	93.4	Very high	26 Å²	26	36.6 Å²	36.6	11%	0.114	19%	0.191	C	C	.	.	H	α-helix	trans	-60.7	-40.8	179.5	-174.4	-97.4	0	0	0	112.2	A286 F287 S292 V293 F294 F298 L368 A371	A286-F290 PolarHBondContact O-N 3.5Å; A286-F290 VanDerWaalsContact O-N 3.14Å; F287-F290 PolarHBondContact O-N 2.84Å; F290-S292 VanDerWaalsContact C-N 3.29Å; F290-S292 PolarHBondContact O-N 3.44Å; F290-V293 PolarHBondContact O-N 2.74Å; F290-F294 HydrophobicContact CD1-CB 4.26Å; F290-F294 AromaticContact CD2-CD2 3.87Å; F290-F294 HydrophobicContact CD2-CD2 3.87Å; F290-F294 HydrophobicContact CE1-CB 3.82Å; F290-F294 HydrophobicContact CE2-CB 4.16Å; F290-F294 AromaticContact CE2-CD2 3.56Å; F290-F294 HydrophobicContact CE2-CD2 3.56Å; F290-F294 HydrophobicContact CE2-CE2 4.28Å; F290-F294 HydrophobicContact CE2-CG 4.13Å; F290-F294 HydrophobicContact CZ-CB 3.76Å; F290-F294 HydrophobicContact CZ-CD2 4.02Å; F290-F294 HydrophobicContact CZ-CG 4.12Å; F290-F294 PolarHBondContact O-N 2.99Å; F290-F298 HydrophobicContact CD1-CB 4Å; F290-F298 HydrophobicContact CD1-CD2 4.08Å; F290-F298 HydrophobicContact CE1-CB 4.2Å; F290-L368 HydrophobicContact CB-CB 4.13Å; F290-L368 HydrophobicContact CB-CD2 4Å; F290-L368 HydrophobicContact CD1-CD2 3.8Å; F290-L368 HydrophobicContact CD2-CB 4.4Å; F290-L368 HydrophobicContact CD2-CD2 3.64Å; F290-L368 HydrophobicContact CE1-CD2 4.15Å; F290-L368 HydrophobicContact CE2-CD2 4Å; F290-L368 HydrophobicContact CG-CB 4.42Å; F290-L368 HydrophobicContact CG-CD2 3.52Å; F290-L368 HydrophobicContact CZ-CD2 4.24Å; F290-A371 HydrophobicContact CD2-CB 4.16Å; F290-A371 HydrophobicContact CE2-CB 4.06Å
291	A	92.9	Very high	93.3	Very high	9 Å²	9	38.5 Å²	38.5	7%	0.074	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-29.3	175.3	0	0	0	0	0	113.4	F287 L289 V293 Q295 F298	F287-A291 VanDerWaalsContact O-CB 3.23Å; F287-A291 WeakPolarHBondContact O-CB 3.42Å; F287-A291 PolarHBondContact O-N 2.98Å; L289-A291 VanDerWaalsContact C-N 3.31Å; L289-A291 PolarHBondContact O-N 3.34Å; A291-V293 PolarHBondContact O-N 2.86Å; A291-Q295 WeakPolarHBondContact O-CG 3.41Å; A291-F298 HydrophobicContact CB-CB 4.28Å; A291-F298 HydrophobicContact CB-CD1 3.79Å; A291-F298 HydrophobicContact CB-CD2 4.3Å; A291-F298 HydrophobicContact CB-CE1 4.19Å; A291-F298 HydrophobicContact CB-CG 3.85Å
292	S	89.8	Confident	93.3	Very high	21 Å²	21	40 Å²	40	15%	0.147	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-14.1	179.7	96	0	0	0	0	113.8	A288 L289 F290 W372	A288-S292 WeakPolarHBondContact O-CB 3.47Å; A288-S292 PolarHBondContact O-N 3.14Å; L289-S292 PolarHBondContact O-N 2.97Å; L289-S292 PolarHBondContact O-OG 3.49Å; F290-S292 VanDerWaalsContact C-N 3.29Å; F290-S292 PolarHBondContact O-N 3.44Å; S292-W372 PolarHBondContact OG-NE1 3.37Å
293	V	89.3	Confident	93.2	Very high	54 Å²	54	44.1 Å²	44.1	33%	0.327	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	-40.9	177.2	178.4	0	0	0	0	111.4	F290 A291	F290-V293 PolarHBondContact O-N 2.74Å; A291-V293 PolarHBondContact O-N 2.86Å
294	F	89.8	Confident	93.1	Very high	46 Å²	46	47 Å²	47	20%	0.202	25%	0.25	C	S	.	.			trans	-118.6	47.4	-167.7	-65.4	-67.2	0	0	0	113.6	F290 L296 Y297 F298 Y375	F290-F294 HydrophobicContact CD1-CB 4.26Å; F290-F294 AromaticContact CD2-CD2 3.87Å; F290-F294 HydrophobicContact CD2-CD2 3.87Å; F290-F294 HydrophobicContact CE1-CB 3.82Å; F290-F294 HydrophobicContact CE2-CB 4.16Å; F290-F294 AromaticContact CE2-CD2 3.56Å; F290-F294 HydrophobicContact CE2-CD2 3.56Å; F290-F294 HydrophobicContact CE2-CE2 4.28Å; F290-F294 HydrophobicContact CE2-CG 4.13Å; F290-F294 HydrophobicContact CZ-CB 3.76Å; F290-F294 HydrophobicContact CZ-CD2 4.02Å; F290-F294 HydrophobicContact CZ-CG 4.12Å; F290-F294 PolarHBondContact O-N 2.99Å; F294-L296 VanDerWaalsContact C-N 3.34Å; F294-L296 PolarHBondContact O-N 3.07Å; F294-L296 VanDerWaalsContact O-N 3.11Å; F294-Y297 HydrophobicContact CB-CD2 4.27Å; F294-Y297 HydrophobicContact CD1-CD2 4.01Å; F294-Y297 HydrophobicContact CD1-CE2 4.47Å; F294-Y297 PolarHBondContact O-N 3.24Å; F294-F298 PolarHBondContact O-N 2.76Å; F294-Y375 AromaticContact CE2-CD2 3.94Å; F294-Y375 HydrophobicContact CE2-CD2 3.94Å; F294-Y375 HydrophobicContact CE2-CG 4.19Å; F294-Y375 HydrophobicContact CZ-CD1 4.41Å; F294-Y375 AromaticContact CZ-CD2 3.59Å; F294-Y375 HydrophobicContact CZ-CD2 3.59Å; F294-Y375 HydrophobicContact CZ-CE2 4.31Å; F294-Y375 AromaticContact CZ-CG 3.65Å; F294-Y375 HydrophobicContact CZ-CG 3.65Å
295	Q	87.9	Confident	93	Very high	119 Å²	119	47.2 Å²	47.2	56%	0.556	25%	0.251	S	S	*	.	H	α-helix	trans	-41.6	-50.3	-174.5	-66.4	179.4	-8.6	0	0	115.1	A291 G299	A291-Q295 WeakPolarHBondContact O-CG 3.41Å; Q295-G299 PolarHBondContact O-N 3Å
296	L	88.6	Confident	93	Very high	129 Å²	129	49.3 Å²	49.3	68%	0.675	26%	0.256	S	S	*	.	H	α-helix	trans	-72.7	-40.5	-178.4	-174.3	146.5	0	0	0	112.7	F294 F298 G299 I300	F294-L296 VanDerWaalsContact C-N 3.34Å; F294-L296 PolarHBondContact O-N 3.07Å; F294-L296 VanDerWaalsContact O-N 3.11Å; L296-F298 VanDerWaalsContact C-N 3.29Å; L296-F298 PolarHBondContact O-N 2.84Å; L296-G299 PolarHBondContact O-N 3.26Å; L296-I300 HydrophobicContact CD2-CD1 3.76Å; L296-I300 PolarHBondContact O-N 3.11Å
297	Y	92.4	Very high	92.8	Very high	147 Å²	147	52.3 Å²	52.3	58%	0.576	28%	0.276	S	S	*	.	H	α-helix	trans	-69.2	-28.4	176.4	-62.1	-79	0	0	0	112.2	F294 G299 I300 F301	F294-Y297 HydrophobicContact CB-CD2 4.27Å; F294-Y297 HydrophobicContact CD1-CD2 4.01Å; F294-Y297 HydrophobicContact CD1-CE2 4.47Å; F294-Y297 PolarHBondContact O-N 3.24Å; Y297-G299 VanDerWaalsContact C-N 3.34Å; Y297-I300 HydrophobicContact CD1-CD1 4.46Å; Y297-I300 PolarHBondContact O-N 3.37Å; Y297-F301 WeakPolarHBondContact O-CB 3.23Å; Y297-F301 PolarHBondContact O-N 3.47Å
298	F	92.9	Very high	92.7	Very high	38 Å²	38	56.6 Å²	56.6	17%	0.167	30%	0.302	C	S	.	.	H	α-helix	trans	-61	-42.2	172.7	177.9	-113.4	0	0	0	111.5	V216 F287 F290 A291 F294 L296 I300 F301 I302	V216-F298 HydrophobicContact CG1-CE1 4.31Å; V216-F298 HydrophobicContact CG1-CZ 3.93Å; F287-F298 HydrophobicContact CB-CE2 3.74Å; F287-F298 HydrophobicContact CB-CZ 4.01Å; F287-F298 HydrophobicContact CD1-CE2 4.2Å; F287-F298 HydrophobicContact CD2-CE2 4.31Å; F287-F298 HydrophobicContact CD2-CZ 4.36Å; F287-F298 AromaticContact CG-CE2 3.85Å; F287-F298 HydrophobicContact CG-CE2 3.85Å; F287-F298 HydrophobicContact CG-CZ 4.26Å; F290-F298 HydrophobicContact CD1-CB 4Å; F290-F298 HydrophobicContact CD1-CD2 4.08Å; F290-F298 HydrophobicContact CE1-CB 4.2Å; A291-F298 HydrophobicContact CB-CB 4.28Å; A291-F298 HydrophobicContact CB-CD1 3.79Å; A291-F298 HydrophobicContact CB-CD2 4.3Å; A291-F298 HydrophobicContact CB-CE1 4.19Å; A291-F298 HydrophobicContact CB-CG 3.85Å; F294-F298 PolarHBondContact O-N 2.76Å; L296-F298 VanDerWaalsContact C-N 3.29Å; L296-F298 PolarHBondContact O-N 2.84Å; F298-I300 PolarHBondContact O-N 2.92Å; F298-F301 PolarHBondContact O-N 3.21Å; F298-I302 HydrophobicContact CD1-CG1 4.47Å; F298-I302 HydrophobicContact CD2-CG1 4.08Å; F298-I302 HydrophobicContact CE1-CG1 4.05Å; F298-I302 HydrophobicContact CE2-CD1 3.7Å; F298-I302 HydrophobicContact CE2-CG1 3.61Å; F298-I302 HydrophobicContact CG-CG1 4.48Å; F298-I302 HydrophobicContact CZ-CD1 3.76Å; F298-I302 HydrophobicContact CZ-CG1 3.59Å; F298-I302 WeakPolarHBondContact O-CG1 3.47Å; F298-I302 PolarHBondContact O-N 2.82Å
299	G	91.6	Very high	92.5	Very high	36 Å²	36	57.2 Å²	57.2	37%	0.371	31%	0.305	S	S	.	.	H	α-helix	trans	-59.4	-44.9	172.6	0	0	0	0	0	112.9	Q295 L296 Y297 I302 V303	Q295-G299 PolarHBondContact O-N 3Å; L296-G299 PolarHBondContact O-N 3.26Å; Y297-G299 VanDerWaalsContact C-N 3.34Å; G299-I302 PolarHBondContact O-N 2.89Å; G299-V303 WeakPolarHBondContact O-CG2 3.41Å; G299-V303 PolarHBondContact O-N 3.28Å
300	I	93.9	Very high	92.4	Very high	99 Å²	99	57.3 Å²	57.3	51%	0.508	31%	0.306	S	S	.	.	H	α-helix	trans	-63.5	-41.4	176.6	-61.4	171.5	0	0	0	111.2	L296 Y297 F298 S304	L296-I300 HydrophobicContact CD2-CD1 3.76Å; L296-I300 PolarHBondContact O-N 3.11Å; Y297-I300 HydrophobicContact CD1-CD1 4.46Å; Y297-I300 PolarHBondContact O-N 3.37Å; F298-I300 PolarHBondContact O-N 2.92Å; I300-S304 WeakPolarHBondContact O-CB 3.45Å; I300-S304 PolarHBondContact O-N 3.31Å; I300-S304 PolarHBondContact O-OG 3.33Å
301	F	94.9	Very high	92.1	Very high	41 Å²	41	62 Å²	62	18%	0.18	33%	0.326	C	S	.	.	H	α-helix	trans	-62.5	-48.7	176.4	172.6	-93.5	0	0	0	111.5	F287 Y297 F298 V303 S304 H305 E364 L368	F287-F301 HydrophobicContact CD1-CE1 4.45Å; F287-F301 AromaticContact CE1-CE1 3.66Å; F287-F301 HydrophobicContact CE1-CE1 3.66Å; F287-F301 HydrophobicContact CE1-CZ 4.39Å; F287-F301 HydrophobicContact CZ-CE1 4.15Å; Y297-F301 WeakPolarHBondContact O-CB 3.23Å; Y297-F301 PolarHBondContact O-N 3.47Å; F298-F301 PolarHBondContact O-N 3.21Å; F301-V303 PolarHBondContact O-N 3.43Å; F301-S304 PolarHBondContact O-N 2.83Å; F301-S304 PolarHBondContact O-OG 2.81Å; F301-S304 VanDerWaalsContact O-OG 3.11Å; F301-H305 HydrophobicContact CE1-CB 4.48Å; F301-H305 HydrophobicContact CZ-CB 4.36Å; F301-H305 VanDerWaalsContact O-CB 3.23Å; F301-H305 WeakPolarHBondContact O-CB 3.41Å; F301-H305 PolarHBondContact O-N 3.15Å; F301-E364 HydrophobicContact CZ-CG 4.45Å; F301-L368 HydrophobicContact CD2-CD2 4.5Å; F301-L368 HydrophobicContact CE1-CD1 4.01Å; F301-L368 HydrophobicContact CE2-CD2 4.49Å; F301-L368 HydrophobicContact CZ-CD1 3.95Å
302	I	94.6	Very high	92	Very high	39 Å²	39	67 Å²	67	20%	0.2	34%	0.343	C	S	.	.	H	α-helix	trans	-62.3	-44	-179.7	-68.7	-67.3	0	0	0	111.5	F287 F298 G299 W306 I339	F287-I302 HydrophobicContact CD2-CD1 4.23Å; F287-I302 HydrophobicContact CE2-CD1 3.8Å; F287-I302 HydrophobicContact CZ-CD1 3.92Å; F298-I302 HydrophobicContact CD1-CG1 4.47Å; F298-I302 HydrophobicContact CD2-CG1 4.08Å; F298-I302 HydrophobicContact CE1-CG1 4.05Å; F298-I302 HydrophobicContact CE2-CD1 3.7Å; F298-I302 HydrophobicContact CE2-CG1 3.61Å; F298-I302 HydrophobicContact CG-CG1 4.48Å; F298-I302 HydrophobicContact CZ-CD1 3.76Å; F298-I302 HydrophobicContact CZ-CG1 3.59Å; F298-I302 WeakPolarHBondContact O-CG1 3.47Å; F298-I302 PolarHBondContact O-N 2.82Å; G299-I302 PolarHBondContact O-N 2.89Å; I302-W306 VanDerWaalsContact O-CB 3.25Å; I302-W306 WeakPolarHBondContact O-CB 3.27Å; I302-W306 PolarHBondContact O-N 3.33Å; I302-I339 HydrophobicContact CD1-CG2 3.75Å; I302-I339 HydrophobicContact CG2-CD1 4.34Å
303	V	94.8	Very high	91.7	Very high	88 Å²	88	66.4 Å²	66.4	53%	0.533	34%	0.338	S	S	.	.	H	α-helix	trans	-66.6	-43.3	177.8	173.7	0	0	0	0	111.7	G299 F301 W306 C307	G299-V303 WeakPolarHBondContact O-CG2 3.41Å; G299-V303 PolarHBondContact O-N 3.28Å; F301-V303 PolarHBondContact O-N 3.43Å; V303-W306 PolarHBondContact O-N 3.4Å; V303-C307 PolarHBondContact O-N 3.49Å; V303-C307 PolarHBondContact O-SG 3.35Å; V303-C307 VanDerWaalsContact O-SG 3.33Å
304	S	94.3	Very high	91.4	Very high	59 Å²	59	67.3 Å²	67.3	41%	0.413	34%	0.341	S	S	.	.	H	α-helix	trans	-69.4	-41.5	179.8	57.3	0	0	0	0	112.5	I300 F301 C307 V308	I300-S304 WeakPolarHBondContact O-CB 3.45Å; I300-S304 PolarHBondContact O-N 3.31Å; I300-S304 PolarHBondContact O-OG 3.33Å; F301-S304 PolarHBondContact O-N 2.83Å; F301-S304 PolarHBondContact O-OG 2.81Å; F301-S304 VanDerWaalsContact O-OG 3.11Å; S304-C307 PolarHBondContact O-N 2.88Å; S304-V308 WeakPolarHBondContact O-CG2 3.49Å; S304-V308 PolarHBondContact O-N 2.82Å
305	H	94.4	Very high	91	Very high	7 Å²	7	71.2 Å²	71.2	3%	0.032	36%	0.36	C	S	.	.	H	α-helix	trans	-62.5	-41.5	173.2	-175.8	97.8	0	0	0	111.9	R283 F301 V308 M309 E364	R283-H305 PolarHBondContact NH2-CE1 3.48Å; R283-H305 PolarHBondContact NH2-NE2 2.83Å; F301-H305 HydrophobicContact CE1-CB 4.48Å; F301-H305 HydrophobicContact CZ-CB 4.36Å; F301-H305 VanDerWaalsContact O-CB 3.23Å; F301-H305 WeakPolarHBondContact O-CB 3.41Å; F301-H305 PolarHBondContact O-N 3.15Å; H305-V308 PolarHBondContact O-N 3.01Å; H305-M309 WeakPolarHBondContact CE1-CE 3.19Å; H305-M309 WeakPolarHBondContact NE2-CG 3.35Å; H305-M309 WeakPolarHBondContact O-CB 3.39Å; H305-M309 WeakPolarHBondContact O-CG 3.36Å; H305-M309 PolarHBondContact O-N 3.46Å; H305-E364 IonicContact CE1-OE1 3.26Å; H305-E364 PolarHBondContact CE1-OE1 2.97Å; H305-E364 VanDerWaalsContact CE1-OE1 3.26Å; H305-E364 IonicContact CE1-OE2 3.09Å; H305-E364 PolarHBondContact CE1-OE2 2.95Å; H305-E364 IonicContact CG-OE1 3.99Å; H305-E364 IonicContact ND1-OE1 2.74Å; H305-E364 PolarHBondContact ND1-OE1 2.87Å; H305-E364 IonicContact ND1-OE2 3.3Å; H305-E364 PolarHBondContact ND1-OE2 3.03Å
306	W	94.9	Very high	90.2	Very high	75 Å²	75	67 Å²	67	28%	0.284	35%	0.348	S	S	.	.	H	α-helix	trans	-60.1	-45.3	173.7	173.5	66.2	0	0	0	112.5	I302 V303 M309 T310 M332 G335 I339	I302-W306 VanDerWaalsContact O-CB 3.25Å; I302-W306 WeakPolarHBondContact O-CB 3.27Å; I302-W306 PolarHBondContact O-N 3.33Å; V303-W306 PolarHBondContact O-N 3.4Å; W306-M309 PolarHBondContact O-N 3.2Å; W306-T310 PolarHBondContact NE1-OG1 2.97Å; W306-T310 VanDerWaalsContact O-CB 3.25Å; W306-T310 WeakPolarHBondContact O-CB 3.41Å; W306-T310 PolarHBondContact O-N 3.35Å; W306-T310 PolarHBondContact O-OG1 3.37Å; W306-M332 HydrophobicContact CH2-SD 3.68Å; W306-M332 HydrophobicContact CZ2-CB 4.44Å; W306-M332 HydrophobicContact CZ2-SD 3.4Å; W306-M332 WeakPolarHBondContact CZ2-SD 3.12Å; W306-M332 PolarHBondContact NE1-O 3.21Å; W306-G335 VanDerWaalsContact CD1-C 3.5Å; W306-I339 HydrophobicContact CB-CD1 3.94Å; W306-I339 HydrophobicContact CB-CG1 4.3Å; W306-I339 HydrophobicContact CG-CD1 4.36Å
307	C	93.8	Very high	88.9	Confident	63 Å²	63	67.6 Å²	67.6	43%	0.426	35%	0.347	S	S	.	.	H	α-helix	trans	-60.7	-45.3	175.3	-73.5	0	0	0	0	111.8	V303 S304 F311	V303-C307 PolarHBondContact O-N 3.49Å; V303-C307 PolarHBondContact O-SG 3.35Å; V303-C307 VanDerWaalsContact O-SG 3.33Å; S304-C307 PolarHBondContact O-N 2.88Å; C307-F311 VanDerWaalsContact O-CB 3.26Å; C307-F311 WeakPolarHBondContact O-CB 3.15Å; C307-F311 PolarHBondContact O-N 3.26Å
308	V	93.1	Very high	87.4	Confident	89 Å²	89	61.1 Å²	61.1	54%	0.539	32%	0.323	S	S	.	.	H	α-helix	trans	-62.5	-48.2	178	169.1	0	0	0	0	111.4	S304 H305 F311 W312	S304-V308 WeakPolarHBondContact O-CG2 3.49Å; S304-V308 PolarHBondContact O-N 2.82Å; H305-V308 PolarHBondContact O-N 3.01Å; V308-F311 PolarHBondContact O-N 2.8Å; V308-W312 WeakPolarHBondContact O-CB 3.43Å; V308-W312 PolarHBondContact O-N 3.31Å
309	M	91.1	Very high	85.6	Confident	13 Å²	13	65 Å²	65	6%	0.064	35%	0.345	C	S	.	.	H	α-helix	trans	-67.3	-39.1	179.8	-70.1	-61.5	173.3	0	0	112.2	H305 W306 W312 I313 Y338 Y357 V360	H305-M309 WeakPolarHBondContact CE1-CE 3.19Å; H305-M309 WeakPolarHBondContact NE2-CG 3.35Å; H305-M309 WeakPolarHBondContact O-CB 3.39Å; H305-M309 WeakPolarHBondContact O-CG 3.36Å; H305-M309 PolarHBondContact O-N 3.46Å; W306-M309 PolarHBondContact O-N 3.2Å; M309-W312 WeakPolarHBondContact O-CB 3.48Å; M309-W312 PolarHBondContact O-N 2.9Å; M309-I313 VanDerWaalsContact O-CD1 3.28Å; M309-I313 WeakPolarHBondContact O-CD1 3.19Å; M309-I313 VanDerWaalsContact O-CG1 3.22Å; M309-I313 WeakPolarHBondContact O-CG1 3.45Å; M309-I313 PolarHBondContact O-N 3.34Å; M309-Y338 HydrophobicContact SD-CD1 3.93Å; M309-Y357 HydrophobicContact CE-CD2 4.13Å; M309-Y357 HydrophobicContact CE-CE2 4.1Å; M309-Y357 HydrophobicContact SD-CD2 4.31Å; M309-Y357 HydrophobicContact SD-CE2 4.32Å; M309-V360 HydrophobicContact CE-CG1 4.23Å
310	T	90.9	Very high	83.7	Confident	6 Å²	6	64.5 Å²	64.5	4%	0.037	33%	0.333	C	S	.	.	H	α-helix	trans	-63.5	-44.4	174.9	-57.3	0	0	0	0	111.4	W306 I313 I314 M332	W306-T310 PolarHBondContact NE1-OG1 2.97Å; W306-T310 VanDerWaalsContact O-CB 3.25Å; W306-T310 WeakPolarHBondContact O-CB 3.41Å; W306-T310 PolarHBondContact O-N 3.35Å; W306-T310 PolarHBondContact O-OG1 3.37Å; T310-I313 PolarHBondContact O-N 3.09Å; T310-I314 HydrophobicContact CG2-CD1 3.89Å; T310-I314 WeakPolarHBondContact O-CG1 3.24Å; T310-I314 PolarHBondContact O-N 3.36Å; T310-M332 HydrophobicContact CG2-CE 4.21Å; T310-M332 HydrophobicContact CG2-CG 4.14Å; T310-M332 HydrophobicContact CG2-SD 3.82Å
311	F	89.4	Confident	81.8	Confident	123 Å²	123	61 Å²	61	54%	0.539	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-41.7	176	-176	-107.7	0	0	0	111.9	C307 V308 I313 I314 Q315	C307-F311 VanDerWaalsContact O-CB 3.26Å; C307-F311 WeakPolarHBondContact O-CB 3.15Å; C307-F311 PolarHBondContact O-N 3.26Å; V308-F311 PolarHBondContact O-N 2.8Å; F311-I313 VanDerWaalsContact C-N 3.33Å; F311-I313 PolarHBondContact O-N 2.81Å; F311-I314 PolarHBondContact O-N 3.1Å; F311-Q315 HydrophobicContact CD1-CG 4.26Å; F311-Q315 HydrophobicContact CE1-CG 3.97Å; F311-Q315 VanDerWaalsContact CE1-NE2 3.33Å; F311-Q315 HydrophobicContact CE2-CG 4.28Å; F311-Q315 HydrophobicContact CZ-CG 3.99Å; F311-Q315 VanDerWaalsContact CZ-NE2 3.29Å; F311-Q315 WeakPolarHBondContact O-CB 3.33Å; F311-Q315 WeakPolarHBondContact O-CG 3.49Å; F311-Q315 PolarHBondContact O-N 3.04Å
312	W	88.7	Confident	79.8	Confident	115 Å²	115	65.6 Å²	65.6	44%	0.436	34%	0.341	S	S	.	.	H	α-helix	trans	-58.2	-41.4	173.6	-177.3	-79.3	0	0	0	112.7	V308 M309 G316 L356	V308-W312 WeakPolarHBondContact O-CB 3.43Å; V308-W312 PolarHBondContact O-N 3.31Å; M309-W312 WeakPolarHBondContact O-CB 3.48Å; M309-W312 PolarHBondContact O-N 2.9Å; W312-G316 PolarHBondContact O-N 3.2Å; W312-L356 HydrophobicContact CH2-CD2 3.44Å; W312-L356 VanDerWaalsContact CH2-CD2 3.44Å; W312-L356 HydrophobicContact CH2-CG 4.5Å; W312-L356 HydrophobicContact CZ2-CD2 3.88Å; W312-L356 HydrophobicContact CZ3-CD2 4.41Å
313	I	85.2	Confident	78.6	Confident	8 Å²	8	66.2 Å²	66.2	4%	0.041	35%	0.349	C	S	.	.	H	α-helix	trans	-66.9	-45.8	176.4	-65.9	155.1	0	0	0	110.7	M309 T310 F311 G316 T318 N331 V334 Y338	M309-I313 VanDerWaalsContact O-CD1 3.28Å; M309-I313 WeakPolarHBondContact O-CD1 3.19Å; M309-I313 VanDerWaalsContact O-CG1 3.22Å; M309-I313 WeakPolarHBondContact O-CG1 3.45Å; M309-I313 PolarHBondContact O-N 3.34Å; T310-I313 PolarHBondContact O-N 3.09Å; F311-I313 VanDerWaalsContact C-N 3.33Å; F311-I313 PolarHBondContact O-N 2.81Å; I313-G316 WeakPolarHBondContact O-CA 3.36Å; I313-G316 PolarHBondContact O-N 3.37Å; I313-T318 HydrophobicContact CG2-CG2 4.17Å; I313-N331 HydrophobicContact CG2-CB 4.02Å; I313-N331 WeakPolarHBondContact CG2-OD1 3.48Å; I313-V334 HydrophobicContact CD1-CB 4.14Å; I313-V334 HydrophobicContact CD1-CG1 3.57Å; I313-V334 HydrophobicContact CG1-CG1 4.36Å; I313-Y338 HydrophobicContact CD1-CD2 3.94Å; I313-Y338 HydrophobicContact CD1-CE2 4.15Å; I313-Y338 HydrophobicContact CD1-CG 4.12Å; I313-Y338 HydrophobicContact CG1-CE2 4.43Å
314	I	83.1	Confident	77.4	Confident	74 Å²	74	70.1 Å²	70.1	38%	0.379	36%	0.359	S	S	.	.	H	α-helix	trans	-65.5	-44.2	-179.1	-67.7	167.6	0	0	0	111.6	T310 F311 G316 E317 N331	T310-I314 HydrophobicContact CG2-CD1 3.89Å; T310-I314 WeakPolarHBondContact O-CG1 3.24Å; T310-I314 PolarHBondContact O-N 3.36Å; F311-I314 PolarHBondContact O-N 3.1Å; I314-G316 PolarHBondContact O-N 3.32Å; I314-G316 VanDerWaalsContact O-N 3.14Å; I314-E317 PolarHBondContact O-N 3.26Å; I314-E317 VanDerWaalsContact O-N 3.14Å; I314-N331 HydrophobicContact CG1-CB 3.93Å
315	Q	81.6	Confident	76.5	Confident	128 Å²	128	77 Å²	77	60%	0.598	38%	0.376	S	S	*	.	H	α-helix	trans	-61.5	-17.9	171.5	-74.2	-164.8	-40.9	0	0	112.9	F311 E317	F311-Q315 HydrophobicContact CD1-CG 4.26Å; F311-Q315 HydrophobicContact CE1-CG 3.97Å; F311-Q315 VanDerWaalsContact CE1-NE2 3.33Å; F311-Q315 HydrophobicContact CE2-CG 4.28Å; F311-Q315 HydrophobicContact CZ-CG 3.99Å; F311-Q315 VanDerWaalsContact CZ-NE2 3.29Å; F311-Q315 WeakPolarHBondContact O-CB 3.33Å; F311-Q315 WeakPolarHBondContact O-CG 3.49Å; F311-Q315 PolarHBondContact O-N 3.04Å; Q315-E317 PolarHBondContact O-N 3.4Å
316	G	70.4	Confident	75.4	Confident	30 Å²	30	80.8 Å²	80.8	31%	0.309	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-4.9	174.2	0	0	0	0	0	115.3	W312 I313 I314 K346	W312-G316 PolarHBondContact O-N 3.2Å; I313-G316 WeakPolarHBondContact O-CA 3.36Å; I313-G316 PolarHBondContact O-N 3.37Å; I314-G316 PolarHBondContact O-N 3.32Å; I314-G316 VanDerWaalsContact O-N 3.14Å; G316-K346 WeakPolarHBondContact O-CD 3.43Å; G316-K346 WeakPolarHBondContact O-CE 3.49Å; G316-K346 PolarHBondContact O-NZ 2.89Å
317	E	61.1	Low	74.6	Confident	142 Å²	142	79.1 Å²	79.1	66%	0.664	39%	0.389	S	S	*	.			trans	54.3	76.9	-175.6	-61.1	177.3	146.4	0	0	112.7	I314 Q315 K346	I314-E317 PolarHBondContact O-N 3.26Å; I314-E317 VanDerWaalsContact O-N 3.14Å; Q315-E317 PolarHBondContact O-N 3.4Å; E317-K346 WeakPolarHBondContact O-CD 3.14Å; E317-K346 PolarHBondContact O-NZ 3.3Å; E317-K346 IonicContact OE2-NZ 2.72Å
318	T	60.6	Low	73.9	Confident	11 Å²	11	79.2 Å²	79.2	7%	0.067	38%	0.384	C	S	.	.			trans	-103.5	69.1	-171.5	45.2	0	0	0	0	113.4	I313 F320 E327 N331 V345 K346	I313-T318 HydrophobicContact CG2-CG2 4.17Å; T318-F320 PolarHBondContact O-N 2.98Å; T318-E327 VanDerWaalsContact O-CG 3.31Å; T318-E327 WeakPolarHBondContact O-CG 3.33Å; T318-N331 PolarHBondContact OG1-ND2 2.99Å; T318-N331 PolarHBondContact OG1-OD1 3.12Å; T318-V345 HydrophobicContact CG2-CG1 3.94Å; T318-K346 HydrophobicContact CG2-CB 4.37Å; T318-K346 HydrophobicContact CG2-CD 4.48Å
319	D	54.8	Low	73.4	Confident	118 Å²	118	80.3 Å²	80.3	63%	0.631	39%	0.386	S	S	*	.			trans	-56.5	73.3	175.3	-64.2	-48.3	0	0	0	113	E327 K524	D319-E327 WeakPolarHBondContact CA-OE2 3.44Å; D319-K524 PolarHBondContact O-NZ 3.34Å
320	F	52.7	Low	72.9	Confident	27 Å²	27	81.8 Å²	81.8	12%	0.118	39%	0.391	C	S	.	.			trans	-100.6	-45.8	-173.2	-169.6	-104.4	0	0	0	111.8	T318 E327 Y330 K524 A528 I534	T318-F320 PolarHBondContact O-N 2.98Å; F320-E327 PolarHBondContact N-OE2 2.93Å; F320-Y330 HydrophobicContact CB-CD1 3.92Å; F320-Y330 HydrophobicContact CB-CE1 3.92Å; F320-Y330 AromaticContact CD1-CD1 3.7Å; F320-Y330 HydrophobicContact CD1-CD1 3.7Å; F320-Y330 AromaticContact CD1-CD2 3.78Å; F320-Y330 HydrophobicContact CD1-CD2 3.78Å; F320-Y330 AromaticContact CD1-CE1 3.74Å; F320-Y330 HydrophobicContact CD1-CE1 3.74Å; F320-Y330 AromaticContact CD1-CE2 3.82Å; F320-Y330 HydrophobicContact CD1-CE2 3.82Å; F320-Y330 AromaticContact CD1-CG 3.72Å; F320-Y330 HydrophobicContact CD1-CG 3.72Å; F320-Y330 AromaticContact CD1-CZ 3.8Å; F320-Y330 HydrophobicContact CD2-CE1 4.08Å; F320-Y330 HydrophobicContact CE1-CD1 4.46Å; F320-Y330 AromaticContact CE1-CD2 3.78Å; F320-Y330 HydrophobicContact CE1-CD2 3.78Å; F320-Y330 HydrophobicContact CE1-CE1 4.29Å; F320-Y330 AromaticContact CE1-CE2 3.59Å; F320-Y330 HydrophobicContact CE1-CE2 3.59Å; F320-Y330 HydrophobicContact CE1-CG 4.21Å; F320-Y330 AromaticContact CE1-CZ 3.87Å; F320-Y330 AromaticContact CG-CD1 3.88Å; F320-Y330 HydrophobicContact CG-CD1 3.88Å; F320-Y330 AromaticContact CG-CE1 3.63Å; F320-Y330 HydrophobicContact CG-CE1 3.63Å; F320-Y330 HydrophobicContact CG-CE2 4.42Å; F320-Y330 HydrophobicContact CG-CG 4.37Å; F320-Y330 AromaticContact CG-CZ 3.93Å; F320-Y330 AromaticContact CZ-CE2 3.99Å; F320-Y330 HydrophobicContact CZ-CE2 3.99Å; F320-K524 VanDerWaalsContact C-NZ 3.34Å; F320-K524 PolarHBondContact O-NZ 3.35Å; F320-A528 HydrophobicContact CD2-CB 4.37Å; F320-A528 HydrophobicContact CE2-CB 3.87Å; F320-I534 HydrophobicContact CE1-CD1 4.06Å; F320-I534 HydrophobicContact CE2-CD1 3.92Å; F320-I534 HydrophobicContact CZ-CD1 3.52Å; F320-I534 HydrophobicContact CZ-CG1 4.46Å
321	C	53.8	Low	72.5	Confident	24 Å²	24	81.6 Å²	81.6	16%	0.162	39%	0.39	C	S	.	.	S	Bend	trans	-100.5	172.3	-171.2	-63.8	0	0	0	0	113.3	E326 E327	C321-E326 HydrophobicContact CB-CB 3.79Å; C321-E326 HydrophobicContact CB-CG 3.89Å; C321-E326 WeakPolarHBondContact CB-OE2 3.35Å; C321-E326 VanDerWaalsContact SG-C 3.57Å; C321-E326 VanDerWaalsContact SG-CG 3.55Å; C321-E327 HydrophobicContact CB-CB 3.99Å
322	M	53.7	Low	72.4	Confident	138 Å²	138	79.1 Å²	79.1	68%	0.68	38%	0.381	S	S	*	.	S	Bend	trans	-87	-14.3	174	-65.8	-64.2	-175.7	0	0	112.7	L521	M322-L521 HydrophobicContact CE-CD1 4.35Å; M322-L521 HydrophobicContact CE-CD2 3.86Å
323	S	67.9	Low	72.3	Confident	53 Å²	53	76 Å²	76	37%	0.371	37%	0.374	S	S	.	.	S	Bend	trans	-129.6	141.9	175.1	74.7	0	0	0	0	111.1	W325 E326 E327	S323-W325 PolarHBondContact O-N 3.27Å; S323-E326 PolarHBondContact O-N 3.38Å; S323-E326 VanDerWaalsContact O-N 3.17Å; S323-E326 VanDerWaalsContact OG-CB 3.23Å; S323-E326 WeakPolarHBondContact OG-CB 3.47Å; S323-E326 PolarHBondContact OG-N 3.3Å; S323-E327 PolarHBondContact O-N 2.9Å
324	K	70.6	Confident	72.4	Confident	170 Å²	170	75.7 Å²	75.7	74%	0.739	37%	0.373	S	S	*	.	H	α-helix	trans	-59.2	-32.9	-179.7	-63.7	-172.3	175.7	-171.7	0	112.9	E327 I328	K324-E327 PolarHBondContact O-N 3.48Å; K324-I328 WeakPolarHBondContact O-CD1 3.37Å; K324-I328 VanDerWaalsContact O-CG1 3.22Å; K324-I328 WeakPolarHBondContact O-CG1 3.31Å; K324-I328 PolarHBondContact O-N 2.89Å
325	W	74.4	Confident	72.7	Confident	203 Å²	203	72.2 Å²	72.2	77%	0.769	36%	0.355	S	S	*	.	H	α-helix	trans	-67.5	-43	177.3	-64.6	117.2	0	0	0	112.7	S323 E327 I328 I329	S323-W325 PolarHBondContact O-N 3.27Å; W325-E327 VanDerWaalsContact C-N 3.33Å; W325-I328 HydrophobicContact CE3-CD1 4.28Å; W325-I328 PolarHBondContact O-N 2.78Å; W325-I329 WeakPolarHBondContact O-CD1 3.33Å; W325-I329 VanDerWaalsContact O-CG1 3.29Å; W325-I329 WeakPolarHBondContact O-CG1 3.29Å; W325-I329 PolarHBondContact O-N 2.87Å
326	E	72.4	Confident	73.2	Confident	87 Å²	87	68.2 Å²	68.2	41%	0.407	34%	0.337	S	S	.	.	H	α-helix	trans	-66.4	-37.2	176.1	-168.9	-170.4	-169.4	0	0	111.2	C321 S323 I329 Y330	C321-E326 HydrophobicContact CB-CB 3.79Å; C321-E326 HydrophobicContact CB-CG 3.89Å; C321-E326 WeakPolarHBondContact CB-OE2 3.35Å; C321-E326 VanDerWaalsContact SG-C 3.57Å; C321-E326 VanDerWaalsContact SG-CG 3.55Å; S323-E326 PolarHBondContact O-N 3.38Å; S323-E326 VanDerWaalsContact O-N 3.17Å; S323-E326 VanDerWaalsContact OG-CB 3.23Å; S323-E326 WeakPolarHBondContact OG-CB 3.47Å; S323-E326 PolarHBondContact OG-N 3.3Å; E326-I329 PolarHBondContact O-N 3.37Å; E326-Y330 WeakPolarHBondContact O-CB 3.35Å; E326-Y330 PolarHBondContact O-N 3.23Å
327	E	76.8	Confident	74.2	Confident	39 Å²	39	67.1 Å²	67.1	18%	0.182	32%	0.324	C	S	.	.	H	α-helix	trans	-65.2	-43.6	175	-165.8	179.5	101.9	0	0	112.5	T318 D319 F320 C321 S323 K324 W325 I329 Y330 N331	T318-E327 VanDerWaalsContact O-CG 3.31Å; T318-E327 WeakPolarHBondContact O-CG 3.33Å; D319-E327 WeakPolarHBondContact CA-OE2 3.44Å; F320-E327 PolarHBondContact N-OE2 2.93Å; C321-E327 HydrophobicContact CB-CB 3.99Å; S323-E327 PolarHBondContact O-N 2.9Å; K324-E327 PolarHBondContact O-N 3.48Å; W325-E327 VanDerWaalsContact C-N 3.33Å; E327-I329 VanDerWaalsContact C-N 3.33Å; E327-I329 PolarHBondContact O-N 2.88Å; E327-Y330 PolarHBondContact O-N 2.99Å; E327-N331 WeakPolarHBondContact O-CB 3.49Å; E327-N331 VanDerWaalsContact O-CG 3.24Å; E327-N331 PolarHBondContact O-N 3.28Å; E327-N331 PolarHBondContact O-ND2 3.28Å
328	I	80.1	Confident	75.7	Confident	65 Å²	65	60.9 Å²	60.9	33%	0.333	30%	0.295	S	S	.	.	H	α-helix	trans	-59.7	-44.9	173.8	-70.6	161.4	0	0	0	110.3	K324 W325 N331 M332	K324-I328 WeakPolarHBondContact O-CD1 3.37Å; K324-I328 VanDerWaalsContact O-CG1 3.22Å; K324-I328 WeakPolarHBondContact O-CG1 3.31Å; K324-I328 PolarHBondContact O-N 2.89Å; W325-I328 HydrophobicContact CE3-CD1 4.28Å; W325-I328 PolarHBondContact O-N 2.78Å; I328-N331 PolarHBondContact O-N 3.43Å; I328-M332 HydrophobicContact CG2-CE 4.38Å; I328-M332 HydrophobicContact CG2-CG 4.34Å; I328-M332 WeakPolarHBondContact O-CB 3.48Å; I328-M332 WeakPolarHBondContact O-CG 3.38Å; I328-M332 PolarHBondContact O-N 2.89Å
329	I	81.9	Confident	77.3	Confident	112 Å²	112	60.7 Å²	60.7	57%	0.574	29%	0.293	S	S	*	.	H	α-helix	trans	-64	-41.9	177.7	-68	164.3	0	0	0	111.1	W325 E326 E327 M332 V333	W325-I329 WeakPolarHBondContact O-CD1 3.33Å; W325-I329 VanDerWaalsContact O-CG1 3.29Å; W325-I329 WeakPolarHBondContact O-CG1 3.29Å; W325-I329 PolarHBondContact O-N 2.87Å; E326-I329 PolarHBondContact O-N 3.37Å; E327-I329 VanDerWaalsContact C-N 3.33Å; E327-I329 PolarHBondContact O-N 2.88Å; I329-M332 PolarHBondContact O-N 3.18Å; I329-V333 WeakPolarHBondContact O-CG2 3.34Å; I329-V333 PolarHBondContact O-N 3.48Å
330	Y	80.3	Confident	79.2	Confident	44 Å²	44	55.8 Å²	55.8	17%	0.173	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-48.5	174.6	173.1	-101.6	0	0	0	111.8	F320 E326 E327 M332 V333 V334 V345	F320-Y330 HydrophobicContact CB-CD1 3.92Å; F320-Y330 HydrophobicContact CB-CE1 3.92Å; F320-Y330 AromaticContact CD1-CD1 3.7Å; F320-Y330 HydrophobicContact CD1-CD1 3.7Å; F320-Y330 AromaticContact CD1-CD2 3.78Å; F320-Y330 HydrophobicContact CD1-CD2 3.78Å; F320-Y330 AromaticContact CD1-CE1 3.74Å; F320-Y330 HydrophobicContact CD1-CE1 3.74Å; F320-Y330 AromaticContact CD1-CE2 3.82Å; F320-Y330 HydrophobicContact CD1-CE2 3.82Å; F320-Y330 AromaticContact CD1-CG 3.72Å; F320-Y330 HydrophobicContact CD1-CG 3.72Å; F320-Y330 AromaticContact CD1-CZ 3.8Å; F320-Y330 HydrophobicContact CD2-CE1 4.08Å; F320-Y330 HydrophobicContact CE1-CD1 4.46Å; F320-Y330 AromaticContact CE1-CD2 3.78Å; F320-Y330 HydrophobicContact CE1-CD2 3.78Å; F320-Y330 HydrophobicContact CE1-CE1 4.29Å; F320-Y330 AromaticContact CE1-CE2 3.59Å; F320-Y330 HydrophobicContact CE1-CE2 3.59Å; F320-Y330 HydrophobicContact CE1-CG 4.21Å; F320-Y330 AromaticContact CE1-CZ 3.87Å; F320-Y330 AromaticContact CG-CD1 3.88Å; F320-Y330 HydrophobicContact CG-CD1 3.88Å; F320-Y330 AromaticContact CG-CE1 3.63Å; F320-Y330 HydrophobicContact CG-CE1 3.63Å; F320-Y330 HydrophobicContact CG-CE2 4.42Å; F320-Y330 HydrophobicContact CG-CG 4.37Å; F320-Y330 AromaticContact CG-CZ 3.93Å; F320-Y330 AromaticContact CZ-CE2 3.99Å; F320-Y330 HydrophobicContact CZ-CE2 3.99Å; E326-Y330 WeakPolarHBondContact O-CB 3.35Å; E326-Y330 PolarHBondContact O-N 3.23Å; E327-Y330 PolarHBondContact O-N 2.99Å; Y330-M332 VanDerWaalsContact C-N 3.34Å; Y330-M332 PolarHBondContact O-N 2.9Å; Y330-V333 PolarHBondContact O-N 3.45Å; Y330-V334 HydrophobicContact CD1-CG2 4.39Å; Y330-V334 HydrophobicContact CD2-CG2 4.42Å; Y330-V334 HydrophobicContact CE1-CG2 4.01Å; Y330-V334 HydrophobicContact CE2-CG2 4.03Å; Y330-V334 WeakPolarHBondContact O-CG2 3.4Å; Y330-V334 PolarHBondContact O-N 3.47Å; Y330-V345 HydrophobicContact CE1-CG1 3.76Å
331	N	84.3	Confident	81.1	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.011	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-38.1	178	-71.4	-30.5	0	0	0	112.3	I313 I314 T318 E327 I328 V334 G335	I313-N331 HydrophobicContact CG2-CB 4.02Å; I313-N331 WeakPolarHBondContact CG2-OD1 3.48Å; I314-N331 HydrophobicContact CG1-CB 3.93Å; T318-N331 PolarHBondContact OG1-ND2 2.99Å; T318-N331 PolarHBondContact OG1-OD1 3.12Å; E327-N331 WeakPolarHBondContact O-CB 3.49Å; E327-N331 VanDerWaalsContact O-CG 3.24Å; E327-N331 PolarHBondContact O-N 3.28Å; E327-N331 PolarHBondContact O-ND2 3.28Å; I328-N331 PolarHBondContact O-N 3.43Å; N331-V334 PolarHBondContact O-N 2.96Å; N331-G335 PolarHBondContact O-N 3.44Å
332	M	87.4	Confident	82.7	Confident	71 Å²	71	53.9 Å²	53.9	35%	0.35	26%	0.255	S	S	.	.	H	α-helix	trans	-62.8	-43.5	174	-71.8	-89.7	177.8	0	0	112.2	W306 T310 I328 I329 Y330 G335 I336	W306-M332 HydrophobicContact CH2-SD 3.68Å; W306-M332 HydrophobicContact CZ2-CB 4.44Å; W306-M332 HydrophobicContact CZ2-SD 3.4Å; W306-M332 WeakPolarHBondContact CZ2-SD 3.12Å; W306-M332 PolarHBondContact NE1-O 3.21Å; T310-M332 HydrophobicContact CG2-CE 4.21Å; T310-M332 HydrophobicContact CG2-CG 4.14Å; T310-M332 HydrophobicContact CG2-SD 3.82Å; I328-M332 HydrophobicContact CG2-CE 4.38Å; I328-M332 HydrophobicContact CG2-CG 4.34Å; I328-M332 WeakPolarHBondContact O-CB 3.48Å; I328-M332 WeakPolarHBondContact O-CG 3.38Å; I328-M332 PolarHBondContact O-N 2.89Å; I329-M332 PolarHBondContact O-N 3.18Å; Y330-M332 VanDerWaalsContact C-N 3.34Å; Y330-M332 PolarHBondContact O-N 2.9Å; M332-G335 PolarHBondContact O-N 3.46Å; M332-I336 PolarHBondContact O-N 3.35Å
333	V	86	Confident	84.1	Confident	50 Å²	50	47.7 Å²	47.7	30%	0.303	23%	0.225	S	C	.	.	H	α-helix	trans	-64.9	-45.3	176.1	164.8	0	0	0	0	111.1	L205 I329 Y330 G335 I336 I337	L205-V333 HydrophobicContact CD1-CG1 3.6Å; L205-V333 HydrophobicContact CD1-CG2 4.37Å; I329-V333 WeakPolarHBondContact O-CG2 3.34Å; I329-V333 PolarHBondContact O-N 3.48Å; Y330-V333 PolarHBondContact O-N 3.45Å; V333-G335 PolarHBondContact O-N 3.14Å; V333-I336 WeakPolarHBondContact O-CB 3.2Å; V333-I336 PolarHBondContact O-N 2.91Å; V333-I336 VanDerWaalsContact O-N 3.1Å; V333-I337 PolarHBondContact O-N 3.16Å
334	V	86.3	Confident	84.5	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.012	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-38.4	173.4	173.6	0	0	0	0	110.6	I313 Y330 N331 I336 I337 Y338 F343 V345	I313-V334 HydrophobicContact CD1-CB 4.14Å; I313-V334 HydrophobicContact CD1-CG1 3.57Å; I313-V334 HydrophobicContact CG1-CG1 4.36Å; Y330-V334 HydrophobicContact CD1-CG2 4.39Å; Y330-V334 HydrophobicContact CD2-CG2 4.42Å; Y330-V334 HydrophobicContact CE1-CG2 4.01Å; Y330-V334 HydrophobicContact CE2-CG2 4.03Å; Y330-V334 WeakPolarHBondContact O-CG2 3.4Å; Y330-V334 PolarHBondContact O-N 3.47Å; N331-V334 PolarHBondContact O-N 2.96Å; V334-I336 PolarHBondContact O-N 3.01Å; V334-I337 WeakPolarHBondContact O-CA 3.36Å; V334-I337 WeakPolarHBondContact O-CB 3.48Å; V334-I337 PolarHBondContact O-N 2.98Å; V334-Y338 HydrophobicContact CG1-CD2 3.64Å; V334-Y338 HydrophobicContact CG1-CE2 3.54Å; V334-Y338 WeakPolarHBondContact O-CD2 3.35Å; V334-Y338 PolarHBondContact O-N 2.82Å; V334-F343 HydrophobicContact CG1-CD1 4.22Å; V334-F343 HydrophobicContact CG2-CD1 4.41Å; V334-F343 HydrophobicContact CG2-CE1 4.4Å; V334-V345 HydrophobicContact CB-CG2 4.34Å; V334-V345 HydrophobicContact CG1-CG2 3.54Å; V334-V345 HydrophobicContact CG2-CG2 3.84Å
335	G	91.1	Very high	84.2	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-54.8	-35.7	174	0	0	0	0	0	113.5	W306 N331 M332 V333 Y338 I339	W306-G335 VanDerWaalsContact CD1-C 3.5Å; N331-G335 PolarHBondContact O-N 3.44Å; M332-G335 PolarHBondContact O-N 3.46Å; V333-G335 PolarHBondContact O-N 3.14Å; G335-Y338 PolarHBondContact O-N 3.33Å; G335-I339 WeakPolarHBondContact O-CG1 3.45Å
336	I	91.1	Very high	83.3	Confident	45 Å²	45	31.9 Å²	31.9	23%	0.231	16%	0.157	C	C	.	.	H	α-helix	trans	-68.4	-42.2	174.6	-58.4	172.2	0	0	0	110.9	L209 M332 V333 V334 Y338 I339	L209-I336 HydrophobicContact CD2-CD1 3.73Å; L209-I336 HydrophobicContact CD2-CG2 4.45Å; M332-I336 PolarHBondContact O-N 3.35Å; V333-I336 WeakPolarHBondContact O-CB 3.2Å; V333-I336 PolarHBondContact O-N 2.91Å; V333-I336 VanDerWaalsContact O-N 3.1Å; V334-I336 PolarHBondContact O-N 3.01Å; I336-Y338 VanDerWaalsContact C-N 3.29Å; I336-Y338 PolarHBondContact O-N 3.06Å; I336-I339 HydrophobicContact CG2-CD1 4.32Å; I336-I339 WeakPolarHBondContact O-CB 3.33Å; I336-I339 WeakPolarHBondContact O-CG1 3.37Å; I336-I339 PolarHBondContact O-N 3.23Å
337	I	91.2	Very high	82.2	Confident	7 Å²	7	30.9 Å²	30.9	4%	0.036	15%	0.153	C	C	.	.	H	α-helix	trans	-60.3	-41.7	176.5	-55.7	-179.7	0	0	0	110.5	L204 F208 V333 V334 I339 F340 C341 F343	L204-I337 HydrophobicContact CD2-CD1 4.09Å; L204-I337 HydrophobicContact CG-CD1 4.44Å; F208-I337 HydrophobicContact CB-CG1 4.15Å; F208-I337 HydrophobicContact CD1-CG2 4.33Å; F208-I337 HydrophobicContact CD2-CB 4.27Å; F208-I337 HydrophobicContact CD2-CD1 4.13Å; F208-I337 HydrophobicContact CD2-CG1 3.71Å; F208-I337 HydrophobicContact CD2-CG2 3.93Å; F208-I337 HydrophobicContact CE1-CG2 4.08Å; F208-I337 HydrophobicContact CE2-CB 4.49Å; F208-I337 HydrophobicContact CE2-CG1 4.29Å; F208-I337 HydrophobicContact CE2-CG2 3.66Å; F208-I337 HydrophobicContact CG-CB 4.32Å; F208-I337 HydrophobicContact CG-CG1 3.91Å; F208-I337 HydrophobicContact CG-CG2 4.26Å; F208-I337 HydrophobicContact CZ-CG2 3.73Å; V333-I337 PolarHBondContact O-N 3.16Å; V334-I337 WeakPolarHBondContact O-CA 3.36Å; V334-I337 WeakPolarHBondContact O-CB 3.48Å; V334-I337 PolarHBondContact O-N 2.98Å; I337-I339 PolarHBondContact O-N 3.21Å; I337-F340 PolarHBondContact O-N 2.82Å; I337-C341 PolarHBondContact O-N 3.23Å; I337-F343 HydrophobicContact CB-CB 4.46Å; I337-F343 HydrophobicContact CD1-CD1 4.43Å; I337-F343 HydrophobicContact CD1-CG 4.4Å; I337-F343 HydrophobicContact CG2-CB 3.66Å; I337-F343 HydrophobicContact CG2-CD2 4.3Å; I337-F343 HydrophobicContact CG2-CG 4.07Å
338	Y	92.4	Very high	81.1	Confident	11 Å²	11	31.3 Å²	31.3	4%	0.043	17%	0.167	C	C	.	.	H	α-helix	trans	-61.9	-23.1	-179.4	-94.6	-115.1	0	0	0	114.5	M309 I313 V334 G335 I336 F340 C341 W342 F343 Y357	M309-Y338 HydrophobicContact SD-CD1 3.93Å; I313-Y338 HydrophobicContact CD1-CD2 3.94Å; I313-Y338 HydrophobicContact CD1-CE2 4.15Å; I313-Y338 HydrophobicContact CD1-CG 4.12Å; I313-Y338 HydrophobicContact CG1-CE2 4.43Å; V334-Y338 HydrophobicContact CG1-CD2 3.64Å; V334-Y338 HydrophobicContact CG1-CE2 3.54Å; V334-Y338 WeakPolarHBondContact O-CD2 3.35Å; V334-Y338 PolarHBondContact O-N 2.82Å; G335-Y338 PolarHBondContact O-N 3.33Å; I336-Y338 VanDerWaalsContact C-N 3.29Å; I336-Y338 PolarHBondContact O-N 3.06Å; Y338-F340 PolarHBondContact O-N 3.36Å; Y338-C341 WeakPolarHBondContact CA-O 3.26Å; Y338-W342 AromaticContact CE1-CE3 3.65Å; Y338-W342 HydrophobicContact CE1-CE3 3.65Å; Y338-W342 AromaticContact CE1-CZ3 3.61Å; Y338-W342 HydrophobicContact CE1-CZ3 3.61Å; Y338-W342 AromaticContact CZ-CE3 3.86Å; Y338-W342 AromaticContact CZ-CZ3 3.85Å; Y338-W342 VanDerWaalsContact OH-CZ3 3.28Å; Y338-W342 WeakPolarHBondContact OH-CZ3 3.11Å; Y338-F343 HydrophobicContact CD2-CB 4.35Å; Y338-F343 HydrophobicContact CE2-CB 4.06Å; Y338-F343 WeakPolarHBondContact CE2-O 3.35Å; Y338-F343 PolarHBondContact OH-O 3.28Å; Y338-F343 VanDerWaalsContact OH-O 3.09Å; Y338-Y357 AromaticContact CD1-CD2 3.89Å; Y338-Y357 HydrophobicContact CD1-CD2 3.89Å; Y338-Y357 AromaticContact CD1-CE2 3.74Å; Y338-Y357 HydrophobicContact CD1-CE2 3.74Å; Y338-Y357 HydrophobicContact CE1-CD2 4.13Å; Y338-Y357 HydrophobicContact CE1-CE2 4.37Å; Y338-Y357 HydrophobicContact CG-CE2 4.39Å; Y338-Y357 WeakPolarHBondContact O-CE2 3.36Å; Y338-Y357 PolarHBondContact O-OH 3.02Å
339	I	93.9	Very high	80.1	Confident	7 Å²	7	33.5 Å²	33.5	4%	0.036	19%	0.186	C	C	.	.	H	α-helix	trans	-58.6	-34.4	173.2	-51.3	171.1	0	0	0	110.7	R283 F287 I302 W306 G335 I336 I337	R283-I339 PolarHBondContact NE-O 3.48Å; R283-I339 PolarHBondContact NH2-O 3.38Å; F287-I339 HydrophobicContact CE2-CG2 3.85Å; F287-I339 HydrophobicContact CZ-CG2 3.89Å; I302-I339 HydrophobicContact CD1-CG2 3.75Å; I302-I339 HydrophobicContact CG2-CD1 4.34Å; W306-I339 HydrophobicContact CB-CD1 3.94Å; W306-I339 HydrophobicContact CB-CG1 4.3Å; W306-I339 HydrophobicContact CG-CD1 4.36Å; G335-I339 WeakPolarHBondContact O-CG1 3.45Å; I336-I339 HydrophobicContact CG2-CD1 4.32Å; I336-I339 WeakPolarHBondContact O-CB 3.33Å; I336-I339 WeakPolarHBondContact O-CG1 3.37Å; I336-I339 PolarHBondContact O-N 3.23Å; I337-I339 PolarHBondContact O-N 3.21Å
340	F	94.3	Very high	79.4	Confident	14 Å²	14	29.7 Å²	29.7	6%	0.061	17%	0.169	C	C	.	.	H	α-helix	trans	-107.4	-40.5	-172.8	-62.9	-81.8	0	0	0	113.9	F208 A212 P213 V216 T284 F287 I337 Y338	F208-F340 HydrophobicContact CD1-CB 4.14Å; F208-F340 AromaticContact CD1-CD2 3.99Å; F208-F340 HydrophobicContact CD1-CD2 3.99Å; F208-F340 HydrophobicContact CD1-CG 4.33Å; F208-F340 HydrophobicContact CE1-CB 3.84Å; F208-F340 HydrophobicContact CE1-CG 4.48Å; A212-F340 HydrophobicContact CB-CD1 3.81Å; A212-F340 HydrophobicContact CB-CD2 3.96Å; A212-F340 HydrophobicContact CB-CE1 3.72Å; A212-F340 HydrophobicContact CB-CE2 3.87Å; A212-F340 HydrophobicContact CB-CG 3.94Å; A212-F340 HydrophobicContact CB-CZ 3.75Å; P213-F340 HydrophobicContact CG-CE2 4.46Å; P213-F340 HydrophobicContact CG-CZ 4.17Å; V216-F340 HydrophobicContact CG2-CE1 4.06Å; T284-F340 HydrophobicContact CG2-CD1 4.16Å; T284-F340 HydrophobicContact CG2-CE1 4.38Å; F287-F340 HydrophobicContact CD2-CD1 4.46Å; F287-F340 HydrophobicContact CD2-CE1 4.05Å; F287-F340 HydrophobicContact CE2-CD1 4.1Å; F287-F340 AromaticContact CE2-CE1 3.92Å; F287-F340 HydrophobicContact CE2-CE1 3.92Å; I337-F340 PolarHBondContact O-N 2.82Å; Y338-F340 PolarHBondContact O-N 3.36Å
341	C	93	Very high	79.3	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.02	19%	0.19	C	C	.	.	S	Bend	trans	-152.3	158.3	-179.1	74.4	0	0	0	0	115.2	F208 I280 I337 Y338 F343 Y357	F208-C341 VanDerWaalsContact CZ-SG 3.51Å; I280-C341 HydrophobicContact CD1-CB 3.7Å; I280-C341 HydrophobicContact CG1-CB 3.77Å; I337-C341 PolarHBondContact O-N 3.23Å; Y338-C341 WeakPolarHBondContact CA-O 3.26Å; C341-F343 PolarHBondContact O-N 3.28Å; C341-Y357 VanDerWaalsContact CA-OH 3.29Å; C341-Y357 WeakPolarHBondContact CA-OH 3.41Å; C341-Y357 PolarHBondContact N-OH 2.73Å
342	W	88.9	Confident	79.2	Confident	9 Å²	9	42.4 Å²	42.4	3%	0.034	22%	0.221	C	C	.	.			trans	-66.5	119.8	170.2	176.9	-105.9	0	0	0	111.6	H276 Y338 R353 M354 Y357 Y358	H276-W342 PolarHBondContact CE1-O 2.72Å; H276-W342 VanDerWaalsContact CE1-O 3.26Å; Y338-W342 AromaticContact CE1-CE3 3.65Å; Y338-W342 HydrophobicContact CE1-CE3 3.65Å; Y338-W342 AromaticContact CE1-CZ3 3.61Å; Y338-W342 HydrophobicContact CE1-CZ3 3.61Å; Y338-W342 AromaticContact CZ-CE3 3.86Å; Y338-W342 AromaticContact CZ-CZ3 3.85Å; Y338-W342 VanDerWaalsContact OH-CZ3 3.28Å; Y338-W342 WeakPolarHBondContact OH-CZ3 3.11Å; W342-R353 HydrophobicContact CH2-CB 3.88Å; W342-M354 HydrophobicContact CD2-CB 4.45Å; W342-M354 HydrophobicContact CD2-CG 4.39Å; W342-M354 HydrophobicContact CG-CG 4.36Å; W342-M354 HydrophobicContact CZ2-CB 4.03Å; W342-Y357 HydrophobicContact CB-CD1 3.69Å; W342-Y357 HydrophobicContact CB-CE1 3.72Å; W342-Y357 HydrophobicContact CB-CG 4.41Å; W342-Y357 HydrophobicContact CD2-CG 4.44Å; W342-Y357 HydrophobicContact CE3-CD1 4.03Å; W342-Y357 AromaticContact CE3-CD2 3.97Å; W342-Y357 HydrophobicContact CE3-CD2 3.97Å; W342-Y357 AromaticContact CE3-CG 3.56Å; W342-Y357 HydrophobicContact CE3-CG 3.56Å; W342-Y357 HydrophobicContact CG-CD1 4.42Å; W342-Y357 HydrophobicContact CZ3-CG 4.27Å; W342-Y358 HydrophobicContact CB-CE2 3.86Å; W342-Y358 HydrophobicContact CG-CE2 4.32Å
343	F	82.1	Confident	79	Confident	8 Å²	8	42 Å²	42	4%	0.035	22%	0.216	C	C	.	.			trans	-122.9	106.8	177.8	-176.4	-96.9	0	0	0	110.6	L204 Y250 V334 I337 Y338 C341 V345	L204-F343 HydrophobicContact CD2-CD2 4.43Å; L204-F343 HydrophobicContact CD2-CE2 3.52Å; L204-F343 HydrophobicContact CD2-CZ 3.76Å; Y250-F343 AromaticContact CD1-CE2 3.82Å; Y250-F343 HydrophobicContact CD1-CE2 3.82Å; Y250-F343 HydrophobicContact CD1-CZ 4.24Å; Y250-F343 AromaticContact CE1-CE2 3.46Å; Y250-F343 HydrophobicContact CE1-CE2 3.46Å; Y250-F343 VanDerWaalsContact CE1-CE2 3.46Å; Y250-F343 AromaticContact CE1-CZ 3.44Å; Y250-F343 HydrophobicContact CE1-CZ 3.44Å; Y250-F343 VanDerWaalsContact CE1-CZ 3.44Å; Y250-F343 AromaticContact CZ-CZ 3.81Å; V334-F343 HydrophobicContact CG1-CD1 4.22Å; V334-F343 HydrophobicContact CG2-CD1 4.41Å; V334-F343 HydrophobicContact CG2-CE1 4.4Å; I337-F343 HydrophobicContact CB-CB 4.46Å; I337-F343 HydrophobicContact CD1-CD1 4.43Å; I337-F343 HydrophobicContact CD1-CG 4.4Å; I337-F343 HydrophobicContact CG2-CB 3.66Å; I337-F343 HydrophobicContact CG2-CD2 4.3Å; I337-F343 HydrophobicContact CG2-CG 4.07Å; Y338-F343 HydrophobicContact CD2-CB 4.35Å; Y338-F343 HydrophobicContact CE2-CB 4.06Å; Y338-F343 WeakPolarHBondContact CE2-O 3.35Å; Y338-F343 PolarHBondContact OH-O 3.28Å; Y338-F343 VanDerWaalsContact OH-O 3.09Å; C341-F343 PolarHBondContact O-N 3.28Å; F343-V345 HydrophobicContact CD1-CG2 3.69Å; F343-V345 HydrophobicContact CE1-CG2 3.96Å; F343-V345 PolarHBondContact O-N 3.43Å
344	N	76.1	Confident	79	Confident	34 Å²	34	40.3 Å²	40.3	18%	0.182	21%	0.205	C	C	.	.			trans	-74.9	101.1	-167.1	-172	12	0	0	0	113.3	K346 P527	N344-K346 PolarHBondContact OD1-O 3.31Å; N344-P527 HydrophobicContact CB-CG 4.41Å; N344-P527 WeakPolarHBondContact O-CG 3.38Å
345	V	64.3	Low	79.1	Confident	13 Å²	13	42.7 Å²	42.7	8%	0.079	23%	0.225	C	C	.	.			trans	-91	-31.5	-180	172.3	0	0	0	0	114.5	T318 Y330 V334 F343	T318-V345 HydrophobicContact CG2-CG1 3.94Å; Y330-V345 HydrophobicContact CE1-CG1 3.76Å; V334-V345 HydrophobicContact CB-CG2 4.34Å; V334-V345 HydrophobicContact CG1-CG2 3.54Å; V334-V345 HydrophobicContact CG2-CG2 3.84Å; F343-V345 HydrophobicContact CD1-CG2 3.69Å; F343-V345 HydrophobicContact CE1-CG2 3.96Å; F343-V345 PolarHBondContact O-N 3.43Å
346	K	55.5	Low	79.1	Confident	46 Å²	46	45.6 Å²	45.6	20%	0.2	24%	0.24	C	C	.	.			trans	-127.7	128.2	-171.6	176.9	161.2	-177.9	174.1	0	113.9	G316 E317 T318 N344 R353 Y526	G316-K346 WeakPolarHBondContact O-CD 3.43Å; G316-K346 WeakPolarHBondContact O-CE 3.49Å; G316-K346 PolarHBondContact O-NZ 2.89Å; E317-K346 WeakPolarHBondContact O-CD 3.14Å; E317-K346 PolarHBondContact O-NZ 3.3Å; E317-K346 IonicContact OE2-NZ 2.72Å; T318-K346 HydrophobicContact CG2-CB 4.37Å; T318-K346 HydrophobicContact CG2-CD 4.48Å; N344-K346 PolarHBondContact OD1-O 3.31Å; K346-R353 PolarHBondContact O-NH1 3.27Å; K346-R353 PolarHBondContact O-NH2 3.22Å; K346-Y526 HydrophobicContact CG-CD1 4.18Å; K346-Y526 HydrophobicContact CG-CE1 3.99Å
347	E	49.5	Very low	79.2	Confident	66 Å²	66	43.9 Å²	43.9	31%	0.308	23%	0.231	S	C	.	.			trans	-68.2	176.1	172.8	-122.5	173.6	-155.5	0	0	113.5	K261 R353 R525 Y526	K261-E347 IonicContact NZ-OE1 3.23Å; K261-E347 PolarHBondContact NZ-OE1 3.4Å; E347-R353 PolarHBondContact O-NH2 3.34Å; E347-R525 WeakPolarHBondContact OE2-CB 3.43Å; E347-Y526 HydrophobicContact CB-CD1 3.97Å; E347-Y526 HydrophobicContact CB-CG 4.26Å; E347-Y526 PolarHBondContact OE2-N 3.45Å; E347-Y526 VanDerWaalsContact OE2-N 3.15Å
348	G	54.6	Low	79.3	Confident	48 Å²	48	44.4 Å²	44.4	50%	0.495	23%	0.232	S	C	.	.	S	Bend	trans	109.5	-170.6	-164.1	0	0	0	0	0	110.6	S350	G348-S350 VanDerWaalsContact C-N 3.3Å; G348-S350 PolarHBondContact O-N 3.33Å
349	P	58.4	Low	79.3	Confident	112 Å²	112	47.3 Å²	47.3	73%	0.727	26%	0.255	S	S	*	.			trans	-66.6	87.3	177.2	27.6	-34	0	0	0	110.5	R351	P349-R351 VanDerWaalsContact C-N 3.31Å
350	S	67.4	Low	79.4	Confident	31 Å²	31	49.5 Å²	49.5	22%	0.217	27%	0.268	C	S	.	.	H	α-helix	trans	-67.7	-31.9	179.2	54.7	0	0	0	0	112	G348 F352 R353 M354	G348-S350 VanDerWaalsContact C-N 3.3Å; G348-S350 PolarHBondContact O-N 3.33Å; S350-F352 VanDerWaalsContact C-N 3.32Å; S350-F352 PolarHBondContact O-N 3Å; S350-R353 PolarHBondContact O-N 2.98Å; S350-R353 VanDerWaalsContact O-N 3.14Å; S350-M354 WeakPolarHBondContact O-CB 3.39Å; S350-M354 PolarHBondContact O-N 3.39Å
351	R	78.6	Confident	79.4	Confident	159 Å²	159	49 Å²	49	60%	0.6	27%	0.266	S	S	*	.	H	α-helix	trans	-47.7	-48.6	-176.1	-59.1	-174.1	-169.2	178.7	5.8	113	P349 A355	P349-R351 VanDerWaalsContact C-N 3.31Å; R351-A355 WeakPolarHBondContact O-CB 3.19Å; R351-A355 PolarHBondContact O-N 3.16Å
352	F	81	Confident	79.5	Confident	154 Å²	154	52.7 Å²	52.7	68%	0.675	29%	0.285	S	S	*	.	H	α-helix	trans	-69.8	-48.1	179.7	-178	-99.7	0	0	0	112.8	S350 M354 A355 L356	S350-F352 VanDerWaalsContact C-N 3.32Å; S350-F352 PolarHBondContact O-N 3Å; F352-M354 VanDerWaalsContact C-N 3.29Å; F352-M354 PolarHBondContact O-N 3.01Å; F352-A355 PolarHBondContact O-N 3.46Å; F352-L356 HydrophobicContact CE1-CD2 4.26Å; F352-L356 WeakPolarHBondContact O-CB 3.35Å; F352-L356 PolarHBondContact O-N 3.38Å
353	R	84.3	Confident	79.9	Confident	62 Å²	62	55.1 Å²	55.1	23%	0.234	31%	0.307	C	S	.	.	H	α-helix	trans	-61.9	-38.4	179.5	-66.8	178.9	-71.7	147.4	1.8	112.1	W342 K346 E347 S350 Y357	W342-R353 HydrophobicContact CH2-CB 3.88Å; K346-R353 PolarHBondContact O-NH1 3.27Å; K346-R353 PolarHBondContact O-NH2 3.22Å; E347-R353 PolarHBondContact O-NH2 3.34Å; S350-R353 PolarHBondContact O-N 2.98Å; S350-R353 VanDerWaalsContact O-N 3.14Å; R353-Y357 WeakPolarHBondContact O-CB 3.29Å; R353-Y357 PolarHBondContact O-N 2.99Å
354	M	86	Confident	80.6	Confident	15 Å²	15	56.4 Å²	56.4	7%	0.074	31%	0.314	C	S	.	.	H	α-helix	trans	-70	-45.7	176.5	-178.7	-175.1	167.2	0	0	111.6	W275 W342 S350 F352 Y357 Y358 M403 Y407	W275-M354 HydrophobicContact CH2-CE 3.97Å; W275-M354 HydrophobicContact CZ2-CE 3.75Å; W342-M354 HydrophobicContact CD2-CB 4.45Å; W342-M354 HydrophobicContact CD2-CG 4.39Å; W342-M354 HydrophobicContact CG-CG 4.36Å; W342-M354 HydrophobicContact CZ2-CB 4.03Å; S350-M354 WeakPolarHBondContact O-CB 3.39Å; S350-M354 PolarHBondContact O-N 3.39Å; F352-M354 VanDerWaalsContact C-N 3.29Å; F352-M354 PolarHBondContact O-N 3.01Å; M354-Y357 PolarHBondContact O-N 2.9Å; M354-Y358 HydrophobicContact CE-CD2 4.4Å; M354-Y358 HydrophobicContact CE-CE2 3.95Å; M354-Y358 HydrophobicContact CG-CD2 4Å; M354-Y358 HydrophobicContact CG-CE2 4.01Å; M354-Y358 VanDerWaalsContact O-CD2 3.29Å; M354-Y358 WeakPolarHBondContact O-CD2 3.43Å; M354-Y358 PolarHBondContact O-N 3.41Å; M354-M403 HydrophobicContact CE-CE 4.37Å; M354-M403 HydrophobicContact CE-CG 3.6Å; M354-M403 HydrophobicContact CE-SD 3.32Å; M354-M403 WeakPolarHBondContact CE-SD 3.18Å; M354-Y407 HydrophobicContact CE-CD2 4.1Å; M354-Y407 HydrophobicContact CE-CE2 3.47Å; M354-Y407 VanDerWaalsContact CE-CE2 3.47Å; M354-Y407 HydrophobicContact SD-CE2 4.1Å
355	A	88.4	Confident	81.6	Confident	53 Å²	53	55 Å²	55	44%	0.438	31%	0.306	S	S	.	.	H	α-helix	trans	-59.8	-45.9	174.2	0	0	0	0	0	111.2	R351 F352 Y357 Y358 S359	R351-A355 WeakPolarHBondContact O-CB 3.19Å; R351-A355 PolarHBondContact O-N 3.16Å; F352-A355 PolarHBondContact O-N 3.46Å; A355-Y357 PolarHBondContact O-N 3.27Å; A355-Y358 PolarHBondContact O-N 2.77Å; A355-S359 WeakPolarHBondContact O-CB 3.33Å; A355-S359 PolarHBondContact O-N 3.4Å; A355-S359 PolarHBondContact O-OG 2.92Å; A355-S359 VanDerWaalsContact O-OG 3.14Å
356	L	90.8	Very high	83.1	Confident	60 Å²	60	58.5 Å²	58.5	31%	0.314	33%	0.327	S	S	.	.	H	α-helix	trans	-61	-43.8	177	-178.7	57.4	0	0	0	112.2	W312 F352 S359 V360	W312-L356 HydrophobicContact CH2-CD2 3.44Å; W312-L356 VanDerWaalsContact CH2-CD2 3.44Å; W312-L356 HydrophobicContact CH2-CG 4.5Å; W312-L356 HydrophobicContact CZ2-CD2 3.88Å; W312-L356 HydrophobicContact CZ3-CD2 4.41Å; F352-L356 HydrophobicContact CE1-CD2 4.26Å; F352-L356 WeakPolarHBondContact O-CB 3.35Å; F352-L356 PolarHBondContact O-N 3.38Å; L356-S359 PolarHBondContact O-N 2.82Å; L356-V360 HydrophobicContact CD1-CG2 4.41Å; L356-V360 WeakPolarHBondContact O-CG2 3.45Å; L356-V360 PolarHBondContact O-N 2.96Å
357	Y	91.8	Very high	85.1	Confident	10 Å²	10	59.1 Å²	59.1	4%	0.039	34%	0.341	C	S	.	.	H	α-helix	trans	-57	-51.5	172.6	175.5	-89.1	0	0	0	111.4	M309 Y338 C341 W342 R353 M354 A355 S359 V360 T361	M309-Y357 HydrophobicContact CE-CD2 4.13Å; M309-Y357 HydrophobicContact CE-CE2 4.1Å; M309-Y357 HydrophobicContact SD-CD2 4.31Å; M309-Y357 HydrophobicContact SD-CE2 4.32Å; Y338-Y357 AromaticContact CD1-CD2 3.89Å; Y338-Y357 HydrophobicContact CD1-CD2 3.89Å; Y338-Y357 AromaticContact CD1-CE2 3.74Å; Y338-Y357 HydrophobicContact CD1-CE2 3.74Å; Y338-Y357 HydrophobicContact CE1-CD2 4.13Å; Y338-Y357 HydrophobicContact CE1-CE2 4.37Å; Y338-Y357 HydrophobicContact CG-CE2 4.39Å; Y338-Y357 WeakPolarHBondContact O-CE2 3.36Å; Y338-Y357 PolarHBondContact O-OH 3.02Å; C341-Y357 VanDerWaalsContact CA-OH 3.29Å; C341-Y357 WeakPolarHBondContact CA-OH 3.41Å; C341-Y357 PolarHBondContact N-OH 2.73Å; W342-Y357 HydrophobicContact CB-CD1 3.69Å; W342-Y357 HydrophobicContact CB-CE1 3.72Å; W342-Y357 HydrophobicContact CB-CG 4.41Å; W342-Y357 HydrophobicContact CD2-CG 4.44Å; W342-Y357 HydrophobicContact CE3-CD1 4.03Å; W342-Y357 AromaticContact CE3-CD2 3.97Å; W342-Y357 HydrophobicContact CE3-CD2 3.97Å; W342-Y357 AromaticContact CE3-CG 3.56Å; W342-Y357 HydrophobicContact CE3-CG 3.56Å; W342-Y357 HydrophobicContact CG-CD1 4.42Å; W342-Y357 HydrophobicContact CZ3-CG 4.27Å; R353-Y357 WeakPolarHBondContact O-CB 3.29Å; R353-Y357 PolarHBondContact O-N 2.99Å; M354-Y357 PolarHBondContact O-N 2.9Å; A355-Y357 PolarHBondContact O-N 3.27Å; Y357-S359 VanDerWaalsContact C-N 3.3Å; Y357-S359 PolarHBondContact O-N 3.36Å; Y357-V360 PolarHBondContact O-N 3.37Å; Y357-V360 VanDerWaalsContact O-N 3.14Å; Y357-T361 WeakPolarHBondContact CE1-OG1 3.31Å; Y357-T361 PolarHBondContact O-N 2.92Å; Y357-T361 PolarHBondContact O-OG1 3.2Å
358	Y	93.4	Very high	87.3	Confident	17 Å²	17	56.4 Å²	56.4	7%	0.067	33%	0.328	C	S	.	.	H	α-helix	trans	-65.9	-30.4	-179.9	-80.4	-69.3	0	0	0	113.2	W275 T279 W342 M354 A355 L362 F396 M403	W275-Y358 HydrophobicContact CZ2-CE2 4.2Å; W275-Y358 WeakPolarHBondContact CZ2-OH 3.45Å; W275-Y358 AromaticContact NE1-CZ 3.7Å; W275-Y358 PolarHBondContact NE1-OH 2.85Å; T279-Y358 HydrophobicContact CG2-CE1 3.94Å; W342-Y358 HydrophobicContact CB-CE2 3.86Å; W342-Y358 HydrophobicContact CG-CE2 4.32Å; M354-Y358 HydrophobicContact CE-CD2 4.4Å; M354-Y358 HydrophobicContact CE-CE2 3.95Å; M354-Y358 HydrophobicContact CG-CD2 4Å; M354-Y358 HydrophobicContact CG-CE2 4.01Å; M354-Y358 VanDerWaalsContact O-CD2 3.29Å; M354-Y358 WeakPolarHBondContact O-CD2 3.43Å; M354-Y358 PolarHBondContact O-N 3.41Å; A355-Y358 PolarHBondContact O-N 2.77Å; Y358-L362 VanDerWaalsContact O-CB 3.23Å; Y358-L362 WeakPolarHBondContact O-CB 3.35Å; Y358-L362 PolarHBondContact O-N 2.81Å; Y358-F396 HydrophobicContact CD1-CE2 4.38Å; Y358-F396 AromaticContact CD1-CZ 3.97Å; Y358-F396 HydrophobicContact CD1-CZ 3.97Å; Y358-M403 HydrophobicContact CD2-SD 3.86Å; Y358-M403 HydrophobicContact CE2-SD 3.7Å; Y358-M403 HydrophobicContact CG-SD 4.48Å
359	S	93.9	Very high	89.2	Confident	73 Å²	73	54.5 Å²	54.5	51%	0.51	31%	0.307	S	S	.	.	H	α-helix	trans	-66.6	-41.4	170.5	-65.9	0	0	0	0	112.6	A355 L356 Y357 L362 A363	A355-S359 WeakPolarHBondContact O-CB 3.33Å; A355-S359 PolarHBondContact O-N 3.4Å; A355-S359 PolarHBondContact O-OG 2.92Å; A355-S359 VanDerWaalsContact O-OG 3.14Å; L356-S359 PolarHBondContact O-N 2.82Å; Y357-S359 VanDerWaalsContact C-N 3.3Å; Y357-S359 PolarHBondContact O-N 3.36Å; S359-L362 PolarHBondContact O-N 3.04Å; S359-A363 WeakPolarHBondContact O-CB 3.21Å; S359-A363 PolarHBondContact O-N 2.84Å
360	V	94.7	Very high	90.9	Very high	53 Å²	53	51.4 Å²	51.4	32%	0.321	29%	0.291	S	S	.	.	H	α-helix	trans	-64.8	-49.3	174.1	170.5	0	0	0	0	110.4	M309 L356 Y357 L362 A363 E364	M309-V360 HydrophobicContact CE-CG1 4.23Å; L356-V360 HydrophobicContact CD1-CG2 4.41Å; L356-V360 WeakPolarHBondContact O-CG2 3.45Å; L356-V360 PolarHBondContact O-N 2.96Å; Y357-V360 PolarHBondContact O-N 3.37Å; Y357-V360 VanDerWaalsContact O-N 3.14Å; V360-L362 VanDerWaalsContact C-N 3.28Å; V360-L362 PolarHBondContact O-N 3.41Å; V360-A363 PolarHBondContact O-N 2.86Å; V360-A363 VanDerWaalsContact O-N 3.16Å; V360-E364 HydrophobicContact CG1-CG 4.34Å; V360-E364 WeakPolarHBondContact O-CB 3.38Å; V360-E364 WeakPolarHBondContact O-CG 3.44Å; V360-E364 PolarHBondContact O-N 3.47Å
361	T	94.7	Very high	92.2	Very high	4 Å²	4	51 Å²	51	3%	0.025	29%	0.29	C	S	.	.	H	α-helix	trans	-59.8	-38.1	177.5	-53.1	0	0	0	0	111.9	Y357 N365 F396	Y357-T361 WeakPolarHBondContact CE1-OG1 3.31Å; Y357-T361 PolarHBondContact O-N 2.92Å; Y357-T361 PolarHBondContact O-OG1 3.2Å; T361-N365 VanDerWaalsContact O-CB 3.22Å; T361-N365 WeakPolarHBondContact O-CB 3.23Å; T361-N365 PolarHBondContact O-N 3.33Å; T361-N365 PolarHBondContact O-ND2 3.39Å; T361-N365 PolarHBondContact O-OD1 3.04Å; T361-F396 HydrophobicContact CG2-CE2 3.94Å
362	L	96	Very high	93	Very high	80 Å²	80	44 Å²	44	42%	0.419	26%	0.263	S	S	.	.	H	α-helix	trans	-64.2	-49.9	173.6	176.7	58.6	0	0	0	111.6	Y358 S359 V360 E364 N365 V366 F396	Y358-L362 VanDerWaalsContact O-CB 3.23Å; Y358-L362 WeakPolarHBondContact O-CB 3.35Å; Y358-L362 PolarHBondContact O-N 2.81Å; S359-L362 PolarHBondContact O-N 3.04Å; V360-L362 VanDerWaalsContact C-N 3.28Å; V360-L362 PolarHBondContact O-N 3.41Å; L362-E364 VanDerWaalsContact C-N 3.35Å; L362-E364 PolarHBondContact O-N 2.82Å; L362-N365 PolarHBondContact O-N 3.15Å; L362-V366 HydrophobicContact CD1-CG2 4.09Å; L362-V366 WeakPolarHBondContact O-CB 3.31Å; L362-V366 WeakPolarHBondContact O-CG2 3.44Å; L362-V366 PolarHBondContact O-N 3.18Å; L362-F396 HydrophobicContact CB-CE1 3.75Å; L362-F396 HydrophobicContact CB-CZ 3.85Å; L362-F396 HydrophobicContact CD1-CD1 3.82Å; L362-F396 HydrophobicContact CD1-CE1 3.9Å; L362-F396 HydrophobicContact CD1-CG 4.47Å; L362-F396 HydrophobicContact CD2-CE1 4.4Å; L362-F396 HydrophobicContact CG-CE1 4.22Å
363	A	96.8	Very high	93.5	Very high	60 Å²	60	40.6 Å²	40.6	50%	0.496	25%	0.246	S	C	.	.	H	α-helix	trans	-60.9	-42.8	-179.9	0	0	0	0	0	112	S359 V360 A367	S359-A363 WeakPolarHBondContact O-CB 3.21Å; S359-A363 PolarHBondContact O-N 2.84Å; V360-A363 PolarHBondContact O-N 2.86Å; V360-A363 VanDerWaalsContact O-N 3.16Å; A363-A367 WeakPolarHBondContact O-CB 3.44Å; A363-A367 PolarHBondContact O-N 3.2Å
364	E	96.3	Very high	93.9	Very high	35 Å²	35	42.2 Å²	42.2	16%	0.164	26%	0.264	C	S	.	.	H	α-helix	trans	-65	-46.9	174.1	-71.6	179.6	155.1	0	0	112.2	R283 F301 H305 V360 L362 V366 A367 L368	R283-E364 IonicContact CZ-OE2 2.68Å; R283-E364 IonicContact NH1-OE2 2.8Å; R283-E364 PolarHBondContact NH1-OE2 3.41Å; R283-E364 IonicContact NH2-OE2 3.2Å; R283-E364 PolarHBondContact NH2-OE2 3.37Å; F301-E364 HydrophobicContact CZ-CG 4.45Å; H305-E364 IonicContact CE1-OE1 3.26Å; H305-E364 PolarHBondContact CE1-OE1 2.97Å; H305-E364 VanDerWaalsContact CE1-OE1 3.26Å; H305-E364 IonicContact CE1-OE2 3.09Å; H305-E364 PolarHBondContact CE1-OE2 2.95Å; H305-E364 IonicContact CG-OE1 3.99Å; H305-E364 IonicContact ND1-OE1 2.74Å; H305-E364 PolarHBondContact ND1-OE1 2.87Å; H305-E364 IonicContact ND1-OE2 3.3Å; H305-E364 PolarHBondContact ND1-OE2 3.03Å; V360-E364 HydrophobicContact CG1-CG 4.34Å; V360-E364 WeakPolarHBondContact O-CB 3.38Å; V360-E364 WeakPolarHBondContact O-CG 3.44Å; V360-E364 PolarHBondContact O-N 3.47Å; L362-E364 VanDerWaalsContact C-N 3.35Å; L362-E364 PolarHBondContact O-N 2.82Å; E364-V366 VanDerWaalsContact C-N 3.27Å; E364-V366 PolarHBondContact O-N 2.79Å; E364-A367 PolarHBondContact O-N 2.95Å; E364-A367 VanDerWaalsContact O-N 3.15Å; E364-L368 WeakPolarHBondContact O-CB 3.41Å; E364-L368 WeakPolarHBondContact O-CG 3.32Å; E364-L368 PolarHBondContact O-N 3.35Å
365	N	96.5	Very high	94.1	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-60.9	-39	179	-72.2	1	0	0	0	111.2	R283 A286 T361 L362 T369	R283-N365 WeakPolarHBondContact CD-OD1 3.44Å; R283-N365 PolarHBondContact NH1-OD1 3.39Å; A286-N365 HydrophobicContact CB-CB 4.23Å; T361-N365 VanDerWaalsContact O-CB 3.22Å; T361-N365 WeakPolarHBondContact O-CB 3.23Å; T361-N365 PolarHBondContact O-N 3.33Å; T361-N365 PolarHBondContact O-ND2 3.39Å; T361-N365 PolarHBondContact O-OD1 3.04Å; L362-N365 PolarHBondContact O-N 3.15Å; N365-T369 WeakPolarHBondContact O-CB 3.23Å; N365-T369 PolarHBondContact O-N 2.83Å; N365-T369 VanDerWaalsContact O-N 3.07Å; N365-T369 PolarHBondContact O-OG1 3.14Å
366	V	97.1	Very high	93.9	Very high	87 Å²	87	49 Å²	49	53%	0.527	28%	0.278	S	S	.	.	H	α-helix	trans	-64.7	-48.3	172.8	169.8	0	0	0	0	110.9	L362 E364 T369 A370	L362-V366 HydrophobicContact CD1-CG2 4.09Å; L362-V366 WeakPolarHBondContact O-CB 3.31Å; L362-V366 WeakPolarHBondContact O-CG2 3.44Å; L362-V366 PolarHBondContact O-N 3.18Å; E364-V366 VanDerWaalsContact C-N 3.27Å; E364-V366 PolarHBondContact O-N 2.79Å; V366-T369 PolarHBondContact O-N 3.2Å; V366-A370 WeakPolarHBondContact O-CB 2.95Å; V366-A370 PolarHBondContact O-N 3.18Å
367	A	96.5	Very high	93.4	Very high	58 Å²	58	48 Å²	48	48%	0.479	28%	0.283	S	S	.	.	H	α-helix	trans	-62.6	-45.2	-179	0	0	0	0	0	112.9	A363 E364 A370 A371	A363-A367 WeakPolarHBondContact O-CB 3.44Å; A363-A367 PolarHBondContact O-N 3.2Å; E364-A367 PolarHBondContact O-N 2.95Å; E364-A367 VanDerWaalsContact O-N 3.15Å; A367-A370 PolarHBondContact O-N 2.9Å; A367-A371 VanDerWaalsContact O-CB 3.32Å; A367-A371 WeakPolarHBondContact O-CB 3.19Å; A367-A371 PolarHBondContact O-N 2.88Å
368	L	95.7	Very high	92.4	Very high	10 Å²	10	54 Å²	54	5%	0.052	32%	0.323	C	S	.	.	H	α-helix	trans	-65	-43.8	178.2	-66.9	170.3	0	0	0	111.5	F287 F290 F301 E364 W372	F287-L368 HydrophobicContact CD1-CD1 3.81Å; F287-L368 HydrophobicContact CE1-CD1 3.89Å; F290-L368 HydrophobicContact CB-CB 4.13Å; F290-L368 HydrophobicContact CB-CD2 4Å; F290-L368 HydrophobicContact CD1-CD2 3.8Å; F290-L368 HydrophobicContact CD2-CB 4.4Å; F290-L368 HydrophobicContact CD2-CD2 3.64Å; F290-L368 HydrophobicContact CE1-CD2 4.15Å; F290-L368 HydrophobicContact CE2-CD2 4Å; F290-L368 HydrophobicContact CG-CB 4.42Å; F290-L368 HydrophobicContact CG-CD2 3.52Å; F290-L368 HydrophobicContact CZ-CD2 4.24Å; F301-L368 HydrophobicContact CD2-CD2 4.5Å; F301-L368 HydrophobicContact CE1-CD1 4.01Å; F301-L368 HydrophobicContact CE2-CD2 4.49Å; F301-L368 HydrophobicContact CZ-CD1 3.95Å; E364-L368 WeakPolarHBondContact O-CB 3.41Å; E364-L368 WeakPolarHBondContact O-CG 3.32Å; E364-L368 PolarHBondContact O-N 3.35Å; L368-W372 PolarHBondContact O-N 2.98Å
369	T	95.3	Very high	91.1	Very high	7 Å²	7	60.9 Å²	60.9	4%	0.043	36%	0.356	C	S	.	.	H	α-helix	trans	-69.4	-37.1	178.2	-55.6	0	0	0	0	111.8	L289 N365 V366 W372 Y373 V389	L289-T369 HydrophobicContact CD1-CG2 4.45Å; N365-T369 WeakPolarHBondContact O-CB 3.23Å; N365-T369 PolarHBondContact O-N 2.83Å; N365-T369 VanDerWaalsContact O-N 3.07Å; N365-T369 PolarHBondContact O-OG1 3.14Å; V366-T369 PolarHBondContact O-N 3.2Å; T369-W372 PolarHBondContact O-N 2.97Å; T369-Y373 WeakPolarHBondContact O-CB 3.27Å; T369-Y373 PolarHBondContact O-N 3.19Å; T369-V389 HydrophobicContact CG2-CB 4.33Å; T369-V389 HydrophobicContact CG2-CG1 4.19Å; T369-V389 HydrophobicContact CG2-CG2 3.87Å
370	A	94.6	Very high	90.3	Very high	47 Å²	47	59.2 Å²	59.2	39%	0.388	34%	0.343	S	S	.	.	H	α-helix	trans	-67.9	-44	175.3	0	0	0	0	0	111.8	V366 A367 W372 Y373 T374	V366-A370 WeakPolarHBondContact O-CB 2.95Å; V366-A370 PolarHBondContact O-N 3.18Å; A367-A370 PolarHBondContact O-N 2.9Å; A370-W372 VanDerWaalsContact C-N 3.32Å; A370-W372 PolarHBondContact O-N 2.78Å; A370-Y373 WeakPolarHBondContact O-CB 3.36Å; A370-Y373 PolarHBondContact O-N 3.25Å; A370-Y373 VanDerWaalsContact O-N 3.1Å; A370-T374 PolarHBondContact O-N 2.95Å; A370-T374 PolarHBondContact O-OG1 3.44Å
371	A	94.6	Very high	89.8	Confident	24 Å²	24	59.5 Å²	59.5	20%	0.198	35%	0.347	C	S	.	.	H	α-helix	trans	-61	-40.3	175	0	0	0	0	0	111.8	F290 A367 T374 Y375	F290-A371 HydrophobicContact CD2-CB 4.16Å; F290-A371 HydrophobicContact CE2-CB 4.06Å; A367-A371 VanDerWaalsContact O-CB 3.32Å; A367-A371 WeakPolarHBondContact O-CB 3.19Å; A367-A371 PolarHBondContact O-N 2.88Å; A371-T374 PolarHBondContact O-OG1 2.71Å; A371-Y375 WeakPolarHBondContact O-CB 3.27Å; A371-Y375 VanDerWaalsContact O-CD2 3.31Å; A371-Y375 WeakPolarHBondContact O-CD2 3.43Å; A371-Y375 PolarHBondContact O-N 3.4Å; A371-Y375 VanDerWaalsContact O-N 3.17Å
372	W	94	Very high	89.3	Confident	12 Å²	12	64.3 Å²	64.3	5%	0.045	37%	0.372	C	S	.	.	H	α-helix	trans	-61.2	-48.5	169.7	175.2	81.8	0	0	0	111.7	L289 S292 L368 T369 A370 T374 Y375 R376 A385 V388 V389	L289-W372 HydrophobicContact CB-CB 4.09Å; L289-W372 HydrophobicContact CB-CD2 4.05Å; L289-W372 HydrophobicContact CB-CG 3.75Å; L289-W372 HydrophobicContact CD2-CD2 3.73Å; L289-W372 VanDerWaalsContact CD2-CE2 3.48Å; L289-W372 HydrophobicContact CD2-CE3 4.07Å; L289-W372 HydrophobicContact CD2-CG 4.28Å; L289-W372 HydrophobicContact CD2-CH2 4.01Å; L289-W372 HydrophobicContact CD2-CZ2 3.65Å; L289-W372 HydrophobicContact CD2-CZ3 4.2Å; L289-W372 HydrophobicContact CG-CD2 4.34Å; S292-W372 PolarHBondContact OG-NE1 3.37Å; L368-W372 PolarHBondContact O-N 2.98Å; T369-W372 PolarHBondContact O-N 2.97Å; A370-W372 VanDerWaalsContact C-N 3.32Å; A370-W372 PolarHBondContact O-N 2.78Å; W372-T374 VanDerWaalsContact C-N 3.3Å; W372-T374 PolarHBondContact O-N 2.86Å; W372-Y375 PolarHBondContact O-N 3.09Å; W372-R376 WeakPolarHBondContact O-CB 3.48Å; W372-R376 PolarHBondContact O-N 3.02Å; W372-A385 HydrophobicContact CH2-CB 3.99Å; W372-A385 HydrophobicContact CZ3-CB 4.17Å; W372-V388 HydrophobicContact CH2-CG1 4.32Å; W372-V388 HydrophobicContact CZ3-CG1 4.31Å; W372-V389 HydrophobicContact CZ3-CG2 4.41Å
373	Y	92.3	Very high	88.9	Confident	81 Å²	81	64.4 Å²	64.4	32%	0.318	38%	0.38	S	S	.	.	H	α-helix	trans	-59.1	-37.6	-178	-175.2	-88.1	0	0	0	112.8	T369 A370 R376 A385 L386 V389	T369-Y373 WeakPolarHBondContact O-CB 3.27Å; T369-Y373 PolarHBondContact O-N 3.19Å; A370-Y373 WeakPolarHBondContact O-CB 3.36Å; A370-Y373 PolarHBondContact O-N 3.25Å; A370-Y373 VanDerWaalsContact O-N 3.1Å; Y373-R376 VanDerWaalsContact CZ-NH1 3.33Å; Y373-R376 PolarHBondContact O-NH1 3.23Å; Y373-A385 HydrophobicContact CD2-CB 4.44Å; Y373-A385 HydrophobicContact CE2-CB 4.33Å; Y373-L386 HydrophobicContact CE2-CD2 3.91Å; Y373-L386 HydrophobicContact CE2-CG 4.3Å; Y373-V389 HydrophobicContact CD2-CG2 3.73Å; Y373-V389 HydrophobicContact CE2-CG2 4.44Å; Y373-V389 HydrophobicContact CG-CG2 4.48Å
374	T	91.9	Very high	88.3	Confident	97 Å²	97	64.8 Å²	64.8	60%	0.595	38%	0.379	S	S	*	.	H	α-helix	trans	-79.9	-27.3	179.4	55	0	0	0	0	114.5	A370 A371 W372	A370-T374 PolarHBondContact O-N 2.95Å; A370-T374 PolarHBondContact O-OG1 3.44Å; A371-T374 PolarHBondContact O-OG1 2.71Å; W372-T374 VanDerWaalsContact C-N 3.3Å; W372-T374 PolarHBondContact O-N 2.86Å
375	Y	90.6	Very high	88	Confident	161 Å²	161	63.2 Å²	63.2	63%	0.631	37%	0.372	S	S	*	.	H	α-helix	trans	-112	12.7	-175.8	-66.6	-74.7	0	0	0	113.9	F294 A371 W372	F294-Y375 AromaticContact CE2-CD2 3.94Å; F294-Y375 HydrophobicContact CE2-CD2 3.94Å; F294-Y375 HydrophobicContact CE2-CG 4.19Å; F294-Y375 HydrophobicContact CZ-CD1 4.41Å; F294-Y375 AromaticContact CZ-CD2 3.59Å; F294-Y375 HydrophobicContact CZ-CD2 3.59Å; F294-Y375 HydrophobicContact CZ-CE2 4.31Å; F294-Y375 AromaticContact CZ-CG 3.65Å; F294-Y375 HydrophobicContact CZ-CG 3.65Å; A371-Y375 WeakPolarHBondContact O-CB 3.27Å; A371-Y375 VanDerWaalsContact O-CD2 3.31Å; A371-Y375 WeakPolarHBondContact O-CD2 3.43Å; A371-Y375 PolarHBondContact O-N 3.4Å; A371-Y375 VanDerWaalsContact O-N 3.17Å; W372-Y375 PolarHBondContact O-N 3.09Å
376	R	85.3	Confident	87.7	Confident	48 Å²	48	67.2 Å²	67.2	18%	0.181	39%	0.393	C	S	.	.			trans	-63.2	147.3	174.2	73.9	-176.3	-171.7	-103.7	10	111.9	W372 Y373 T380 D382	W372-R376 WeakPolarHBondContact O-CB 3.48Å; W372-R376 PolarHBondContact O-N 3.02Å; Y373-R376 VanDerWaalsContact CZ-NH1 3.33Å; Y373-R376 PolarHBondContact O-NH1 3.23Å; R376-T380 VanDerWaalsContact CD-OG1 3.3Å; R376-T380 WeakPolarHBondContact CD-OG1 3.4Å; R376-D382 IonicContact CZ-OD1 2.78Å; R376-D382 IonicContact NH2-OD1 3.78Å; R376-D382 PolarHBondContact NH2-OD1 3.36Å
377	G	78.6	Confident	87.4	Confident	41 Å²	41	67.8 Å²	67.8	42%	0.423	40%	0.396	S	S	.	.			trans	-70.6	156.4	173.6	0	0	0	0	0	112.6	Q379 T380	G377-Q379 PolarHBondContact O-N 3.43Å; G377-T380 PolarHBondContact O-N 3.12Å; G377-T380 PolarHBondContact O-OG1 3.01Å; G377-T380 VanDerWaalsContact O-OG1 3.08Å
378	P	71.5	Confident	87.2	Confident	135 Å²	135	67 Å²	67	88%	0.877	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-4.4	-176.7	28	-36.3	0	0	0	114.8
379	Q	67.1	Low	87.1	Confident	162 Å²	162	68.5 Å²	68.5	76%	0.757	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-13.2	179.3	-58.3	-69.8	26.6	0	0	113.8	G377	G377-Q379 PolarHBondContact O-N 3.43Å
380	T	76.4	Confident	87.1	Confident	38 Å²	38	71.7 Å²	71.7	23%	0.233	42%	0.417	C	S	.	.	S	Bend	trans	-97.6	116.8	176.2	51.5	0	0	0	0	110.4	R376 G377	R376-T380 VanDerWaalsContact CD-OG1 3.3Å; R376-T380 WeakPolarHBondContact CD-OG1 3.4Å; G377-T380 PolarHBondContact O-N 3.12Å; G377-T380 PolarHBondContact O-OG1 3.01Å; G377-T380 VanDerWaalsContact O-OG1 3.08Å
381	S	83.5	Confident	87.1	Confident	59 Å²	59	74 Å²	74	41%	0.413	42%	0.422	S	S	.	.			trans	-65.1	145.8	-179.1	60.5	0	0	0	0	112.7	S383 S384 A385	S381-S383 VanDerWaalsContact C-N 3.27Å; S381-S383 PolarHBondContact O-N 2.7Å; S381-S384 PolarHBondContact O-N 3.21Å; S381-S384 VanDerWaalsContact O-N 3.16Å; S381-S384 WeakPolarHBondContact OG-CB 3.43Å; S381-S384 PolarHBondContact OG-OG 3.35Å; S381-S384 VanDerWaalsContact OG-OG 3.13Å; S381-A385 PolarHBondContact O-N 3.19Å
382	D	85.4	Confident	87.2	Confident	104 Å²	104	73.3 Å²	73.3	56%	0.556	42%	0.415	S	S	*	.	H	α-helix	trans	-59.8	-37	-176.8	-64.9	-6.7	0	0	0	112.9	R376 A385 L386	R376-D382 IonicContact CZ-OD1 2.78Å; R376-D382 IonicContact NH2-OD1 3.78Å; R376-D382 PolarHBondContact NH2-OD1 3.36Å; D382-A385 PolarHBondContact O-N 2.75Å; D382-L386 WeakPolarHBondContact O-CB 3.41Å; D382-L386 VanDerWaalsContact O-CG 3.27Å; D382-L386 WeakPolarHBondContact O-CG 3.32Å; D382-L386 PolarHBondContact O-N 3.26Å
383	S	86.8	Confident	87.3	Confident	82 Å²	82	75.5 Å²	75.5	57%	0.573	44%	0.436	S	S	*	.	H	α-helix	trans	-63.3	-47.6	175.5	50.5	0	0	0	0	112.1	S381 L386 V387	S381-S383 VanDerWaalsContact C-N 3.27Å; S381-S383 PolarHBondContact O-N 2.7Å; S383-L386 PolarHBondContact O-N 2.88Å; S383-V387 WeakPolarHBondContact O-CG2 3.32Å; S383-V387 PolarHBondContact O-N 2.83Å
384	S	84.8	Confident	87.5	Confident	68 Å²	68	75.8 Å²	75.8	48%	0.476	45%	0.449	S	S	.	.	H	α-helix	trans	-65.9	-39.4	176.7	-66.2	0	0	0	0	112	S381 V387 V388	S381-S384 PolarHBondContact O-N 3.21Å; S381-S384 VanDerWaalsContact O-N 3.16Å; S381-S384 WeakPolarHBondContact OG-CB 3.43Å; S381-S384 PolarHBondContact OG-OG 3.35Å; S381-S384 VanDerWaalsContact OG-OG 3.13Å; S384-V387 PolarHBondContact O-N 3.1Å; S384-V388 WeakPolarHBondContact O-CG2 3.47Å; S384-V388 PolarHBondContact O-N 3.37Å; S384-V388 VanDerWaalsContact O-N 3.08Å
385	A	88.7	Confident	87.7	Confident	2 Å²	2	72.1 Å²	72.1	2%	0.017	43%	0.427	C	S	.	.	H	α-helix	trans	-63.2	-45.2	175.9	0	0	0	0	0	111.9	W372 Y373 S381 D382 V388 V389	W372-A385 HydrophobicContact CH2-CB 3.99Å; W372-A385 HydrophobicContact CZ3-CB 4.17Å; Y373-A385 HydrophobicContact CD2-CB 4.44Å; Y373-A385 HydrophobicContact CE2-CB 4.33Å; S381-A385 PolarHBondContact O-N 3.19Å; D382-A385 PolarHBondContact O-N 2.75Å; A385-V388 PolarHBondContact O-N 3.08Å; A385-V389 WeakPolarHBondContact O-CG2 3.37Å; A385-V389 PolarHBondContact O-N 2.96Å
386	L	91.1	Very high	88	Confident	88 Å²	88	65.1 Å²	65.1	46%	0.461	40%	0.4	S	S	.	.	H	α-helix	trans	-63.1	-40.6	175.6	-73.7	170.1	0	0	0	112.4	Y373 D382 S383 V388 V389 C390	Y373-L386 HydrophobicContact CE2-CD2 3.91Å; Y373-L386 HydrophobicContact CE2-CG 4.3Å; D382-L386 WeakPolarHBondContact O-CB 3.41Å; D382-L386 VanDerWaalsContact O-CG 3.27Å; D382-L386 WeakPolarHBondContact O-CG 3.32Å; D382-L386 PolarHBondContact O-N 3.26Å; S383-L386 PolarHBondContact O-N 2.88Å; L386-V388 VanDerWaalsContact C-N 3.28Å; L386-V388 PolarHBondContact O-N 3.11Å; L386-V389 PolarHBondContact O-N 3.15Å; L386-C390 WeakPolarHBondContact O-CB 3.49Å; L386-C390 PolarHBondContact O-N 3.09Å; L386-C390 PolarHBondContact O-SG 3.44Å
387	V	91.9	Very high	88.6	Confident	100 Å²	100	65.7 Å²	65.7	61%	0.606	42%	0.415	S	S	*	.	H	α-helix	trans	-58.4	-40.9	174	166.8	0	0	0	0	111.3	S383 S384 L391	S383-V387 WeakPolarHBondContact O-CG2 3.32Å; S383-V387 PolarHBondContact O-N 2.83Å; S384-V387 PolarHBondContact O-N 3.1Å; V387-L391 WeakPolarHBondContact O-CB 3.41Å; V387-L391 PolarHBondContact O-N 3.26Å
388	V	91.1	Very high	89.5	Confident	41 Å²	41	66.8 Å²	66.8	25%	0.248	41%	0.411	C	S	.	.	H	α-helix	trans	-68.5	-42.4	177.6	169.3	0	0	0	0	112.4	L289 W372 S384 A385 L386 L391 V392	L289-V388 HydrophobicContact CD1-CG1 3.59Å; L289-V388 HydrophobicContact CD2-CG1 3.64Å; L289-V388 HydrophobicContact CG-CG1 4.21Å; W372-V388 HydrophobicContact CH2-CG1 4.32Å; W372-V388 HydrophobicContact CZ3-CG1 4.31Å; S384-V388 WeakPolarHBondContact O-CG2 3.47Å; S384-V388 PolarHBondContact O-N 3.37Å; S384-V388 VanDerWaalsContact O-N 3.08Å; A385-V388 PolarHBondContact O-N 3.08Å; L386-V388 VanDerWaalsContact C-N 3.28Å; L386-V388 PolarHBondContact O-N 3.11Å; V388-L391 WeakPolarHBondContact O-CB 3.34Å; V388-L391 PolarHBondContact O-N 3.08Å; V388-V392 PolarHBondContact O-N 3.35Å; V388-V392 VanDerWaalsContact O-N 3.08Å
389	V	94.2	Very high	90.6	Very high	42 Å²	42	60.3 Å²	60.3	26%	0.255	37%	0.369	S	S	.	.	H	α-helix	trans	-61.9	-45.5	174.8	177.1	0	0	0	0	110.7	T369 W372 Y373 A385 L386 L391 V392 A393	T369-V389 HydrophobicContact CG2-CB 4.33Å; T369-V389 HydrophobicContact CG2-CG1 4.19Å; T369-V389 HydrophobicContact CG2-CG2 3.87Å; W372-V389 HydrophobicContact CZ3-CG2 4.41Å; Y373-V389 HydrophobicContact CD2-CG2 3.73Å; Y373-V389 HydrophobicContact CE2-CG2 4.44Å; Y373-V389 HydrophobicContact CG-CG2 4.48Å; A385-V389 WeakPolarHBondContact O-CG2 3.37Å; A385-V389 PolarHBondContact O-N 2.96Å; L386-V389 PolarHBondContact O-N 3.15Å; V389-L391 VanDerWaalsContact C-N 3.33Å; V389-L391 PolarHBondContact O-N 2.96Å; V389-V392 PolarHBondContact O-N 2.98Å; V389-A393 PolarHBondContact O-N 3.34Å
390	C	95.1	Very high	91.9	Very high	74 Å²	74	54.5 Å²	54.5	50%	0.5	34%	0.344	S	S	.	.	H	α-helix	trans	-61.9	-38.7	175.2	-72.2	0	0	0	0	112	L386 A393 C394	L386-C390 WeakPolarHBondContact O-CB 3.49Å; L386-C390 PolarHBondContact O-N 3.09Å; L386-C390 PolarHBondContact O-SG 3.44Å; C390-A393 PolarHBondContact O-N 2.89Å; C390-C394 WeakPolarHBondContact O-CB 3.48Å; C390-C394 PolarHBondContact O-N 2.95Å; C390-C394 PolarHBondContact O-SG 3.16Å
391	L	94.2	Very high	92.8	Very high	95 Å²	95	58.1 Å²	58.1	50%	0.497	36%	0.357	S	S	.	.	H	α-helix	trans	-60.9	-44.9	176	179.3	64	0	0	0	111.8	V387 V388 V389 S395	V387-L391 WeakPolarHBondContact O-CB 3.41Å; V387-L391 PolarHBondContact O-N 3.26Å; V388-L391 WeakPolarHBondContact O-CB 3.34Å; V388-L391 PolarHBondContact O-N 3.08Å; V389-L391 VanDerWaalsContact C-N 3.33Å; V389-L391 PolarHBondContact O-N 2.96Å; L391-S395 WeakPolarHBondContact O-CB 3.39Å; L391-S395 PolarHBondContact O-N 3.3Å; L391-S395 PolarHBondContact O-OG 3.45Å
392	V	96.5	Very high	93.3	Very high	9 Å²	9	57.3 Å²	57.3	6%	0.055	35%	0.346	C	S	.	.	H	α-helix	trans	-62.6	-49	176.2	174.8	0	0	0	0	111	A282 V285 A286 L289 V388 V389 S395 F396	A282-V392 HydrophobicContact CB-CG1 4.49Å; V285-V392 HydrophobicContact CB-CG2 4.09Å; V285-V392 HydrophobicContact CG1-CG2 3.52Å; A286-V392 HydrophobicContact CB-CG1 4.33Å; L289-V392 HydrophobicContact CD1-CG2 4.1Å; V388-V392 PolarHBondContact O-N 3.35Å; V388-V392 VanDerWaalsContact O-N 3.08Å; V389-V392 PolarHBondContact O-N 2.98Å; V392-S395 PolarHBondContact O-N 2.98Å; V392-F396 PolarHBondContact O-N 3.39Å
393	A	96.6	Very high	93.5	Very high	59 Å²	59	53.4 Å²	53.4	49%	0.488	33%	0.325	S	S	.	.	H	α-helix	trans	-63.3	-49.5	-178.5	0	0	0	0	0	112.4	V389 C390 S395 F396 A397	V389-A393 PolarHBondContact O-N 3.34Å; C390-A393 PolarHBondContact O-N 2.89Å; A393-S395 PolarHBondContact O-N 3.39Å; A393-F396 PolarHBondContact O-N 3.46Å; A393-A397 WeakPolarHBondContact O-CB 3.42Å; A393-A397 PolarHBondContact O-N 3.16Å
394	C	96.9	Very high	93.7	Very high	86 Å²	86	54 Å²	54	58%	0.581	32%	0.321	S	S	*	.	H	α-helix	trans	-64.7	-37.4	178	-69.7	0	0	0	0	112.3	C390 A397 L398	C390-C394 WeakPolarHBondContact O-CB 3.48Å; C390-C394 PolarHBondContact O-N 2.95Å; C390-C394 PolarHBondContact O-SG 3.16Å; C394-A397 PolarHBondContact O-N 3.02Å; C394-L398 VanDerWaalsContact O-CB 3.23Å; C394-L398 WeakPolarHBondContact O-CB 3.17Å; C394-L398 PolarHBondContact O-N 3.25Å
395	S	96.5	Very high	93.9	Very high	21 Å²	21	52 Å²	52	15%	0.147	31%	0.306	C	S	.	.	H	α-helix	trans	-63.8	-46.6	175.1	-61.1	0	0	0	0	111.2	F278 L391 V392 A393 A397 L398 G399	F278-S395 WeakPolarHBondContact CB-O 3.49Å; L391-S395 WeakPolarHBondContact O-CB 3.39Å; L391-S395 PolarHBondContact O-N 3.3Å; L391-S395 PolarHBondContact O-OG 3.45Å; V392-S395 PolarHBondContact O-N 2.98Å; A393-S395 PolarHBondContact O-N 3.39Å; S395-A397 PolarHBondContact O-N 3.36Å; S395-L398 PolarHBondContact O-N 3.48Å; S395-G399 PolarHBondContact O-N 2.89Å
396	F	96.9	Very high	93.9	Very high	14 Å²	14	52.5 Å²	52.5	6%	0.061	31%	0.308	C	S	.	.	H	α-helix	trans	-63.6	-42.1	178.4	-167.3	-88.5	0	0	0	112.2	A282 Y358 T361 L362 V392 A393 G399 T400	A282-F396 HydrophobicContact CB-CB 3.85Å; A282-F396 HydrophobicContact CB-CD2 4.24Å; Y358-F396 HydrophobicContact CD1-CE2 4.38Å; Y358-F396 AromaticContact CD1-CZ 3.97Å; Y358-F396 HydrophobicContact CD1-CZ 3.97Å; T361-F396 HydrophobicContact CG2-CE2 3.94Å; L362-F396 HydrophobicContact CB-CE1 3.75Å; L362-F396 HydrophobicContact CB-CZ 3.85Å; L362-F396 HydrophobicContact CD1-CD1 3.82Å; L362-F396 HydrophobicContact CD1-CE1 3.9Å; L362-F396 HydrophobicContact CD1-CG 4.47Å; L362-F396 HydrophobicContact CD2-CE1 4.4Å; L362-F396 HydrophobicContact CG-CE1 4.22Å; V392-F396 PolarHBondContact O-N 3.39Å; A393-F396 PolarHBondContact O-N 3.46Å; F396-G399 PolarHBondContact O-N 3.48Å; F396-T400 PolarHBondContact O-N 3.47Å; F396-T400 PolarHBondContact O-OG1 2.76Å
397	A	96.8	Very high	93.6	Very high	59 Å²	59	51.2 Å²	51.2	49%	0.488	30%	0.297	S	S	.	.	H	α-helix	trans	-62.1	-43.6	175.6	0	0	0	0	0	112.2	A393 C394 S395 T400 F401	A393-A397 WeakPolarHBondContact O-CB 3.42Å; A393-A397 PolarHBondContact O-N 3.16Å; C394-A397 PolarHBondContact O-N 3.02Å; S395-A397 PolarHBondContact O-N 3.36Å; A397-T400 CarbonylContact O-C 3.58Å; A397-T400 WeakPolarHBondContact O-CB 3.46Å; A397-T400 PolarHBondContact O-N 3.26Å; A397-F401 PolarHBondContact O-N 2.86Å
398	L	96.6	Very high	93.2	Very high	64 Å²	64	48.1 Å²	48.1	34%	0.335	28%	0.279	S	S	.	.	H	α-helix	trans	-67.9	-36.5	178	-174.8	56.3	0	0	0	112.2	F278 C394 S395 F401 F402	F278-L398 HydrophobicContact CD1-CD2 4.01Å; F278-L398 HydrophobicContact CD1-CG 4.41Å; F278-L398 HydrophobicContact CD2-CD2 4.01Å; F278-L398 HydrophobicContact CD2-CG 3.88Å; F278-L398 HydrophobicContact CE1-CD2 3.67Å; F278-L398 HydrophobicContact CE1-CG 4.49Å; F278-L398 HydrophobicContact CE2-CD2 3.68Å; F278-L398 HydrophobicContact CE2-CG 3.98Å; F278-L398 HydrophobicContact CG-CB 4.39Å; F278-L398 HydrophobicContact CG-CD2 4.19Å; F278-L398 HydrophobicContact CG-CG 4.14Å; F278-L398 HydrophobicContact CZ-CD2 3.51Å; F278-L398 HydrophobicContact CZ-CG 4.29Å; C394-L398 VanDerWaalsContact O-CB 3.23Å; C394-L398 WeakPolarHBondContact O-CB 3.17Å; C394-L398 PolarHBondContact O-N 3.25Å; S395-L398 PolarHBondContact O-N 3.48Å; L398-F401 HydrophobicContact CD1-CD1 4.08Å; L398-F401 WeakPolarHBondContact O-CB 3.23Å; L398-F401 PolarHBondContact O-N 3.27Å; L398-F402 HydrophobicContact CD1-CD2 3.98Å; L398-F402 HydrophobicContact CD1-CE2 3.53Å; L398-F402 HydrophobicContact CD1-CZ 4.34Å; L398-F402 HydrophobicContact CD2-CE2 4.33Å; L398-F402 HydrophobicContact CG-CD2 4.01Å; L398-F402 HydrophobicContact CG-CE2 3.73Å; L398-F402 VanDerWaalsContact O-CD2 3.24Å; L398-F402 WeakPolarHBondContact O-CD2 3.41Å; L398-F402 PolarHBondContact O-N 2.87Å
399	G	96.1	Very high	92.7	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.3	-42.1	170.5	0	0	0	0	0	112.6	W275 S395 F396 F401 F402 M403	W275-G399 VanDerWaalsContact CD1-O 3.29Å; S395-G399 PolarHBondContact O-N 2.89Å; F396-G399 PolarHBondContact O-N 3.48Å; G399-F401 VanDerWaalsContact C-N 3.33Å; G399-F402 PolarHBondContact O-N 3.2Å; G399-M403 WeakPolarHBondContact O-CB 3.36Å; G399-M403 PolarHBondContact O-N 2.85Å
400	T	93.5	Very high	92	Very high	40 Å²	40	55.5 Å²	55.5	25%	0.245	30%	0.302	C	S	.	.	H	α-helix	trans	-65.3	-35	173.6	-53	0	0	0	0	111.8	F396 A397 M403 L404	F396-T400 PolarHBondContact O-N 3.47Å; F396-T400 PolarHBondContact O-OG1 2.76Å; A397-T400 CarbonylContact O-C 3.58Å; A397-T400 WeakPolarHBondContact O-CB 3.46Å; A397-T400 PolarHBondContact O-N 3.26Å; T400-M403 HydrophobicContact CG2-CE 3.87Å; T400-M403 WeakPolarHBondContact O-CB 3.16Å; T400-L404 WeakPolarHBondContact O-CG 3.34Å; T400-L404 PolarHBondContact O-N 3.42Å; T400-L404 VanDerWaalsContact O-N 3.11Å
401	F	95.1	Very high	91.2	Very high	114 Å²	114	53.8 Å²	53.8	50%	0.5	29%	0.287	S	S	.	.	H	α-helix	trans	-64.4	-49.6	172.6	171	-97.5	0	0	0	112	A397 L398 G399 M403 L404 V405	A397-F401 PolarHBondContact O-N 2.86Å; L398-F401 HydrophobicContact CD1-CD1 4.08Å; L398-F401 WeakPolarHBondContact O-CB 3.23Å; L398-F401 PolarHBondContact O-N 3.27Å; G399-F401 VanDerWaalsContact C-N 3.33Å; F401-M403 VanDerWaalsContact C-N 3.3Å; F401-M403 PolarHBondContact O-N 2.95Å; F401-L404 PolarHBondContact O-N 2.93Å; F401-L404 VanDerWaalsContact O-N 3.09Å; F401-V405 HydrophobicContact CD1-CG2 4.27Å; F401-V405 HydrophobicContact CD2-CG2 4.43Å; F401-V405 HydrophobicContact CE1-CG2 3.82Å; F401-V405 HydrophobicContact CE2-CG2 3.99Å; F401-V405 HydrophobicContact CZ-CG2 3.66Å; F401-V405 WeakPolarHBondContact O-CG2 3.28Å; F401-V405 PolarHBondContact O-N 3.37Å
402	F	94.4	Very high	89.8	Confident	42 Å²	42	50.3 Å²	50.3	18%	0.184	27%	0.27	C	S	.	.	H	α-helix	trans	-64.9	-32.7	178.2	-77.6	-64.9	0	0	0	113	L274 W275 F278 L398 G399 V405 Y406	L274-F402 HydrophobicContact CB-CB 4.35Å; L274-F402 HydrophobicContact CB-CD1 4.04Å; L274-F402 HydrophobicContact CB-CD2 3.83Å; L274-F402 HydrophobicContact CB-CE1 4.31Å; L274-F402 HydrophobicContact CB-CE2 4.09Å; L274-F402 HydrophobicContact CB-CG 3.81Å; L274-F402 HydrophobicContact CB-CZ 4.34Å; L274-F402 HydrophobicContact CD1-CD1 4.13Å; L274-F402 HydrophobicContact CD1-CE1 3.69Å; L274-F402 HydrophobicContact CD1-CE2 4.38Å; L274-F402 HydrophobicContact CD1-CZ 3.84Å; W275-F402 HydrophobicContact CB-CB 3.93Å; F278-F402 AromaticContact CD2-CD2 3.75Å; F278-F402 HydrophobicContact CD2-CD2 3.75Å; F278-F402 AromaticContact CD2-CE2 3.85Å; F278-F402 HydrophobicContact CD2-CE2 3.85Å; F278-F402 HydrophobicContact CE2-CD2 4.02Å; F278-F402 AromaticContact CE2-CE2 3.62Å; F278-F402 HydrophobicContact CE2-CE2 3.62Å; L398-F402 HydrophobicContact CD1-CD2 3.98Å; L398-F402 HydrophobicContact CD1-CE2 3.53Å; L398-F402 HydrophobicContact CD1-CZ 4.34Å; L398-F402 HydrophobicContact CD2-CE2 4.33Å; L398-F402 HydrophobicContact CG-CD2 4.01Å; L398-F402 HydrophobicContact CG-CE2 3.73Å; L398-F402 VanDerWaalsContact O-CD2 3.24Å; L398-F402 WeakPolarHBondContact O-CD2 3.41Å; L398-F402 PolarHBondContact O-N 2.87Å; G399-F402 PolarHBondContact O-N 3.2Å; F402-V405 PolarHBondContact O-N 3.44Å; F402-Y406 WeakPolarHBondContact O-CB 3.49Å; F402-Y406 PolarHBondContact O-N 2.91Å
403	M	90.7	Very high	88.3	Confident	22 Å²	22	54.2 Å²	54.2	11%	0.108	29%	0.29	C	S	.	.	H	α-helix	trans	-57.2	-47.9	168.8	-176.2	-174.7	79.3	0	0	111.9	W275 M354 Y358 G399 T400 F401 Y406 Y407	W275-M403 HydrophobicContact CD2-CB 3.84Å; W275-M403 HydrophobicContact CD2-CG 3.98Å; W275-M403 HydrophobicContact CG-CB 3.8Å; W275-M403 HydrophobicContact CG-CG 4.44Å; W275-M403 HydrophobicContact CH2-CG 4.34Å; W275-M403 HydrophobicContact CZ2-CB 4.48Å; W275-M403 HydrophobicContact CZ2-CG 3.76Å; W275-M403 HydrophobicContact CZ2-SD 4.19Å; M354-M403 HydrophobicContact CE-CE 4.37Å; M354-M403 HydrophobicContact CE-CG 3.6Å; M354-M403 HydrophobicContact CE-SD 3.32Å; M354-M403 WeakPolarHBondContact CE-SD 3.18Å; Y358-M403 HydrophobicContact CD2-SD 3.86Å; Y358-M403 HydrophobicContact CE2-SD 3.7Å; Y358-M403 HydrophobicContact CG-SD 4.48Å; G399-M403 WeakPolarHBondContact O-CB 3.36Å; G399-M403 PolarHBondContact O-N 2.85Å; T400-M403 HydrophobicContact CG2-CE 3.87Å; T400-M403 WeakPolarHBondContact O-CB 3.16Å; F401-M403 VanDerWaalsContact C-N 3.3Å; F401-M403 PolarHBondContact O-N 2.95Å; M403-Y406 WeakPolarHBondContact O-CB 3.4Å; M403-Y406 PolarHBondContact O-N 3.03Å; M403-Y407 HydrophobicContact CG-CD2 4.16Å; M403-Y407 HydrophobicContact CG-CE2 4.29Å; M403-Y407 WeakPolarHBondContact O-CD2 3.43Å; M403-Y407 PolarHBondContact O-N 3.3Å
404	L	89.5	Confident	86.5	Confident	94 Å²	94	52.9 Å²	52.9	49%	0.492	28%	0.282	S	S	.	.	H	α-helix	trans	-67.2	-43.7	178.5	-69.6	170.5	0	0	0	111.5	T400 F401 Y406 Y407 C408	T400-L404 WeakPolarHBondContact O-CG 3.34Å; T400-L404 PolarHBondContact O-N 3.42Å; T400-L404 VanDerWaalsContact O-N 3.11Å; F401-L404 PolarHBondContact O-N 2.93Å; F401-L404 VanDerWaalsContact O-N 3.09Å; L404-Y406 VanDerWaalsContact C-N 3.26Å; L404-Y406 PolarHBondContact O-N 3.41Å; L404-Y407 PolarHBondContact O-N 2.93Å; L404-C408 WeakPolarHBondContact O-CB 3.45Å; L404-C408 PolarHBondContact O-N 3.17Å; L404-C408 PolarHBondContact O-SG 3.02Å; L404-C408 VanDerWaalsContact O-SG 3.34Å
405	V	89.7	Confident	84.9	Confident	26 Å²	26	52.2 Å²	52.2	16%	0.158	28%	0.277	C	S	.	.	H	α-helix	trans	-58.4	-40.3	173.8	173.2	0	0	0	0	111.3	F401 F402 W409 L410	F401-V405 HydrophobicContact CD1-CG2 4.27Å; F401-V405 HydrophobicContact CD2-CG2 4.43Å; F401-V405 HydrophobicContact CE1-CG2 3.82Å; F401-V405 HydrophobicContact CE2-CG2 3.99Å; F401-V405 HydrophobicContact CZ-CG2 3.66Å; F401-V405 WeakPolarHBondContact O-CG2 3.28Å; F401-V405 PolarHBondContact O-N 3.37Å; F402-V405 PolarHBondContact O-N 3.44Å; V405-W409 HydrophobicContact CG1-CE3 4.24Å; V405-W409 PolarHBondContact O-N 2.89Å; V405-W409 VanDerWaalsContact O-N 3.11Å; V405-L410 HydrophobicContact CG1-CD1 4.15Å; V405-L410 PolarHBondContact O-N 2.68Å
406	Y	87.9	Confident	83.1	Confident	13 Å²	13	53.1 Å²	53.1	5%	0.051	28%	0.281	C	S	.	.	I	π-helix	trans	-60.5	-57.1	174.7	174.5	-111.9	0	0	0	111.6	M264 A268 W275 F402 M403 L404 L410 H411	M264-Y406 HydrophobicContact CE-CE2 3.59Å; A268-Y406 HydrophobicContact CB-CD2 4.38Å; A268-Y406 HydrophobicContact CB-CE2 4.1Å; W275-Y406 AromaticContact CE3-CD1 3.95Å; W275-Y406 HydrophobicContact CE3-CD1 3.95Å; W275-Y406 HydrophobicContact CE3-CG 4.43Å; W275-Y406 AromaticContact CZ3-CD1 3.64Å; W275-Y406 HydrophobicContact CZ3-CD1 3.64Å; W275-Y406 AromaticContact CZ3-CE1 3.99Å; W275-Y406 HydrophobicContact CZ3-CE1 3.99Å; F402-Y406 WeakPolarHBondContact O-CB 3.49Å; F402-Y406 PolarHBondContact O-N 2.91Å; M403-Y406 WeakPolarHBondContact O-CB 3.4Å; M403-Y406 PolarHBondContact O-N 3.03Å; L404-Y406 VanDerWaalsContact C-N 3.26Å; L404-Y406 PolarHBondContact O-N 3.41Å; Y406-L410 HydrophobicContact CD2-CB 4.34Å; Y406-L410 CarbonylContact O-C 3.6Å; Y406-L410 PolarHBondContact O-N 3.37Å; Y406-L410 VanDerWaalsContact O-N 3.1Å; Y406-H411 AromaticContact CE1-CD2 3.81Å; Y406-H411 AromaticContact CZ-CD2 3.71Å; Y406-H411 PolarHBondContact O-N 2.96Å
407	Y	84.6	Confident	81	Confident	60 Å²	60	55.6 Å²	55.6	24%	0.235	30%	0.295	C	S	.	.	I	π-helix	trans	-71.5	-30.4	-176.9	-77.4	-70.7	0	0	0	114.8	W275 M354 M403 L404 H411 V416	W275-Y407 AromaticContact CH2-CE2 3.58Å; W275-Y407 HydrophobicContact CH2-CE2 3.58Å; W275-Y407 HydrophobicContact CZ2-CE2 4.4Å; W275-Y407 AromaticContact CZ3-CE2 3.72Å; W275-Y407 HydrophobicContact CZ3-CE2 3.72Å; M354-Y407 HydrophobicContact CE-CD2 4.1Å; M354-Y407 HydrophobicContact CE-CE2 3.47Å; M354-Y407 VanDerWaalsContact CE-CE2 3.47Å; M354-Y407 HydrophobicContact SD-CE2 4.1Å; M403-Y407 HydrophobicContact CG-CD2 4.16Å; M403-Y407 HydrophobicContact CG-CE2 4.29Å; M403-Y407 WeakPolarHBondContact O-CD2 3.43Å; M403-Y407 PolarHBondContact O-N 3.3Å; L404-Y407 PolarHBondContact O-N 2.93Å; Y407-H411 AromaticContact CD1-CD2 3.69Å; Y407-H411 AromaticContact CE1-CD2 3.71Å; Y407-H411 AromaticContact CE1-NE2 3.89Å; Y407-V416 WeakPolarHBondContact O-CG2 3.28Å
408	C	83.6	Confident	78.5	Confident	35 Å²	35	54.9 Å²	54.9	24%	0.236	29%	0.293	C	S	.	.	I	π-helix	trans	-81.9	-35.5	-177.9	-69.5	0	0	0	0	113.3	L404 P415	L404-C408 WeakPolarHBondContact O-CB 3.45Å; L404-C408 PolarHBondContact O-N 3.17Å; L404-C408 PolarHBondContact O-SG 3.02Å; L404-C408 VanDerWaalsContact O-SG 3.34Å; C408-P415 WeakPolarHBondContact O-CA 3.24Å; C408-P415 WeakPolarHBondContact O-CB 3.49Å
409	W	80.9	Confident	75.9	Confident	184 Å²	184	56.4 Å²	56.4	70%	0.697	31%	0.309	S	S	*	.	I	π-helix	trans	-127.5	-32.5	-171.4	-64	-18.3	0	0	0	115.5	V405	V405-W409 HydrophobicContact CG1-CE3 4.24Å; V405-W409 PolarHBondContact O-N 2.89Å; V405-W409 VanDerWaalsContact O-N 3.11Å
410	L	79.8	Confident	73.4	Confident	55 Å²	55	63.5 Å²	63.5	29%	0.288	34%	0.342	S	S	.	.	I	π-helix	trans	-105.5	-1.9	-171.7	-63	171.5	0	0	0	113.8	K267 A268 A271 V405 Y406 P412	K267-L410 HydrophobicContact CB-CD2 4.2Å; A268-L410 HydrophobicContact CB-CB 3.99Å; A268-L410 VanDerWaalsContact CB-O 3.27Å; A268-L410 WeakPolarHBondContact CB-O 3.42Å; A271-L410 HydrophobicContact CB-CD1 3.45Å; A271-L410 VanDerWaalsContact CB-CD1 3.45Å; V405-L410 HydrophobicContact CG1-CD1 4.15Å; V405-L410 PolarHBondContact O-N 2.68Å; Y406-L410 HydrophobicContact CD2-CB 4.34Å; Y406-L410 CarbonylContact O-C 3.6Å; Y406-L410 PolarHBondContact O-N 3.37Å; Y406-L410 VanDerWaalsContact O-N 3.1Å; L410-P412 VanDerWaalsContact O-CD 3.32Å; L410-P412 WeakPolarHBondContact O-CD 3.24Å
411	H	77.9	Confident	70.4	Confident	38 Å²	38	70.6 Å²	70.6	18%	0.176	37%	0.365	C	S	.	.			trans	-66.4	120.7	-178.5	-165.5	-102.1	0	0	0	110.4	Y406 Y407 D413 G414	Y406-H411 AromaticContact CE1-CD2 3.81Å; Y406-H411 AromaticContact CZ-CD2 3.71Å; Y406-H411 PolarHBondContact O-N 2.96Å; Y407-H411 AromaticContact CD1-CD2 3.69Å; Y407-H411 AromaticContact CE1-CD2 3.71Å; Y407-H411 AromaticContact CE1-NE2 3.89Å; H411-D413 IonicContact CE1-OD2 2.7Å; H411-D413 PolarHBondContact CE1-OD2 3.29Å; H411-D413 IonicContact ND1-OD2 3.55Å; H411-D413 PolarHBondContact O-N 3.16Å; H411-D413 VanDerWaalsContact O-N 3.08Å; H411-G414 CarbonylContact O-C 3.58Å; H411-G414 PolarHBondContact O-N 2.91Å
412	P	65	Low	67.4	Low	22 Å²	22	68.6 Å²	68.6	14%	0.143	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-5.7	-173	22.7	-33.4	0	0	0	116.1	L410 G414	L410-P412 VanDerWaalsContact O-CD 3.32Å; L410-P412 WeakPolarHBondContact O-CD 3.24Å; P412-G414 VanDerWaalsContact C-N 3.32Å
413	D	64.6	Low	64.6	Low	91 Å²	91	69.9 Å²	69.9	49%	0.487	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	6.7	166.6	-58.8	-46.1	0	0	0	113.2	R255 H411	R255-D413 IonicContact CZ-OD1 3.67Å; R255-D413 IonicContact CZ-OD2 3.88Å; R255-D413 VanDerWaalsContact NH1-CG 3.26Å; R255-D413 IonicContact NH1-OD1 2.75Å; R255-D413 PolarHBondContact NH1-OD1 2.96Å; R255-D413 IonicContact NH1-OD2 2.65Å; R255-D413 PolarHBondContact NH1-OD2 3.46Å; R255-D413 IonicContact NH2-OD1 3.72Å; R255-D413 PolarHBondContact NH2-OD1 3.43Å; R255-D413 IonicContact NH2-OD2 2.76Å; H411-D413 IonicContact CE1-OD2 2.7Å; H411-D413 PolarHBondContact CE1-OD2 3.29Å; H411-D413 IonicContact ND1-OD2 3.55Å; H411-D413 PolarHBondContact O-N 3.16Å; H411-D413 VanDerWaalsContact O-N 3.08Å
414	G	60.3	Low	61.9	Low	31 Å²	31	74 Å²	74	32%	0.32	43%	0.431	S	S	.	.			trans	106.7	159.2	179.1	0	0	0	0	0	113.9	H411 P412 V416	H411-G414 CarbonylContact O-C 3.58Å; H411-G414 PolarHBondContact O-N 2.91Å; P412-G414 VanDerWaalsContact C-N 3.32Å; G414-V416 PolarHBondContact O-N 2.81Å
415	P	62.2	Low	59.2	Low	71 Å²	71	76.2 Å²	76.2	46%	0.461	45%	0.448	S	S	.	.			trans	-68.3	116	178.8	28.3	-34.5	0	0	0	110.7	C408 L417 G418	C408-P415 WeakPolarHBondContact O-CA 3.24Å; C408-P415 WeakPolarHBondContact O-CB 3.49Å; P415-L417 PolarHBondContact O-N 2.92Å; P415-L417 VanDerWaalsContact O-N 3.1Å; P415-G418 PolarHBondContact O-N 3.42Å
416	V	60	Low	56.4	Low	40 Å²	40	82.5 Å²	82.5	24%	0.242	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-37.1	178.9	169	0	0	0	0	111.8	Y407 G414 G418 S419	Y407-V416 WeakPolarHBondContact O-CG2 3.28Å; G414-V416 PolarHBondContact O-N 2.81Å; V416-G418 VanDerWaalsContact C-N 3.3Å; V416-G418 PolarHBondContact O-N 3.12Å; V416-S419 PolarHBondContact O-N 3.34Å; V416-S419 PolarHBondContact O-OG 3.49Å
417	L	51.3	Low	53.9	Low	67 Å²	67	90.2 Å²	90.2	35%	0.351	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-32.5	179.4	-166.9	65.5	0	0	0	113.4	P415 S419 Q420 W421	P415-L417 PolarHBondContact O-N 2.92Å; P415-L417 VanDerWaalsContact O-N 3.1Å; L417-S419 VanDerWaalsContact C-N 3.32Å; L417-S419 PolarHBondContact O-N 3.26Å; L417-Q420 PolarHBondContact O-N 2.65Å; L417-W421 HydrophobicContact CD1-CE3 3.75Å; L417-W421 HydrophobicContact CD1-CZ3 3.95Å; L417-W421 HydrophobicContact CD2-CE3 4Å; L417-W421 HydrophobicContact CD2-CZ3 4.04Å; L417-W421 HydrophobicContact CG-CE3 3.78Å; L417-W421 HydrophobicContact CG-CZ3 4.2Å; L417-W421 PolarHBondContact O-N 3.23Å
418	G	44.3	Very low	51.1	Low	43 Å²	43	91.2 Å²	91.2	44%	0.443	55%	0.546	S	S	.	.	H	α-helix	trans	-65.3	-34.4	-178.9	0	0	0	0	0	113.2	P415 V416 Q420 G422	P415-G418 PolarHBondContact O-N 3.42Å; V416-G418 VanDerWaalsContact C-N 3.3Å; V416-G418 PolarHBondContact O-N 3.12Å; G418-Q420 PolarHBondContact O-N 2.73Å; G418-G422 PolarHBondContact O-N 2.94Å; G418-G422 VanDerWaalsContact O-N 3.15Å
419	S	43.5	Very low	48.5	Very low	97 Å²	97	96.2 Å²	96.2	68%	0.678	58%	0.575	S	S	*	*	H	α-helix	trans	-73.7	-9	178.7	66.1	0	0	0	0	115	V416 L417	V416-S419 PolarHBondContact O-N 3.34Å; V416-S419 PolarHBondContact O-OG 3.49Å; L417-S419 VanDerWaalsContact C-N 3.32Å; L417-S419 PolarHBondContact O-N 3.26Å
420	Q	42.7	Very low	46	Very low	148 Å²	148	94.3 Å²	94.3	69%	0.692	58%	0.583	S	S	*	*	H	α-helix	trans	-113.1	-30.1	174.7	-79.2	-175.7	-52.9	0	0	113.3	L417 G418	L417-Q420 PolarHBondContact O-N 2.65Å; G418-Q420 PolarHBondContact O-N 2.73Å
421	W	30.8	Very low	43.4	Very low	190 Å²	190	94.7 Å²	94.7	72%	0.72	60%	0.601	S	S	*	*	H	α-helix	trans	-85.7	-19.3	177	-119	-37.6	0	0	0	114.4	L417 G423	L417-W421 HydrophobicContact CD1-CE3 3.75Å; L417-W421 HydrophobicContact CD1-CZ3 3.95Å; L417-W421 HydrophobicContact CD2-CE3 4Å; L417-W421 HydrophobicContact CD2-CZ3 4.04Å; L417-W421 HydrophobicContact CG-CE3 3.78Å; L417-W421 HydrophobicContact CG-CZ3 4.2Å; L417-W421 PolarHBondContact O-N 3.23Å; W421-G423 PolarHBondContact O-N 3.31Å; W421-G423 VanDerWaalsContact O-N 3.09Å
422	G	31.8	Very low	40.9	Very low	72 Å²	72	99.7 Å²	99.7	74%	0.742	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	1.8	179.9	0	0	0	0	0	116.2	G418	G418-G422 PolarHBondContact O-N 2.94Å; G418-G422 VanDerWaalsContact O-N 3.15Å
423	G	34.8	Very low	39	Very low	69 Å²	69	102.9 Å²	102.9	71%	0.711	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	3	178	0	0	0	0	0	115.2	W421	W421-G423 PolarHBondContact O-N 3.31Å; W421-G423 VanDerWaalsContact O-N 3.09Å
424	C	34	Very low	37.1	Very low	108 Å²	108	102.5 Å²	102.5	73%	0.73	69%	0.689	S	S	*	*	S	Bend	trans	-137.9	45.7	-172.1	-60.8	0	0	0	0	113.8
425	V	34.3	Very low	35.4	Very low	140 Å²	140	109.7 Å²	109.7	85%	0.848	72%	0.716	S	S	*	*			trans	-136.2	85	157.3	-173.7	0	0	0	0	107.6
426	D	30.7	Very low	33.8	Very low	159 Å²	159	112.9 Å²	112.9	85%	0.85	73%	0.734	S	S	*	*			trans	-94.6	148.2	163.1	-160.7	2.5	0	0	0	108.2
427	E	34.1	Very low	32.1	Very low	175 Å²	175	113.7 Å²	113.7	82%	0.818	75%	0.751	S	S	*	*			trans	-74.6	139.6	-176.7	-79.6	-165.9	94.3	0	0	111.7	V429	E427-V429 PolarHBondContact O-N 2.95Å
428	G	27.3	Very low	31	Very low	80 Å²	80	117 Å²	117	83%	0.825	77%	0.773	S	S	*	*			trans	-72.1	87.5	-171.4	0	0	0	0	0	114.1
429	V	28.4	Very low	30.3	Very low	141 Å²	141	122.3 Å²	122.3	86%	0.855	79%	0.79	S	S	*	*			trans	-84.9	122	164.2	-178.9	0	0	0	0	109.8	E427	E427-V429 PolarHBondContact O-N 2.95Å
430	V	28.2	Very low	29.4	Very low	143 Å²	143	125.1 Å²	125.1	87%	0.867	80%	0.797	S	S	*	*			trans	-78.2	125.8	-177.8	177.2	0	0	0	0	110.7
431	G	25	Very low	28.6	Very low	64 Å²	64	121.5 Å²	121.5	66%	0.66	79%	0.793	S	S	*	*			trans	-164	47.3	-171.4	0	0	0	0	0	117.9
432	T	25.6	Very low	28.3	Very low	142 Å²	142	117.8 Å²	117.8	87%	0.871	80%	0.795	S	S	*	*			trans	34.7	109.6	154.7	54.6	0	0	0	0	121.1
433	G	24.6	Very low	28	Very low	89 Å²	89	121.7 Å²	121.7	92%	0.918	80%	0.797	S	S	*	*			trans	106.9	135.7	137.7	0	0	0	0	0	118.1
434	G	24.3	Very low	27.5	Very low	84 Å²	84	124 Å²	124	87%	0.866	80%	0.798	S	S	*	*			trans	137.2	139.4	176.1	0	0	0	0	0	112.5
435	M	26.4	Very low	27.6	Very low	182 Å²	182	124.6 Å²	124.6	90%	0.897	80%	0.801	S	S	*	*			trans	-143.2	161.8	-177.6	-171.8	176.8	178.6	0	0	109.6
436	V	27.5	Very low	27.1	Very low	138 Å²	138	124 Å²	124	84%	0.836	80%	0.802	S	S	*	*			trans	73.9	138.7	-178.3	-166.7	0	0	0	0	112.6
437	G	25.5	Very low	26.8	Very low	57 Å²	57	126 Å²	126	59%	0.588	81%	0.807	S	S	*	*			cis	142.7	100.7	-5.6	0	0	0	0	0	113
438	V	28.1	Very low	26.3	Very low	136 Å²	136	121.5 Å²	121.5	82%	0.824	81%	0.807	S	S	*	*			trans	58.6	138.4	156.5	-139.3	0	0	0	0	119.7
439	I	29.1	Very low	26.1	Very low	154 Å²	154	122.8 Å²	122.8	79%	0.79	80%	0.804	S	S	*	*			trans	62.3	127.1	167	-20.4	172.4	0	0	0	117
440	D	24.4	Very low	25.9	Very low	156 Å²	156	125.4 Å²	125.4	83%	0.834	81%	0.806	S	S	*	*			trans	-141	150.3	131.2	-170.8	24.4	0	0	0	109.8
441	A	25.9	Very low	25.7	Very low	72 Å²	72	124.3 Å²	124.3	60%	0.595	80%	0.8	S	S	*	*			trans	-153.7	122.6	176.3	0	0	0	0	0	111.6
442	C	24.6	Very low	25.7	Very low	113 Å²	113	129 Å²	129	76%	0.764	81%	0.81	S	S	*	*			trans	85.1	134.8	164.5	-50.6	0	0	0	0	118.6
443	L	24.5	Very low	25.6	Very low	153 Å²	153	130.6 Å²	130.6	80%	0.801	81%	0.81	S	S	*	*			trans	86.8	92.8	153	-61.1	158.8	0	0	0	120.4
444	T	24.1	Very low	25.6	Very low	119 Å²	119	132.1 Å²	132.1	73%	0.73	80%	0.801	S	S	*	*				41.3	160.1	110.8	62.4	0	0	0	0	121.9
445	P	37.4	Very low	25.7	Very low	120 Å²	120	136.1 Å²	136.1	78%	0.779	80%	0.801	S	S	*	*			cis	-139.9	163.3	-41	39.1	-23.3	0	0	0	113.3
446	S	22.7	Very low	25.6	Very low	126 Å²	126	133.2 Å²	133.2	88%	0.881	79%	0.793	S	S	*	*			trans	-150.6	151	162.1	56.9	0	0	0	0	115.5
447	Q	24.3	Very low	25.5	Very low	203 Å²	203	131.9 Å²	131.9	95%	0.949	79%	0.79	S	S	*	*			trans	-65.8	148.4	-165.7	-61.2	163.2	-5.7	0	0	115.3
448	G	24.4	Very low	25.6	Very low	80 Å²	80	134.4 Å²	134.4	83%	0.825	80%	0.797	S	S	*	*			trans	-162	96.6	165.2	0	0	0	0	0	110
449	S	22.9	Very low	25.6	Very low	107 Å²	107	134 Å²	134	75%	0.748	80%	0.797	S	S	*	*			trans	-87.9	132.3	-170	-178.6	0	0	0	0	113.1
450	Q	24.5	Very low	25.4	Very low	195 Å²	195	138.3 Å²	138.3	91%	0.911	80%	0.803	S	S	*	*				-150.7	159.1	127.1	-114.6	170.1	51.7	0	0	111.1
451	T	24.2	Very low	25.3	Very low	120 Å²	120	136.7 Å²	136.7	74%	0.736	80%	0.799	S	S	*	*			trans	-112.3	141.7	-156.4	50.7	0	0	0	0	113.2
452	D	24	Very low	25.5	Very low	162 Å²	162	141.1 Å²	141.1	87%	0.866	81%	0.812	S	S	*	*			trans	-142.7	145.1	147	-129	-28.7	0	0	0	110.6
453	M	24.6	Very low	25.7	Very low	176 Å²	176	141.3 Å²	141.3	87%	0.867	81%	0.812	S	S	*	*			trans	-92.1	115.9	-166.7	-78.6	-175.2	-76.9	0	0	113.2
454	V	24.4	Very low	25.9	Very low	121 Å²	121	145.2 Å²	145.2	73%	0.733	82%	0.816	S	S	*	*			trans	-119.4	103.9	165.3	-176.3	0	0	0	0	109.9	T456	V454-T456 HydrophobicContact CG1-CG2 4.05Å; V454-T456 PolarHBondContact O-N 2.84Å
455	I	25.3	Very low	26	Very low	168 Å²	168	146.3 Å²	146.3	86%	0.862	82%	0.822	S	S	*	*			trans	-72.2	112	170.1	-61.3	176.4	0	0	0	108
456	T	24.8	Very low	25.5	Very low	121 Å²	121	148.4 Å²	148.4	74%	0.742	82%	0.819	S	S	*	*			trans	-102.4	145.1	170.3	53.1	0	0	0	0	110.3	V454	V454-T456 HydrophobicContact CG1-CG2 4.05Å; V454-T456 PolarHBondContact O-N 2.84Å
457	S	25.1	Very low	25.7	Very low	110 Å²	110	148 Å²	148	77%	0.769	81%	0.807	S	S	*	*			trans	-126.9	138.1	167.2	52	0	0	0	0	108.9
458	P	29	Very low	25.7	Very low	111 Å²	111	146.2 Å²	146.2	72%	0.721	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-85.5	153.5	-164.1	32.9	-36.7	0	0	0	113.4	R460	P458-R460 PolarHBondContact O-N 3.11Å
459	P	26.6	Very low	25.9	Very low	127 Å²	127	148.1 Å²	148.1	83%	0.825	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-70.3	126.6	172.1	29.9	-33.5	0	0	0	110.8
460	R	25.9	Very low	26.1	Very low	244 Å²	244	151.4 Å²	151.4	92%	0.921	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-95.2	147.7	165.2	-88.2	-169	169.8	104.2	-2.6	111.1	P458	P458-R460 PolarHBondContact O-N 3.11Å
461	T	23.1	Very low	26.3	Very low	123 Å²	123	145.6 Å²	145.6	76%	0.755	79%	0.788	S	S	*	*			trans	-105.8	139.7	-174.5	38.9	0	0	0	0	112.3
462	L	28.9	Very low	26.3	Very low	165 Å²	165	147.6 Å²	147.6	86%	0.864	79%	0.794	S	S	*	*			trans	66.2	171.9	157.1	-66	170.7	0	0	0	115.2
463	P	30	Very low	27.1	Very low	117 Å²	117	145.1 Å²	145.1	76%	0.76	79%	0.787	S	S	*	*			cis	-130.6	-167.3	9.4	44.4	-27.7	0	0	0	116.2
464	R	28.3	Very low	27.5	Very low	235 Å²	235	143.1 Å²	143.1	89%	0.887	78%	0.784	S	S	*	*			trans	-117.8	124.1	174.5	162	-168.6	173.9	155.4	-0.4	109.3
465	T	25.6	Very low	28	Very low	141 Å²	141	143.4 Å²	143.4	87%	0.865	79%	0.789	S	S	*	*			trans	-157	-164.7	161.5	4.7	0	0	0	0	112
466	K	26.6	Very low	28.2	Very low	165 Å²	165	139 Å²	139	72%	0.717	79%	0.785	S	S	*	*			trans	-140.5	160.5	-143.5	-150.3	-175.7	165.8	-76.7	0	113.1
467	D	26.3	Very low	28.3	Very low	117 Å²	117	140.4 Å²	140.4	63%	0.626	78%	0.783	S	S	*	*			trans	72.4	120.6	155	-60.7	-38.1	0	0	0	123.1
468	K	26.2	Very low	28.4	Very low	165 Å²	165	144.6 Å²	144.6	72%	0.717	78%	0.782	S	S	*	*				85.5	141.2	128.9	-100.4	-178.3	146.4	-73.9	0	124.4
469	D	27.3	Very low	28.4	Very low	121 Å²	121	145 Å²	145	65%	0.647	78%	0.778	S	S	*	*			trans	65.9	139.5	151.6	-58.6	-21.4	0	0	0	117.7
470	L	28.6	Very low	28.5	Very low	175 Å²	175	149.1 Å²	149.1	92%	0.916	78%	0.777	S	S	*	*			cis	-160.8	141.5	-1.6	174.8	69.2	0	0	0	109.5
471	G	27.3	Very low	28.6	Very low	73 Å²	73	145.1 Å²	145.1	75%	0.753	77%	0.774	S	S	*	*			trans	145.3	108.2	162.5	0	0	0	0	0	117.8
472	D	24.1	Very low	28.8	Very low	163 Å²	163	148.5 Å²	148.5	87%	0.872	78%	0.778	S	S	*	*			trans	-112.2	172.8	166.8	-95.5	-49.4	0	0	0	109.4
473	P	41.8	Very low	28.8	Very low	110 Å²	110	148.4 Å²	148.4	71%	0.714	78%	0.779	S	S	*	*			cis	-116.7	-151.2	5.3	20.2	6.9	0	0	0	110.8
474	V	32.1	Very low	28.6	Very low	133 Å²	133	148 Å²	148	81%	0.806	78%	0.779	S	S	*	*			cis	-152.1	171.1	23.8	-110.9	0	0	0	0	110.5
475	P	35.3	Very low	28.7	Very low	128 Å²	128	142.6 Å²	142.6	83%	0.831	78%	0.776	S	S	*	*			trans	-106.4	163	-147.6	40.8	-38.5	0	0	0	117.8
476	G	28.4	Very low	28.8	Very low	75 Å²	75	143 Å²	143	77%	0.773	77%	0.772	S	S	*	*			trans	-155.6	141.9	164.3	0	0	0	0	0	110.3
477	E	28.3	Very low	29	Very low	151 Å²	151	140.2 Å²	140.2	71%	0.706	77%	0.77	S	S	*	*			trans	-80.9	147.3	-161	-60.2	-172.3	71.3	0	0	116.5
478	R	27.7	Very low	29.8	Very low	197 Å²	197	139.5 Å²	139.5	74%	0.743	77%	0.77	S	S	*	*				28.9	146.3	127.5	-63.1	-176.9	-83.8	-148	0.4	120.2
479	D	28.6	Very low	30.4	Very low	120 Å²	120	136.4 Å²	136.4	64%	0.642	76%	0.757	S	S	*	*			cis	-147.5	-168.2	10	-134.9	-57.4	0	0	0	112.6
480	R	27.9	Very low	30.9	Very low	213 Å²	213	135.2 Å²	135.2	80%	0.804	75%	0.747	S	S	*	*			trans	-63.8	152	-174.4	-54.1	153.9	-146.9	-149.8	-1.3	113
481	D	27.6	Very low	31	Very low	161 Å²	161	131.3 Å²	131.3	86%	0.861	73%	0.73	S	S	*	*				-157.5	158	68.4	-102.4	-26.7	0	0	0	114.9
482	K	28.8	Very low	31.2	Very low	194 Å²	194	136.1 Å²	136.1	84%	0.843	73%	0.726	S	S	*	*			trans	-151.4	83.4	178.4	-172.4	-167.3	177.1	-179.1	0	112.2
483	D	28.4	Very low	31.3	Very low	163 Å²	163	133.9 Å²	133.9	87%	0.872	72%	0.72	S	S	*	*			trans	-154	124.9	152.6	-103.6	-33.6	0	0	0	110.2
484	S	25.7	Very low	30.7	Very low	109 Å²	109	134 Å²	134	76%	0.762	72%	0.724	S	S	*	*			trans	-154.1	93.2	173	-173.4	0	0	0	0	109.6	L486	S484-L486 PolarHBondContact O-N 3.47Å
485	C	29.2	Very low	30.7	Very low	121 Å²	121	133.7 Å²	133.7	82%	0.818	72%	0.724	S	S	*	*			trans	-70.8	114.2	171.4	-60.6	0	0	0	0	109.2
486	L	29.6	Very low	30.3	Very low	149 Å²	149	133 Å²	133	78%	0.78	72%	0.722	S	S	*	*			trans	-60.6	135.5	170.9	-66.2	173.9	0	0	0	109.9	S484 V488	S484-L486 PolarHBondContact O-N 3.47Å; L486-V488 PolarHBondContact O-N 2.89Å
487	P	30.6	Very low	30.3	Very low	106 Å²	106	135 Å²	135	69%	0.688	73%	0.725	S	S	*	*			trans	-66.8	128	-179.3	26.3	-33.6	0	0	0	111	F489	P487-F489 PolarHBondContact O-N 3.36Å; P487-F489 VanDerWaalsContact O-N 3.16Å
488	V	42.8	Very low	30.3	Very low	102 Å²	102	133.2 Å²	133.2	62%	0.618	73%	0.729	S	S	*	*	S	Bend	trans	-72.2	-5.3	-173.3	177.6	0	0	0	0	113.6	L486	L486-V488 PolarHBondContact O-N 2.89Å
489	F	38.5	Very low	30.7	Very low	100 Å²	100	130 Å²	130	44%	0.439	73%	0.733	S	S	.	*			trans	-139.6	128.4	-178.6	-56.2	-79	0	0	0	110.3	P487	P487-F489 PolarHBondContact O-N 3.36Å; P487-F489 VanDerWaalsContact O-N 3.16Å
490	Q	36.8	Very low	30.6	Very low	97 Å²	97	128.5 Å²	128.5	45%	0.453	74%	0.738	S	S	.	*			trans	-126.4	97.6	179.6	-166.2	174.3	46.5	0	0	112.3	R492	Q490-R492 HydrophobicContact CG-CG 4.12Å; Q490-R492 PolarHBondContact O-N 2.86Å
491	V	31.2	Very low	30.7	Very low	92 Å²	92	126.4 Å²	126.4	56%	0.558	74%	0.742	S	S	*	*			trans	-80.5	103.9	164.6	-178.2	0	0	0	0	108
492	R	31.2	Very low	30.7	Very low	175 Å²	175	125.9 Å²	125.9	66%	0.66	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-89.6	130.2	169.2	-77.2	-164.9	175.5	87.2	-1.1	110	Q490	Q490-R492 HydrophobicContact CG-CG 4.12Å; Q490-R492 PolarHBondContact O-N 2.86Å
493	P	27.8	Very low	30.7	Very low	116 Å²	116	122.6 Å²	122.6	75%	0.753	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-57.7	152.4	154.7	-19.2	32.5	0	0	0	110.4
494	S	28.5	Very low	30.6	Very low	112 Å²	112	125.4 Å²	125.4	78%	0.783	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-64.3	137.8	169.3	39.2	0	0	0	0	110.1	S496	S494-S496 PolarHBondContact O-N 3.41Å
495	P	31.5	Very low	30.6	Very low	126 Å²	126	126 Å²	126	82%	0.818	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-68.9	125.3	-177.7	27.2	-33.7	0	0	0	110.9	S497	P495-S497 PolarHBondContact O-N 3.14Å; P495-S497 VanDerWaalsContact O-N 3.09Å
496	S	27.2	Very low	30.4	Very low	114 Å²	114	125 Å²	125	80%	0.797	72%	0.718	S	S	*	*			trans	-69.5	100.7	171.1	52.9	0	0	0	0	110.1	S494 S498	S494-S496 PolarHBondContact O-N 3.41Å; S496-S498 PolarHBondContact O-N 2.75Å
497	S	29	Very low	30.4	Very low	117 Å²	117	123.3 Å²	123.3	82%	0.818	72%	0.718	S	S	*	*			trans	-65.4	115.9	178.2	55.2	0	0	0	0	111.3	P495	P495-S497 PolarHBondContact O-N 3.14Å; P495-S497 VanDerWaalsContact O-N 3.09Å
498	S	27	Very low	30.3	Very low	114 Å²	114	125.1 Å²	125.1	80%	0.797	73%	0.727	S	S	*	*			trans	-68.3	151.5	172.8	-67.9	0	0	0	0	111.7	S496	S496-S498 PolarHBondContact O-N 2.75Å
499	P	36.2	Very low	29.5	Very low	129 Å²	129	125.7 Å²	125.7	84%	0.838	74%	0.736	S	S	*	*			trans	-93.5	129.3	-162.6	34.2	-34.4	0	0	0	114.5
500	A	27.9	Very low	29.3	Very low	89 Å²	89	132.9 Å²	132.9	74%	0.736	76%	0.76	S	S	*	*			trans	-155.4	137.8	157.1	0	0	0	0	0	111.8
501	L	28.5	Very low	29.3	Very low	168 Å²	168	132 Å²	132	88%	0.88	77%	0.77	S	S	*	*			trans	59.6	87	158.9	-60.1	171.5	0	0	0	119.2
502	L	29.1	Very low	29.5	Very low	151 Å²	151	135.4 Å²	135.4	79%	0.791	78%	0.78	S	S	*	*			trans	-6.8	153.4	132.1	-61.8	165.6	0	0	0	117.3
503	H	27.4	Very low	30.3	Very low	125 Å²	125	134.2 Å²	134.2	58%	0.579	78%	0.781	S	S	*	*			cis	-166.6	131.9	34.6	-146.6	-56.4	0	0	0	114.4
504	R	27.1	Very low	31.6	Very low	222 Å²	222	129.2 Å²	129.2	84%	0.838	75%	0.751	S	S	*	*			trans	57.1	151.1	161.4	-85.8	174.1	-177.6	154.2	0.1	118
505	T	25	Very low	33.4	Very low	121 Å²	121	125.9 Å²	125.9	74%	0.742	73%	0.727	S	S	*	*			cis	-135.5	139.2	20	46.3	0	0	0	0	115.2
506	S	24.9	Very low	34.8	Very low	101 Å²	101	122.1 Å²	122.1	71%	0.706	70%	0.701	S	S	*	*			trans	35.1	107.6	146.2	59.6	0	0	0	0	122.8
507	S	31.1	Very low	36.7	Very low	113 Å²	113	117.1 Å²	117.1	79%	0.79	67%	0.665	S	S	*	*				59.7	80.9	127.5	66.4	0	0	0	0	121.2
508	T	27.4	Very low	38.4	Very low	143 Å²	143	118.4 Å²	118.4	88%	0.877	65%	0.652	S	S	*	*			trans	-106.5	153.4	132.4	41.7	0	0	0	0	109.6	R510	T508-R510 PolarHBondContact O-N 3.14Å
509	S	27	Very low	40.3	Very low	115 Å²	115	113.2 Å²	113.2	80%	0.804	62%	0.616	S	S	*	*			trans	-72.9	101.8	-175.9	54.2	0	0	0	0	110.9	A511	S509-A511 PolarHBondContact O-N 2.87Å
510	R	33.6	Very low	41.1	Very low	250 Å²	250	110.5 Å²	110.5	94%	0.943	59%	0.594	S	S	*	*			trans	-61.4	99.1	172.6	-159	176.8	-158.3	166.9	7.1	108.8	T508 Q512	T508-R510 PolarHBondContact O-N 3.14Å; R510-Q512 PolarHBondContact O-N 3.18Å
511	A	36.2	Very low	42.5	Very low	79 Å²	79	109 Å²	109	65%	0.653	57%	0.573	S	S	*	*			trans	-57.2	131.9	-176	0	0	0	0	0	109.6	S509 E513	S509-A511 PolarHBondContact O-N 2.87Å; A511-E513 VanDerWaalsContact C-N 3.32Å; A511-E513 PolarHBondContact O-N 3.37Å
512	Q	36.8	Very low	43.7	Very low	164 Å²	164	103.8 Å²	103.8	77%	0.766	55%	0.549	S	S	*	.			trans	-77.2	85.9	-174.9	-148.7	175.4	15.8	0	0	108.7	R510 G514 I551	R510-Q512 PolarHBondContact O-N 3.18Å; Q512-G514 PolarHBondContact O-N 2.94Å; Q512-I551 HydrophobicContact CB-CD1 3.95Å; Q512-I551 HydrophobicContact CG-CD1 3.71Å; Q512-I551 WeakPolarHBondContact O-CD1 3.47Å
513	E	46.6	Very low	44.9	Very low	149 Å²	149	100 Å²	100	70%	0.696	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-65.1	119.5	-176.5	-66.4	-152.6	113.2	0	0	111.1	A511 R554	A511-E513 VanDerWaalsContact C-N 3.32Å; A511-E513 PolarHBondContact O-N 3.37Å; E513-R554 IonicContact OE1-NH1 3.21Å
514	G	56.7	Low	46.2	Very low	11 Å²	11	96 Å²	96	11%	0.113	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-70.8	164.7	176.6	0	0	0	0	0	112.9	Q512 V516	Q512-G514 PolarHBondContact O-N 2.94Å; G514-V516 PolarHBondContact O-N 2.95Å
515	P	64.8	Low	47.3	Very low	43 Å²	43	93.4 Å²	93.4	28%	0.279	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-56.4	126.3	-176.6	21.8	-32.1	0	0	0	111.8	L545 S549 P553 R554	P515-L545 HydrophobicContact CB-CD2 4.4Å; P515-L545 HydrophobicContact CG-CD2 4.42Å; P515-S549 WeakPolarHBondContact CG-OG 3.17Å; P515-P553 HydrophobicContact CG-CB 4.23Å; P515-P553 CarbonylContact O-C 3.59Å; P515-P553 WeakPolarHBondContact O-CA 3.41Å; P515-P553 WeakPolarHBondContact O-CB 3.33Å; P515-R554 PolarHBondContact O-N 3.37Å
516	V	61.5	Low	48.6	Very low	46 Å²	46	91.5 Å²	91.5	28%	0.279	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	115.2	-176.3	-176.7	0	0	0	0	110.1	G514 R518 R554 Q556	G514-V516 PolarHBondContact O-N 2.95Å; V516-R518 HydrophobicContact CG1-CG 4.01Å; V516-R518 PolarHBondContact O-N 3.38Å; V516-R554 CarbonylContact C-O 3.51Å; V516-R554 WeakPolarHBondContact CA-O 3.47Å; V516-R554 HydrophobicContact CG2-CB 4.45Å; V516-Q556 HydrophobicContact CG1-CB 4.02Å; V516-Q556 HydrophobicContact CG1-CG 3.68Å
517	I	67.3	Low	49.9	Very low	9 Å²	9	88.3 Å²	88.3	5%	0.046	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	102.1	173.3	-56.2	172.5	0	0	0	107.4	L538 I542 L545 P553 R554 Q556	I517-L538 HydrophobicContact CG2-CD1 3.86Å; I517-I542 HydrophobicContact CD1-CB 4.33Å; I517-I542 HydrophobicContact CD1-CG1 3.51Å; I517-L545 HydrophobicContact CD1-CD1 3.69Å; I517-L545 HydrophobicContact CG1-CD1 3.67Å; I517-P553 HydrophobicContact CD1-CB 3.75Å; I517-P553 HydrophobicContact CD1-CG 4.25Å; I517-P553 HydrophobicContact CG1-CB 4.1Å; I517-R554 PolarHBondContact N-O 3.37Å; I517-Q556 PolarHBondContact O-N 3.18Å
518	R	64.8	Low	51.1	Low	144 Å²	144	83.2 Å²	83.2	54%	0.543	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	127.5	172.9	-70.8	-172	173.4	167.8	3.7	110.4	V516 Q556	V516-R518 HydrophobicContact CG1-CG 4.01Å; V516-R518 PolarHBondContact O-N 3.38Å; R518-Q556 CarbonylContact C-O 3.4Å; R518-Q556 WeakPolarHBondContact CA-O 3.47Å; R518-Q556 HydrophobicContact CG-CB 4.14Å
519	I	66.3	Low	52.9	Low	5 Å²	5	76.8 Å²	76.8	3%	0.026	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	108.5	173.9	-59	166.4	0	0	0	106.2	L521 L538 I555 Q556 Y557 R558	I519-L521 HydrophobicContact CG2-CB 3.87Å; I519-L521 PolarHBondContact O-N 3.5Å; I519-L538 HydrophobicContact CD1-CD1 4.5Å; I519-L538 HydrophobicContact CD1-CD2 3.65Å; I519-L538 HydrophobicContact CG1-CD1 4.44Å; I519-L538 HydrophobicContact CG1-CD2 4.05Å; I519-I555 HydrophobicContact CD1-CG2 3.45Å; I519-I555 VanDerWaalsContact CD1-CG2 3.45Å; I519-I555 HydrophobicContact CG1-CG2 4.34Å; I519-Q556 PolarHBondContact N-O 2.69Å; I519-Y557 HydrophobicContact CB-CD1 3.88Å; I519-Y557 HydrophobicContact CB-CE1 4.16Å; I519-Y557 HydrophobicContact CD1-CD1 3.92Å; I519-Y557 HydrophobicContact CD1-CD2 4.48Å; I519-Y557 HydrophobicContact CD1-CE1 3.47Å; I519-Y557 VanDerWaalsContact CD1-CE1 3.47Å; I519-Y557 HydrophobicContact CD1-CE2 4.11Å; I519-Y557 HydrophobicContact CD1-CG 4.4Å; I519-Y557 HydrophobicContact CG1-CE1 4.43Å; I519-Y557 HydrophobicContact CG2-CD1 3.83Å; I519-Y557 HydrophobicContact CG2-CE1 3.9Å; I519-R558 PolarHBondContact O-N 2.73Å; I519-R558 VanDerWaalsContact O-N 3.07Å
520	D	52.9	Low	54.8	Low	72 Å²	72	71.4 Å²	71.4	39%	0.385	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	-10	-176.2	-71.2	-56.6	0	0	0	113.6	R558	D520-R558 WeakPolarHBondContact O-CD 3.32Å
521	L	57.9	Low	56.4	Low	57 Å²	57	60.4 Å²	60.4	30%	0.298	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	131.8	165.7	-158.3	78.6	0	0	0	110.3	M322 I519	M322-L521 HydrophobicContact CE-CD1 4.35Å; M322-L521 HydrophobicContact CE-CD2 3.86Å; I519-L521 HydrophobicContact CG2-CB 3.87Å; I519-L521 PolarHBondContact O-N 3.5Å
522	P	52.8	Low	58.1	Low	59 Å²	59	56.9 Å²	56.9	38%	0.383	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	144.5	176.4	25.7	-34.6	0	0	0	111.9	K524 R558	P522-K524 PolarHBondContact O-N 2.88Å; P522-R558 WeakPolarHBondContact CA-O 3.35Å
523	R	55.2	Low	59.7	Low	71 Å²	71	49.2 Å²	49.2	27%	0.268	24%	0.236	S	C	.	.			trans	-63.4	114.5	-179.2	-157.3	171.7	-176.4	-137.4	-15.1	110.7	D260 R525 D530 Y557 R558	D260-R523 VanDerWaalsContact CG-NH1 3.26Å; D260-R523 IonicContact OD1-CZ 3.56Å; D260-R523 IonicContact OD1-NH1 2.86Å; D260-R523 PolarHBondContact OD1-NH1 3.4Å; D260-R523 IonicContact OD1-NH2 2.71Å; D260-R523 PolarHBondContact OD1-NH2 2.9Å; R523-R525 PolarHBondContact O-N 2.92Å; R523-D530 IonicContact CZ-OD1 2.82Å; R523-D530 IonicContact CZ-OD2 2.7Å; R523-D530 VanDerWaalsContact CZ-OD2 3.23Å; R523-D530 IonicContact NE-OD1 3.74Å; R523-D530 IonicContact NE-OD2 3.9Å; R523-D530 PolarHBondContact NE-OD2 3.45Å; R523-D530 VanDerWaalsContact NH2-CG 3.34Å; R523-D530 IonicContact NH2-OD1 3.23Å; R523-D530 PolarHBondContact NH2-OD1 2.86Å; R523-D530 IonicContact NH2-OD2 3.19Å; R523-D530 PolarHBondContact NH2-OD2 3.43Å; R523-Y557 HydrophobicContact CB-CD1 4.04Å; R523-Y557 HydrophobicContact CB-CD2 4.15Å; R523-Y557 HydrophobicContact CB-CG 3.68Å; R523-Y557 VanDerWaalsContact CD-CD2 3.48Å; R523-Y557 HydrophobicContact CG-CD1 4.03Å; R523-Y557 HydrophobicContact CG-CD2 3.63Å; R523-Y557 HydrophobicContact CG-CE1 4.33Å; R523-Y557 HydrophobicContact CG-CE2 3.95Å; R523-Y557 HydrophobicContact CG-CG 3.65Å; R523-R558 PolarHBondContact N-O 3.02Å
524	K	55.1	Low	60.9	Low	42 Å²	42	45.3 Å²	45.3	18%	0.183	22%	0.219	C	C	.	.			trans	-63.8	99.3	174	-66.3	-166.6	-173	-167.7	0	109.2	R258 D319 F320 P522 Y526	R258-K524 PolarHBondContact NH2-O 3.48Å; D319-K524 PolarHBondContact O-NZ 3.34Å; F320-K524 VanDerWaalsContact C-NZ 3.34Å; F320-K524 PolarHBondContact O-NZ 3.35Å; P522-K524 PolarHBondContact O-N 2.88Å; K524-Y526 VanDerWaalsContact C-N 3.29Å; K524-Y526 HydrophobicContact CB-CD2 3.69Å; K524-Y526 HydrophobicContact CB-CE2 4.28Å; K524-Y526 HydrophobicContact CG-CD2 4.37Å; K524-Y526 PolarHBondContact O-N 2.92Å
525	R	48.6	Very low	61.7	Low	168 Å²	168	46.5 Å²	46.5	63%	0.634	22%	0.223	S	C	*	.			trans	-63.6	-32.4	-178.9	-68	-170.3	175.3	-160.5	-0.9	113.7	R258 E347 R523	R258-R525 PolarHBondContact NH1-O 2.9Å; E347-R525 WeakPolarHBondContact OE2-CB 3.43Å; R523-R525 PolarHBondContact O-N 2.92Å
526	Y	53.3	Low	62.3	Low	80 Å²	80	45.5 Å²	45.5	31%	0.314	21%	0.213	S	C	.	.	S	Bend	trans	-29.3	150.3	170.6	-46.4	-103.2	0	0	0	115.5	R258 K346 E347 K524 A528	R258-Y526 VanDerWaalsContact CZ-O 3.28Å; R258-Y526 PolarHBondContact NH1-O 2.64Å; R258-Y526 PolarHBondContact NH2-O 2.71Å; K346-Y526 HydrophobicContact CG-CD1 4.18Å; K346-Y526 HydrophobicContact CG-CE1 3.99Å; E347-Y526 HydrophobicContact CB-CD1 3.97Å; E347-Y526 HydrophobicContact CB-CG 4.26Å; E347-Y526 PolarHBondContact OE2-N 3.45Å; E347-Y526 VanDerWaalsContact OE2-N 3.15Å; K524-Y526 VanDerWaalsContact C-N 3.29Å; K524-Y526 HydrophobicContact CB-CD2 3.69Å; K524-Y526 HydrophobicContact CB-CE2 4.28Å; K524-Y526 HydrophobicContact CG-CD2 4.37Å; K524-Y526 PolarHBondContact O-N 2.92Å; Y526-A528 PolarHBondContact O-N 3.08Å
527	P	51.7	Low	62.9	Low	34 Å²	34	49.8 Å²	49.8	22%	0.221	23%	0.225	C	C	.	.	S	Bend	trans	-69.6	60.3	164.7	34	-37.7	0	0	0	110.5	N344	N344-P527 HydrophobicContact CB-CG 4.41Å; N344-P527 WeakPolarHBondContact O-CG 3.38Å
528	A	57.8	Low	63.1	Low	6 Å²	6	49.8 Å²	49.8	5%	0.05	23%	0.225	C	C	.	.	S	Bend	trans	-118.1	153.6	178.2	0	0	0	0	0	107.3	F320 Y526 D530	F320-A528 HydrophobicContact CD2-CB 4.37Å; F320-A528 HydrophobicContact CE2-CB 3.87Å; Y526-A528 PolarHBondContact O-N 3.08Å; A528-D530 PolarHBondContact O-N 2.94Å
529	W	64	Low	63.9	Low	8 Å²	8	44 Å²	44	3%	0.03	20%	0.203	C	C	.	.			trans	-57.5	127.8	165.2	-65.8	103.4	0	0	0	108.7	A197 Y250 V253 L254 S257 F533 I534	A197-W529 HydrophobicContact CB-CD2 4.45Å; A197-W529 HydrophobicContact CB-CE3 3.98Å; A197-W529 HydrophobicContact CB-CH2 3.41Å; A197-W529 VanDerWaalsContact CB-CH2 3.41Å; A197-W529 HydrophobicContact CB-CZ2 3.94Å; A197-W529 HydrophobicContact CB-CZ3 3.43Å; A197-W529 VanDerWaalsContact CB-CZ3 3.43Å; Y250-W529 HydrophobicContact CD2-CZ2 4.25Å; Y250-W529 AromaticContact CE2-CE2 3.98Å; Y250-W529 AromaticContact CE2-CZ2 3.81Å; Y250-W529 HydrophobicContact CE2-CZ2 3.81Å; Y250-W529 AromaticContact CE2-NE1 3.51Å; Y250-W529 AromaticContact CZ-NE1 3.57Å; Y250-W529 PolarHBondContact OH-NE1 3.13Å; V253-W529 HydrophobicContact CB-CH2 4.06Å; V253-W529 HydrophobicContact CG1-CH2 3.76Å; V253-W529 HydrophobicContact CG1-CZ3 4.22Å; L254-W529 HydrophobicContact CB-CH2 4.13Å; L254-W529 HydrophobicContact CB-CZ2 4.01Å; L254-W529 HydrophobicContact CD1-CD2 3.71Å; L254-W529 HydrophobicContact CD1-CE3 4.13Å; L254-W529 HydrophobicContact CD1-CG 3.9Å; L254-W529 HydrophobicContact CD1-CZ2 4.38Å; S257-W529 WeakPolarHBondContact OG-CZ3 3.47Å; W529-F533 HydrophobicContact CB-CB 3.94Å; W529-F533 HydrophobicContact CD2-CB 4.34Å; W529-F533 HydrophobicContact CE3-CB 3.77Å; W529-F533 AromaticContact CE3-CD1 3.95Å; W529-F533 HydrophobicContact CE3-CD1 3.95Å; W529-F533 AromaticContact CE3-CG 3.87Å; W529-F533 HydrophobicContact CE3-CG 3.87Å; W529-F533 HydrophobicContact CG-CB 4.45Å; W529-F533 HydrophobicContact CZ3-CD1 4.07Å; W529-F533 HydrophobicContact CZ3-CG 4.42Å; W529-I534 HydrophobicContact CB-CD1 4.03Å; W529-I534 HydrophobicContact CB-CG1 3.5Å; W529-I534 WeakPolarHBondContact O-CD1 3.28Å
530	D	67.3	Low	64.3	Low	2 Å²	2	46 Å²	46	1%	0.011	21%	0.212	C	C	.	.			trans	-55.2	150.1	170.4	-100.4	55.7	0	0	0	109.7	R258 R523 A528 H532 F533 I534 Y557	R258-D530 IonicContact CZ-OD1 3.77Å; R258-D530 IonicContact NE-OD1 3.83Å; R258-D530 PolarHBondContact NE-OD1 2.78Å; R258-D530 IonicContact NH2-OD1 2.73Å; R258-D530 PolarHBondContact NH2-OD1 3.37Å; R523-D530 IonicContact CZ-OD1 2.82Å; R523-D530 IonicContact CZ-OD2 2.7Å; R523-D530 VanDerWaalsContact CZ-OD2 3.23Å; R523-D530 IonicContact NE-OD1 3.74Å; R523-D530 IonicContact NE-OD2 3.9Å; R523-D530 PolarHBondContact NE-OD2 3.45Å; R523-D530 VanDerWaalsContact NH2-CG 3.34Å; R523-D530 IonicContact NH2-OD1 3.23Å; R523-D530 PolarHBondContact NH2-OD1 2.86Å; R523-D530 IonicContact NH2-OD2 3.19Å; R523-D530 PolarHBondContact NH2-OD2 3.43Å; A528-D530 PolarHBondContact O-N 2.94Å; D530-H532 PolarHBondContact O-N 3.05Å; D530-H532 IonicContact OD2-CE1 3.78Å; D530-F533 HydrophobicContact CB-CD2 4.27Å; D530-F533 WeakPolarHBondContact O-CA 3.48Å; D530-F533 WeakPolarHBondContact O-CB 3.45Å; D530-F533 PolarHBondContact O-N 3.21Å; D530-I534 PolarHBondContact O-N 2.9Å; D530-Y557 WeakPolarHBondContact CB-OH 3.37Å; D530-Y557 VanDerWaalsContact OD2-CE2 3.31Å; D530-Y557 WeakPolarHBondContact OD2-CE2 3.32Å; D530-Y557 PolarHBondContact OD2-OH 3.44Å; D530-Y557 VanDerWaalsContact OD2-OH 3.11Å
531	A	67.5	Low	65.3	Low	19 Å²	19	45.4 Å²	45.4	16%	0.157	21%	0.21	C	C	.	.	H	α-helix	trans	-55.9	-32.5	-169.4	0	0	0	0	0	113.6	F533 I534 D535 L538 Y557	A531-F533 VanDerWaalsContact C-N 3.28Å; A531-F533 PolarHBondContact O-N 3.38Å; A531-I534 PolarHBondContact O-N 3.49Å; A531-D535 WeakPolarHBondContact O-CB 3.38Å; A531-D535 PolarHBondContact O-N 3.27Å; A531-L538 HydrophobicContact CB-CD2 4.45Å; A531-Y557 HydrophobicContact CB-CE1 3.91Å; A531-Y557 PolarHBondContact N-OH 3.04Å
532	H	70.4	Confident	66.1	Low	5 Å²	5	42.8 Å²	42.8	2%	0.023	20%	0.197	C	C	.	.	H	α-helix	trans	-71.7	-14.8	175.4	63.7	-87.5	0	0	0	115	W190 F194 D530 L538 R539 I542 I555 Y557	W190-H532 AromaticContact CH2-NE2 3.74Å; W190-H532 AromaticContact CZ3-CD2 3.93Å; W190-H532 AromaticContact CZ3-NE2 3.57Å; F194-H532 AromaticContact CE1-CD2 3.99Å; F194-H532 WeakPolarHBondContact CE1-O 3.32Å; D530-H532 PolarHBondContact O-N 3.05Å; D530-H532 IonicContact OD2-CE1 3.78Å; H532-L538 HydrophobicContact CB-CD2 3.74Å; H532-L538 HydrophobicContact CB-CG 3.79Å; H532-R539 WeakPolarHBondContact O-CG 3.19Å; H532-I542 HydrophobicContact CB-CD1 3.49Å; H532-I542 VanDerWaalsContact CB-CD1 3.49Å; H532-I555 HydrophobicContact CB-CD1 4.29Å; H532-Y557 AromaticContact ND1-CZ 3.89Å; H532-Y557 PolarHBondContact ND1-OH 3.28Å
533	F	72	Confident	67.2	Low	4 Å²	4	41.6 Å²	41.6	2%	0.018	19%	0.187	C	C	.	.	H	α-helix	trans	-86.2	-29.5	168.5	-80.7	-85.3	0	0	0	112.6	W190 M193 F194 A197 S257 W529 D530 A531 R539	W190-F533 HydrophobicContact CE3-CZ 4.12Å; W190-F533 AromaticContact CZ3-CE2 3.76Å; W190-F533 HydrophobicContact CZ3-CE2 3.76Å; W190-F533 AromaticContact CZ3-CZ 3.67Å; W190-F533 HydrophobicContact CZ3-CZ 3.67Å; M193-F533 HydrophobicContact CB-CE1 3.89Å; M193-F533 HydrophobicContact CB-CZ 4.11Å; F194-F533 AromaticContact CD1-CD1 3.56Å; F194-F533 HydrophobicContact CD1-CD1 3.56Å; F194-F533 AromaticContact CD1-CE1 3.54Å; F194-F533 HydrophobicContact CD1-CE1 3.54Å; F194-F533 HydrophobicContact CD1-CG 4.24Å; F194-F533 HydrophobicContact CD1-CZ 4.22Å; F194-F533 AromaticContact CE1-CD1 3.89Å; F194-F533 HydrophobicContact CE1-CD1 3.89Å; F194-F533 HydrophobicContact CE1-CD2 4.41Å; F194-F533 AromaticContact CE1-CE1 3.81Å; F194-F533 HydrophobicContact CE1-CE1 3.81Å; F194-F533 HydrophobicContact CE1-CE2 4.36Å; F194-F533 HydrophobicContact CE1-CG 4.18Å; F194-F533 HydrophobicContact CE1-CZ 4.04Å; A197-F533 HydrophobicContact CB-CD1 4.02Å; S257-F533 VanDerWaalsContact CB-CZ 3.5Å; S257-F533 VanDerWaalsContact O-CE2 3.29Å; S257-F533 WeakPolarHBondContact O-CE2 3.37Å; W529-F533 HydrophobicContact CB-CB 3.94Å; W529-F533 HydrophobicContact CD2-CB 4.34Å; W529-F533 HydrophobicContact CE3-CB 3.77Å; W529-F533 AromaticContact CE3-CD1 3.95Å; W529-F533 HydrophobicContact CE3-CD1 3.95Å; W529-F533 AromaticContact CE3-CG 3.87Å; W529-F533 HydrophobicContact CE3-CG 3.87Å; W529-F533 HydrophobicContact CG-CB 4.45Å; W529-F533 HydrophobicContact CZ3-CD1 4.07Å; W529-F533 HydrophobicContact CZ3-CG 4.42Å; D530-F533 HydrophobicContact CB-CD2 4.27Å; D530-F533 WeakPolarHBondContact O-CA 3.48Å; D530-F533 WeakPolarHBondContact O-CB 3.45Å; D530-F533 PolarHBondContact O-N 3.21Å; A531-F533 VanDerWaalsContact C-N 3.28Å; A531-F533 PolarHBondContact O-N 3.38Å; F533-R539 PolarHBondContact O-NE 3.09Å; F533-R539 VanDerWaalsContact O-NE 3.14Å; F533-R539 PolarHBondContact O-NH2 3.34Å
534	I	71.3	Confident	68.1	Low	66 Å²	66	42.5 Å²	42.5	34%	0.338	20%	0.197	S	C	.	.	H	α-helix	trans	-84	-50.5	177.7	-51.9	175.5	0	0	0	111.1	F320 W529 D530 A531 R536	F320-I534 HydrophobicContact CE1-CD1 4.06Å; F320-I534 HydrophobicContact CE2-CD1 3.92Å; F320-I534 HydrophobicContact CZ-CD1 3.52Å; F320-I534 HydrophobicContact CZ-CG1 4.46Å; W529-I534 HydrophobicContact CB-CD1 4.03Å; W529-I534 HydrophobicContact CB-CG1 3.5Å; W529-I534 WeakPolarHBondContact O-CD1 3.28Å; D530-I534 PolarHBondContact O-N 2.9Å; A531-I534 PolarHBondContact O-N 3.49Å; I534-R536 PolarHBondContact O-N 3.09Å
535	D	73.4	Confident	68.9	Low	37 Å²	37	42 Å²	42	20%	0.198	20%	0.196	C	C	.	.			trans	-79.4	111.2	-172.7	-175.8	-4.1	0	0	0	111.7	A531 R537 L538 R539	A531-D535 WeakPolarHBondContact O-CB 3.38Å; A531-D535 PolarHBondContact O-N 3.27Å; D535-R537 VanDerWaalsContact C-N 3.3Å; D535-R537 PolarHBondContact O-N 3.42Å; D535-R537 WeakPolarHBondContact OD1-CB 3.29Å; D535-R537 PolarHBondContact OD1-N 2.59Å; D535-L538 HydrophobicContact CB-CB 3.95Å; D535-L538 PolarHBondContact O-N 3.06Å; D535-R539 PolarHBondContact O-N 3.25Å
536	R	76.5	Confident	69.9	Low	21 Å²	21	35 Å²	35	8%	0.079	17%	0.17	C	C	.	.	H	α-helix	trans	-65.5	-26.8	178.1	-70.4	-178.8	172	-70.2	-17.7	113.6	Y103 D104 D198 I534 K540	Y103-R536 HydrophobicContact CD1-CB 3.58Å; Y103-R536 HydrophobicContact CD1-CG 4.35Å; Y103-R536 HydrophobicContact CE1-CB 3.59Å; D104-R536 WeakPolarHBondContact OD1-CD 3.42Å; D104-R536 IonicContact OD1-CZ 3Å; D104-R536 IonicContact OD1-NE 2.69Å; D104-R536 IonicContact OD1-NH1 3.33Å; D104-R536 PolarHBondContact OD1-NH1 3.25Å; D104-R536 IonicContact OD2-CZ 2.82Å; D104-R536 IonicContact OD2-NH1 2.79Å; D104-R536 PolarHBondContact OD2-NH1 3.1Å; D198-R536 IonicContact OD1-NH2 3.29Å; D198-R536 PolarHBondContact OD1-NH2 3.44Å; D198-R536 IonicContact OD2-CZ 3.2Å; D198-R536 IonicContact OD2-NH1 2.66Å; D198-R536 PolarHBondContact OD2-NH1 3.44Å; D198-R536 IonicContact OD2-NH2 2.74Å; D198-R536 PolarHBondContact OD2-NH2 3.43Å; I534-R536 PolarHBondContact O-N 3.09Å; R536-K540 WeakPolarHBondContact O-CG 3.31Å; R536-K540 PolarHBondContact O-N 3.22Å
537	R	74	Confident	70.7	Confident	136 Å²	136	35.6 Å²	35.6	51%	0.513	18%	0.183	S	C	.	.	H	α-helix	trans	-67.2	-49.7	173.4	-65.7	179.3	165.1	162.3	-1.8	109.8	Y103 D535 R539 K540 T541	Y103-R537 HydrophobicContact CE1-CG 4.01Å; Y103-R537 WeakPolarHBondContact OH-CD 3.26Å; Y103-R537 WeakPolarHBondContact OH-CG 3.49Å; Y103-R537 PolarHBondContact OH-NE 3.33Å; D535-R537 VanDerWaalsContact C-N 3.3Å; D535-R537 PolarHBondContact O-N 3.42Å; D535-R537 WeakPolarHBondContact OD1-CB 3.29Å; D535-R537 PolarHBondContact OD1-N 2.59Å; R537-R539 VanDerWaalsContact C-N 3.32Å; R537-R539 PolarHBondContact O-N 2.77Å; R537-K540 WeakPolarHBondContact O-CB 3.49Å; R537-K540 PolarHBondContact O-N 2.83Å; R537-T541 PolarHBondContact O-N 3.28Å; R537-T541 PolarHBondContact O-OG1 3.05Å
538	L	73	Confident	71.3	Confident	9 Å²	9	38.7 Å²	38.7	5%	0.047	20%	0.201	C	C	.	.	H	α-helix	trans	-60.8	-39.4	178.8	-174.8	52.2	0	0	0	112	I517 I519 A531 H532 D535 K540 T541 I542	I517-L538 HydrophobicContact CG2-CD1 3.86Å; I519-L538 HydrophobicContact CD1-CD1 4.5Å; I519-L538 HydrophobicContact CD1-CD2 3.65Å; I519-L538 HydrophobicContact CG1-CD1 4.44Å; I519-L538 HydrophobicContact CG1-CD2 4.05Å; A531-L538 HydrophobicContact CB-CD2 4.45Å; H532-L538 HydrophobicContact CB-CD2 3.74Å; H532-L538 HydrophobicContact CB-CG 3.79Å; D535-L538 HydrophobicContact CB-CB 3.95Å; D535-L538 PolarHBondContact O-N 3.06Å; L538-K540 PolarHBondContact O-N 3.48Å; L538-T541 PolarHBondContact O-N 2.79Å; L538-I542 HydrophobicContact CD1-CD1 4.2Å; L538-I542 HydrophobicContact CD1-CG1 4.44Å; L538-I542 HydrophobicContact CG-CD1 4.07Å; L538-I542 WeakPolarHBondContact O-CD1 3.48Å; L538-I542 VanDerWaalsContact O-CG1 3.26Å; L538-I542 WeakPolarHBondContact O-CG1 3.44Å; L538-I542 PolarHBondContact O-N 2.86Å
539	R	80.1	Confident	71.5	Confident	22 Å²	22	40 Å²	40	8%	0.083	21%	0.21	C	C	.	.	H	α-helix	trans	-54.3	-49.3	168.8	-69.9	-173.7	-174.6	-174.8	2.5	112.4	F194 D198 H532 F533 D535 R537 I542 L543	F194-R539 HydrophobicContact CD1-CG 3.88Å; F194-R539 HydrophobicContact CD2-CG 4.33Å; F194-R539 HydrophobicContact CE1-CG 3.92Å; F194-R539 HydrophobicContact CE2-CG 4.36Å; F194-R539 HydrophobicContact CG-CG 4.12Å; F194-R539 HydrophobicContact CZ-CG 4.17Å; F194-R539 PolarHBondContact O-NH1 3.12Å; D198-R539 VanDerWaalsContact CG-NH1 3.3Å; D198-R539 IonicContact OD1-CZ 3.2Å; D198-R539 IonicContact OD1-NH1 2.82Å; D198-R539 PolarHBondContact OD1-NH1 3.32Å; D198-R539 IonicContact OD1-NH2 3.88Å; D198-R539 PolarHBondContact OD1-NH2 2.9Å; D198-R539 IonicContact OD2-NH1 3.18Å; D198-R539 PolarHBondContact OD2-NH1 3.24Å; H532-R539 WeakPolarHBondContact O-CG 3.19Å; F533-R539 PolarHBondContact O-NE 3.09Å; F533-R539 VanDerWaalsContact O-NE 3.14Å; F533-R539 PolarHBondContact O-NH2 3.34Å; D535-R539 PolarHBondContact O-N 3.25Å; R537-R539 VanDerWaalsContact C-N 3.32Å; R537-R539 PolarHBondContact O-N 2.77Å; R539-I542 PolarHBondContact O-N 3.24Å; R539-L543 WeakPolarHBondContact O-CG 3.44Å; R539-L543 PolarHBondContact O-N 2.86Å
540	K	75.5	Confident	71.1	Confident	49 Å²	49	44.8 Å²	44.8	21%	0.213	25%	0.251	C	S	.	.	H	α-helix	trans	-60.8	-46.9	178.9	-67	170.5	-166.1	-176.4	0	111.3	Y103 D104 D107 R536 R537 L538 I542 L543 L544	Y103-K540 PolarHBondContact O-NZ 3.49Å; D104-K540 VanDerWaalsContact O-CE 3.29Å; D104-K540 WeakPolarHBondContact O-CE 3.48Å; D104-K540 PolarHBondContact O-NZ 3.22Å; D107-K540 IonicContact OD2-NZ 3.21Å; D107-K540 PolarHBondContact OD2-NZ 3.4Å; R536-K540 WeakPolarHBondContact O-CG 3.31Å; R536-K540 PolarHBondContact O-N 3.22Å; R537-K540 WeakPolarHBondContact O-CB 3.49Å; R537-K540 PolarHBondContact O-N 2.83Å; L538-K540 PolarHBondContact O-N 3.48Å; K540-I542 VanDerWaalsContact C-N 3.35Å; K540-I542 PolarHBondContact O-N 2.88Å; K540-L543 PolarHBondContact O-N 3.13Å; K540-L544 VanDerWaalsContact O-CB 3.32Å; K540-L544 WeakPolarHBondContact O-CB 3.45Å; K540-L544 PolarHBondContact O-N 3.3Å
541	T	74.8	Confident	70.8	Confident	58 Å²	58	47.5 Å²	47.5	36%	0.356	27%	0.265	S	S	.	.	H	α-helix	trans	-60.4	-42.1	178.9	-50	0	0	0	0	112.1	R537 L538 L545	R537-T541 PolarHBondContact O-N 3.28Å; R537-T541 PolarHBondContact O-OG1 3.05Å; L538-T541 PolarHBondContact O-N 2.79Å; T541-L545 HydrophobicContact CG2-CD1 4Å; T541-L545 WeakPolarHBondContact O-CB 3.23Å; T541-L545 WeakPolarHBondContact O-CG 3.48Å; T541-L545 PolarHBondContact O-N 3.47Å
542	I	74	Confident	70.3	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.015	27%	0.271	C	S	.	.	H	α-helix	trans	-62	-50	175.1	-69.8	159.2	0	0	0	111	I517 H532 L538 R539 K540 L544 L545 E546 P553 I555	I517-I542 HydrophobicContact CD1-CB 4.33Å; I517-I542 HydrophobicContact CD1-CG1 3.51Å; H532-I542 HydrophobicContact CB-CD1 3.49Å; H532-I542 VanDerWaalsContact CB-CD1 3.49Å; L538-I542 HydrophobicContact CD1-CD1 4.2Å; L538-I542 HydrophobicContact CD1-CG1 4.44Å; L538-I542 HydrophobicContact CG-CD1 4.07Å; L538-I542 WeakPolarHBondContact O-CD1 3.48Å; L538-I542 VanDerWaalsContact O-CG1 3.26Å; L538-I542 WeakPolarHBondContact O-CG1 3.44Å; L538-I542 PolarHBondContact O-N 2.86Å; R539-I542 PolarHBondContact O-N 3.24Å; K540-I542 VanDerWaalsContact C-N 3.35Å; K540-I542 PolarHBondContact O-N 2.88Å; I542-L544 PolarHBondContact O-N 2.89Å; I542-L545 PolarHBondContact O-N 3.13Å; I542-E546 WeakPolarHBondContact O-CB 3.47Å; I542-E546 PolarHBondContact O-N 2.88Å; I542-P553 HydrophobicContact CG2-CG 4.46Å; I542-I555 HydrophobicContact CD1-CD1 3.63Å; I542-I555 HydrophobicContact CD1-CG1 4.41Å; I542-I555 HydrophobicContact CG1-CD1 4.23Å
543	L	75.3	Confident	69.8	Low	33 Å²	33	48.8 Å²	48.8	17%	0.173	27%	0.273	C	S	.	.	H	α-helix	trans	-67.7	-34.3	-177.4	-68.5	174	0	0	0	112.6	H187 R191 F194 R539 K540 T547	H187-L543 PolarHBondContact CE1-O 3.21Å; R191-L543 HydrophobicContact CG-CD1 4.21Å; R191-L543 HydrophobicContact CG-CD2 3.55Å; F194-L543 HydrophobicContact CD2-CD1 4.35Å; F194-L543 HydrophobicContact CD2-CD2 4.49Å; F194-L543 HydrophobicContact CE2-CD2 4.27Å; F194-L543 HydrophobicContact CE2-CG 4.28Å; R539-L543 WeakPolarHBondContact O-CG 3.44Å; R539-L543 PolarHBondContact O-N 2.86Å; K540-L543 PolarHBondContact O-N 3.13Å; L543-T547 WeakPolarHBondContact O-CB 3.45Å; L543-T547 PolarHBondContact O-N 3.35Å; L543-T547 PolarHBondContact O-OG1 3.44Å
544	L	74.6	Confident	69.3	Low	91 Å²	91	55.3 Å²	55.3	48%	0.476	30%	0.297	S	S	.	.	H	α-helix	trans	-64.4	-53.5	172.9	-171.2	163.8	0	0	0	109.9	K540 I542 E546 T547 T548	K540-L544 VanDerWaalsContact O-CB 3.32Å; K540-L544 WeakPolarHBondContact O-CB 3.45Å; K540-L544 PolarHBondContact O-N 3.3Å; I542-L544 PolarHBondContact O-N 2.89Å; L544-E546 VanDerWaalsContact C-N 3.34Å; L544-E546 PolarHBondContact O-N 3.05Å; L544-T547 CarbonylContact O-C 3.6Å; L544-T547 WeakPolarHBondContact O-CA 3.32Å; L544-T547 WeakPolarHBondContact O-CB 3.38Å; L544-T547 PolarHBondContact O-N 2.88Å; L544-T548 HydrophobicContact CD2-CG2 3.92Å; L544-T548 PolarHBondContact O-N 3.32Å; L544-T548 PolarHBondContact O-OG1 3.06Å
545	L	70.9	Confident	69	Low	30 Å²	30	54.1 Å²	54.1	16%	0.157	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-38.2	-179.4	-74.1	169.2	0	0	0	112.7	P515 I517 T541 I542 T547 T548 S549 P553	P515-L545 HydrophobicContact CB-CD2 4.4Å; P515-L545 HydrophobicContact CG-CD2 4.42Å; I517-L545 HydrophobicContact CD1-CD1 3.69Å; I517-L545 HydrophobicContact CG1-CD1 3.67Å; T541-L545 HydrophobicContact CG2-CD1 4Å; T541-L545 WeakPolarHBondContact O-CB 3.23Å; T541-L545 WeakPolarHBondContact O-CG 3.48Å; T541-L545 PolarHBondContact O-N 3.47Å; I542-L545 PolarHBondContact O-N 3.13Å; L545-T547 PolarHBondContact O-N 2.87Å; L545-T548 PolarHBondContact O-N 3.34Å; L545-S549 WeakPolarHBondContact O-CB 3.27Å; L545-S549 PolarHBondContact O-N 3.17Å; L545-S549 PolarHBondContact O-OG 2.98Å; L545-P553 HydrophobicContact CB-CB 4.19Å; L545-P553 HydrophobicContact CB-CG 4.08Å
546	E	70.6	Confident	68.6	Low	21 Å²	21	55 Å²	55	10%	0.098	29%	0.294	C	S	.	.	H	α-helix	trans	-70.3	-17.5	174	-163.7	177.4	-150	0	0	113.2	H187 I542 L544 P553	H187-E546 VanDerWaalsContact CA-OE2 3.29Å; H187-E546 WeakPolarHBondContact CA-OE2 3.43Å; H187-E546 HydrophobicContact CB-CG 4.26Å; H187-E546 IonicContact CE1-OE2 2.72Å; H187-E546 IonicContact CG-OE2 3.55Å; H187-E546 PolarHBondContact N-OE1 3.05Å; H187-E546 IonicContact ND1-OE2 2.78Å; H187-E546 PolarHBondContact ND1-OE2 2.89Å; I542-E546 WeakPolarHBondContact O-CB 3.47Å; I542-E546 PolarHBondContact O-N 2.88Å; L544-E546 VanDerWaalsContact C-N 3.34Å; L544-E546 PolarHBondContact O-N 3.05Å; E546-P553 HydrophobicContact CB-CG 4.31Å
547	T	69.1	Low	68	Low	94 Å²	94	56 Å²	56	58%	0.577	30%	0.298	S	S	*	.	H	α-helix	trans	-87	-33.9	172.6	-53.3	0	0	0	0	112	L543 L544 L545	L543-T547 WeakPolarHBondContact O-CB 3.45Å; L543-T547 PolarHBondContact O-N 3.35Å; L543-T547 PolarHBondContact O-OG1 3.44Å; L544-T547 CarbonylContact O-C 3.6Å; L544-T547 WeakPolarHBondContact O-CA 3.32Å; L544-T547 WeakPolarHBondContact O-CB 3.38Å; L544-T547 PolarHBondContact O-N 2.88Å; L545-T547 PolarHBondContact O-N 2.87Å
548	T	65.2	Low	67.4	Low	99 Å²	99	57.1 Å²	57.1	61%	0.607	30%	0.302	S	S	*	.	H	α-helix	trans	-95.7	-16.4	-175	56.9	0	0	0	0	115.1	L544 L545	L544-T548 HydrophobicContact CD2-CG2 3.92Å; L544-T548 PolarHBondContact O-N 3.32Å; L544-T548 PolarHBondContact O-OG1 3.06Å; L545-T548 PolarHBondContact O-N 3.34Å
549	S	61.2	Low	66.2	Low	34 Å²	34	59.9 Å²	59.9	24%	0.238	32%	0.323	C	S	.	.			trans	-114.8	141.1	-178.6	68.2	0	0	0	0	112.9	P515 L545 I551	P515-S549 WeakPolarHBondContact CG-OG 3.17Å; L545-S549 WeakPolarHBondContact O-CB 3.27Å; L545-S549 PolarHBondContact O-N 3.17Å; L545-S549 PolarHBondContact O-OG 2.98Å; S549-I551 PolarHBondContact O-N 3.41Å; S549-I551 PolarHBondContact OG-O 2.83Å; S549-I551 VanDerWaalsContact OG-O 3.08Å
550	A	57.1	Low	64.4	Low	107 Å²	107	63.1 Å²	63.1	88%	0.884	35%	0.348	S	S	*	.	S	Bend	trans	-72.4	-10.5	-178.2	0	0	0	0	0	114.2
551	I	59.7	Low	63	Low	60 Å²	60	67.3 Å²	67.3	31%	0.308	37%	0.372	S	S	.	.	S	Bend	trans	-127.2	124	-179.8	-55.8	123.2	0	0	0	107.1	Q512 S549	Q512-I551 HydrophobicContact CB-CD1 3.95Å; Q512-I551 HydrophobicContact CG-CD1 3.71Å; Q512-I551 WeakPolarHBondContact O-CD1 3.47Å; S549-I551 PolarHBondContact O-N 3.41Å; S549-I551 PolarHBondContact OG-O 2.83Å; S549-I551 VanDerWaalsContact OG-O 3.08Å
552	S	56.7	Low	61.2	Low	40 Å²	40	71 Å²	71	28%	0.28	39%	0.388	S	S	.	.			trans	-51.4	138.1	-177.4	-55.7	0	0	0	0	112.4	R186 R554	R186-S552 WeakPolarHBondContact CD-OG 3.5Å; R186-S552 PolarHBondContact NH1-OG 3.02Å; S552-R554 PolarHBondContact O-N 2.94Å
553	P	60.2	Low	59.3	Low	11 Å²	11	74 Å²	74	7%	0.071	42%	0.419	C	S	.	.			trans	-60.6	138.8	179.3	23.2	-33.1	0	0	0	112.1	P515 I517 I542 L545 E546	P515-P553 HydrophobicContact CG-CB 4.23Å; P515-P553 CarbonylContact O-C 3.59Å; P515-P553 WeakPolarHBondContact O-CA 3.41Å; P515-P553 WeakPolarHBondContact O-CB 3.33Å; I517-P553 HydrophobicContact CD1-CB 3.75Å; I517-P553 HydrophobicContact CD1-CG 4.25Å; I517-P553 HydrophobicContact CG1-CB 4.1Å; I542-P553 HydrophobicContact CG2-CG 4.46Å; L545-P553 HydrophobicContact CB-CB 4.19Å; L545-P553 HydrophobicContact CB-CG 4.08Å; E546-P553 HydrophobicContact CB-CG 4.31Å
554	R	61.6	Low	57.3	Low	140 Å²	140	78.9 Å²	78.9	53%	0.528	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	111.6	177.1	-173.7	178.8	-176.7	-178.3	3	109.4	E513 P515 V516 I517 S552 Q556	E513-R554 IonicContact OE1-NH1 3.21Å; P515-R554 PolarHBondContact O-N 3.37Å; V516-R554 CarbonylContact C-O 3.51Å; V516-R554 WeakPolarHBondContact CA-O 3.47Å; V516-R554 HydrophobicContact CG2-CB 4.45Å; I517-R554 PolarHBondContact N-O 3.37Å; S552-R554 PolarHBondContact O-N 2.94Å; R554-Q556 PolarHBondContact O-N 3.22Å
555	I	65.8	Low	55	Low	42 Å²	42	82 Å²	82	22%	0.215	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	124.8	174.1	-56.4	175.3	0	0	0	108.8	I519 H532 I542 Y557	I519-I555 HydrophobicContact CD1-CG2 3.45Å; I519-I555 VanDerWaalsContact CD1-CG2 3.45Å; I519-I555 HydrophobicContact CG1-CG2 4.34Å; H532-I555 HydrophobicContact CB-CD1 4.29Å; I542-I555 HydrophobicContact CD1-CD1 3.63Å; I542-I555 HydrophobicContact CD1-CG1 4.41Å; I542-I555 HydrophobicContact CG1-CD1 4.23Å; I555-Y557 HydrophobicContact CG2-CD2 4.18Å; I555-Y557 HydrophobicContact CG2-CE2 3.9Å
556	Q	64.6	Low	52.9	Low	55 Å²	55	89.1 Å²	89.1	26%	0.257	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	115.9	173.3	-78.5	-175.6	-3.8	0	0	109.3	V516 I517 R518 I519 R554	V516-Q556 HydrophobicContact CG1-CB 4.02Å; V516-Q556 HydrophobicContact CG1-CG 3.68Å; I517-Q556 PolarHBondContact O-N 3.18Å; R518-Q556 CarbonylContact C-O 3.4Å; R518-Q556 WeakPolarHBondContact CA-O 3.47Å; R518-Q556 HydrophobicContact CG-CB 4.14Å; I519-Q556 PolarHBondContact N-O 2.69Å; R554-Q556 PolarHBondContact O-N 3.22Å
557	Y	64.6	Low	50.7	Low	43 Å²	43	94.1 Å²	94.1	17%	0.169	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	149.7	168.8	-72.4	-88.2	0	0	0	111.1	I519 R523 D530 A531 H532 I555 S559	I519-Y557 HydrophobicContact CB-CD1 3.88Å; I519-Y557 HydrophobicContact CB-CE1 4.16Å; I519-Y557 HydrophobicContact CD1-CD1 3.92Å; I519-Y557 HydrophobicContact CD1-CD2 4.48Å; I519-Y557 HydrophobicContact CD1-CE1 3.47Å; I519-Y557 VanDerWaalsContact CD1-CE1 3.47Å; I519-Y557 HydrophobicContact CD1-CE2 4.11Å; I519-Y557 HydrophobicContact CD1-CG 4.4Å; I519-Y557 HydrophobicContact CG1-CE1 4.43Å; I519-Y557 HydrophobicContact CG2-CD1 3.83Å; I519-Y557 HydrophobicContact CG2-CE1 3.9Å; R523-Y557 HydrophobicContact CB-CD1 4.04Å; R523-Y557 HydrophobicContact CB-CD2 4.15Å; R523-Y557 HydrophobicContact CB-CG 3.68Å; R523-Y557 VanDerWaalsContact CD-CD2 3.48Å; R523-Y557 HydrophobicContact CG-CD1 4.03Å; R523-Y557 HydrophobicContact CG-CD2 3.63Å; R523-Y557 HydrophobicContact CG-CE1 4.33Å; R523-Y557 HydrophobicContact CG-CE2 3.95Å; R523-Y557 HydrophobicContact CG-CG 3.65Å; D530-Y557 WeakPolarHBondContact CB-OH 3.37Å; D530-Y557 VanDerWaalsContact OD2-CE2 3.31Å; D530-Y557 WeakPolarHBondContact OD2-CE2 3.32Å; D530-Y557 PolarHBondContact OD2-OH 3.44Å; D530-Y557 VanDerWaalsContact OD2-OH 3.11Å; A531-Y557 HydrophobicContact CB-CE1 3.91Å; A531-Y557 PolarHBondContact N-OH 3.04Å; H532-Y557 AromaticContact ND1-CZ 3.89Å; H532-Y557 PolarHBondContact ND1-OH 3.28Å; I555-Y557 HydrophobicContact CG2-CD2 4.18Å; I555-Y557 HydrophobicContact CG2-CE2 3.9Å; Y557-S559 PolarHBondContact O-N 3.07Å
558	R	59.8	Low	48.7	Very low	158 Å²	158	96.8 Å²	96.8	60%	0.596	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.2	134	167.4	-167.5	172	-175.9	166.4	1.6	110.8	I519 D520 P522 R523	I519-R558 PolarHBondContact O-N 2.73Å; I519-R558 VanDerWaalsContact O-N 3.07Å; D520-R558 WeakPolarHBondContact O-CD 3.32Å; P522-R558 WeakPolarHBondContact CA-O 3.35Å; R523-R558 PolarHBondContact N-O 3.02Å
559	S	48.3	Very low	46.8	Very low	68 Å²	68	99.8 Å²	99.8	48%	0.476	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-79.7	134.4	168.5	-172.7	0	0	0	0	109.7	Y557 L561	Y557-S559 PolarHBondContact O-N 3.07Å; S559-L561 VanDerWaalsContact C-N 3.29Å; S559-L561 PolarHBondContact OG-N 2.88Å; S559-L561 PolarHBondContact OG-O 3.21Å
560	S	43.3	Very low	45	Very low	89 Å²	89	107.9 Å²	107.9	62%	0.622	57%	0.574	S	S	*	*	S	Bend	trans	-76.9	-17.3	168.6	51.5	0	0	0	0	112.8
561	L	45.2	Very low	43.4	Very low	137 Å²	137	111 Å²	111	72%	0.717	57%	0.57	S	S	*	*	S	Bend	trans	-115.4	85.2	164.1	-83.2	89.1	0	0	0	109.3	S559	S559-L561 VanDerWaalsContact C-N 3.29Å; S559-L561 PolarHBondContact OG-N 2.88Å; S559-L561 PolarHBondContact OG-O 3.21Å
562	M	36.9	Very low	41.8	Very low	137 Å²	137	113.9 Å²	113.9	68%	0.675	59%	0.59	S	S	*	*				-175.7	129.5	128.6	-108	-177.2	173.6	0	0	109.6	K565	M562-K565 HydrophobicContact SD-CB 4.11Å
563	G	34.7	Very low	40.2	Very low	66 Å²	66	118.6 Å²	118.6	68%	0.68	62%	0.618	S	S	*	*	S	Bend	trans	-64.1	156.3	151.2	0	0	0	0	0	109.3	K565	G563-K565 PolarHBondContact O-N 3.46Å
564	S	33.6	Very low	38.6	Very low	134 Å²	134	128.5 Å²	128.5	94%	0.937	68%	0.677	S	S	*	*	S	Bend	trans	-31.2	100.1	-176.4	51.6	0	0	0	0	115.2
565	K	25	Very low	37.5	Very low	156 Å²	156	127.9 Å²	127.9	68%	0.678	69%	0.685	S	S	*	*			trans	-134.6	96.5	158.8	-136	-179.9	-171.2	-173.7	0	109.3	M562 G563 V567	M562-K565 HydrophobicContact SD-CB 4.11Å; G563-K565 PolarHBondContact O-N 3.46Å; K565-V567 PolarHBondContact O-N 3.15Å
566	E	28.1	Very low	36	Very low	180 Å²	180	132.4 Å²	132.4	84%	0.841	71%	0.71	S	S	*	*			trans	-63.5	111.7	157.6	-65.2	-178.8	137.7	0	0	106.4	L568	E566-L568 PolarHBondContact O-N 3.19Å
567	V	23.2	Very low	34.4	Very low	127 Å²	127	136.7 Å²	136.7	77%	0.77	74%	0.735	S	S	*	*			trans	-87.6	97	170.2	179.4	0	0	0	0	106	K565	K565-V567 PolarHBondContact O-N 3.15Å
568	L	26.7	Very low	32.6	Very low	150 Å²	150	142.2 Å²	142.2	79%	0.785	77%	0.768	S	S	*	*			trans	-64.1	170.1	166.9	-112.2	77.9	0	0	0	110.9	E566	E566-L568 PolarHBondContact O-N 3.19Å
569	E	25.6	Very low	30.9	Very low	161 Å²	161	141.3 Å²	141.3	75%	0.752	78%	0.779	S	S	*	*			trans	-68.1	144.5	-171.2	-86.3	179.1	115.1	0	0	116.3
570	Y	24.1	Very low	29.8	Very low	205 Å²	205	146.1 Å²	146.1	80%	0.804	80%	0.799	S	S	*	*			trans	66.5	161.7	144.9	-76.7	-64.4	0	0	0	122.6
571	E	22.9	Very low	28.8	Very low	171 Å²	171	150.2 Å²	150.2	80%	0.799	81%	0.812	S	S	*	*			trans	57.4	104.4	171.3	-65.8	177.4	-179.7	0	0	117.6
572	T	26.1	Very low	27.5	Very low	121 Å²	121	151.2 Å²	151.2	74%	0.742	82%	0.819	S	S	*	*				64	108.8	70.5	66.8	0	0	0	0	116
573	T	23.9	Very low	26.8	Very low	139 Å²	139	152.4 Å²	152.4	85%	0.853	83%	0.831	S	S	*	*				-171.6	139.8	126.6	14.1	0	0	0	0	111.1
574	V	27.1	Very low	26	Very low	219 Å²	219	160.3 Å²	160.3	100%	1.327	84%	0.844	S	S	*	*			trans	48.2	0	170	-167.1	0	0	0	0	115.9

Retrieved 574 of 574 residues in 625.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).