A0A096MPG5_PAPAN Loading...

Mitochondrial adenyl nucleotide antiporter SLC25A24

Electroneutral antiporter that mediates the transport of adenyl nucleotides through the inner mitochondrial membrane. Originally identified as an ATP-magnesium/inorganic phosphate antiporter, it also acts as a broad specificity adenyl nucleotide antiporter. By regulating the mitochondrial matrix adenyl nucleotide pool could adapt to changing cellular energetic demands and indirectly regulate adenyl nucleotide-dependent metabolic pathways. In vitro, a low activity is also observed with guanyl and pyrimidine nucleotides. May play a role in protecting cells against oxidative stress-induced cell death, by buffering calcium levels in the mitochondrial matrix through the formation of calcium-phosphate precipitates.

AlphaFold DB , UniProt , Accession A0A096MPG5, Species PAPAN (Papio anubis, Olive baboon), Gene SLC25A24, Length 477 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	24.4	Very low	34.4	Very low	246 Å²	246	163.6 Å²	163.6	100%	1.212	81%	0.808	S	S	*	*				0	25.3	0	-147.5	-179.1	-76.5	0	0	112.3
2	L	31.6	Very low	34.5	Very low	147 Å²	147	161.8 Å²	161.8	77%	0.77	81%	0.813	S	S	*	*			trans	-119.3	-1.3	-170.4	-87.4	149.6	0	0	0	114.5
3	R	33	Very low	35	Very low	215 Å²	215	157.5 Å²	157.5	81%	0.811	82%	0.818	S	S	*	*	S	Bend	trans	-89.3	-3.9	-171.9	-94.3	-176.4	169.2	-172.9	-4.2	116
4	W	30.8	Very low	34.6	Very low	239 Å²	239	153.1 Å²	153.1	91%	0.905	82%	0.816	S	S	*	*	S	Bend	trans	-122.5	17.5	-160.3	-113.1	70.3	0	0	0	117.7
5	L	33.3	Very low	34.5	Very low	158 Å²	158	151.3 Å²	151.3	83%	0.827	82%	0.819	S	S	*	*	S	Bend	trans	-134.8	9.7	178.7	-75.8	170.9	0	0	0	116.2
6	R	41.8	Very low	34.2	Very low	153 Å²	153	154.1 Å²	154.1	58%	0.577	83%	0.825	S	S	*	*	G	3₁₀ helix	trans	-86.7	-1.5	178.7	-85.9	-174.5	171.5	-174.6	-3.8	115.4	F8	R6-F8 VanDerWaalsContact C-N 3.32Å; R6-F8 PolarHBondContact O-N 3.48Å
7	G	35.2	Very low	34.4	Very low	73 Å²	73	157.1 Å²	157.1	75%	0.753	83%	0.832	S	S	*	*	G	3₁₀ helix	trans	-80.1	2.3	-174.1	0	0	0	0	0	116.7
8	F	36.7	Very low	34.6	Very low	201 Å²	201	153.1 Å²	153.1	88%	0.882	83%	0.826	S	S	*	*	G	3₁₀ helix	trans	-109.6	-2	-167.1	-125.7	-92.5	0	0	0	116	R6	R6-F8 VanDerWaalsContact C-N 3.32Å; R6-F8 PolarHBondContact O-N 3.48Å
9	V	38.8	Very low	34.9	Very low	91 Å²	91	154.8 Å²	154.8	55%	0.552	83%	0.828	S	S	*	*	S	Bend	trans	-111.2	-5.7	-176.3	-171.2	0	0	0	0	113.6	L51	V9-L51 HydrophobicContact CG2-CD2 4.14Å
10	L	40	Very low	35.5	Very low	157 Å²	157	152.9 Å²	152.9	82%	0.822	82%	0.824	S	S	*	*			trans	-131.3	94	178	-69	170.3	0	0	0	111.3
11	P	33.3	Very low	36.3	Very low	120 Å²	120	148.6 Å²	148.6	78%	0.779	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-77.4	136.5	166	-8.2	25.6	0	0	0	110.8
12	T	35.4	Very low	38.6	Very low	141 Å²	141	140.1 Å²	140.1	87%	0.865	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-53.6	133.6	162.3	7.7	0	0	0	0	110.6	A14	T12-A14 PolarHBondContact O-N 2.98Å
13	A	40.5	Very low	40.9	Very low	107 Å²	107	137.3 Å²	137.3	88%	0.884	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-50.3	127.7	-176.6	0	0	0	0	0	113.8
14	A	29.2	Very low	43.3	Very low	95 Å²	95	128.6 Å²	128.6	79%	0.785	71%	0.713	S	S	*	*			trans	-151.3	109.4	157.8	0	0	0	0	0	110.9	T12	T12-A14 PolarHBondContact O-N 2.98Å
15	C	33.6	Very low	45.9	Very low	127 Å²	127	120.2 Å²	120.2	86%	0.858	68%	0.684	S	S	*	*			trans	20.2	112.4	158.5	-60.1	0	0	0	0	120.3
16	Q	29.7	Very low	48.3	Very low	195 Å²	195	115.8 Å²	115.8	91%	0.911	66%	0.664	S	S	*	*				-174.1	153.2	117.4	-101.2	171.1	-2.5	0	0	111.1	A18	Q16-A18 PolarHBondContact O-N 3.04Å
17	E	38.1	Very low	50.4	Low	205 Å²	205	109.7 Å²	109.7	96%	0.958	64%	0.642	S	S	*	*	S	Bend	trans	-61.9	104.4	-164.8	-63.3	171.1	155.1	0	0	115
18	A	36.8	Very low	52.8	Low	86 Å²	86	106.8 Å²	106.8	71%	0.711	61%	0.609	S	S	*	*	S	Bend	trans	-160.2	144.1	149.2	0	0	0	0	0	106.2	Q16	Q16-A18 PolarHBondContact O-N 3.04Å
19	E	40.1	Very low	55.2	Low	186 Å²	186	103.3 Å²	103.3	87%	0.869	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-53.2	131.4	172.2	-72.1	-170.6	158.1	0	0	108.9
20	P	46.8	Very low	57.3	Low	116 Å²	116	101.8 Å²	101.8	75%	0.753	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-62	129.1	-175.8	23.7	-31.2	0	0	0	108.7	T22	P20-T22 PolarHBondContact O-N 3.46Å
21	P	53.5	Low	59.5	Low	63 Å²	63	94.4 Å²	94.4	41%	0.409	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-53.5	142.2	175.4	18.6	-29.1	0	0	0	109.6	E25	P21-E25 VanDerWaalsContact CA-OE2 3.27Å; P21-E25 WeakPolarHBondContact CA-OE2 3.43Å; P21-E25 HydrophobicContact CB-CB 3.92Å; P21-E25 WeakPolarHBondContact CB-OE2 3.49Å
22	T	71.8	Confident	62	Low	67 Å²	67	89.5 Å²	89.5	41%	0.411	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-57.9	147.9	175.1	67	0	0	0	0	108.5	P20 Y24 E25 T26	P20-T22 PolarHBondContact O-N 3.46Å; T22-Y24 PolarHBondContact O-N 3.46Å; T22-E25 WeakPolarHBondContact CG2-OE1 3.25Å; T22-E25 PolarHBondContact N-OE2 3.42Å; T22-E25 WeakPolarHBondContact O-CA 3.16Å; T22-E25 WeakPolarHBondContact O-CB 3.34Å; T22-E25 PolarHBondContact O-N 3.32Å; T22-E25 WeakPolarHBondContact OG1-CG 3.45Å; T22-E25 PolarHBondContact OG1-OE1 2.74Å; T22-T26 PolarHBondContact O-N 2.76Å
23	R	80.2	Confident	64.3	Low	88 Å²	88	88.6 Å²	88.6	33%	0.332	50%	0.502	S	S	.	.	H	α-helix	trans	-49.9	-34	-178.2	179.3	-179.8	176	-141.1	5.4	113.2	L27 E88 R148 D149	R23-L27 HydrophobicContact CG-CD1 4.33Å; R23-L27 WeakPolarHBondContact O-CG 3.36Å; R23-L27 PolarHBondContact O-N 2.87Å; R23-E88 IonicContact NH1-OE1 3.99Å; R23-R148 VanDerWaalsContact NH1-CD 3.33Å; R23-D149 IonicContact CZ-OD1 3.81Å; R23-D149 IonicContact NH1-OD1 3.56Å; R23-D149 IonicContact NH2-OD1 3.78Å; R23-D149 PolarHBondContact NH2-OD1 3.43Å; R23-D149 IonicContact NH2-OD2 2.79Å
24	Y	83.6	Confident	66.4	Low	33 Å²	33	87.7 Å²	87.7	13%	0.129	48%	0.482	C	S	.	.	H	α-helix	trans	-71	-35.5	176.7	-57.6	-57.9	0	0	0	112.7	T22 L27 F28 M81 L84 K85 E88	T22-Y24 PolarHBondContact O-N 3.46Å; Y24-L27 PolarHBondContact O-N 3.01Å; Y24-F28 VanDerWaalsContact O-CB 3.25Å; Y24-F28 WeakPolarHBondContact O-CB 3.39Å; Y24-F28 PolarHBondContact O-N 3.49Å; Y24-M81 HydrophobicContact CD2-CG 4.02Å; Y24-M81 HydrophobicContact CG-CG 4.3Å; Y24-L84 HydrophobicContact CD1-CB 4.02Å; Y24-L84 HydrophobicContact CD1-CD1 3.64Å; Y24-L84 HydrophobicContact CE1-CB 3.79Å; Y24-L84 HydrophobicContact CE1-CD1 4.09Å; Y24-K85 HydrophobicContact CE2-CG 3.94Å; Y24-E88 WeakPolarHBondContact CE1-OE1 3.28Å; Y24-E88 PolarHBondContact OH-OE1 3.4Å; Y24-E88 PolarHBondContact OH-OE2 3.46Å
25	E	84.9	Confident	69.1	Low	62 Å²	62	86 Å²	86	29%	0.29	47%	0.474	S	S	.	.	H	α-helix	trans	-64.5	-44.9	175	-73	154.6	-145	0	0	111.2	P21 T22 L27 F28 Q29 F77	P21-E25 VanDerWaalsContact CA-OE2 3.27Å; P21-E25 WeakPolarHBondContact CA-OE2 3.43Å; P21-E25 HydrophobicContact CB-CB 3.92Å; P21-E25 WeakPolarHBondContact CB-OE2 3.49Å; T22-E25 WeakPolarHBondContact CG2-OE1 3.25Å; T22-E25 PolarHBondContact N-OE2 3.42Å; T22-E25 WeakPolarHBondContact O-CA 3.16Å; T22-E25 WeakPolarHBondContact O-CB 3.34Å; T22-E25 PolarHBondContact O-N 3.32Å; T22-E25 WeakPolarHBondContact OG1-CG 3.45Å; T22-E25 PolarHBondContact OG1-OE1 2.74Å; E25-L27 VanDerWaalsContact C-N 3.3Å; E25-L27 PolarHBondContact O-N 3.44Å; E25-F28 PolarHBondContact O-N 3.45Å; E25-Q29 WeakPolarHBondContact O-CB 3.5Å; E25-Q29 VanDerWaalsContact O-CG 3.28Å; E25-Q29 WeakPolarHBondContact O-CG 3.42Å; E25-Q29 PolarHBondContact O-N 2.94Å; E25-F77 HydrophobicContact CB-CE2 4.27Å; E25-F77 HydrophobicContact CB-CZ 4.44Å; E25-F77 HydrophobicContact CG-CE1 4.14Å; E25-F77 HydrophobicContact CG-CE2 3.62Å; E25-F77 HydrophobicContact CG-CZ 3.38Å
26	T	84.9	Confident	71.7	Confident	66 Å²	66	83.9 Å²	83.9	41%	0.405	45%	0.454	S	S	.	.	H	α-helix	trans	-61.8	-40.6	177	-48.7	0	0	0	0	111.6	T22 A30	T22-T26 PolarHBondContact O-N 2.76Å; T26-A30 WeakPolarHBondContact O-CB 3.4Å; T26-A30 PolarHBondContact O-N 3.4Å; T26-A30 VanDerWaalsContact O-N 3.09Å
27	L	84.9	Confident	74.4	Confident	24 Å²	24	76.4 Å²	76.4	13%	0.126	43%	0.429	C	S	.	.	H	α-helix	trans	-67.9	-42.2	176.2	-72.7	170.3	0	0	0	111.7	R23 Y24 E25 A30 L31 F80 L84 L152 F153	R23-L27 HydrophobicContact CG-CD1 4.33Å; R23-L27 WeakPolarHBondContact O-CG 3.36Å; R23-L27 PolarHBondContact O-N 2.87Å; Y24-L27 PolarHBondContact O-N 3.01Å; E25-L27 VanDerWaalsContact C-N 3.3Å; E25-L27 PolarHBondContact O-N 3.44Å; L27-A30 PolarHBondContact O-N 3.44Å; L27-L31 WeakPolarHBondContact O-CG 3.38Å; L27-L31 PolarHBondContact O-N 3.35Å; L27-F80 HydrophobicContact CB-CE1 4.27Å; L27-F80 HydrophobicContact CB-CZ 4.35Å; L27-L84 HydrophobicContact CD1-CD1 4.49Å; L27-L152 HydrophobicContact CD1-CD2 3.86Å; L27-F153 HydrophobicContact CD1-CZ 4.46Å; L27-F153 HydrophobicContact CD2-CE2 4.33Å; L27-F153 HydrophobicContact CD2-CZ 4.34Å
28	F	86.6	Confident	76.9	Confident	12 Å²	12	67.8 Å²	67.8	5%	0.053	39%	0.39	C	S	.	.	H	α-helix	trans	-62.4	-48.9	178.1	-175.5	-93.7	0	0	0	111.1	Y24 E25 A30 L31 D32 G37 V39 F77 F80	Y24-F28 VanDerWaalsContact O-CB 3.25Å; Y24-F28 WeakPolarHBondContact O-CB 3.39Å; Y24-F28 PolarHBondContact O-N 3.49Å; E25-F28 PolarHBondContact O-N 3.45Å; F28-A30 PolarHBondContact O-N 2.93Å; F28-L31 CarbonylContact O-C 3.26Å; F28-L31 PolarHBondContact O-N 3.2Å; F28-D32 HydrophobicContact CD1-CB 4.4Å; F28-D32 HydrophobicContact CE1-CB 4.14Å; F28-D32 PolarHBondContact O-N 3.4Å; F28-G37 WeakPolarHBondContact CZ-O 3.22Å; F28-V39 HydrophobicContact CD2-CG2 3.94Å; F28-V39 HydrophobicContact CE2-CB 4.49Å; F28-V39 HydrophobicContact CE2-CG2 3.65Å; F28-V39 HydrophobicContact CZ-CG2 4.06Å; F28-F77 HydrophobicContact CB-CD2 3.81Å; F28-F77 HydrophobicContact CB-CE2 4.19Å; F28-F77 HydrophobicContact CD1-CB 4.38Å; F28-F77 HydrophobicContact CD1-CD2 4.07Å; F28-F77 HydrophobicContact CD2-CB 4.37Å; F28-F77 HydrophobicContact CD2-CD2 4.02Å; F28-F77 HydrophobicContact CE1-CB 4.18Å; F28-F77 HydrophobicContact CE2-CB 4.15Å; F28-F77 HydrophobicContact CG-CB 4.46Å; F28-F77 AromaticContact CG-CD2 3.69Å; F28-F77 HydrophobicContact CG-CD2 3.69Å; F28-F77 HydrophobicContact CZ-CB 4.05Å; F28-F80 HydrophobicContact CB-CD1 3.96Å; F28-F80 HydrophobicContact CB-CE1 3.94Å; F28-F80 HydrophobicContact CD2-CB 3.82Å; F28-F80 AromaticContact CD2-CD1 3.63Å; F28-F80 HydrophobicContact CD2-CD1 3.63Å; F28-F80 HydrophobicContact CD2-CE1 4.27Å; F28-F80 AromaticContact CD2-CG 3.74Å; F28-F80 HydrophobicContact CD2-CG 3.74Å; F28-F80 HydrophobicContact CE2-CB 4.06Å; F28-F80 HydrophobicContact CE2-CG 4.41Å; F28-F80 HydrophobicContact CG-CD1 4.28Å
29	Q	86.6	Confident	79.4	Confident	128 Å²	128	63.7 Å²	63.7	60%	0.598	36%	0.356	S	S	*	.	H	α-helix	trans	-63.1	-27.8	176.4	-71	173.6	-1.1	0	0	113.2	E25 L31	E25-Q29 WeakPolarHBondContact O-CB 3.5Å; E25-Q29 VanDerWaalsContact O-CG 3.28Å; E25-Q29 WeakPolarHBondContact O-CG 3.42Å; E25-Q29 PolarHBondContact O-N 2.94Å; Q29-L31 VanDerWaalsContact C-N 3.3Å
30	A	83.4	Confident	81.7	Confident	59 Å²	59	57.8 Å²	57.8	49%	0.488	33%	0.331	S	S	.	.	H	α-helix	trans	-74.1	-23.2	174.3	0	0	0	0	0	112.7	T26 L27 F28	T26-A30 WeakPolarHBondContact O-CB 3.4Å; T26-A30 PolarHBondContact O-N 3.4Å; T26-A30 VanDerWaalsContact O-N 3.09Å; L27-A30 PolarHBondContact O-N 3.44Å; F28-A30 PolarHBondContact O-N 2.93Å
31	L	84.9	Confident	83.5	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-92.9	-41.6	177.6	-64.5	174.9	0	0	0	111.8	L27 F28 Q29 R33 V39 L44 L51 F80 F153	L27-L31 WeakPolarHBondContact O-CG 3.38Å; L27-L31 PolarHBondContact O-N 3.35Å; F28-L31 CarbonylContact O-C 3.26Å; F28-L31 PolarHBondContact O-N 3.2Å; Q29-L31 VanDerWaalsContact C-N 3.3Å; L31-R33 PolarHBondContact O-N 3.44Å; L31-V39 HydrophobicContact CB-CG1 4.15Å; L31-V39 HydrophobicContact CB-CG2 3.89Å; L31-L44 HydrophobicContact CD1-CD1 4.1Å; L31-L51 HydrophobicContact CD2-CD1 4.5Å; L31-F80 HydrophobicContact CD1-CE2 3.59Å; L31-F80 HydrophobicContact CD1-CZ 3.64Å; L31-F153 HydrophobicContact CD1-CE1 4.29Å; L31-F153 HydrophobicContact CD1-CZ 4.43Å
32	D	87.4	Confident	85	Confident	17 Å²	17	53.7 Å²	53.7	9%	0.091	31%	0.306	C	S	.	.			trans	-72.2	91.4	173.4	175.2	8.8	0	0	0	109.8	F28 N34 G35 D36 G37 V39	F28-D32 HydrophobicContact CD1-CB 4.4Å; F28-D32 HydrophobicContact CE1-CB 4.14Å; F28-D32 PolarHBondContact O-N 3.4Å; D32-N34 PolarHBondContact OD1-OD1 3.5Å; D32-G35 VanDerWaalsContact OD1-CA 3.23Å; D32-G35 WeakPolarHBondContact OD1-CA 3.23Å; D32-G35 PolarHBondContact OD1-N 2.94Å; D32-D36 PolarHBondContact OD1-N 3.3Å; D32-G37 VanDerWaalsContact OD2-CA 3.3Å; D32-G37 WeakPolarHBondContact OD2-CA 3.48Å; D32-G37 PolarHBondContact OD2-N 2.99Å; D32-V39 HydrophobicContact CB-CG2 4.05Å
33	R	82.2	Confident	85.7	Confident	122 Å²	122	51.2 Å²	51.2	46%	0.46	29%	0.29	S	S	.	.			trans	-84.1	-34.3	-173.9	-77.8	-177.6	162.9	-160.3	-5.4	112.8	L31 G35 E43 E46 N50	L31-R33 PolarHBondContact O-N 3.44Å; R33-G35 VanDerWaalsContact C-N 3.29Å; R33-E43 PolarHBondContact N-OE1 2.87Å; R33-E46 IonicContact CZ-OE1 3.53Å; R33-E46 IonicContact CZ-OE2 2.69Å; R33-E46 IonicContact NH1-OE1 2.62Å; R33-E46 PolarHBondContact NH1-OE1 2.82Å; R33-E46 IonicContact NH1-OE2 2.8Å; R33-E46 PolarHBondContact NH1-OE2 3.47Å; R33-N50 PolarHBondContact NH2-ND2 3.36Å
34	N	85.8	Confident	85.9	Confident	89 Å²	89	47 Å²	47	48%	0.476	27%	0.274	S	S	.	.	S	Bend	trans	-82.5	-14.2	-177	74.3	44	0	0	0	111.5	D32 D36 E43	D32-N34 PolarHBondContact OD1-OD1 3.5Å; N34-D36 WeakPolarHBondContact OD1-CA 3.26Å; N34-D36 WeakPolarHBondContact OD1-CB 3.25Å; N34-D36 PolarHBondContact OD1-N 2.87Å; N34-D36 PolarHBondContact OD1-OD1 3.46Å; N34-E43 PolarHBondContact N-OE1 3.19Å; N34-E43 PolarHBondContact ND2-OE1 3.38Å
35	G	86	Confident	86	Confident	59 Å²	59	49 Å²	49	61%	0.608	29%	0.285	S	S	*	.			trans	74.4	23.5	176.3	0	0	0	0	0	113.5	D32 R33 G37	D32-G35 VanDerWaalsContact OD1-CA 3.23Å; D32-G35 WeakPolarHBondContact OD1-CA 3.23Å; D32-G35 PolarHBondContact OD1-N 2.94Å; R33-G35 VanDerWaalsContact C-N 3.29Å; G35-G37 VanDerWaalsContact C-N 3.26Å
36	D	87.6	Confident	85.8	Confident	82 Å²	82	50.8 Å²	50.8	44%	0.439	29%	0.293	S	S	.	.	S	Bend	trans	-84.2	-1.2	-179.4	77.1	-9.7	0	0	0	113.1	D32 N34 V38 K74	D32-D36 PolarHBondContact OD1-N 3.3Å; N34-D36 WeakPolarHBondContact OD1-CA 3.26Å; N34-D36 WeakPolarHBondContact OD1-CB 3.25Å; N34-D36 PolarHBondContact OD1-N 2.87Å; N34-D36 PolarHBondContact OD1-OD1 3.46Å; D36-V38 VanDerWaalsContact C-N 3.32Å; D36-V38 VanDerWaalsContact CG-CG2 3.45Å; D36-V38 WeakPolarHBondContact OD1-CG2 3.4Å; D36-V38 PolarHBondContact OD1-N 3.21Å; D36-V38 VanDerWaalsContact OD1-O 3.11Å; D36-V38 VanDerWaalsContact OD2-CG2 3.31Å; D36-V38 WeakPolarHBondContact OD2-CG2 3.43Å; D36-K74 IonicContact OD2-NZ 2.68Å
37	G	87.2	Confident	85.6	Confident	38 Å²	38	47.8 Å²	47.8	39%	0.392	28%	0.275	S	S	.	.	S	Bend	trans	81	11.4	176.8	0	0	0	0	0	113.7	F28 D32 G35	F28-G37 WeakPolarHBondContact CZ-O 3.22Å; D32-G37 VanDerWaalsContact OD2-CA 3.3Å; D32-G37 WeakPolarHBondContact OD2-CA 3.48Å; D32-G37 PolarHBondContact OD2-N 2.99Å; G35-G37 VanDerWaalsContact C-N 3.26Å
38	V	90.4	Very high	85.2	Confident	24 Å²	24	46.7 Å²	46.7	15%	0.145	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	161.2	169.9	-63.7	0	0	0	0	110.2	D36 K74 L75 D76	D36-V38 VanDerWaalsContact C-N 3.32Å; D36-V38 VanDerWaalsContact CG-CG2 3.45Å; D36-V38 WeakPolarHBondContact OD1-CG2 3.4Å; D36-V38 PolarHBondContact OD1-N 3.21Å; D36-V38 VanDerWaalsContact OD1-O 3.11Å; D36-V38 VanDerWaalsContact OD2-CG2 3.31Å; D36-V38 WeakPolarHBondContact OD2-CG2 3.43Å; V38-K74 HydrophobicContact CB-CB 4.17Å; V38-K74 HydrophobicContact CG1-CB 4.38Å; V38-K74 HydrophobicContact CG2-CB 4.33Å; V38-K74 HydrophobicContact CG2-CD 3.98Å; V38-K74 HydrophobicContact CG2-CG 4.29Å; V38-L75 CarbonylContact C-O 3.56Å; V38-L75 WeakPolarHBondContact CA-O 3.14Å; V38-D76 HydrophobicContact CG1-CB 4.36Å
39	V	88.6	Confident	84.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	119	171.7	176.8	0	0	0	0	108.4	F28 L31 D32 E43 L44 F64 L75	F28-V39 HydrophobicContact CD2-CG2 3.94Å; F28-V39 HydrophobicContact CE2-CB 4.49Å; F28-V39 HydrophobicContact CE2-CG2 3.65Å; F28-V39 HydrophobicContact CZ-CG2 4.06Å; L31-V39 HydrophobicContact CB-CG1 4.15Å; L31-V39 HydrophobicContact CB-CG2 3.89Å; D32-V39 HydrophobicContact CB-CG2 4.05Å; V39-E43 HydrophobicContact CG1-CB 4.11Å; V39-L44 HydrophobicContact CG1-CB 4Å; V39-F64 WeakPolarHBondContact O-CE2 3.31Å; V39-L75 HydrophobicContact CB-CB 4.34Å; V39-L75 PolarHBondContact N-O 3.22Å; V39-L75 PolarHBondContact O-N 2.9Å
40	D	88.5	Confident	84.1	Confident	62 Å²	62	53.5 Å²	53.5	33%	0.332	30%	0.297	S	S	.	.			trans	-87.2	170.8	172	77.5	38.3	0	0	0	112.9	G42 E43 L44	D40-G42 PolarHBondContact O-N 2.92Å; D40-G42 VanDerWaalsContact OD1-CA 3.26Å; D40-G42 WeakPolarHBondContact OD1-CA 3.31Å; D40-G42 PolarHBondContact OD1-N 2.94Å; D40-E43 PolarHBondContact N-OE2 3.18Å; D40-E43 VanDerWaalsContact N-OE2 3.1Å; D40-E43 PolarHBondContact O-N 3.37Å; D40-E43 PolarHBondContact OD1-N 2.85Å; D40-L44 WeakPolarHBondContact O-CB 3.32Å; D40-L44 PolarHBondContact O-N 3.36Å
41	I	85.1	Confident	83.3	Confident	62 Å²	62	53.8 Å²	53.8	32%	0.318	29%	0.29	S	S	.	.	H	α-helix	trans	-62.3	-31.6	-178.3	-171.7	62.4	0	0	0	112.6	Q45 E60 F64	I41-Q45 WeakPolarHBondContact O-CB 3.24Å; I41-Q45 WeakPolarHBondContact O-CG 3.38Å; I41-Q45 PolarHBondContact O-N 3.24Å; I41-E60 HydrophobicContact CD1-CB 4.31Å; I41-F64 HydrophobicContact CB-CD2 4.1Å; I41-F64 HydrophobicContact CB-CE2 4.14Å; I41-F64 HydrophobicContact CB-CG 4.4Å; I41-F64 HydrophobicContact CB-CZ 4.46Å; I41-F64 HydrophobicContact CD1-CB 3.69Å; I41-F64 HydrophobicContact CD1-CD2 3.96Å; I41-F64 HydrophobicContact CD1-CG 3.82Å; I41-F64 VanDerWaalsContact N-CE2 3.32Å
42	G	84.3	Confident	82	Confident	32 Å²	32	55.8 Å²	55.8	33%	0.33	31%	0.312	S	S	.	.	H	α-helix	trans	-71.6	-44.3	177.7	0	0	0	0	0	111.6	D40 Q45 E46	D40-G42 PolarHBondContact O-N 2.92Å; D40-G42 VanDerWaalsContact OD1-CA 3.26Å; D40-G42 WeakPolarHBondContact OD1-CA 3.31Å; D40-G42 PolarHBondContact OD1-N 2.94Å; G42-Q45 PolarHBondContact O-N 2.97Å; G42-E46 WeakPolarHBondContact O-CB 3.22Å; G42-E46 PolarHBondContact O-N 3.45Å
43	E	87.4	Confident	80.7	Confident	15 Å²	15	57.7 Å²	57.7	7%	0.07	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-41.3	174.5	-73.3	-179.1	137.6	0	0	112	R33 N34 V39 D40 E46 G47	R33-E43 PolarHBondContact N-OE1 2.87Å; N34-E43 PolarHBondContact N-OE1 3.19Å; N34-E43 PolarHBondContact ND2-OE1 3.38Å; V39-E43 HydrophobicContact CG1-CB 4.11Å; D40-E43 PolarHBondContact N-OE2 3.18Å; D40-E43 VanDerWaalsContact N-OE2 3.1Å; D40-E43 PolarHBondContact O-N 3.37Å; D40-E43 PolarHBondContact OD1-N 2.85Å; E43-E46 PolarHBondContact O-N 2.86Å; E43-G47 WeakPolarHBondContact O-CA 3.13Å; E43-G47 PolarHBondContact O-N 2.87Å
44	L	84.5	Confident	79.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.3	-49	174.4	-174.1	63.8	0	0	0	111.4	L31 V39 D40 E46 G47 L48 E60 I63 F64	L31-L44 HydrophobicContact CD1-CD1 4.1Å; V39-L44 HydrophobicContact CG1-CB 4Å; D40-L44 WeakPolarHBondContact O-CB 3.32Å; D40-L44 PolarHBondContact O-N 3.36Å; L44-E46 PolarHBondContact O-N 3.43Å; L44-G47 PolarHBondContact O-N 3.29Å; L44-L48 HydrophobicContact CD1-CD1 3.65Å; L44-L48 HydrophobicContact CD1-CG 4.17Å; L44-L48 HydrophobicContact CG-CD1 3.69Å; L44-L48 WeakPolarHBondContact O-CB 3.28Å; L44-L48 WeakPolarHBondContact O-CD1 3.16Å; L44-L48 WeakPolarHBondContact O-CG 3.42Å; L44-L48 PolarHBondContact O-N 3.09Å; L44-E60 HydrophobicContact CD2-CB 4.44Å; L44-I63 HydrophobicContact CD2-CB 4.32Å; L44-I63 HydrophobicContact CD2-CG2 4.01Å; L44-F64 HydrophobicContact CD2-CB 4.1Å; L44-F64 HydrophobicContact CD2-CD2 4.06Å
45	Q	84.2	Confident	78	Confident	74 Å²	74	54.1 Å²	54.1	35%	0.346	32%	0.317	S	S	.	.	H	α-helix	trans	-60.1	-44.8	177.9	-77.9	175.4	-0.8	0	0	112.1	I41 G42 R49 E60	I41-Q45 WeakPolarHBondContact O-CB 3.24Å; I41-Q45 WeakPolarHBondContact O-CG 3.38Å; I41-Q45 PolarHBondContact O-N 3.24Å; G42-Q45 PolarHBondContact O-N 2.97Å; Q45-R49 WeakPolarHBondContact O-CB 3.2Å; Q45-R49 WeakPolarHBondContact O-CG 3.46Å; Q45-R49 PolarHBondContact O-N 3.34Å; Q45-R49 VanDerWaalsContact O-N 3.15Å; Q45-E60 HydrophobicContact CG-CB 3.85Å; Q45-E60 HydrophobicContact CG-CG 3.9Å
46	E	81.3	Confident	76.6	Confident	99 Å²	99	53.7 Å²	53.7	46%	0.463	31%	0.312	S	S	.	.	H	α-helix	trans	-72.5	-40	-178.4	-156.2	-175.3	169.7	0	0	111.7	R33 G42 E43 L44 R49 N50	R33-E46 IonicContact CZ-OE1 3.53Å; R33-E46 IonicContact CZ-OE2 2.69Å; R33-E46 IonicContact NH1-OE1 2.62Å; R33-E46 PolarHBondContact NH1-OE1 2.82Å; R33-E46 IonicContact NH1-OE2 2.8Å; R33-E46 PolarHBondContact NH1-OE2 3.47Å; G42-E46 WeakPolarHBondContact O-CB 3.22Å; G42-E46 PolarHBondContact O-N 3.45Å; E43-E46 PolarHBondContact O-N 2.86Å; L44-E46 PolarHBondContact O-N 3.43Å; E46-R49 PolarHBondContact O-N 2.7Å; E46-N50 WeakPolarHBondContact O-CB 2.95Å; E46-N50 PolarHBondContact O-N 3.18Å; E46-N50 PolarHBondContact O-ND2 3.02Å
47	G	80	Confident	75	Confident	4 Å²	4	57 Å²	57	4%	0.041	33%	0.325	C	S	.	.	H	α-helix	trans	-60.8	-47.4	176.1	0	0	0	0	0	112.3	E43 L44 R49 N50 L51	E43-G47 WeakPolarHBondContact O-CA 3.13Å; E43-G47 PolarHBondContact O-N 2.87Å; L44-G47 PolarHBondContact O-N 3.29Å; G47-R49 PolarHBondContact O-N 3.22Å; G47-N50 PolarHBondContact O-N 2.96Å; G47-L51 WeakPolarHBondContact O-CG 3.49Å; G47-L51 PolarHBondContact O-N 2.87Å
48	L	76.7	Confident	74	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-66.9	-36.8	179.5	-66.1	168.3	0	0	0	112.5	L44 L51 G52 I53 L55 E60 I63 F153	L44-L48 HydrophobicContact CD1-CD1 3.65Å; L44-L48 HydrophobicContact CD1-CG 4.17Å; L44-L48 HydrophobicContact CG-CD1 3.69Å; L44-L48 WeakPolarHBondContact O-CB 3.28Å; L44-L48 WeakPolarHBondContact O-CD1 3.16Å; L44-L48 WeakPolarHBondContact O-CG 3.42Å; L44-L48 PolarHBondContact O-N 3.09Å; L48-L51 PolarHBondContact O-N 3.1Å; L48-G52 PolarHBondContact O-N 3.35Å; L48-I53 HydrophobicContact CD2-CD1 4.15Å; L48-I53 PolarHBondContact O-N 2.94Å; L48-L55 HydrophobicContact CB-CD1 3.91Å; L48-L55 HydrophobicContact CD1-CD1 3.47Å; L48-L55 VanDerWaalsContact CD1-CD1 3.47Å; L48-L55 HydrophobicContact CD2-CD1 4.29Å; L48-L55 HydrophobicContact CG-CD1 4.08Å; L48-E60 HydrophobicContact CD1-CG 3.87Å; L48-I63 HydrophobicContact CD1-CD1 4.31Å; L48-F153 HydrophobicContact CD2-CB 3.65Å; L48-F153 HydrophobicContact CD2-CD1 3.66Å; L48-F153 HydrophobicContact CD2-CD2 3.88Å; L48-F153 HydrophobicContact CD2-CE1 4.23Å; L48-F153 HydrophobicContact CD2-CE2 4.42Å; L48-F153 HydrophobicContact CD2-CG 3.45Å; L48-F153 VanDerWaalsContact CD2-CG 3.45Å
49	R	76.4	Confident	73.2	Confident	180 Å²	180	59.6 Å²	59.6	68%	0.679	33%	0.33	S	S	*	.	H	α-helix	trans	-61.4	-43.3	171.4	-76.8	175.2	-174.8	-151.2	3.4	112.2	Q45 E46 G47 L51 G52	Q45-R49 WeakPolarHBondContact O-CB 3.2Å; Q45-R49 WeakPolarHBondContact O-CG 3.46Å; Q45-R49 PolarHBondContact O-N 3.34Å; Q45-R49 VanDerWaalsContact O-N 3.15Å; E46-R49 PolarHBondContact O-N 2.7Å; G47-R49 PolarHBondContact O-N 3.22Å; R49-L51 VanDerWaalsContact C-N 3.32Å; R49-G52 PolarHBondContact O-N 3Å
50	N	73.4	Confident	72.7	Confident	104 Å²	104	60.7 Å²	60.7	56%	0.556	34%	0.335	S	S	*	.	H	α-helix	trans	-72.1	-27.2	-179.5	-74.9	-55.4	0	0	0	113.1	R33 E46 G47 G52	R33-N50 PolarHBondContact NH2-ND2 3.36Å; E46-N50 WeakPolarHBondContact O-CB 2.95Å; E46-N50 PolarHBondContact O-N 3.18Å; E46-N50 PolarHBondContact O-ND2 3.02Å; G47-N50 PolarHBondContact O-N 2.96Å; N50-G52 PolarHBondContact O-N 2.67Å
51	L	66.3	Low	72.3	Confident	64 Å²	64	63 Å²	63	34%	0.335	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-1.5	169.2	-68.2	170.4	0	0	0	112.9	V9 L31 G47 L48 R49 I53 F153	V9-L51 HydrophobicContact CG2-CD2 4.14Å; L31-L51 HydrophobicContact CD2-CD1 4.5Å; G47-L51 WeakPolarHBondContact O-CG 3.49Å; G47-L51 PolarHBondContact O-N 2.87Å; L48-L51 PolarHBondContact O-N 3.1Å; R49-L51 VanDerWaalsContact C-N 3.32Å; L51-I53 HydrophobicContact CB-CD1 3.95Å; L51-I53 HydrophobicContact CB-CG1 3.93Å; L51-I53 HydrophobicContact CD1-CD1 4.41Å; L51-I53 PolarHBondContact O-N 2.89Å; L51-F153 HydrophobicContact CD1-CE2 4.42Å
52	G	59.4	Low	72.1	Confident	45 Å²	45	63.7 Å²	63.7	46%	0.464	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	26.2	177.7	0	0	0	0	0	112.9	L48 R49 N50 P54	L48-G52 PolarHBondContact O-N 3.35Å; R49-G52 PolarHBondContact O-N 3Å; N50-G52 PolarHBondContact O-N 2.67Å; G52-P54 WeakPolarHBondContact O-CD 3.44Å
53	I	58.6	Low	72	Confident	56 Å²	56	62.2 Å²	62.2	29%	0.287	33%	0.329	S	S	.	.			trans	-91.9	105.7	179.4	-52.8	177.4	0	0	0	107.4	L48 L51 L55 F153	L48-I53 HydrophobicContact CD2-CD1 4.15Å; L48-I53 PolarHBondContact O-N 2.94Å; L51-I53 HydrophobicContact CB-CD1 3.95Å; L51-I53 HydrophobicContact CB-CG1 3.93Å; L51-I53 HydrophobicContact CD1-CD1 4.41Å; L51-I53 PolarHBondContact O-N 2.89Å; I53-L55 HydrophobicContact CG2-CD1 4.49Å; I53-L55 HydrophobicContact CG2-CD2 3.7Å; I53-L55 HydrophobicContact CG2-CG 3.82Å; I53-L55 PolarHBondContact O-N 3.28Å; I53-F153 HydrophobicContact CD1-CB 4.15Å; I53-F153 HydrophobicContact CD1-CD2 3.65Å; I53-F153 HydrophobicContact CD1-CG 4.28Å
54	P	51.2	Low	71.9	Confident	103 Å²	103	62.3 Å²	62.3	67%	0.669	33%	0.33	S	S	*	.			trans	-74.4	95	175.7	30.6	-32.2	0	0	0	108.4	G52	G52-P54 WeakPolarHBondContact O-CD 3.44Å
55	L	61.1	Low	71.9	Confident	34 Å²	34	66.4 Å²	66.4	18%	0.178	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-85.1	146.4	173.5	-65.1	174.3	0	0	0	110	L48 I53 A59 E60 I63 F153	L48-L55 HydrophobicContact CB-CD1 3.91Å; L48-L55 HydrophobicContact CD1-CD1 3.47Å; L48-L55 VanDerWaalsContact CD1-CD1 3.47Å; L48-L55 HydrophobicContact CD2-CD1 4.29Å; L48-L55 HydrophobicContact CG-CD1 4.08Å; I53-L55 HydrophobicContact CG2-CD1 4.49Å; I53-L55 HydrophobicContact CG2-CD2 3.7Å; I53-L55 HydrophobicContact CG2-CG 3.82Å; I53-L55 PolarHBondContact O-N 3.28Å; L55-A59 HydrophobicContact CB-CB 3.82Å; L55-A59 HydrophobicContact CD2-CB 4.45Å; L55-E60 HydrophobicContact CD1-CG 4.06Å; L55-I63 HydrophobicContact CD1-CD1 4.45Å; L55-F153 WeakPolarHBondContact CD2-O 3.29Å
56	G	56.7	Low	71.8	Confident	49 Å²	49	66.5 Å²	66.5	51%	0.505	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-66.2	165.1	174.8	0	0	0	0	0	111.5	D58 A59	G56-D58 PolarHBondContact O-N 2.92Å; G56-A59 WeakPolarHBondContact O-CB 3.15Å; G56-A59 PolarHBondContact O-N 3.45Å
57	Q	53.4	Low	71.8	Confident	151 Å²	151	61.9 Å²	61.9	71%	0.706	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	131.5	169.6	-87.3	172.8	-19.9	0	0	109.3	A59	Q57-A59 VanDerWaalsContact C-N 3.31Å; Q57-A59 PolarHBondContact O-N 3.29Å
58	D	67.4	Low	72.2	Confident	108 Å²	108	62.6 Å²	62.6	58%	0.578	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	6.1	174.5	-41.2	-32.4	0	0	0	116.3	G56 E61 K62	G56-D58 PolarHBondContact O-N 2.92Å; D58-E61 PolarHBondContact O-N 3.39Å; D58-K62 PolarHBondContact O-N 3.22Å
59	A	71.8	Confident	72.7	Confident	9 Å²	9	66.9 Å²	66.9	7%	0.074	37%	0.368	C	S	.	.	H	α-helix	trans	-68	-39.7	179.6	0	0	0	0	0	112.8	L55 G56 Q57 E61 K62 I63 P155	L55-A59 HydrophobicContact CB-CB 3.82Å; L55-A59 HydrophobicContact CD2-CB 4.45Å; G56-A59 WeakPolarHBondContact O-CB 3.15Å; G56-A59 PolarHBondContact O-N 3.45Å; Q57-A59 VanDerWaalsContact C-N 3.31Å; Q57-A59 PolarHBondContact O-N 3.29Å; A59-E61 VanDerWaalsContact C-N 3.32Å; A59-K62 PolarHBondContact O-N 2.74Å; A59-I63 VanDerWaalsContact O-CG1 3.28Å; A59-I63 WeakPolarHBondContact O-CG1 3.28Å; A59-I63 PolarHBondContact O-N 3.34Å; A59-P155 HydrophobicContact CB-CG 3.8Å
60	E	79.1	Confident	73.1	Confident	24 Å²	24	62.4 Å²	62.4	11%	0.112	36%	0.358	C	S	.	.	H	α-helix	trans	-65.3	-38.8	176.2	-54.5	94.2	149.6	0	0	110.9	I41 L44 Q45 L48 L55 I63 F64	I41-E60 HydrophobicContact CD1-CB 4.31Å; L44-E60 HydrophobicContact CD2-CB 4.44Å; Q45-E60 HydrophobicContact CG-CB 3.85Å; Q45-E60 HydrophobicContact CG-CG 3.9Å; L48-E60 HydrophobicContact CD1-CG 3.87Å; L55-E60 HydrophobicContact CD1-CG 4.06Å; E60-I63 PolarHBondContact O-N 2.88Å; E60-F64 WeakPolarHBondContact O-CB 3.45Å; E60-F64 PolarHBondContact O-N 3.32Å
61	E	81	Confident	73.7	Confident	110 Å²	110	66 Å²	66	51%	0.514	37%	0.368	S	S	.	.	H	α-helix	trans	-65.5	-39.8	175.3	-169.8	174.6	-176	0	0	111.1	D58 A59 F64 T65	D58-E61 PolarHBondContact O-N 3.39Å; A59-E61 VanDerWaalsContact C-N 3.32Å; E61-F64 PolarHBondContact O-N 3.37Å; E61-T65 HydrophobicContact CG-CG2 4.17Å; E61-T65 VanDerWaalsContact O-CB 3.31Å; E61-T65 WeakPolarHBondContact O-CB 3.24Å; E61-T65 VanDerWaalsContact O-CG2 3.24Å; E61-T65 WeakPolarHBondContact O-CG2 3.37Å; E61-T65 PolarHBondContact O-N 3.06Å; E61-T65 PolarHBondContact O-OG1 3.34Å
62	K	80.1	Confident	74.6	Confident	76 Å²	76	67.3 Å²	67.3	33%	0.33	38%	0.376	S	S	.	.	H	α-helix	trans	-65.7	-41.7	175.6	-171.3	170.2	173.2	-167.8	0	112.3	D58 A59 T65 T66 P155 E161	D58-K62 PolarHBondContact O-N 3.22Å; A59-K62 PolarHBondContact O-N 2.74Å; K62-T65 PolarHBondContact O-OG1 2.93Å; K62-T66 VanDerWaalsContact O-CB 3.24Å; K62-T66 WeakPolarHBondContact O-CB 3.36Å; K62-T66 PolarHBondContact O-N 2.86Å; K62-T66 VanDerWaalsContact O-N 3.14Å; K62-T66 PolarHBondContact O-OG1 3.37Å; K62-P155 HydrophobicContact CB-CB 4.12Å; K62-P155 HydrophobicContact CB-CG 4.48Å; K62-P155 HydrophobicContact CD-CB 3.83Å; K62-P155 HydrophobicContact CD-CG 4.27Å; K62-P155 HydrophobicContact CG-CB 3.95Å; K62-P155 PolarHBondContact NZ-O 3.23Å; K62-E161 IonicContact NZ-OE1 3.98Å; K62-E161 IonicContact NZ-OE2 2.6Å
63	I	82.6	Confident	75.9	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.01	37%	0.374	C	S	.	.	H	α-helix	trans	-60.5	-50.6	173.8	-67.2	163.3	0	0	0	109.5	L44 L48 L55 A59 E60 T66 G67 Y83 F153 P155	L44-I63 HydrophobicContact CD2-CB 4.32Å; L44-I63 HydrophobicContact CD2-CG2 4.01Å; L48-I63 HydrophobicContact CD1-CD1 4.31Å; L55-I63 HydrophobicContact CD1-CD1 4.45Å; A59-I63 VanDerWaalsContact O-CG1 3.28Å; A59-I63 WeakPolarHBondContact O-CG1 3.28Å; A59-I63 PolarHBondContact O-N 3.34Å; E60-I63 PolarHBondContact O-N 2.88Å; I63-T66 PolarHBondContact O-N 3.39Å; I63-G67 PolarHBondContact O-N 3.48Å; I63-Y83 HydrophobicContact CB-CE1 4.47Å; I63-Y83 HydrophobicContact CG1-CE1 4.43Å; I63-Y83 WeakPolarHBondContact CG1-OH 3.38Å; I63-Y83 HydrophobicContact CG2-CD1 4.26Å; I63-Y83 HydrophobicContact CG2-CE1 3.71Å; I63-F153 WeakPolarHBondContact CD1-O 3.49Å; I63-P155 HydrophobicContact CG1-CB 4.17Å
64	F	84.3	Confident	77.3	Confident	17 Å²	17	68.5 Å²	68.5	8%	0.075	38%	0.378	C	S	.	.	H	α-helix	trans	-61.6	-53.7	-176.5	-165.3	-86.5	0	0	0	112	V39 I41 L44 E60 E61 T66 G67 D68 G73 L75	V39-F64 WeakPolarHBondContact O-CE2 3.31Å; I41-F64 HydrophobicContact CB-CD2 4.1Å; I41-F64 HydrophobicContact CB-CE2 4.14Å; I41-F64 HydrophobicContact CB-CG 4.4Å; I41-F64 HydrophobicContact CB-CZ 4.46Å; I41-F64 HydrophobicContact CD1-CB 3.69Å; I41-F64 HydrophobicContact CD1-CD2 3.96Å; I41-F64 HydrophobicContact CD1-CG 3.82Å; I41-F64 VanDerWaalsContact N-CE2 3.32Å; L44-F64 HydrophobicContact CD2-CB 4.1Å; L44-F64 HydrophobicContact CD2-CD2 4.06Å; E60-F64 WeakPolarHBondContact O-CB 3.45Å; E60-F64 PolarHBondContact O-N 3.32Å; E61-F64 PolarHBondContact O-N 3.37Å; F64-T66 PolarHBondContact O-N 3.47Å; F64-G67 PolarHBondContact O-N 2.89Å; F64-G67 VanDerWaalsContact O-N 3.15Å; F64-D68 HydrophobicContact CE1-CB 4.49Å; F64-D68 WeakPolarHBondContact O-CB 3.5Å; F64-D68 PolarHBondContact O-N 3.46Å; F64-G73 VanDerWaalsContact CZ-C 3.48Å; F64-G73 VanDerWaalsContact CZ-O 3.29Å; F64-G73 WeakPolarHBondContact CZ-O 3.06Å; F64-L75 HydrophobicContact CD2-CD1 3.74Å; F64-L75 HydrophobicContact CD2-CG 3.93Å; F64-L75 HydrophobicContact CE2-CD1 4.08Å; F64-L75 HydrophobicContact CE2-CG 3.83Å; F64-L75 HydrophobicContact CG-CD1 4.45Å; F64-L75 HydrophobicContact CZ-CG 4.4Å
65	T	84.2	Confident	79.1	Confident	86 Å²	86	63.8 Å²	63.8	53%	0.528	35%	0.347	S	S	.	.	H	α-helix	trans	-65.2	-25.7	-179.5	53.1	0	0	0	0	113.9	E61 K62	E61-T65 HydrophobicContact CG-CG2 4.17Å; E61-T65 VanDerWaalsContact O-CB 3.31Å; E61-T65 WeakPolarHBondContact O-CB 3.24Å; E61-T65 VanDerWaalsContact O-CG2 3.24Å; E61-T65 WeakPolarHBondContact O-CG2 3.37Å; E61-T65 PolarHBondContact O-N 3.06Å; E61-T65 PolarHBondContact O-OG1 3.34Å; K62-T65 PolarHBondContact O-OG1 2.93Å
66	T	82.4	Confident	80.5	Confident	76 Å²	76	64.6 Å²	64.6	47%	0.466	35%	0.351	S	S	.	.	H	α-helix	trans	-82.7	-32.6	175.4	-55	0	0	0	0	111.7	K62 I63 F64 Y83	K62-T66 VanDerWaalsContact O-CB 3.24Å; K62-T66 WeakPolarHBondContact O-CB 3.36Å; K62-T66 PolarHBondContact O-N 2.86Å; K62-T66 VanDerWaalsContact O-N 3.14Å; K62-T66 PolarHBondContact O-OG1 3.37Å; I63-T66 PolarHBondContact O-N 3.39Å; F64-T66 PolarHBondContact O-N 3.47Å; T66-Y83 HydrophobicContact CG2-CD2 3.93Å; T66-Y83 HydrophobicContact CG2-CE2 3.76Å
67	G	82.6	Confident	82.1	Confident	2 Å²	2	65.1 Å²	65.1	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-77.9	-36.7	178.9	0	0	0	0	0	113.7	I63 F64 V69 E79	I63-G67 PolarHBondContact O-N 3.48Å; F64-G67 PolarHBondContact O-N 2.89Å; F64-G67 VanDerWaalsContact O-N 3.15Å; G67-V69 WeakPolarHBondContact O-CG2 3.21Å; G67-V69 PolarHBondContact O-N 3.25Å; G67-E79 WeakPolarHBondContact O-CB 3.32Å
68	D	87.6	Confident	83.8	Confident	19 Å²	19	64.6 Å²	64.6	10%	0.102	34%	0.337	C	S	.	.			trans	-73.4	88.7	-179.8	179.9	4.1	0	0	0	110	F64 N70 K71 D72 G73 L75	F64-D68 HydrophobicContact CE1-CB 4.49Å; F64-D68 WeakPolarHBondContact O-CB 3.5Å; F64-D68 PolarHBondContact O-N 3.46Å; D68-N70 PolarHBondContact OD1-OD1 2.91Å; D68-K71 WeakPolarHBondContact OD1-CA 3.49Å; D68-K71 PolarHBondContact OD1-N 2.94Å; D68-K71 WeakPolarHBondContact OD2-CA 3.3Å; D68-D72 PolarHBondContact OD1-N 3.36Å; D68-G73 WeakPolarHBondContact OD2-CA 3.27Å; D68-G73 PolarHBondContact OD2-N 3.28Å; D68-L75 HydrophobicContact CB-CD2 4.01Å; D68-L75 VanDerWaalsContact N-CD2 3.26Å
69	V	86.7	Confident	84.8	Confident	90 Å²	90	60.2 Å²	60.2	55%	0.545	31%	0.313	S	S	.	.	S	Bend	trans	-76.6	-38.2	-175.1	176.7	0	0	0	0	110	G67 E79	G67-V69 WeakPolarHBondContact O-CG2 3.21Å; G67-V69 PolarHBondContact O-N 3.25Å; V69-E79 PolarHBondContact N-OE1 3.02Å
70	N	85.6	Confident	85.6	Confident	85 Å²	85	59.9 Å²	59.9	46%	0.455	31%	0.31	S	S	.	.	S	Bend	trans	-84.6	-13.4	-175	76.8	24.2	0	0	0	113.2	D68 D72 E79	D68-N70 PolarHBondContact OD1-OD1 2.91Å; N70-D72 PolarHBondContact ND2-OD2 3.42Å; N70-D72 WeakPolarHBondContact OD1-CB 3.44Å; N70-D72 PolarHBondContact OD1-N 3.43Å; N70-D72 PolarHBondContact OD1-OD1 3.06Å; N70-D72 PolarHBondContact OD1-OD2 3.19Å; N70-E79 PolarHBondContact N-OE1 3.36Å
71	K	86.6	Confident	86.1	Confident	180 Å²	180	60.8 Å²	60.8	78%	0.783	32%	0.315	S	S	*	.			trans	64.4	33.6	-179.8	-56.9	-175	179.4	-176.7	0	114.5	D68 G73	D68-K71 WeakPolarHBondContact OD1-CA 3.49Å; D68-K71 PolarHBondContact OD1-N 2.94Å; D68-K71 WeakPolarHBondContact OD2-CA 3.3Å; K71-G73 VanDerWaalsContact C-N 3.29Å
72	D	85.2	Confident	86.3	Confident	91 Å²	91	60.5 Å²	60.5	49%	0.487	31%	0.312	S	S	.	.	S	Bend	trans	-85.9	-3.6	177.4	72.1	10.8	0	0	0	113.2	D68 N70 K74	D68-D72 PolarHBondContact OD1-N 3.36Å; N70-D72 PolarHBondContact ND2-OD2 3.42Å; N70-D72 WeakPolarHBondContact OD1-CB 3.44Å; N70-D72 PolarHBondContact OD1-N 3.43Å; N70-D72 PolarHBondContact OD1-OD1 3.06Å; N70-D72 PolarHBondContact OD1-OD2 3.19Å; D72-K74 WeakPolarHBondContact OD1-CA 3.48Å; D72-K74 WeakPolarHBondContact OD1-CB 3.47Å; D72-K74 PolarHBondContact OD1-N 2.91Å
73	G	84.8	Confident	86.7	Confident	41 Å²	41	58 Å²	58	42%	0.423	30%	0.301	S	S	.	.	S	Bend	trans	76.8	22.5	179.5	0	0	0	0	0	113.3	F64 D68 K71	F64-G73 VanDerWaalsContact CZ-C 3.48Å; F64-G73 VanDerWaalsContact CZ-O 3.29Å; F64-G73 WeakPolarHBondContact CZ-O 3.06Å; D68-G73 WeakPolarHBondContact OD2-CA 3.27Å; D68-G73 PolarHBondContact OD2-N 3.28Å; K71-G73 VanDerWaalsContact C-N 3.29Å
74	K	89	Confident	86.9	Confident	86 Å²	86	58 Å²	58	37%	0.374	30%	0.3	S	S	.	.	S	Bend	trans	-136.8	161.4	174.6	-66.2	171.6	162.4	-128.1	0	109.2	D36 V38 D72	D36-K74 IonicContact OD2-NZ 2.68Å; V38-K74 HydrophobicContact CB-CB 4.17Å; V38-K74 HydrophobicContact CG1-CB 4.38Å; V38-K74 HydrophobicContact CG2-CB 4.33Å; V38-K74 HydrophobicContact CG2-CD 3.98Å; V38-K74 HydrophobicContact CG2-CG 4.29Å; D72-K74 WeakPolarHBondContact OD1-CA 3.48Å; D72-K74 WeakPolarHBondContact OD1-CB 3.47Å; D72-K74 PolarHBondContact OD1-N 2.91Å
75	L	89.3	Confident	87	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.016	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	108.7	170.5	-67.3	175.3	0	0	0	109.3	V38 V39 F64 D68	V38-L75 CarbonylContact C-O 3.56Å; V38-L75 WeakPolarHBondContact CA-O 3.14Å; V39-L75 HydrophobicContact CB-CB 4.34Å; V39-L75 PolarHBondContact N-O 3.22Å; V39-L75 PolarHBondContact O-N 2.9Å; F64-L75 HydrophobicContact CD2-CD1 3.74Å; F64-L75 HydrophobicContact CD2-CG 3.93Å; F64-L75 HydrophobicContact CE2-CD1 4.08Å; F64-L75 HydrophobicContact CE2-CG 3.83Å; F64-L75 HydrophobicContact CG-CD1 4.45Å; F64-L75 HydrophobicContact CZ-CG 4.4Å; D68-L75 HydrophobicContact CB-CD2 4.01Å; D68-L75 VanDerWaalsContact N-CD2 3.26Å
76	D	90.8	Very high	86.9	Confident	52 Å²	52	60.4 Å²	60.4	28%	0.278	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	169.2	168.5	73	42.7	0	0	0	111.6	V38 E78 E79 F80	V38-D76 HydrophobicContact CG1-CB 4.36Å; D76-E78 VanDerWaalsContact C-N 3.26Å; D76-E78 PolarHBondContact O-N 3.21Å; D76-E78 WeakPolarHBondContact OD1-CA 3.48Å; D76-E78 WeakPolarHBondContact OD1-CB 3.32Å; D76-E78 PolarHBondContact OD1-N 3.32Å; D76-E79 PolarHBondContact N-OE2 3.44Å; D76-E79 PolarHBondContact O-N 3.3Å; D76-E79 PolarHBondContact OD1-N 2.73Å; D76-F80 WeakPolarHBondContact O-CB 3.33Å; D76-F80 PolarHBondContact O-N 3.24Å
77	F	89.6	Confident	87.2	Confident	60 Å²	60	57 Å²	57	26%	0.263	29%	0.285	S	S	.	.	H	α-helix	trans	-60.6	-34.8	-179	176.6	-109	0	0	0	113.1	E25 F28 M81	E25-F77 HydrophobicContact CB-CE2 4.27Å; E25-F77 HydrophobicContact CB-CZ 4.44Å; E25-F77 HydrophobicContact CG-CE1 4.14Å; E25-F77 HydrophobicContact CG-CE2 3.62Å; E25-F77 HydrophobicContact CG-CZ 3.38Å; F28-F77 HydrophobicContact CB-CD2 3.81Å; F28-F77 HydrophobicContact CB-CE2 4.19Å; F28-F77 HydrophobicContact CD1-CB 4.38Å; F28-F77 HydrophobicContact CD1-CD2 4.07Å; F28-F77 HydrophobicContact CD2-CB 4.37Å; F28-F77 HydrophobicContact CD2-CD2 4.02Å; F28-F77 HydrophobicContact CE1-CB 4.18Å; F28-F77 HydrophobicContact CE2-CB 4.15Å; F28-F77 HydrophobicContact CG-CB 4.46Å; F28-F77 AromaticContact CG-CD2 3.69Å; F28-F77 HydrophobicContact CG-CD2 3.69Å; F28-F77 HydrophobicContact CZ-CB 4.05Å; F77-M81 HydrophobicContact CE1-SD 4.3Å; F77-M81 HydrophobicContact CE2-CB 4.49Å; F77-M81 HydrophobicContact CZ-CB 4.35Å; F77-M81 HydrophobicContact CZ-SD 4.28Å; F77-M81 WeakPolarHBondContact O-CB 3.4Å; F77-M81 PolarHBondContact O-N 3.22Å
78	E	88.4	Confident	87.4	Confident	140 Å²	140	58.2 Å²	58.2	65%	0.654	29%	0.291	S	S	*	.	H	α-helix	trans	-70.7	-44.4	-178.7	-171.6	173.9	176.3	0	0	110.9	D76 K82	D76-E78 VanDerWaalsContact C-N 3.26Å; D76-E78 PolarHBondContact O-N 3.21Å; D76-E78 WeakPolarHBondContact OD1-CA 3.48Å; D76-E78 WeakPolarHBondContact OD1-CB 3.32Å; D76-E78 PolarHBondContact OD1-N 3.32Å; E78-K82 WeakPolarHBondContact O-CB 3.34Å; E78-K82 PolarHBondContact O-N 3.38Å
79	E	89.6	Confident	87.2	Confident	15 Å²	15	63.4 Å²	63.4	7%	0.07	31%	0.312	C	S	.	.	H	α-helix	trans	-61.6	-48.4	174.3	-74.3	-176.9	143.2	0	0	111.8	G67 V69 N70 D76 K82 Y83	G67-E79 WeakPolarHBondContact O-CB 3.32Å; V69-E79 PolarHBondContact N-OE1 3.02Å; N70-E79 PolarHBondContact N-OE1 3.36Å; D76-E79 PolarHBondContact N-OE2 3.44Å; D76-E79 PolarHBondContact O-N 3.3Å; D76-E79 PolarHBondContact OD1-N 2.73Å; E79-K82 PolarHBondContact O-N 3.38Å; E79-Y83 WeakPolarHBondContact O-CB 3.32Å; E79-Y83 PolarHBondContact O-N 3.32Å
80	F	88.4	Confident	87.2	Confident	3 Å²	3	63 Å²	63	1%	0.013	30%	0.303	C	S	.	.	H	α-helix	trans	-60.2	-48.9	176.6	178.5	-102.6	0	0	0	112.2	L27 F28 L31 D76 K82 Y83 L84 F153	L27-F80 HydrophobicContact CB-CE1 4.27Å; L27-F80 HydrophobicContact CB-CZ 4.35Å; F28-F80 HydrophobicContact CB-CD1 3.96Å; F28-F80 HydrophobicContact CB-CE1 3.94Å; F28-F80 HydrophobicContact CD2-CB 3.82Å; F28-F80 AromaticContact CD2-CD1 3.63Å; F28-F80 HydrophobicContact CD2-CD1 3.63Å; F28-F80 HydrophobicContact CD2-CE1 4.27Å; F28-F80 AromaticContact CD2-CG 3.74Å; F28-F80 HydrophobicContact CD2-CG 3.74Å; F28-F80 HydrophobicContact CE2-CB 4.06Å; F28-F80 HydrophobicContact CE2-CG 4.41Å; F28-F80 HydrophobicContact CG-CD1 4.28Å; L31-F80 HydrophobicContact CD1-CE2 3.59Å; L31-F80 HydrophobicContact CD1-CZ 3.64Å; D76-F80 WeakPolarHBondContact O-CB 3.33Å; D76-F80 PolarHBondContact O-N 3.24Å; F80-K82 VanDerWaalsContact C-N 3.33Å; F80-K82 PolarHBondContact O-N 2.72Å; F80-Y83 PolarHBondContact O-N 3.09Å; F80-L84 HydrophobicContact CD1-CD1 4.07Å; F80-L84 HydrophobicContact CE1-CD1 3.42Å; F80-L84 VanDerWaalsContact CE1-CD1 3.42Å; F80-L84 HydrophobicContact CE1-CG 4.37Å; F80-L84 HydrophobicContact CE2-CD1 4.1Å; F80-L84 HydrophobicContact CE2-CG 4.44Å; F80-L84 HydrophobicContact CZ-CD1 3.44Å; F80-L84 VanDerWaalsContact CZ-CD1 3.44Å; F80-L84 HydrophobicContact CZ-CG 4.25Å; F80-L84 PolarHBondContact O-N 3.06Å; F80-F153 HydrophobicContact CE2-CE1 4.17Å; F80-F153 HydrophobicContact CZ-CE1 4.12Å; F80-F153 HydrophobicContact CZ-CZ 4.37Å
81	M	88.6	Confident	87.4	Confident	42 Å²	42	59 Å²	59	21%	0.207	28%	0.282	C	S	.	.	H	α-helix	trans	-62.1	-42.7	178.4	177.6	-172	53.3	0	0	111.2	Y24 F77 L84 K85	Y24-M81 HydrophobicContact CD2-CG 4.02Å; Y24-M81 HydrophobicContact CG-CG 4.3Å; F77-M81 HydrophobicContact CE1-SD 4.3Å; F77-M81 HydrophobicContact CE2-CB 4.49Å; F77-M81 HydrophobicContact CZ-CB 4.35Å; F77-M81 HydrophobicContact CZ-SD 4.28Å; F77-M81 WeakPolarHBondContact O-CB 3.4Å; F77-M81 PolarHBondContact O-N 3.22Å; M81-L84 PolarHBondContact O-N 2.8Å; M81-K85 HydrophobicContact CG-CD 3.98Å; M81-K85 HydrophobicContact CG-CG 4.45Å; M81-K85 WeakPolarHBondContact O-CB 3.29Å; M81-K85 WeakPolarHBondContact O-CG 3.4Å; M81-K85 PolarHBondContact O-N 3.38Å; M81-K85 HydrophobicContact SD-CD 4.47Å; M81-K85 PolarHBondContact SD-NZ 3.2Å
82	K	86.3	Confident	87.4	Confident	105 Å²	105	55.3 Å²	55.3	46%	0.457	27%	0.266	S	S	.	.	H	α-helix	trans	-64.3	-45.4	179.5	-176.6	179.5	178	-174.7	0	111.1	E78 E79 F80 L84 K85 D86	E78-K82 WeakPolarHBondContact O-CB 3.34Å; E78-K82 PolarHBondContact O-N 3.38Å; E79-K82 PolarHBondContact O-N 3.38Å; F80-K82 VanDerWaalsContact C-N 3.33Å; F80-K82 PolarHBondContact O-N 2.72Å; K82-L84 PolarHBondContact O-N 2.87Å; K82-K85 PolarHBondContact O-N 3.27Å; K82-D86 WeakPolarHBondContact O-CB 3.47Å; K82-D86 PolarHBondContact O-N 3.36Å
83	Y	88.1	Confident	87.3	Confident	24 Å²	24	56.8 Å²	56.8	9%	0.094	27%	0.273	C	S	.	.	H	α-helix	trans	-54.9	-53.5	174.5	173.6	-93.5	0	0	0	111.1	I63 T66 E79 F80 K85 D86 H87	I63-Y83 HydrophobicContact CB-CE1 4.47Å; I63-Y83 HydrophobicContact CG1-CE1 4.43Å; I63-Y83 WeakPolarHBondContact CG1-OH 3.38Å; I63-Y83 HydrophobicContact CG2-CD1 4.26Å; I63-Y83 HydrophobicContact CG2-CE1 3.71Å; T66-Y83 HydrophobicContact CG2-CD2 3.93Å; T66-Y83 HydrophobicContact CG2-CE2 3.76Å; E79-Y83 WeakPolarHBondContact O-CB 3.32Å; E79-Y83 PolarHBondContact O-N 3.32Å; F80-Y83 PolarHBondContact O-N 3.09Å; Y83-K85 PolarHBondContact O-N 3.01Å; Y83-D86 PolarHBondContact O-N 2.85Å; Y83-H87 HydrophobicContact CE1-CB 4.49Å; Y83-H87 VanDerWaalsContact O-CB 3.27Å; Y83-H87 WeakPolarHBondContact O-CB 3.18Å; Y83-H87 PolarHBondContact O-N 3.11Å
84	L	87.8	Confident	87.3	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-41.4	-179	-71.2	-176.3	0	0	0	112.5	Y24 L27 F80 M81 K82 D86 H87 E88 L152 F153	Y24-L84 HydrophobicContact CD1-CB 4.02Å; Y24-L84 HydrophobicContact CD1-CD1 3.64Å; Y24-L84 HydrophobicContact CE1-CB 3.79Å; Y24-L84 HydrophobicContact CE1-CD1 4.09Å; L27-L84 HydrophobicContact CD1-CD1 4.49Å; F80-L84 HydrophobicContact CD1-CD1 4.07Å; F80-L84 HydrophobicContact CE1-CD1 3.42Å; F80-L84 VanDerWaalsContact CE1-CD1 3.42Å; F80-L84 HydrophobicContact CE1-CG 4.37Å; F80-L84 HydrophobicContact CE2-CD1 4.1Å; F80-L84 HydrophobicContact CE2-CG 4.44Å; F80-L84 HydrophobicContact CZ-CD1 3.44Å; F80-L84 VanDerWaalsContact CZ-CD1 3.44Å; F80-L84 HydrophobicContact CZ-CG 4.25Å; F80-L84 PolarHBondContact O-N 3.06Å; M81-L84 PolarHBondContact O-N 2.8Å; K82-L84 PolarHBondContact O-N 2.87Å; L84-D86 PolarHBondContact O-N 2.96Å; L84-H87 PolarHBondContact O-N 3.33Å; L84-E88 WeakPolarHBondContact O-CB 3.35Å; L84-E88 WeakPolarHBondContact O-CG 3.04Å; L84-E88 PolarHBondContact O-N 2.95Å; L84-L152 HydrophobicContact CD2-CD1 4.02Å; L84-L152 HydrophobicContact CD2-CG 4.22Å; L84-F153 HydrophobicContact CD2-CD1 4.44Å; L84-F153 HydrophobicContact CD2-CE1 4.14Å
85	K	85.6	Confident	87.3	Confident	90 Å²	90	51.4 Å²	51.4	39%	0.391	24%	0.239	S	C	.	.	H	α-helix	trans	-62.3	-43.8	176.5	-79.3	176.7	177.1	171.1	0	112.3	Y24 M81 K82 Y83 K89	Y24-K85 HydrophobicContact CE2-CG 3.94Å; M81-K85 HydrophobicContact CG-CD 3.98Å; M81-K85 HydrophobicContact CG-CG 4.45Å; M81-K85 WeakPolarHBondContact O-CB 3.29Å; M81-K85 WeakPolarHBondContact O-CG 3.4Å; M81-K85 PolarHBondContact O-N 3.38Å; M81-K85 HydrophobicContact SD-CD 4.47Å; M81-K85 PolarHBondContact SD-NZ 3.2Å; K82-K85 PolarHBondContact O-N 3.27Å; Y83-K85 PolarHBondContact O-N 3.01Å; K85-K89 WeakPolarHBondContact O-CG 3.29Å; K85-K89 PolarHBondContact O-N 3.37Å; K85-K89 VanDerWaalsContact O-N 3.12Å
86	D	82.6	Confident	87.2	Confident	64 Å²	64	57.2 Å²	57.2	34%	0.342	26%	0.264	S	S	.	.	H	α-helix	trans	-71.4	-34.4	179.3	-74.4	-17.7	0	0	0	111.6	K82 Y83 L84 K89 K90	K82-D86 WeakPolarHBondContact O-CB 3.47Å; K82-D86 PolarHBondContact O-N 3.36Å; Y83-D86 PolarHBondContact O-N 2.85Å; L84-D86 PolarHBondContact O-N 2.96Å; D86-K89 PolarHBondContact O-N 3.47Å; D86-K89 IonicContact OD1-NZ 3.5Å; D86-K89 PolarHBondContact OD1-NZ 2.89Å; D86-K90 WeakPolarHBondContact O-CG 3.45Å; D86-K90 PolarHBondContact O-N 2.95Å
87	H	87.1	Confident	86.8	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.019	27%	0.265	C	S	.	.	H	α-helix	trans	-64.2	-46.5	171.9	-169.6	61.4	0	0	0	112.4	Y83 L84 K89 K90 M91 F151 L152 N154 V156	Y83-H87 HydrophobicContact CE1-CB 4.49Å; Y83-H87 VanDerWaalsContact O-CB 3.27Å; Y83-H87 WeakPolarHBondContact O-CB 3.18Å; Y83-H87 PolarHBondContact O-N 3.11Å; L84-H87 PolarHBondContact O-N 3.33Å; H87-K89 VanDerWaalsContact C-N 3.29Å; H87-K89 PolarHBondContact O-N 2.93Å; H87-K90 WeakPolarHBondContact O-CB 3.42Å; H87-K90 PolarHBondContact O-N 3.14Å; H87-K90 VanDerWaalsContact O-N 3.07Å; H87-M91 WeakPolarHBondContact O-CG 3.21Å; H87-M91 PolarHBondContact O-N 3.23Å; H87-F151 PolarHBondContact NE2-O 3.26Å; H87-L152 PolarHBondContact CD2-O 3.17Å; H87-L152 VanDerWaalsContact CD2-O 3.26Å; H87-N154 PolarHBondContact CE1-O 2.87Å; H87-N154 PolarHBondContact NE2-O 3.41Å; H87-V156 PolarHBondContact CE1-O 3.28Å
88	E	87.8	Confident	86.6	Confident	29 Å²	29	54 Å²	54	14%	0.136	25%	0.253	C	S	.	.	H	α-helix	trans	-58.9	-38.9	174.8	-77.6	-170.7	-156.8	0	0	112.1	R23 Y24 L84 K90 M91 K92 W144 R148 L152	R23-E88 IonicContact NH1-OE1 3.99Å; Y24-E88 WeakPolarHBondContact CE1-OE1 3.28Å; Y24-E88 PolarHBondContact OH-OE1 3.4Å; Y24-E88 PolarHBondContact OH-OE2 3.46Å; L84-E88 WeakPolarHBondContact O-CB 3.35Å; L84-E88 WeakPolarHBondContact O-CG 3.04Å; L84-E88 PolarHBondContact O-N 2.95Å; E88-K90 VanDerWaalsContact C-N 3.34Å; E88-K90 PolarHBondContact O-N 2.97Å; E88-M91 PolarHBondContact O-N 3.47Å; E88-K92 WeakPolarHBondContact O-CB 3.36Å; E88-K92 PolarHBondContact O-N 3.16Å; E88-W144 WeakPolarHBondContact O-CH2 3.5Å; E88-R148 HydrophobicContact CG-CG 4.01Å; E88-L152 HydrophobicContact CG-CD1 4.18Å
89	K	83.9	Confident	86.6	Confident	127 Å²	127	47.8 Å²	47.8	55%	0.552	22%	0.224	S	C	*	.	H	α-helix	trans	-60.5	-43.9	174.3	-71.2	170.6	-162.5	158.3	0	111.6	K85 D86 H87 K92 L93	K85-K89 WeakPolarHBondContact O-CG 3.29Å; K85-K89 PolarHBondContact O-N 3.37Å; K85-K89 VanDerWaalsContact O-N 3.12Å; D86-K89 PolarHBondContact O-N 3.47Å; D86-K89 IonicContact OD1-NZ 3.5Å; D86-K89 PolarHBondContact OD1-NZ 2.89Å; H87-K89 VanDerWaalsContact C-N 3.29Å; H87-K89 PolarHBondContact O-N 2.93Å; K89-K92 PolarHBondContact O-N 2.91Å; K89-L93 WeakPolarHBondContact O-CG 3.42Å; K89-L93 PolarHBondContact O-N 3.08Å; K89-L93 VanDerWaalsContact O-N 3.1Å
90	K	85.7	Confident	86.4	Confident	82 Å²	82	51.5 Å²	51.5	36%	0.357	24%	0.24	S	C	.	.	H	α-helix	trans	-63	-45.6	176.3	-67.9	171.9	-173.9	172.7	0	111.2	D86 H87 E88 K92 L93 A94	D86-K90 WeakPolarHBondContact O-CG 3.45Å; D86-K90 PolarHBondContact O-N 2.95Å; H87-K90 WeakPolarHBondContact O-CB 3.42Å; H87-K90 PolarHBondContact O-N 3.14Å; H87-K90 VanDerWaalsContact O-N 3.07Å; E88-K90 VanDerWaalsContact C-N 3.34Å; E88-K90 PolarHBondContact O-N 2.97Å; K90-K92 VanDerWaalsContact C-N 3.26Å; K90-K92 PolarHBondContact O-N 2.92Å; K90-L93 WeakPolarHBondContact O-CB 3.09Å; K90-L93 PolarHBondContact O-N 3.43Å; K90-L93 VanDerWaalsContact O-N 3.12Å; K90-A94 PolarHBondContact O-N 3.05Å
91	M	90.3	Very high	86.4	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-62.7	-33.6	176.7	-67.8	-54.8	97.2	0	0	112.2	H87 E88 A94 F95 W144 W147 F151 V156 I162	H87-M91 WeakPolarHBondContact O-CG 3.21Å; H87-M91 PolarHBondContact O-N 3.23Å; E88-M91 PolarHBondContact O-N 3.47Å; M91-A94 PolarHBondContact O-N 3.01Å; M91-F95 WeakPolarHBondContact O-CB 3.39Å; M91-F95 PolarHBondContact O-N 2.96Å; M91-W144 HydrophobicContact CB-CH2 4.24Å; M91-W144 HydrophobicContact CB-CZ3 4.35Å; M91-W147 PolarHBondContact O-NE1 2.68Å; M91-F151 HydrophobicContact CG-CB 3.95Å; M91-F151 HydrophobicContact SD-CB 3.52Å; M91-F151 VanDerWaalsContact SD-CB 3.52Å; M91-F151 HydrophobicContact SD-CD1 4.45Å; M91-F151 HydrophobicContact SD-CD2 4.39Å; M91-F151 HydrophobicContact SD-CG 3.9Å; M91-V156 HydrophobicContact CE-CG2 4.2Å; M91-V156 WeakPolarHBondContact CE-O 3.5Å; M91-V156 HydrophobicContact SD-CG2 4.16Å; M91-I162 HydrophobicContact CE-CD1 4.17Å; M91-I162 HydrophobicContact SD-CD1 4.06Å
92	K	87.4	Confident	86.4	Confident	101 Å²	101	59.3 Å²	59.3	44%	0.439	28%	0.283	S	S	.	.	H	α-helix	trans	-68.3	-35.8	174.7	-165.1	163.5	-173.2	165.5	0	112.7	E88 K89 K90 K96 W144	E88-K92 WeakPolarHBondContact O-CB 3.36Å; E88-K92 PolarHBondContact O-N 3.16Å; K89-K92 PolarHBondContact O-N 2.91Å; K90-K92 VanDerWaalsContact C-N 3.26Å; K90-K92 PolarHBondContact O-N 2.92Å; K92-K96 WeakPolarHBondContact O-CG 3.36Å; K92-K96 PolarHBondContact O-N 3.06Å; K92-K96 VanDerWaalsContact O-N 3.12Å; K92-W144 HydrophobicContact CB-CH2 3.55Å; K92-W144 HydrophobicContact CB-CZ2 4.2Å; K92-W144 HydrophobicContact CB-CZ3 3.73Å; K92-W144 HydrophobicContact CD-CH2 4.47Å; K92-W144 HydrophobicContact CD-CZ2 4.33Å; K92-W144 HydrophobicContact CG-CE3 4.43Å; K92-W144 HydrophobicContact CG-CH2 4.15Å; K92-W144 HydrophobicContact CG-CZ2 4.47Å; K92-W144 HydrophobicContact CG-CZ3 4.12Å
93	L	82.2	Confident	86.6	Confident	123 Å²	123	58 Å²	58	64%	0.644	28%	0.281	S	S	*	.	H	α-helix	trans	-67	-42.5	172.6	-67	173	0	0	0	111.1	K89 K90 K96 S97	K89-L93 WeakPolarHBondContact O-CG 3.42Å; K89-L93 PolarHBondContact O-N 3.08Å; K89-L93 VanDerWaalsContact O-N 3.1Å; K90-L93 WeakPolarHBondContact O-CB 3.09Å; K90-L93 PolarHBondContact O-N 3.43Å; K90-L93 VanDerWaalsContact O-N 3.12Å; L93-K96 PolarHBondContact O-N 3.34Å; L93-S97 PolarHBondContact O-N 3.48Å
94	A	84.8	Confident	86.6	Confident	4 Å²	4	58.5 Å²	58.5	3%	0.033	29%	0.293	C	S	.	.	H	α-helix	trans	-63	-45.2	175.3	0	0	0	0	0	112.1	K90 M91 K96 S97 L98 W147 I162	K90-A94 PolarHBondContact O-N 3.05Å; M91-A94 PolarHBondContact O-N 3.01Å; A94-K96 PolarHBondContact O-N 3.34Å; A94-S97 WeakPolarHBondContact O-CB 3.49Å; A94-S97 PolarHBondContact O-N 2.74Å; A94-S97 PolarHBondContact O-OG 3.31Å; A94-L98 PolarHBondContact O-N 3.13Å; A94-W147 HydrophobicContact CB-CZ2 4.02Å; A94-I162 HydrophobicContact CB-CD1 3.54Å
95	F	88.3	Confident	86.9	Confident	10 Å²	10	63.1 Å²	63.1	4%	0.044	31%	0.313	C	S	.	.	H	α-helix	trans	-54.2	-52.1	174.9	-176.9	-86.5	0	0	0	111.4	M91 S97 L98 D99 G104 I106 W144 W147	M91-F95 WeakPolarHBondContact O-CB 3.39Å; M91-F95 PolarHBondContact O-N 2.96Å; F95-S97 PolarHBondContact O-N 2.98Å; F95-L98 WeakPolarHBondContact O-CB 3.38Å; F95-L98 PolarHBondContact O-N 2.99Å; F95-D99 HydrophobicContact CD1-CB 4.46Å; F95-D99 HydrophobicContact CE1-CB 4.16Å; F95-D99 PolarHBondContact O-N 3.11Å; F95-G104 WeakPolarHBondContact CZ-O 3.39Å; F95-I106 HydrophobicContact CD2-CD1 3.39Å; F95-I106 HydrophobicContact CD2-CG1 4.05Å; F95-I106 HydrophobicContact CE2-CD1 3.48Å; F95-I106 VanDerWaalsContact CE2-CD1 3.48Å; F95-I106 HydrophobicContact CE2-CG1 3.67Å; F95-I106 HydrophobicContact CG-CD1 4.12Å; F95-I106 HydrophobicContact CZ-CD1 4.26Å; F95-I106 HydrophobicContact CZ-CG1 3.99Å; F95-W144 HydrophobicContact CB-CE3 4.08Å; F95-W144 HydrophobicContact CB-CZ3 4.17Å; F95-W144 HydrophobicContact CD2-CE3 4.25Å; F95-W144 HydrophobicContact CG-CE3 4.04Å; F95-W147 HydrophobicContact CB-CD2 4.47Å; F95-W147 HydrophobicContact CB-CG 4.33Å; F95-W147 HydrophobicContact CD2-CB 3.69Å; F95-W147 AromaticContact CD2-CD1 3.98Å; F95-W147 AromaticContact CD2-CD2 3.91Å; F95-W147 HydrophobicContact CD2-CD2 3.91Å; F95-W147 HydrophobicContact CD2-CE3 4.39Å; F95-W147 AromaticContact CD2-CG 3.58Å; F95-W147 HydrophobicContact CD2-CG 3.58Å; F95-W147 HydrophobicContact CE2-CB 4.1Å; F95-W147 HydrophobicContact CE2-CG 4.43Å; F95-W147 HydrophobicContact CG-CG 4.42Å
96	K	86.9	Confident	87.2	Confident	125 Å²	125	58.9 Å²	58.9	54%	0.543	29%	0.294	S	S	.	.	H	α-helix	trans	-63.3	-24	177.2	-74	-177	173.4	-164.6	0	114.2	K92 L93 A94 L98	K92-K96 WeakPolarHBondContact O-CG 3.36Å; K92-K96 PolarHBondContact O-N 3.06Å; K92-K96 VanDerWaalsContact O-N 3.12Å; L93-K96 PolarHBondContact O-N 3.34Å; A94-K96 PolarHBondContact O-N 3.34Å; K96-L98 VanDerWaalsContact C-N 3.29Å
97	S	83.8	Confident	87.7	Confident	43 Å²	43	59.4 Å²	59.4	30%	0.301	30%	0.295	S	S	.	.	H	α-helix	trans	-74.8	-25.3	176.8	78.1	0	0	0	0	112.2	L93 A94 F95 K100	L93-S97 PolarHBondContact O-N 3.48Å; A94-S97 WeakPolarHBondContact O-CB 3.49Å; A94-S97 PolarHBondContact O-N 2.74Å; A94-S97 PolarHBondContact O-OG 3.31Å; F95-S97 PolarHBondContact O-N 2.98Å; S97-K100 PolarHBondContact O-NZ 3.5Å
98	L	84.9	Confident	87.9	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-87.8	-47	177.5	-71.9	175	0	0	0	112.1	A94 F95 K96 K100 I106 S114 W147 I159 W166	A94-L98 PolarHBondContact O-N 3.13Å; F95-L98 WeakPolarHBondContact O-CB 3.38Å; F95-L98 PolarHBondContact O-N 2.99Å; K96-L98 VanDerWaalsContact C-N 3.29Å; L98-K100 PolarHBondContact O-N 3.1Å; L98-I106 HydrophobicContact CB-CD1 3.91Å; L98-I106 HydrophobicContact CB-CG1 4.2Å; L98-I106 HydrophobicContact CB-CG2 4.42Å; L98-I106 HydrophobicContact CD1-CD1 3.91Å; L98-S114 VanDerWaalsContact CD2-CB 3.41Å; L98-S114 PolarHBondContact O-OG 3.38Å; L98-W147 HydrophobicContact CD1-CH2 3.31Å; L98-W147 HydrophobicContact CD1-CZ2 4.21Å; L98-W147 HydrophobicContact CD1-CZ3 3.58Å; L98-I159 HydrophobicContact CD1-CD1 3.7Å; L98-I159 HydrophobicContact CD2-CD1 3.77Å; L98-I159 HydrophobicContact CD2-CG1 4.42Å; L98-I159 HydrophobicContact CG-CD1 3.67Å; L98-W166 HydrophobicContact CD1-CH2 3.91Å
99	D	89.1	Confident	88	Confident	9 Å²	9	60.3 Å²	60.3	5%	0.048	31%	0.306	C	S	.	.			trans	-65.5	93.7	176	176.2	4.2	0	0	0	110.1	F95 N101 N102 D103 G104	F95-D99 HydrophobicContact CD1-CB 4.46Å; F95-D99 HydrophobicContact CE1-CB 4.16Å; F95-D99 PolarHBondContact O-N 3.11Å; D99-N101 PolarHBondContact OD1-OD1 3.26Å; D99-N101 VanDerWaalsContact OD1-OD1 3.07Å; D99-N102 WeakPolarHBondContact OD1-CA 3.29Å; D99-N102 PolarHBondContact OD1-N 3.14Å; D99-D103 PolarHBondContact OD1-N 3.29Å; D99-G104 WeakPolarHBondContact OD2-CA 3.47Å; D99-G104 PolarHBondContact OD2-N 3.07Å
100	K	85.1	Confident	88.3	Confident	93 Å²	93	54.5 Å²	54.5	40%	0.404	28%	0.281	S	S	.	.	S	Bend	trans	-82.4	-36.5	-174.4	-69.4	-53.3	-173.3	-156.1	0	111.2	S97 L98 N102 E110 S114	S97-K100 PolarHBondContact O-NZ 3.5Å; L98-K100 PolarHBondContact O-N 3.1Å; K100-N102 VanDerWaalsContact C-N 3.29Å; K100-N102 PolarHBondContact O-ND2 3.13Å; K100-E110 PolarHBondContact N-OE1 3.12Å; K100-S114 VanDerWaalsContact CE-OG 3.28Å; K100-S114 WeakPolarHBondContact CE-OG 3.37Å
101	N	87.3	Confident	88.4	Confident	86 Å²	86	50.7 Å²	50.7	46%	0.46	26%	0.264	S	S	.	.	S	Bend	trans	-83.6	-8.8	-177.6	72.5	11.4	0	0	0	112.2	D99 D103 E110	D99-N101 PolarHBondContact OD1-OD1 3.26Å; D99-N101 VanDerWaalsContact OD1-OD1 3.07Å; N101-D103 VanDerWaalsContact C-N 3.29Å; N101-D103 PolarHBondContact ND2-OD2 2.97Å; N101-D103 VanDerWaalsContact OD1-CB 3.25Å; N101-D103 WeakPolarHBondContact OD1-CB 3.04Å; N101-D103 PolarHBondContact OD1-N 3.42Å; N101-D103 PolarHBondContact OD1-OD1 3.29Å; N101-D103 PolarHBondContact OD1-OD2 2.83Å; N101-E110 PolarHBondContact N-OE1 2.92Å; N101-E110 VanDerWaalsContact N-OE1 3.13Å; N101-E110 PolarHBondContact OD1-OE1 2.8Å
102	N	88.6	Confident	88.1	Confident	123 Å²	123	52.1 Å²	52.1	66%	0.658	27%	0.273	S	S	*	.			trans	59	34	-177.6	-61.7	-89.4	0	0	0	113.3	D99 K100 G104	D99-N102 WeakPolarHBondContact OD1-CA 3.29Å; D99-N102 PolarHBondContact OD1-N 3.14Å; K100-N102 VanDerWaalsContact C-N 3.29Å; K100-N102 PolarHBondContact O-ND2 3.13Å; N102-G104 VanDerWaalsContact C-N 3.29Å
103	D	90.8	Very high	87.8	Confident	79 Å²	79	51.7 Å²	51.7	42%	0.422	27%	0.273	S	S	.	.	S	Bend	trans	-85.7	-4.5	177.4	75	12.3	0	0	0	113.2	D99 N101 K105	D99-D103 PolarHBondContact OD1-N 3.29Å; N101-D103 VanDerWaalsContact C-N 3.29Å; N101-D103 PolarHBondContact ND2-OD2 2.97Å; N101-D103 VanDerWaalsContact OD1-CB 3.25Å; N101-D103 WeakPolarHBondContact OD1-CB 3.04Å; N101-D103 PolarHBondContact OD1-N 3.42Å; N101-D103 PolarHBondContact OD1-OD1 3.29Å; N101-D103 PolarHBondContact OD1-OD2 2.83Å; D103-K105 VanDerWaalsContact C-N 3.34Å; D103-K105 WeakPolarHBondContact OD1-CA 3.24Å; D103-K105 WeakPolarHBondContact OD1-CB 3.42Å; D103-K105 PolarHBondContact OD1-N 3.25Å
104	G	89.4	Confident	87.7	Confident	33 Å²	33	46.1 Å²	46.1	34%	0.34	24%	0.244	S	C	.	.	S	Bend	trans	81.3	13.1	178.8	0	0	0	0	0	113.9	F95 D99 N102	F95-G104 WeakPolarHBondContact CZ-O 3.39Å; D99-G104 WeakPolarHBondContact OD2-CA 3.47Å; D99-G104 PolarHBondContact OD2-N 3.07Å; N102-G104 VanDerWaalsContact C-N 3.29Å
105	K	93.4	Very high	87.3	Confident	97 Å²	97	45.9 Å²	45.9	42%	0.422	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	155.7	173.2	-59.4	-175.3	175.6	-164.6	0	109.3	D103 E110 V142	D103-K105 VanDerWaalsContact C-N 3.34Å; D103-K105 WeakPolarHBondContact OD1-CA 3.24Å; D103-K105 WeakPolarHBondContact OD1-CB 3.42Å; D103-K105 PolarHBondContact OD1-N 3.25Å; K105-E110 VanDerWaalsContact O-OE2 3.13Å; K105-V142 CarbonylContact C-O 3.53Å; K105-V142 WeakPolarHBondContact CA-O 3.21Å
106	I	92.5	Very high	86.4	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121.7	172.4	-61.9	170.7	0	0	0	108.2	F95 L98 E110 I111 L131 T141 V142 W147	F95-I106 HydrophobicContact CD2-CD1 3.39Å; F95-I106 HydrophobicContact CD2-CG1 4.05Å; F95-I106 HydrophobicContact CE2-CD1 3.48Å; F95-I106 VanDerWaalsContact CE2-CD1 3.48Å; F95-I106 HydrophobicContact CE2-CG1 3.67Å; F95-I106 HydrophobicContact CG-CD1 4.12Å; F95-I106 HydrophobicContact CZ-CD1 4.26Å; F95-I106 HydrophobicContact CZ-CG1 3.99Å; L98-I106 HydrophobicContact CB-CD1 3.91Å; L98-I106 HydrophobicContact CB-CG1 4.2Å; L98-I106 HydrophobicContact CB-CG2 4.42Å; L98-I106 HydrophobicContact CD1-CD1 3.91Å; I106-E110 WeakPolarHBondContact CA-OE2 3.36Å; I106-I111 HydrophobicContact CG2-CD1 3.92Å; I106-I111 HydrophobicContact CG2-CG1 3.55Å; I106-L131 HydrophobicContact CG2-CD2 4.2Å; I106-L131 WeakPolarHBondContact O-CD2 3.41Å; I106-T141 WeakPolarHBondContact O-CA 3.29Å; I106-V142 HydrophobicContact CB-CB 4.31Å; I106-V142 PolarHBondContact N-O 2.88Å; I106-V142 PolarHBondContact O-N 2.89Å; I106-W147 HydrophobicContact CD1-CD2 4.29Å; I106-W147 HydrophobicContact CD1-CE3 3.66Å; I106-W147 HydrophobicContact CD1-CZ3 3.83Å
107	E	93.6	Very high	85.3	Confident	75 Å²	75	50.5 Å²	50.5	35%	0.35	27%	0.273	S	S	.	.			trans	-103.5	165.1	175.3	-61.4	-173.7	168.7	0	0	112.8	S109 E110 I111 T141	E107-S109 PolarHBondContact O-N 3.1Å; E107-E110 HydrophobicContact CB-CG 4.35Å; E107-E110 PolarHBondContact N-OE2 2.91Å; E107-E110 PolarHBondContact O-N 3.26Å; E107-E110 VanDerWaalsContact O-N 3.11Å; E107-I111 PolarHBondContact O-N 3.25Å; E107-I111 VanDerWaalsContact O-N 3.11Å; E107-T141 HydrophobicContact CG-CG2 4.22Å
108	A	90.1	Very high	84.2	Confident	13 Å²	13	50.9 Å²	50.9	11%	0.107	27%	0.272	C	S	.	.	H	α-helix	trans	-61	-40.1	-178.8	0	0	0	0	0	110.5	E110 I111 V112 E124 A127 E128 L131	A108-E110 VanDerWaalsContact C-N 3.28Å; A108-E110 PolarHBondContact O-N 3.39Å; A108-I111 PolarHBondContact O-N 2.91Å; A108-V112 WeakPolarHBondContact O-CG2 3.3Å; A108-V112 PolarHBondContact O-N 3.46Å; A108-E124 HydrophobicContact CB-CG 4.46Å; A108-A127 HydrophobicContact CB-CB 3.99Å; A108-A127 WeakPolarHBondContact O-CB 3.44Å; A108-E128 HydrophobicContact CB-CG 4Å; A108-L131 HydrophobicContact CB-CD1 3.85Å; A108-L131 VanDerWaalsContact N-CD1 3.32Å
109	S	89.4	Confident	82.6	Confident	40 Å²	40	52.1 Å²	52.1	28%	0.28	28%	0.284	S	S	.	.	H	α-helix	trans	-59.7	-37.7	177.8	71	0	0	0	0	112.2	E107 V112 Q113	E107-S109 PolarHBondContact O-N 3.1Å; S109-V112 PolarHBondContact O-N 3.05Å; S109-Q113 WeakPolarHBondContact O-CB 3.17Å; S109-Q113 WeakPolarHBondContact O-CG 3.31Å; S109-Q113 PolarHBondContact O-N 3.39Å
110	E	91.6	Very high	81.3	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.019	29%	0.291	C	S	.	.	H	α-helix	trans	-76.4	-35.2	-179.4	-63.4	-173.7	117.3	0	0	112.6	K100 N101 K105 I106 E107 A108 S114	K100-E110 PolarHBondContact N-OE1 3.12Å; N101-E110 PolarHBondContact N-OE1 2.92Å; N101-E110 VanDerWaalsContact N-OE1 3.13Å; N101-E110 PolarHBondContact OD1-OE1 2.8Å; K105-E110 VanDerWaalsContact O-OE2 3.13Å; I106-E110 WeakPolarHBondContact CA-OE2 3.36Å; E107-E110 HydrophobicContact CB-CG 4.35Å; E107-E110 PolarHBondContact N-OE2 2.91Å; E107-E110 PolarHBondContact O-N 3.26Å; E107-E110 VanDerWaalsContact O-N 3.11Å; A108-E110 VanDerWaalsContact C-N 3.28Å; A108-E110 PolarHBondContact O-N 3.39Å; E110-S114 WeakPolarHBondContact O-CB 3.45Å; E110-S114 PolarHBondContact O-N 3.42Å; E110-S114 PolarHBondContact O-OG 3.21Å
111	I	88	Confident	80.2	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-50	169.4	-64.6	-179.4	0	0	0	109.1	I106 E107 A108 Q113 S114 L115 I122 A127 I130 L131	I106-I111 HydrophobicContact CG2-CD1 3.92Å; I106-I111 HydrophobicContact CG2-CG1 3.55Å; E107-I111 PolarHBondContact O-N 3.25Å; E107-I111 VanDerWaalsContact O-N 3.11Å; A108-I111 PolarHBondContact O-N 2.91Å; I111-Q113 PolarHBondContact O-N 3.3Å; I111-S114 PolarHBondContact O-N 3.43Å; I111-L115 HydrophobicContact CG2-CD1 3.59Å; I111-L115 WeakPolarHBondContact O-CB 3.38Å; I111-L115 WeakPolarHBondContact O-CD1 3.43Å; I111-L115 PolarHBondContact O-N 2.98Å; I111-I122 HydrophobicContact CG2-CD1 3.84Å; I111-A127 HydrophobicContact CB-CB 4.04Å; I111-A127 HydrophobicContact CG2-CB 3.96Å; I111-I130 HydrophobicContact CD1-CB 4.37Å; I111-I130 HydrophobicContact CD1-CG2 4.04Å; I111-I130 HydrophobicContact CG2-CD1 4.17Å; I111-L131 HydrophobicContact CD1-CD2 3.55Å; I111-L131 HydrophobicContact CD1-CG 3.72Å
112	V	84.1	Confident	79.3	Confident	32 Å²	32	49.9 Å²	49.9	19%	0.194	28%	0.28	C	S	.	.	H	α-helix	trans	-56.4	-50.4	177	174	0	0	0	0	110.9	A108 S109 S114 L115 Q116 I122 A127	A108-V112 WeakPolarHBondContact O-CG2 3.3Å; A108-V112 PolarHBondContact O-N 3.46Å; S109-V112 PolarHBondContact O-N 3.05Å; V112-S114 PolarHBondContact O-N 2.95Å; V112-L115 PolarHBondContact O-N 3.37Å; V112-Q116 WeakPolarHBondContact O-CB 3.31Å; V112-Q116 PolarHBondContact O-N 2.86Å; V112-I122 HydrophobicContact CG2-CD1 4.32Å; V112-I122 HydrophobicContact CG2-CG1 4.22Å; V112-A127 HydrophobicContact CG2-CB 3.69Å
113	Q	81.1	Confident	78.8	Confident	93 Å²	93	45.8 Å²	45.8	44%	0.435	26%	0.261	S	S	.	.	H	α-helix	trans	-63.3	-41.3	-179.3	-74.3	172.5	30.2	0	0	112.6	S109 I111 Q116 T117	S109-Q113 WeakPolarHBondContact O-CB 3.17Å; S109-Q113 WeakPolarHBondContact O-CG 3.31Å; S109-Q113 PolarHBondContact O-N 3.39Å; I111-Q113 PolarHBondContact O-N 3.3Å; Q113-Q116 PolarHBondContact O-N 3.04Å; Q113-T117 WeakPolarHBondContact O-CB 3.2Å; Q113-T117 PolarHBondContact O-N 3.37Å; Q113-T117 PolarHBondContact O-OG1 3.41Å
114	S	80.1	Confident	78.3	Confident	5 Å²	5	47.9 Å²	47.9	4%	0.035	27%	0.268	C	S	.	.	H	α-helix	trans	-68.2	-44.3	-179.7	-65.7	0	0	0	0	111.5	L98 K100 E110 I111 V112 Q116 T117 L118	L98-S114 VanDerWaalsContact CD2-CB 3.41Å; L98-S114 PolarHBondContact O-OG 3.38Å; K100-S114 VanDerWaalsContact CE-OG 3.28Å; K100-S114 WeakPolarHBondContact CE-OG 3.37Å; E110-S114 WeakPolarHBondContact O-CB 3.45Å; E110-S114 PolarHBondContact O-N 3.42Å; E110-S114 PolarHBondContact O-OG 3.21Å; I111-S114 PolarHBondContact O-N 3.43Å; V112-S114 PolarHBondContact O-N 2.95Å; S114-Q116 VanDerWaalsContact C-N 3.34Å; S114-T117 PolarHBondContact O-N 3.35Å; S114-L118 WeakPolarHBondContact O-CG 3.38Å; S114-L118 PolarHBondContact O-N 2.76Å; S114-L118 VanDerWaalsContact O-N 3.09Å
115	L	75.1	Confident	77.7	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.3	-40.1	173.8	-85	84.8	0	0	0	110.8	I111 V112 T117 L118 G119 L120 I122 I163 W166 I174	I111-L115 HydrophobicContact CG2-CD1 3.59Å; I111-L115 WeakPolarHBondContact O-CB 3.38Å; I111-L115 WeakPolarHBondContact O-CD1 3.43Å; I111-L115 PolarHBondContact O-N 2.98Å; V112-L115 PolarHBondContact O-N 3.37Å; L115-T117 VanDerWaalsContact C-N 3.29Å; L115-T117 PolarHBondContact O-N 2.89Å; L115-L118 CarbonylContact O-C 3.59Å; L115-L118 VanDerWaalsContact O-C 3.26Å; L115-L118 WeakPolarHBondContact O-CA 3.35Å; L115-L118 WeakPolarHBondContact O-CB 3.25Å; L115-L118 PolarHBondContact O-N 3.15Å; L115-G119 PolarHBondContact O-N 3.42Å; L115-L120 CarbonylContact C-O 3.55Å; L115-L120 HydrophobicContact CB-CB 4.02Å; L115-L120 HydrophobicContact CD2-CB 4.34Å; L115-L120 HydrophobicContact CG-CB 4.46Å; L115-L120 WeakPolarHBondContact O-CA 3.45Å; L115-L120 WeakPolarHBondContact O-CB 3.41Å; L115-L120 PolarHBondContact O-N 2.92Å; L115-L120 VanDerWaalsContact O-O 3.12Å; L115-I122 HydrophobicContact CB-CG1 4.38Å; L115-I122 HydrophobicContact CD2-CD1 4Å; L115-I122 HydrophobicContact CD2-CG1 4.19Å; L115-I122 HydrophobicContact CD2-CG2 3.9Å; L115-I163 HydrophobicContact CD1-CD1 4.34Å; L115-I163 HydrophobicContact CD1-CG1 4.4Å; L115-I163 HydrophobicContact CG-CD1 4.08Å; L115-I163 HydrophobicContact CG-CG1 4.34Å; L115-W166 HydrophobicContact CD1-CZ3 4.44Å; L115-I174 HydrophobicContact CD2-CD1 4.03Å; L115-I174 HydrophobicContact CD2-CG2 3.93Å
116	Q	70.7	Confident	76.8	Confident	125 Å²	125	46.1 Å²	46.1	58%	0.584	25%	0.252	S	S	*	.	H	α-helix	trans	-62.4	-36	176.1	-172.1	177.4	11.6	0	0	112.3	V112 Q113 S114 L118 G119 L120	V112-Q116 WeakPolarHBondContact O-CB 3.31Å; V112-Q116 PolarHBondContact O-N 2.86Å; Q113-Q116 PolarHBondContact O-N 3.04Å; S114-Q116 VanDerWaalsContact C-N 3.34Å; Q116-L118 VanDerWaalsContact C-N 3.29Å; Q116-L118 PolarHBondContact O-N 2.94Å; Q116-G119 VanDerWaalsContact O-CA 3.25Å; Q116-G119 WeakPolarHBondContact O-CA 3.37Å; Q116-G119 PolarHBondContact O-N 2.85Å; Q116-L120 WeakPolarHBondContact CA-O 3.29Å; Q116-L120 PolarHBondContact N-O 3.45Å; Q116-L120 VanDerWaalsContact N-O 3.14Å
117	T	63.6	Low	76.4	Confident	107 Å²	107	46 Å²	46	66%	0.656	25%	0.252	S	S	*	.	H	α-helix	trans	-66.6	-33.9	173.6	-54.7	0	0	0	0	111.6	Q113 S114 L115 G119	Q113-T117 WeakPolarHBondContact O-CB 3.2Å; Q113-T117 PolarHBondContact O-N 3.37Å; Q113-T117 PolarHBondContact O-OG1 3.41Å; S114-T117 PolarHBondContact O-N 3.35Å; L115-T117 VanDerWaalsContact C-N 3.29Å; L115-T117 PolarHBondContact O-N 2.89Å; T117-G119 PolarHBondContact O-N 3.38Å
118	L	60.3	Low	76	Confident	51 Å²	51	46 Å²	46	27%	0.267	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	5.1	169.7	-61.2	170.5	0	0	0	112.4	S114 L115 Q116 L120 I159 I163 T288	S114-L118 WeakPolarHBondContact O-CG 3.38Å; S114-L118 PolarHBondContact O-N 2.76Å; S114-L118 VanDerWaalsContact O-N 3.09Å; L115-L118 CarbonylContact O-C 3.59Å; L115-L118 VanDerWaalsContact O-C 3.26Å; L115-L118 WeakPolarHBondContact O-CA 3.35Å; L115-L118 WeakPolarHBondContact O-CB 3.25Å; L115-L118 PolarHBondContact O-N 3.15Å; Q116-L118 VanDerWaalsContact C-N 3.29Å; Q116-L118 PolarHBondContact O-N 2.94Å; L118-L120 VanDerWaalsContact C-N 3.31Å; L118-L120 HydrophobicContact CB-CD1 4.44Å; L118-L120 PolarHBondContact O-N 3.28Å; L118-I159 HydrophobicContact CD1-CG1 4.37Å; L118-I159 HydrophobicContact CD1-CG2 4.48Å; L118-I163 HydrophobicContact CD1-CD1 3.27Å; L118-T288 PolarHBondContact O-OG1 3.19Å
119	G	50.8	Low	75.3	Confident	26 Å²	26	48.2 Å²	48.2	27%	0.268	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	26.1	177.4	0	0	0	0	0	114	L115 Q116 T117 T288	L115-G119 PolarHBondContact O-N 3.42Å; Q116-G119 VanDerWaalsContact O-CA 3.25Å; Q116-G119 WeakPolarHBondContact O-CA 3.37Å; Q116-G119 PolarHBondContact O-N 2.85Å; T117-G119 PolarHBondContact O-N 3.38Å; G119-T288 WeakPolarHBondContact CA-OG1 3.31Å; G119-T288 WeakPolarHBondContact O-CB 3.39Å; G119-T288 WeakPolarHBondContact O-CG2 3.33Å; G119-T288 PolarHBondContact O-OG1 3.48Å
120	L	61.3	Low	74.9	Confident	36 Å²	36	46.3 Å²	46.3	19%	0.188	25%	0.248	C	C	.	.			trans	-106.2	121.2	175.6	-65.9	170.4	0	0	0	108.1	L115 Q116 L118 I163 I174	L115-L120 CarbonylContact C-O 3.55Å; L115-L120 HydrophobicContact CB-CB 4.02Å; L115-L120 HydrophobicContact CD2-CB 4.34Å; L115-L120 HydrophobicContact CG-CB 4.46Å; L115-L120 WeakPolarHBondContact O-CA 3.45Å; L115-L120 WeakPolarHBondContact O-CB 3.41Å; L115-L120 PolarHBondContact O-N 2.92Å; L115-L120 VanDerWaalsContact O-O 3.12Å; Q116-L120 WeakPolarHBondContact CA-O 3.29Å; Q116-L120 PolarHBondContact N-O 3.45Å; Q116-L120 VanDerWaalsContact N-O 3.14Å; L118-L120 VanDerWaalsContact C-N 3.31Å; L118-L120 HydrophobicContact CB-CD1 4.44Å; L118-L120 PolarHBondContact O-N 3.28Å; L120-I163 HydrophobicContact CD1-CD1 4.4Å; L120-I163 HydrophobicContact CD1-CG2 3.59Å; L120-I174 HydrophobicContact CB-CG2 3.49Å; L120-I174 VanDerWaalsContact CB-CG2 3.49Å; L120-I174 HydrophobicContact CD1-CG2 3.82Å; L120-I174 HydrophobicContact CD2-CG2 3.73Å; L120-I174 HydrophobicContact CG-CG2 3.83Å
121	T	63.3	Low	74.7	Confident	90 Å²	90	46.2 Å²	46.2	55%	0.552	25%	0.248	S	C	*	.			trans	-96	117.6	178	45.8	0	0	0	0	109.6
122	I	68.6	Low	74.4	Confident	16 Å²	16	50.7 Å²	50.7	8%	0.082	27%	0.269	C	S	.	.			trans	-124	151.7	170.6	60.9	157.2	0	0	0	109.5	I111 V112 L115 Q126 A127 I130 I172 I174	I111-I122 HydrophobicContact CG2-CD1 3.84Å; V112-I122 HydrophobicContact CG2-CD1 4.32Å; V112-I122 HydrophobicContact CG2-CG1 4.22Å; L115-I122 HydrophobicContact CB-CG1 4.38Å; L115-I122 HydrophobicContact CD2-CD1 4Å; L115-I122 HydrophobicContact CD2-CG1 4.19Å; L115-I122 HydrophobicContact CD2-CG2 3.9Å; I122-Q126 VanDerWaalsContact CA-OE1 3.24Å; I122-Q126 HydrophobicContact CB-CB 4.13Å; I122-A127 HydrophobicContact CD1-CB 3.8Å; I122-I130 HydrophobicContact CD1-CD1 4.38Å; I122-I172 HydrophobicContact CG2-CG2 4.46Å; I122-I174 HydrophobicContact CG2-CB 4.43Å; I122-I174 HydrophobicContact CG2-CG1 4.26Å; I122-I174 HydrophobicContact CG2-CG2 3.84Å
123	S	76.9	Confident	74.2	Confident	37 Å²	37	51 Å²	51	26%	0.259	27%	0.273	S	S	.	.			trans	-75.5	159.2	172.1	70.6	0	0	0	0	111.1	Q125 Q126 A127	S123-Q125 VanDerWaalsContact C-N 3.26Å; S123-Q125 PolarHBondContact O-N 3.42Å; S123-Q126 WeakPolarHBondContact O-CB 3.4Å; S123-Q126 PolarHBondContact O-N 2.83Å; S123-Q126 VanDerWaalsContact OG-CG 3.29Å; S123-Q126 WeakPolarHBondContact OG-CG 3.49Å; S123-Q126 PolarHBondContact OG-N 3.38Å; S123-A127 PolarHBondContact O-N 2.95Å
124	E	80.8	Confident	74.3	Confident	122 Å²	122	46.8 Å²	46.8	57%	0.57	25%	0.253	S	S	*	.	H	α-helix	trans	-59.2	-39.2	175	-169.5	165.3	-161	0	0	111.5	A108 Q126 A127 E128	A108-E124 HydrophobicContact CB-CG 4.46Å; E124-Q126 VanDerWaalsContact C-N 3.31Å; E124-Q126 PolarHBondContact O-N 3.47Å; E124-A127 WeakPolarHBondContact O-CB 3.16Å; E124-A127 PolarHBondContact O-N 3.15Å; E124-A127 VanDerWaalsContact O-N 3.1Å; E124-E128 WeakPolarHBondContact O-CG 3.22Å; E124-E128 PolarHBondContact O-N 3.19Å
125	Q	76.6	Confident	74.6	Confident	85 Å²	85	47.1 Å²	47.1	40%	0.397	25%	0.254	S	S	.	.	H	α-helix	trans	-59.5	-39.4	172.9	-65.1	173.8	1.8	0	0	112.5	S123 A127 E128 L129	S123-Q125 VanDerWaalsContact C-N 3.26Å; S123-Q125 PolarHBondContact O-N 3.42Å; Q125-A127 VanDerWaalsContact C-N 3.34Å; Q125-E128 PolarHBondContact O-N 3.06Å; Q125-L129 VanDerWaalsContact O-CD1 3.22Å; Q125-L129 WeakPolarHBondContact O-CD1 3.48Å; Q125-L129 VanDerWaalsContact O-CG 3.3Å; Q125-L129 WeakPolarHBondContact O-CG 3.48Å; Q125-L129 PolarHBondContact O-N 3.44Å; Q125-L129 VanDerWaalsContact O-N 3.09Å
126	Q	74.9	Confident	74.7	Confident	8 Å²	8	50.4 Å²	50.4	4%	0.037	28%	0.282	C	S	.	.	H	α-helix	trans	-66.1	-38.8	175.9	-73.4	173.8	-36.8	0	0	111.4	I122 S123 E124 L129 I130 I172 V381	I122-Q126 VanDerWaalsContact CA-OE1 3.24Å; I122-Q126 HydrophobicContact CB-CB 4.13Å; S123-Q126 WeakPolarHBondContact O-CB 3.4Å; S123-Q126 PolarHBondContact O-N 2.83Å; S123-Q126 VanDerWaalsContact OG-CG 3.29Å; S123-Q126 WeakPolarHBondContact OG-CG 3.49Å; S123-Q126 PolarHBondContact OG-N 3.38Å; E124-Q126 VanDerWaalsContact C-N 3.31Å; E124-Q126 PolarHBondContact O-N 3.47Å; Q126-L129 PolarHBondContact O-N 2.9Å; Q126-I130 WeakPolarHBondContact O-CG1 3.45Å; Q126-I130 PolarHBondContact O-N 3.37Å; Q126-I172 HydrophobicContact CB-CD1 4.45Å; Q126-I172 HydrophobicContact CB-CG2 4.17Å; Q126-I172 HydrophobicContact CG-CG2 4.17Å; Q126-I172 WeakPolarHBondContact O-CD1 3.45Å; Q126-V381 HydrophobicContact CG-CG1 3.64Å
127	A	83.9	Confident	75.3	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.9	-41.4	174.7	0	0	0	0	0	112.1	A108 I111 V112 I122 S123 E124 Q125 L129 I130 L131	A108-A127 HydrophobicContact CB-CB 3.99Å; A108-A127 WeakPolarHBondContact O-CB 3.44Å; I111-A127 HydrophobicContact CB-CB 4.04Å; I111-A127 HydrophobicContact CG2-CB 3.96Å; V112-A127 HydrophobicContact CG2-CB 3.69Å; I122-A127 HydrophobicContact CD1-CB 3.8Å; S123-A127 PolarHBondContact O-N 2.95Å; E124-A127 WeakPolarHBondContact O-CB 3.16Å; E124-A127 PolarHBondContact O-N 3.15Å; E124-A127 VanDerWaalsContact O-N 3.1Å; Q125-A127 VanDerWaalsContact C-N 3.34Å; A127-L129 VanDerWaalsContact C-N 3.27Å; A127-L129 PolarHBondContact O-N 3.44Å; A127-I130 WeakPolarHBondContact O-CB 3.43Å; A127-I130 PolarHBondContact O-N 3.02Å; A127-I130 VanDerWaalsContact O-N 3.16Å; A127-L131 PolarHBondContact O-N 3.24Å
128	E	83.9	Confident	76.2	Confident	73 Å²	73	46 Å²	46	34%	0.341	27%	0.267	S	S	.	.	H	α-helix	trans	-58.6	-38.2	173.7	-74.7	176.9	178.1	0	0	112.2	A108 E124 Q125 L131 Q132 M140	A108-E128 HydrophobicContact CB-CG 4Å; E124-E128 WeakPolarHBondContact O-CG 3.22Å; E124-E128 PolarHBondContact O-N 3.19Å; Q125-E128 PolarHBondContact O-N 3.06Å; E128-L131 WeakPolarHBondContact O-CB 3.47Å; E128-L131 PolarHBondContact O-N 2.87Å; E128-Q132 WeakPolarHBondContact O-CB 3.22Å; E128-Q132 VanDerWaalsContact O-CG 3.24Å; E128-Q132 WeakPolarHBondContact O-CG 3.29Å; E128-Q132 PolarHBondContact O-N 2.92Å; E128-M140 HydrophobicContact CB-CE 3.82Å; E128-M140 HydrophobicContact CG-CE 3.86Å
129	L	76.3	Confident	77.5	Confident	61 Å²	61	46.9 Å²	46.9	32%	0.319	28%	0.275	S	S	.	.	H	α-helix	trans	-69.7	-34.1	177.5	-72.8	154.3	0	0	0	112.5	Q125 Q126 A127 S133 V381	Q125-L129 VanDerWaalsContact O-CD1 3.22Å; Q125-L129 WeakPolarHBondContact O-CD1 3.48Å; Q125-L129 VanDerWaalsContact O-CG 3.3Å; Q125-L129 WeakPolarHBondContact O-CG 3.48Å; Q125-L129 PolarHBondContact O-N 3.44Å; Q125-L129 VanDerWaalsContact O-N 3.09Å; Q126-L129 PolarHBondContact O-N 2.9Å; A127-L129 VanDerWaalsContact C-N 3.27Å; A127-L129 PolarHBondContact O-N 3.44Å; L129-S133 PolarHBondContact O-N 3.47Å; L129-S133 VanDerWaalsContact O-N 3.16Å; L129-V381 HydrophobicContact CB-CG2 3.98Å; L129-V381 HydrophobicContact CD1-CB 3.98Å; L129-V381 HydrophobicContact CD1-CG1 3.6Å; L129-V381 HydrophobicContact CD1-CG2 3.24Å; L129-V381 HydrophobicContact CD2-CG2 4.12Å; L129-V381 HydrophobicContact CG-CG2 3.95Å
130	I	81.8	Confident	79.2	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-48.1	170.5	-65.8	168.9	0	0	0	109.4	I111 I122 Q126 A127 Q132 S133 I134 W166 I172	I111-I130 HydrophobicContact CD1-CB 4.37Å; I111-I130 HydrophobicContact CD1-CG2 4.04Å; I111-I130 HydrophobicContact CG2-CD1 4.17Å; I122-I130 HydrophobicContact CD1-CD1 4.38Å; Q126-I130 WeakPolarHBondContact O-CG1 3.45Å; Q126-I130 PolarHBondContact O-N 3.37Å; A127-I130 WeakPolarHBondContact O-CB 3.43Å; A127-I130 PolarHBondContact O-N 3.02Å; A127-I130 VanDerWaalsContact O-N 3.16Å; I130-Q132 PolarHBondContact O-N 3.27Å; I130-S133 WeakPolarHBondContact O-CB 3.35Å; I130-S133 PolarHBondContact O-N 3Å; I130-S133 VanDerWaalsContact O-N 3.12Å; I130-S133 PolarHBondContact O-OG 3.03Å; I130-I134 HydrophobicContact CG2-CD1 4.22Å; I130-I134 PolarHBondContact O-N 2.96Å; I130-W166 HydrophobicContact CD1-CD2 4.29Å; I130-W166 HydrophobicContact CD1-CE3 3.97Å; I130-W166 HydrophobicContact CG2-CD2 3.67Å; I130-W166 VanDerWaalsContact CG2-CE2 3.45Å; I130-W166 HydrophobicContact CG2-CE3 3.97Å; I130-W166 HydrophobicContact CG2-CG 4.22Å; I130-W166 HydrophobicContact CG2-CH2 3.91Å; I130-W166 HydrophobicContact CG2-CZ2 3.61Å; I130-W166 HydrophobicContact CG2-CZ3 4.09Å; I130-I172 HydrophobicContact CD1-CD1 3.91Å; I130-I172 HydrophobicContact CG1-CD1 3.45Å; I130-I172 VanDerWaalsContact CG1-CD1 3.45Å
131	L	86.3	Confident	80.5	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-57.8	-50.7	176.8	-70.8	175.8	0	0	0	111.5	I106 A108 I111 A127 E128 S133 I134 D135 V142	I106-L131 HydrophobicContact CG2-CD2 4.2Å; I106-L131 WeakPolarHBondContact O-CD2 3.41Å; A108-L131 HydrophobicContact CB-CD1 3.85Å; A108-L131 VanDerWaalsContact N-CD1 3.32Å; I111-L131 HydrophobicContact CD1-CD2 3.55Å; I111-L131 HydrophobicContact CD1-CG 3.72Å; A127-L131 PolarHBondContact O-N 3.24Å; E128-L131 WeakPolarHBondContact O-CB 3.47Å; E128-L131 PolarHBondContact O-N 2.87Å; L131-S133 PolarHBondContact O-N 3.41Å; L131-I134 PolarHBondContact O-N 3.37Å; L131-D135 WeakPolarHBondContact O-CB 3.35Å; L131-D135 PolarHBondContact O-N 2.94Å; L131-V142 HydrophobicContact CD2-CB 4.12Å; L131-V142 HydrophobicContact CD2-CG2 3.58Å
132	Q	83.1	Confident	81.9	Confident	97 Å²	97	44.1 Å²	44.1	45%	0.453	25%	0.25	S	C	.	.	H	α-helix	trans	-58	-24.9	178.4	-74.7	172.5	14	0	0	113.7	E128 I130 I134 M140	E128-Q132 WeakPolarHBondContact O-CB 3.22Å; E128-Q132 VanDerWaalsContact O-CG 3.24Å; E128-Q132 WeakPolarHBondContact O-CG 3.29Å; E128-Q132 PolarHBondContact O-N 2.92Å; I130-Q132 PolarHBondContact O-N 3.27Å; Q132-I134 VanDerWaalsContact C-N 3.31Å; Q132-M140 HydrophobicContact CG-CE 4.02Å; Q132-M140 HydrophobicContact CG-SD 3.53Å; Q132-M140 VanDerWaalsContact CG-SD 3.53Å
133	S	78.8	Confident	83	Confident	39 Å²	39	45.6 Å²	45.6	27%	0.273	26%	0.258	S	S	.	.	H	α-helix	trans	-74.9	-22.8	176.3	80	0	0	0	0	112.9	L129 I130 L131 Y150	L129-S133 PolarHBondContact O-N 3.47Å; L129-S133 VanDerWaalsContact O-N 3.16Å; I130-S133 WeakPolarHBondContact O-CB 3.35Å; I130-S133 PolarHBondContact O-N 3Å; I130-S133 VanDerWaalsContact O-N 3.12Å; I130-S133 PolarHBondContact O-OG 3.03Å; L131-S133 PolarHBondContact O-N 3.41Å; S133-Y150 WeakPolarHBondContact O-CE2 3.25Å
134	I	83.9	Confident	83.7	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.015	26%	0.256	C	S	.	.	H	α-helix	trans	-106.6	-44.1	-175	-56.4	170.2	0	0	0	111.1	I130 L131 Q132 A136 V142 W147 Y150 F151 W166	I130-I134 HydrophobicContact CG2-CD1 4.22Å; I130-I134 PolarHBondContact O-N 2.96Å; L131-I134 PolarHBondContact O-N 3.37Å; Q132-I134 VanDerWaalsContact C-N 3.31Å; I134-A136 PolarHBondContact O-N 3.38Å; I134-V142 HydrophobicContact CB-CG1 4.44Å; I134-V142 HydrophobicContact CB-CG2 3.76Å; I134-V142 HydrophobicContact CG2-CB 4.35Å; I134-V142 HydrophobicContact CG2-CG1 3.56Å; I134-V142 HydrophobicContact CG2-CG2 3.76Å; I134-W147 HydrophobicContact CD1-CE3 4.37Å; I134-W147 HydrophobicContact CD1-CZ3 4.27Å; I134-Y150 HydrophobicContact CB-CD2 4.23Å; I134-Y150 HydrophobicContact CB-CG 4.29Å; I134-Y150 HydrophobicContact CD1-CD1 4.43Å; I134-Y150 HydrophobicContact CD1-CE1 4.45Å; I134-Y150 HydrophobicContact CG1-CD1 3.89Å; I134-Y150 HydrophobicContact CG1-CD2 4.02Å; I134-Y150 HydrophobicContact CG1-CE1 3.88Å; I134-Y150 HydrophobicContact CG1-CE2 4.02Å; I134-Y150 HydrophobicContact CG1-CG 3.95Å; I134-Y150 HydrophobicContact CG2-CD1 4.49Å; I134-Y150 HydrophobicContact CG2-CD2 4.26Å; I134-Y150 HydrophobicContact CG2-CG 3.96Å; I134-F151 HydrophobicContact CD1-CE2 4.37Å; I134-W166 HydrophobicContact CD1-CZ2 3.79Å
135	D	85.1	Confident	84	Confident	12 Å²	12	44.2 Å²	44.2	6%	0.064	25%	0.248	C	C	.	.			trans	-55.2	111.1	179.8	174.5	14.1	0	0	0	110.7	L131 D137 G138 T139 M140 V142	L131-D135 WeakPolarHBondContact O-CB 3.35Å; L131-D135 PolarHBondContact O-N 2.94Å; D135-D137 PolarHBondContact OD1-N 3.01Å; D135-G138 WeakPolarHBondContact OD1-CA 3.39Å; D135-G138 PolarHBondContact OD1-N 2.71Å; D135-G138 VanDerWaalsContact OD2-C 3.23Å; D135-G138 WeakPolarHBondContact OD2-CA 3.26Å; D135-T139 PolarHBondContact OD1-N 3.14Å; D135-T139 PolarHBondContact OD2-N 2.91Å; D135-M140 WeakPolarHBondContact OD2-CA 3.43Å; D135-M140 PolarHBondContact OD2-N 3.23Å; D135-V142 HydrophobicContact CB-CG2 4.32Å
136	A	78.7	Confident	84.5	Confident	70 Å²	70	41 Å²	41	58%	0.579	23%	0.232	S	C	*	.	S	Bend	trans	-94.3	-31.5	-176.3	0	0	0	0	0	111.5	I134 E146	I134-A136 PolarHBondContact O-N 3.38Å; A136-E146 HydrophobicContact CB-CG 4.43Å; A136-E146 PolarHBondContact N-OE1 3.23Å
137	D	82.1	Confident	85.1	Confident	101 Å²	101	40.7 Å²	40.7	54%	0.54	23%	0.231	S	C	.	.	S	Bend	trans	-92.7	-9.4	-176.1	73.7	6	0	0	0	113.9	D135 T139 E146	D135-D137 PolarHBondContact OD1-N 3.01Å; D137-T139 VanDerWaalsContact CG-CG2 3.42Å; D137-T139 WeakPolarHBondContact OD1-CB 3.43Å; D137-T139 WeakPolarHBondContact OD1-CG2 3.36Å; D137-T139 PolarHBondContact OD1-N 3.3Å; D137-T139 PolarHBondContact OD1-OG1 3.49Å; D137-T139 WeakPolarHBondContact OD2-CG2 3.22Å; D137-E146 PolarHBondContact N-OE1 2.87Å
138	G	82.8	Confident	85.3	Confident	39 Å²	39	42.6 Å²	42.6	40%	0.402	24%	0.238	S	C	.	.	S	Bend	trans	80	19.4	177.5	0	0	0	0	0	113.5	D135 M140	D135-G138 WeakPolarHBondContact OD1-CA 3.39Å; D135-G138 PolarHBondContact OD1-N 2.71Å; D135-G138 VanDerWaalsContact OD2-C 3.23Å; D135-G138 WeakPolarHBondContact OD2-CA 3.26Å; G138-M140 PolarHBondContact O-N 3.24Å
139	T	87.6	Confident	85.3	Confident	69 Å²	69	41.9 Å²	41.9	42%	0.423	24%	0.237	S	C	.	.	S	Bend	trans	-74	-8.6	179.3	54.6	0	0	0	0	113.8	D135 D137 T141	D135-T139 PolarHBondContact OD1-N 3.14Å; D135-T139 PolarHBondContact OD2-N 2.91Å; D137-T139 VanDerWaalsContact CG-CG2 3.42Å; D137-T139 WeakPolarHBondContact OD1-CB 3.43Å; D137-T139 WeakPolarHBondContact OD1-CG2 3.36Å; D137-T139 PolarHBondContact OD1-N 3.3Å; D137-T139 PolarHBondContact OD1-OG1 3.49Å; D137-T139 WeakPolarHBondContact OD2-CG2 3.22Å; T139-T141 PolarHBondContact O-N 3.04Å; T139-T141 PolarHBondContact OG1-O 3.24Å; T139-T141 PolarHBondContact OG1-OG1 3.44Å
140	M	86.5	Confident	85.6	Confident	70 Å²	70	41.3 Å²	41.3	35%	0.345	23%	0.231	S	C	.	.	S	Bend	trans	57.2	24.3	-170.2	-69.2	-65.9	-53.9	0	0	112.9	E128 Q132 D135 G138	E128-M140 HydrophobicContact CB-CE 3.82Å; E128-M140 HydrophobicContact CG-CE 3.86Å; Q132-M140 HydrophobicContact CG-CE 4.02Å; Q132-M140 HydrophobicContact CG-SD 3.53Å; Q132-M140 VanDerWaalsContact CG-SD 3.53Å; D135-M140 WeakPolarHBondContact OD2-CA 3.43Å; D135-M140 PolarHBondContact OD2-N 3.23Å; G138-M140 PolarHBondContact O-N 3.24Å
141	T	89.6	Confident	85.8	Confident	22 Å²	22	41.3 Å²	41.3	14%	0.135	23%	0.231	C	C	.	.	S	Bend	trans	-133.5	156.2	169.5	59.8	0	0	0	0	107.8	I106 E107 T139	I106-T141 WeakPolarHBondContact O-CA 3.29Å; E107-T141 HydrophobicContact CG-CG2 4.22Å; T139-T141 PolarHBondContact O-N 3.04Å; T139-T141 PolarHBondContact OG1-O 3.24Å; T139-T141 PolarHBondContact OG1-OG1 3.44Å
142	V	91.4	Very high	85.7	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	118.5	176.3	169.8	0	0	0	0	109.9	K105 I106 L131 I134 D135 E146 W147	K105-V142 CarbonylContact C-O 3.53Å; K105-V142 WeakPolarHBondContact CA-O 3.21Å; I106-V142 HydrophobicContact CB-CB 4.31Å; I106-V142 PolarHBondContact N-O 2.88Å; I106-V142 PolarHBondContact O-N 2.89Å; L131-V142 HydrophobicContact CD2-CB 4.12Å; L131-V142 HydrophobicContact CD2-CG2 3.58Å; I134-V142 HydrophobicContact CB-CG1 4.44Å; I134-V142 HydrophobicContact CB-CG2 3.76Å; I134-V142 HydrophobicContact CG2-CB 4.35Å; I134-V142 HydrophobicContact CG2-CG1 3.56Å; I134-V142 HydrophobicContact CG2-CG2 3.76Å; D135-V142 HydrophobicContact CB-CG2 4.32Å; V142-E146 WeakPolarHBondContact CA-OE2 3.26Å; V142-E146 HydrophobicContact CG1-CB 4.18Å; V142-W147 HydrophobicContact CG1-CB 3.95Å; V142-W147 HydrophobicContact CG1-CE3 4.24Å
143	D	92	Very high	85.5	Confident	48 Å²	48	37.5 Å²	37.5	26%	0.257	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	173.9	174.1	82.9	22.3	0	0	0	112.9	N145 E146 W147	D143-N145 VanDerWaalsContact C-N 3.3Å; D143-N145 PolarHBondContact O-N 2.97Å; D143-N145 WeakPolarHBondContact OD1-CA 3.21Å; D143-N145 WeakPolarHBondContact OD1-CB 3.48Å; D143-N145 PolarHBondContact OD1-N 3.27Å; D143-E146 PolarHBondContact N-OE2 2.8Å; D143-E146 VanDerWaalsContact N-OE2 3.09Å; D143-E146 PolarHBondContact O-N 2.98Å; D143-E146 PolarHBondContact OD1-N 2.6Å; D143-W147 WeakPolarHBondContact O-CB 3.17Å; D143-W147 PolarHBondContact O-N 3.43Å
144	W	90.6	Very high	85.6	Confident	54 Å²	54	36.3 Å²	36.3	21%	0.205	20%	0.204	C	C	.	.	H	α-helix	trans	-59.1	-37.4	179.3	168.1	-111.9	0	0	0	113.6	E88 M91 K92 F95 W147 R148	E88-W144 WeakPolarHBondContact O-CH2 3.5Å; M91-W144 HydrophobicContact CB-CH2 4.24Å; M91-W144 HydrophobicContact CB-CZ3 4.35Å; K92-W144 HydrophobicContact CB-CH2 3.55Å; K92-W144 HydrophobicContact CB-CZ2 4.2Å; K92-W144 HydrophobicContact CB-CZ3 3.73Å; K92-W144 HydrophobicContact CD-CH2 4.47Å; K92-W144 HydrophobicContact CD-CZ2 4.33Å; K92-W144 HydrophobicContact CG-CE3 4.43Å; K92-W144 HydrophobicContact CG-CH2 4.15Å; K92-W144 HydrophobicContact CG-CZ2 4.47Å; K92-W144 HydrophobicContact CG-CZ3 4.12Å; F95-W144 HydrophobicContact CB-CE3 4.08Å; F95-W144 HydrophobicContact CB-CZ3 4.17Å; F95-W144 HydrophobicContact CD2-CE3 4.25Å; F95-W144 HydrophobicContact CG-CE3 4.04Å; W144-W147 AromaticContact CZ3-CD1 3.67Å; W144-R148 HydrophobicContact CD2-CB 4.37Å; W144-R148 HydrophobicContact CH2-CB 4.08Å; W144-R148 HydrophobicContact CH2-CG 4.32Å; W144-R148 HydrophobicContact CZ2-CB 3.91Å; W144-R148 HydrophobicContact CZ2-CG 3.95Å; W144-R148 HydrophobicContact CZ3-CB 4.4Å; W144-R148 WeakPolarHBondContact O-CB 3.34Å; W144-R148 PolarHBondContact O-N 3.48Å
145	N	87.1	Confident	85.5	Confident	76 Å²	76	36.9 Å²	36.9	41%	0.406	21%	0.208	S	C	.	.	H	α-helix	trans	-69.7	-45.1	-178	-62.3	-55.2	0	0	0	110.5	D143 R148 D149	D143-N145 VanDerWaalsContact C-N 3.3Å; D143-N145 PolarHBondContact O-N 2.97Å; D143-N145 WeakPolarHBondContact OD1-CA 3.21Å; D143-N145 WeakPolarHBondContact OD1-CB 3.48Å; D143-N145 PolarHBondContact OD1-N 3.27Å; N145-R148 PolarHBondContact O-N 2.77Å; N145-R148 PolarHBondContact OD1-NH1 3.27Å; N145-D149 VanDerWaalsContact O-CB 3.27Å; N145-D149 WeakPolarHBondContact O-CB 3.24Å; N145-D149 PolarHBondContact O-N 2.73Å
146	E	87.8	Confident	85.3	Confident	16 Å²	16	36.8 Å²	36.8	8%	0.075	21%	0.207	C	C	.	.	H	α-helix	trans	-61.8	-45.9	176.6	-65.2	-179	125.4	0	0	111.5	A136 D137 V142 D143 D149 Y150	A136-E146 HydrophobicContact CB-CG 4.43Å; A136-E146 PolarHBondContact N-OE1 3.23Å; D137-E146 PolarHBondContact N-OE1 2.87Å; V142-E146 WeakPolarHBondContact CA-OE2 3.26Å; V142-E146 HydrophobicContact CG1-CB 4.18Å; D143-E146 PolarHBondContact N-OE2 2.8Å; D143-E146 VanDerWaalsContact N-OE2 3.09Å; D143-E146 PolarHBondContact O-N 2.98Å; D143-E146 PolarHBondContact OD1-N 2.6Å; E146-D149 PolarHBondContact O-N 3.03Å; E146-Y150 VanDerWaalsContact O-CB 3.24Å; E146-Y150 WeakPolarHBondContact O-CB 3.38Å; E146-Y150 PolarHBondContact O-N 3.49Å
147	W	88.3	Confident	85.3	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-58.8	-51.4	175.5	179.2	-89.7	0	0	0	112.4	M91 A94 F95 L98 I106 I134 V142 D143 W144 D149 Y150 F151 I162 W166	M91-W147 PolarHBondContact O-NE1 2.68Å; A94-W147 HydrophobicContact CB-CZ2 4.02Å; F95-W147 HydrophobicContact CB-CD2 4.47Å; F95-W147 HydrophobicContact CB-CG 4.33Å; F95-W147 HydrophobicContact CD2-CB 3.69Å; F95-W147 AromaticContact CD2-CD1 3.98Å; F95-W147 AromaticContact CD2-CD2 3.91Å; F95-W147 HydrophobicContact CD2-CD2 3.91Å; F95-W147 HydrophobicContact CD2-CE3 4.39Å; F95-W147 AromaticContact CD2-CG 3.58Å; F95-W147 HydrophobicContact CD2-CG 3.58Å; F95-W147 HydrophobicContact CE2-CB 4.1Å; F95-W147 HydrophobicContact CE2-CG 4.43Å; F95-W147 HydrophobicContact CG-CG 4.42Å; L98-W147 HydrophobicContact CD1-CH2 3.31Å; L98-W147 HydrophobicContact CD1-CZ2 4.21Å; L98-W147 HydrophobicContact CD1-CZ3 3.58Å; I106-W147 HydrophobicContact CD1-CD2 4.29Å; I106-W147 HydrophobicContact CD1-CE3 3.66Å; I106-W147 HydrophobicContact CD1-CZ3 3.83Å; I134-W147 HydrophobicContact CD1-CE3 4.37Å; I134-W147 HydrophobicContact CD1-CZ3 4.27Å; V142-W147 HydrophobicContact CG1-CB 3.95Å; V142-W147 HydrophobicContact CG1-CE3 4.24Å; D143-W147 WeakPolarHBondContact O-CB 3.17Å; D143-W147 PolarHBondContact O-N 3.43Å; W144-W147 AromaticContact CZ3-CD1 3.67Å; W147-D149 VanDerWaalsContact C-N 3.3Å; W147-D149 PolarHBondContact O-N 3.25Å; W147-Y150 PolarHBondContact O-N 2.87Å; W147-F151 AromaticContact CD2-CD2 3.85Å; W147-F151 HydrophobicContact CD2-CD2 3.85Å; W147-F151 AromaticContact CD2-CE2 3.82Å; W147-F151 HydrophobicContact CD2-CE2 3.82Å; W147-F151 AromaticContact CE2-CD2 3.7Å; W147-F151 AromaticContact CE2-CE2 3.77Å; W147-F151 HydrophobicContact CE3-CD2 4.25Å; W147-F151 AromaticContact CE3-CE2 3.76Å; W147-F151 HydrophobicContact CE3-CE2 3.76Å; W147-F151 HydrophobicContact CG-CD2 4.27Å; W147-F151 HydrophobicContact CH2-CD2 4.35Å; W147-F151 AromaticContact CH2-CE2 3.61Å; W147-F151 HydrophobicContact CH2-CE2 3.61Å; W147-F151 HydrophobicContact CH2-CZ 4.25Å; W147-F151 AromaticContact CZ2-CD2 3.99Å; W147-F151 HydrophobicContact CZ2-CD2 3.99Å; W147-F151 AromaticContact CZ2-CE2 3.7Å; W147-F151 HydrophobicContact CZ2-CE2 3.7Å; W147-F151 HydrophobicContact CZ3-CD2 4.49Å; W147-F151 AromaticContact CZ3-CE2 3.66Å; W147-F151 HydrophobicContact CZ3-CE2 3.66Å; W147-F151 HydrophobicContact CZ3-CZ 4.47Å; W147-F151 WeakPolarHBondContact O-CD2 3.35Å; W147-F151 PolarHBondContact O-N 2.99Å; W147-F151 VanDerWaalsContact O-N 3.09Å; W147-I162 HydrophobicContact CH2-CD1 4.11Å; W147-I162 HydrophobicContact CH2-CG2 4.06Å; W147-I162 HydrophobicContact CZ2-CD1 3.6Å; W147-W166 AromaticContact CH2-CH2 3.94Å; W147-W166 HydrophobicContact CH2-CH2 3.94Å; W147-W166 AromaticContact CH2-CZ2 3.89Å; W147-W166 HydrophobicContact CH2-CZ2 3.89Å; W147-W166 AromaticContact CZ3-CH2 3.92Å; W147-W166 HydrophobicContact CZ3-CH2 3.92Å; W147-W166 AromaticContact CZ3-CZ2 3.72Å; W147-W166 HydrophobicContact CZ3-CZ2 3.72Å
148	R	88.1	Confident	85	Confident	41 Å²	41	33.4 Å²	33.4	16%	0.155	18%	0.181	C	C	.	.	H	α-helix	trans	-58.5	-44.6	179.4	178.4	-162.1	64.9	-161.5	-4.7	110.7	R23 E88 W144 N145 L152	R23-R148 VanDerWaalsContact NH1-CD 3.33Å; E88-R148 HydrophobicContact CG-CG 4.01Å; W144-R148 HydrophobicContact CD2-CB 4.37Å; W144-R148 HydrophobicContact CH2-CB 4.08Å; W144-R148 HydrophobicContact CH2-CG 4.32Å; W144-R148 HydrophobicContact CZ2-CB 3.91Å; W144-R148 HydrophobicContact CZ2-CG 3.95Å; W144-R148 HydrophobicContact CZ3-CB 4.4Å; W144-R148 WeakPolarHBondContact O-CB 3.34Å; W144-R148 PolarHBondContact O-N 3.48Å; N145-R148 PolarHBondContact O-N 2.77Å; N145-R148 PolarHBondContact OD1-NH1 3.27Å; R148-L152 WeakPolarHBondContact O-CA 3.26Å; R148-L152 WeakPolarHBondContact O-CB 3.4Å; R148-L152 PolarHBondContact O-N 3.45Å
149	D	83.3	Confident	84.7	Confident	58 Å²	58	32.7 Å²	32.7	31%	0.31	17%	0.168	S	C	.	.	H	α-helix	trans	-74.8	-30.7	-174.9	-65.5	1.6	0	0	0	111.7	R23 N145 E146 W147	R23-D149 IonicContact CZ-OD1 3.81Å; R23-D149 IonicContact NH1-OD1 3.56Å; R23-D149 IonicContact NH2-OD1 3.78Å; R23-D149 PolarHBondContact NH2-OD1 3.43Å; R23-D149 IonicContact NH2-OD2 2.79Å; N145-D149 VanDerWaalsContact O-CB 3.27Å; N145-D149 WeakPolarHBondContact O-CB 3.24Å; N145-D149 PolarHBondContact O-N 2.73Å; E146-D149 PolarHBondContact O-N 3.03Å; W147-D149 VanDerWaalsContact C-N 3.3Å; W147-D149 PolarHBondContact O-N 3.25Å
150	Y	82.9	Confident	84	Confident	49 Å²	49	31.4 Å²	31.4	19%	0.192	16%	0.157	C	C	.	.	H	α-helix	trans	-68.4	-41.6	173.7	-173.8	-92.7	0	0	0	112.8	S133 I134 E146 W147 F165	S133-Y150 WeakPolarHBondContact O-CE2 3.25Å; I134-Y150 HydrophobicContact CB-CD2 4.23Å; I134-Y150 HydrophobicContact CB-CG 4.29Å; I134-Y150 HydrophobicContact CD1-CD1 4.43Å; I134-Y150 HydrophobicContact CD1-CE1 4.45Å; I134-Y150 HydrophobicContact CG1-CD1 3.89Å; I134-Y150 HydrophobicContact CG1-CD2 4.02Å; I134-Y150 HydrophobicContact CG1-CE1 3.88Å; I134-Y150 HydrophobicContact CG1-CE2 4.02Å; I134-Y150 HydrophobicContact CG1-CG 3.95Å; I134-Y150 HydrophobicContact CG2-CD1 4.49Å; I134-Y150 HydrophobicContact CG2-CD2 4.26Å; I134-Y150 HydrophobicContact CG2-CG 3.96Å; E146-Y150 VanDerWaalsContact O-CB 3.24Å; E146-Y150 WeakPolarHBondContact O-CB 3.38Å; E146-Y150 PolarHBondContact O-N 3.49Å; W147-Y150 PolarHBondContact O-N 2.87Å; Y150-F165 AromaticContact CE1-CE1 3.95Å; Y150-F165 HydrophobicContact CE1-CE1 3.95Å
151	F	84.9	Confident	83.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-95.9	-1.1	-177.5	-70.7	-70.8	0	0	0	115	H87 M91 I134 W147 F153 N154 V156 I162 F165 W166	H87-F151 PolarHBondContact NE2-O 3.26Å; M91-F151 HydrophobicContact CG-CB 3.95Å; M91-F151 HydrophobicContact SD-CB 3.52Å; M91-F151 VanDerWaalsContact SD-CB 3.52Å; M91-F151 HydrophobicContact SD-CD1 4.45Å; M91-F151 HydrophobicContact SD-CD2 4.39Å; M91-F151 HydrophobicContact SD-CG 3.9Å; I134-F151 HydrophobicContact CD1-CE2 4.37Å; W147-F151 AromaticContact CD2-CD2 3.85Å; W147-F151 HydrophobicContact CD2-CD2 3.85Å; W147-F151 AromaticContact CD2-CE2 3.82Å; W147-F151 HydrophobicContact CD2-CE2 3.82Å; W147-F151 AromaticContact CE2-CD2 3.7Å; W147-F151 AromaticContact CE2-CE2 3.77Å; W147-F151 HydrophobicContact CE3-CD2 4.25Å; W147-F151 AromaticContact CE3-CE2 3.76Å; W147-F151 HydrophobicContact CE3-CE2 3.76Å; W147-F151 HydrophobicContact CG-CD2 4.27Å; W147-F151 HydrophobicContact CH2-CD2 4.35Å; W147-F151 AromaticContact CH2-CE2 3.61Å; W147-F151 HydrophobicContact CH2-CE2 3.61Å; W147-F151 HydrophobicContact CH2-CZ 4.25Å; W147-F151 AromaticContact CZ2-CD2 3.99Å; W147-F151 HydrophobicContact CZ2-CD2 3.99Å; W147-F151 AromaticContact CZ2-CE2 3.7Å; W147-F151 HydrophobicContact CZ2-CE2 3.7Å; W147-F151 HydrophobicContact CZ3-CD2 4.49Å; W147-F151 AromaticContact CZ3-CE2 3.66Å; W147-F151 HydrophobicContact CZ3-CE2 3.66Å; W147-F151 HydrophobicContact CZ3-CZ 4.47Å; W147-F151 WeakPolarHBondContact O-CD2 3.35Å; W147-F151 PolarHBondContact O-N 2.99Å; W147-F151 VanDerWaalsContact O-N 3.09Å; F151-F153 VanDerWaalsContact C-N 3.29Å; F151-F153 PolarHBondContact O-N 2.91Å; F151-F153 VanDerWaalsContact O-N 3.16Å; F151-N154 HydrophobicContact CD1-CB 4.06Å; F151-N154 PolarHBondContact O-N 3.5Å; F151-V156 HydrophobicContact CD1-CG2 3.57Å; F151-V156 HydrophobicContact CE1-CG2 4.07Å; F151-V156 HydrophobicContact CG-CG2 4.42Å; F151-I162 HydrophobicContact CD1-CG1 4.36Å; F151-I162 HydrophobicContact CE1-CB 4.46Å; F151-I162 HydrophobicContact CE1-CG1 3.94Å; F151-I162 HydrophobicContact CE1-CG2 3.99Å; F151-I162 HydrophobicContact CE2-CG2 4.32Å; F151-I162 HydrophobicContact CZ-CB 4.42Å; F151-I162 HydrophobicContact CZ-CG1 4.12Å; F151-I162 HydrophobicContact CZ-CG2 3.53Å; F151-F165 HydrophobicContact CE1-CD1 4.06Å; F151-F165 HydrophobicContact CE1-CE1 4.36Å; F151-W166 HydrophobicContact CE2-CZ2 4.41Å; F151-W166 HydrophobicContact CZ-CZ2 4.02Å; F151-W166 AromaticContact CZ-NE1 3.7Å
152	L	84.2	Confident	82.9	Confident	7 Å²	7	29.3 Å²	29.3	4%	0.037	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-43.8	-170.7	-171.6	62.9	0	0	0	113.9	L27 L84 H87 E88 R148	L27-L152 HydrophobicContact CD1-CD2 3.86Å; L84-L152 HydrophobicContact CD2-CD1 4.02Å; L84-L152 HydrophobicContact CD2-CG 4.22Å; H87-L152 PolarHBondContact CD2-O 3.17Å; H87-L152 VanDerWaalsContact CD2-O 3.26Å; E88-L152 HydrophobicContact CG-CD1 4.18Å; R148-L152 WeakPolarHBondContact O-CA 3.26Å; R148-L152 WeakPolarHBondContact O-CB 3.4Å; R148-L152 PolarHBondContact O-N 3.45Å
153	F	79.3	Confident	82.1	Confident	11 Å²	11	29.8 Å²	29.8	5%	0.048	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	14.8	179.1	-65.3	-69.8	0	0	0	112.9	L27 L31 L48 L51 I53 L55 I63 F80 L84 F151	L27-F153 HydrophobicContact CD1-CZ 4.46Å; L27-F153 HydrophobicContact CD2-CE2 4.33Å; L27-F153 HydrophobicContact CD2-CZ 4.34Å; L31-F153 HydrophobicContact CD1-CE1 4.29Å; L31-F153 HydrophobicContact CD1-CZ 4.43Å; L48-F153 HydrophobicContact CD2-CB 3.65Å; L48-F153 HydrophobicContact CD2-CD1 3.66Å; L48-F153 HydrophobicContact CD2-CD2 3.88Å; L48-F153 HydrophobicContact CD2-CE1 4.23Å; L48-F153 HydrophobicContact CD2-CE2 4.42Å; L48-F153 HydrophobicContact CD2-CG 3.45Å; L48-F153 VanDerWaalsContact CD2-CG 3.45Å; L51-F153 HydrophobicContact CD1-CE2 4.42Å; I53-F153 HydrophobicContact CD1-CB 4.15Å; I53-F153 HydrophobicContact CD1-CD2 3.65Å; I53-F153 HydrophobicContact CD1-CG 4.28Å; L55-F153 WeakPolarHBondContact CD2-O 3.29Å; I63-F153 WeakPolarHBondContact CD1-O 3.49Å; F80-F153 HydrophobicContact CE2-CE1 4.17Å; F80-F153 HydrophobicContact CZ-CE1 4.12Å; F80-F153 HydrophobicContact CZ-CZ 4.37Å; L84-F153 HydrophobicContact CD2-CD1 4.44Å; L84-F153 HydrophobicContact CD2-CE1 4.14Å; F151-F153 VanDerWaalsContact C-N 3.29Å; F151-F153 PolarHBondContact O-N 2.91Å; F151-F153 VanDerWaalsContact O-N 3.16Å
154	N	81.6	Confident	81	Confident	14 Å²	14	31.8 Å²	31.8	8%	0.075	15%	0.152	C	C	.	.			trans	-94.3	122.5	173.7	-170.7	-25.9	0	0	0	108.8	H87 F151 V156 F165	H87-N154 PolarHBondContact CE1-O 2.87Å; H87-N154 PolarHBondContact NE2-O 3.41Å; F151-N154 HydrophobicContact CD1-CB 4.06Å; F151-N154 PolarHBondContact O-N 3.5Å; N154-V156 HydrophobicContact CB-CG2 4.17Å; N154-V156 PolarHBondContact O-N 2.91Å; N154-V156 VanDerWaalsContact OD1-CG1 3.3Å; N154-V156 WeakPolarHBondContact OD1-CG1 3.24Å; N154-V156 PolarHBondContact OD1-N 3.37Å; N154-F165 VanDerWaalsContact ND2-CD2 3.34Å; N154-F165 WeakPolarHBondContact ND2-CD2 3.39Å; N154-F165 WeakPolarHBondContact ND2-CE1 3.39Å; N154-F165 WeakPolarHBondContact ND2-CE2 3.34Å; N154-F165 VanDerWaalsContact ND2-CZ 3.26Å; N154-F165 WeakPolarHBondContact ND2-CZ 3.27Å
155	P	81.2	Confident	80.2	Confident	15 Å²	15	31.6 Å²	31.6	10%	0.097	15%	0.152	C	C	.	.			trans	-76.3	19.2	-172.7	34.2	-40.1	0	0	0	114.7	A59 K62 I63	A59-P155 HydrophobicContact CB-CG 3.8Å; K62-P155 HydrophobicContact CB-CB 4.12Å; K62-P155 HydrophobicContact CB-CG 4.48Å; K62-P155 HydrophobicContact CD-CB 3.83Å; K62-P155 HydrophobicContact CD-CG 4.27Å; K62-P155 HydrophobicContact CG-CB 3.95Å; K62-P155 PolarHBondContact NZ-O 3.23Å; I63-P155 HydrophobicContact CG1-CB 4.17Å
156	V	80.7	Confident	79.5	Confident	10 Å²	10	28 Å²	28	6%	0.061	13%	0.133	C	C	.	.			trans	-68.1	136.4	173.4	-70.3	0	0	0	0	110.6	H87 M91 F151 N154 E161 I162 F165	H87-V156 PolarHBondContact CE1-O 3.28Å; M91-V156 HydrophobicContact CE-CG2 4.2Å; M91-V156 WeakPolarHBondContact CE-O 3.5Å; M91-V156 HydrophobicContact SD-CG2 4.16Å; F151-V156 HydrophobicContact CD1-CG2 3.57Å; F151-V156 HydrophobicContact CE1-CG2 4.07Å; F151-V156 HydrophobicContact CG-CG2 4.42Å; N154-V156 HydrophobicContact CB-CG2 4.17Å; N154-V156 PolarHBondContact O-N 2.91Å; N154-V156 VanDerWaalsContact OD1-CG1 3.3Å; N154-V156 WeakPolarHBondContact OD1-CG1 3.24Å; N154-V156 PolarHBondContact OD1-N 3.37Å; V156-E161 WeakPolarHBondContact CA-OE2 3.47Å; V156-E161 HydrophobicContact CB-CB 3.97Å; V156-E161 HydrophobicContact CG1-CB 3.97Å; V156-I162 HydrophobicContact CB-CG1 4.02Å; V156-I162 HydrophobicContact CG2-CG1 3.69Å; V156-F165 HydrophobicContact CG1-CB 3.89Å; V156-F165 HydrophobicContact CG1-CG 4.45Å
157	T	78.5	Confident	78.4	Confident	51 Å²	51	29.7 Å²	29.7	31%	0.313	14%	0.14	S	C	.	.			trans	-112.2	-19.6	-170.4	56.8	0	0	0	0	113.8	E161	T157-E161 PolarHBondContact N-OE2 2.63Å; T157-E161 VanDerWaalsContact OG1-CD 3.28Å; T157-E161 PolarHBondContact OG1-OE2 3.42Å
158	D	76.9	Confident	77	Confident	49 Å²	49	36.8 Å²	36.8	26%	0.262	17%	0.173	S	C	.	.	S	Bend	trans	-149.6	177.1	179.4	74.2	19.2	0	0	0	112.4	E160 E161 I162 K285	D158-E160 VanDerWaalsContact C-N 3.26Å; D158-E160 PolarHBondContact O-N 3.37Å; D158-E160 WeakPolarHBondContact OD1-CA 3.39Å; D158-E160 WeakPolarHBondContact OD1-CB 3.39Å; D158-E160 PolarHBondContact OD1-N 2.93Å; D158-E161 PolarHBondContact O-N 3.08Å; D158-E161 PolarHBondContact OD1-N 3.45Å; D158-I162 WeakPolarHBondContact O-CD1 3.44Å; D158-I162 WeakPolarHBondContact O-CG1 3.32Å; D158-I162 PolarHBondContact O-N 3.34Å; D158-K285 IonicContact OD2-NZ 2.77Å; D158-K285 PolarHBondContact OD2-NZ 3.06Å
159	I	77	Confident	75.6	Confident	24 Å²	24	37.8 Å²	37.8	12%	0.123	19%	0.186	C	C	.	.	H	α-helix	trans	-62.8	-28.9	-178.4	-169.3	56.9	0	0	0	113.4	L98 L118 I162 I163	L98-I159 HydrophobicContact CD1-CD1 3.7Å; L98-I159 HydrophobicContact CD2-CD1 3.77Å; L98-I159 HydrophobicContact CD2-CG1 4.42Å; L98-I159 HydrophobicContact CG-CD1 3.67Å; L118-I159 HydrophobicContact CD1-CG1 4.37Å; L118-I159 HydrophobicContact CD1-CG2 4.48Å; I159-I162 HydrophobicContact CD1-CB 4.46Å; I159-I162 HydrophobicContact CD1-CG2 4.46Å; I159-I162 PolarHBondContact O-N 3.08Å; I159-I163 HydrophobicContact CD1-CD1 4.47Å; I159-I163 HydrophobicContact CG1-CD1 4Å; I159-I163 HydrophobicContact CG1-CG1 4.5Å; I159-I163 WeakPolarHBondContact O-CB 3.3Å; I159-I163 WeakPolarHBondContact O-CD1 3.37Å; I159-I163 WeakPolarHBondContact O-CG1 3.46Å; I159-I163 PolarHBondContact O-N 2.79Å
160	E	72.1	Confident	74.3	Confident	42 Å²	42	36.6 Å²	36.6	20%	0.196	18%	0.181	C	C	.	.	H	α-helix	trans	-73.6	-41.6	178.1	-66.1	-176.8	153.1	0	0	110.9	D158 I162 I163 R164 K285	D158-E160 VanDerWaalsContact C-N 3.26Å; D158-E160 PolarHBondContact O-N 3.37Å; D158-E160 WeakPolarHBondContact OD1-CA 3.39Å; D158-E160 WeakPolarHBondContact OD1-CB 3.39Å; D158-E160 PolarHBondContact OD1-N 2.93Å; E160-I162 VanDerWaalsContact C-N 3.32Å; E160-I163 PolarHBondContact O-N 3.43Å; E160-R164 WeakPolarHBondContact O-CG 3.32Å; E160-R164 PolarHBondContact O-N 3.09Å; E160-K285 WeakPolarHBondContact OE1-CD 3Å; E160-K285 IonicContact OE1-NZ 3.27Å; E160-K285 WeakPolarHBondContact OE2-CE 3.41Å; E160-K285 IonicContact OE2-NZ 3.68Å; E160-K285 PolarHBondContact OE2-NZ 3.17Å
161	E	74.1	Confident	72.6	Confident	47 Å²	47	35.2 Å²	35.2	22%	0.22	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-37.3	172.9	-70.8	-166.3	159.3	0	0	111.6	K62 V156 T157 D158 R164 F165	K62-E161 IonicContact NZ-OE1 3.98Å; K62-E161 IonicContact NZ-OE2 2.6Å; V156-E161 WeakPolarHBondContact CA-OE2 3.47Å; V156-E161 HydrophobicContact CB-CB 3.97Å; V156-E161 HydrophobicContact CG1-CB 3.97Å; T157-E161 PolarHBondContact N-OE2 2.63Å; T157-E161 VanDerWaalsContact OG1-CD 3.28Å; T157-E161 PolarHBondContact OG1-OE2 3.42Å; D158-E161 PolarHBondContact O-N 3.08Å; D158-E161 PolarHBondContact OD1-N 3.45Å; E161-R164 PolarHBondContact O-N 2.86Å; E161-F165 VanDerWaalsContact O-CB 3.29Å; E161-F165 WeakPolarHBondContact O-CB 3.37Å; E161-F165 PolarHBondContact O-N 2.91Å
162	I	79.9	Confident	70.9	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.6	-45.3	172.9	-71.3	158.4	0	0	0	111.4	M91 A94 W147 F151 V156 D158 I159 E160 F165 W166	M91-I162 HydrophobicContact CE-CD1 4.17Å; M91-I162 HydrophobicContact SD-CD1 4.06Å; A94-I162 HydrophobicContact CB-CD1 3.54Å; W147-I162 HydrophobicContact CH2-CD1 4.11Å; W147-I162 HydrophobicContact CH2-CG2 4.06Å; W147-I162 HydrophobicContact CZ2-CD1 3.6Å; F151-I162 HydrophobicContact CD1-CG1 4.36Å; F151-I162 HydrophobicContact CE1-CB 4.46Å; F151-I162 HydrophobicContact CE1-CG1 3.94Å; F151-I162 HydrophobicContact CE1-CG2 3.99Å; F151-I162 HydrophobicContact CE2-CG2 4.32Å; F151-I162 HydrophobicContact CZ-CB 4.42Å; F151-I162 HydrophobicContact CZ-CG1 4.12Å; F151-I162 HydrophobicContact CZ-CG2 3.53Å; V156-I162 HydrophobicContact CB-CG1 4.02Å; V156-I162 HydrophobicContact CG2-CG1 3.69Å; D158-I162 WeakPolarHBondContact O-CD1 3.44Å; D158-I162 WeakPolarHBondContact O-CG1 3.32Å; D158-I162 PolarHBondContact O-N 3.34Å; I159-I162 HydrophobicContact CD1-CB 4.46Å; I159-I162 HydrophobicContact CD1-CG2 4.46Å; I159-I162 PolarHBondContact O-N 3.08Å; E160-I162 VanDerWaalsContact C-N 3.32Å; I162-F165 WeakPolarHBondContact O-CB 3.46Å; I162-F165 PolarHBondContact O-N 3.14Å; I162-W166 HydrophobicContact CG2-CD2 3.84Å; I162-W166 HydrophobicContact CG2-CE3 4.04Å; I162-W166 HydrophobicContact CG2-CH2 3.7Å; I162-W166 HydrophobicContact CG2-CZ2 3.45Å; I162-W166 VanDerWaalsContact CG2-CZ2 3.45Å; I162-W166 HydrophobicContact CG2-CZ3 3.98Å; I162-W166 PolarHBondContact O-N 2.88Å
163	I	73.6	Confident	69.2	Low	11 Å²	11	35.6 Å²	35.6	6%	0.056	18%	0.184	C	C	.	.	H	α-helix	trans	-63.7	-42.9	177.9	-74.9	165.9	0	0	0	111.2	L115 L118 L120 I159 E160 F165 W166 K167 I174	L115-I163 HydrophobicContact CD1-CD1 4.34Å; L115-I163 HydrophobicContact CD1-CG1 4.4Å; L115-I163 HydrophobicContact CG-CD1 4.08Å; L115-I163 HydrophobicContact CG-CG1 4.34Å; L118-I163 HydrophobicContact CD1-CD1 3.27Å; L120-I163 HydrophobicContact CD1-CD1 4.4Å; L120-I163 HydrophobicContact CD1-CG2 3.59Å; I159-I163 HydrophobicContact CD1-CD1 4.47Å; I159-I163 HydrophobicContact CG1-CD1 4Å; I159-I163 HydrophobicContact CG1-CG1 4.5Å; I159-I163 WeakPolarHBondContact O-CB 3.3Å; I159-I163 WeakPolarHBondContact O-CD1 3.37Å; I159-I163 WeakPolarHBondContact O-CG1 3.46Å; I159-I163 PolarHBondContact O-N 2.79Å; E160-I163 PolarHBondContact O-N 3.43Å; I163-F165 VanDerWaalsContact C-N 3.32Å; I163-W166 HydrophobicContact CG1-CE3 4.18Å; I163-W166 HydrophobicContact CG1-CZ3 4.28Å; I163-W166 PolarHBondContact O-N 2.84Å; I163-K167 PolarHBondContact O-N 2.98Å; I163-I174 HydrophobicContact CG2-CD1 3.66Å
164	R	69.1	Low	67.5	Low	91 Å²	91	35.4 Å²	35.4	34%	0.343	18%	0.183	S	C	.	.	H	α-helix	trans	-63	-40.8	173.1	-73.6	-177.7	-170.5	136.4	2.9	111.4	E160 E161 K167 H168	E160-R164 WeakPolarHBondContact O-CG 3.32Å; E160-R164 PolarHBondContact O-N 3.09Å; E161-R164 PolarHBondContact O-N 2.86Å; R164-K167 WeakPolarHBondContact O-CB 3.27Å; R164-K167 PolarHBondContact O-N 3.45Å; R164-H168 PolarHBondContact O-CD2 3.11Å; R164-H168 PolarHBondContact O-N 3.27Å
165	F	73.1	Confident	65.4	Low	50 Å²	50	36.5 Å²	36.5	22%	0.219	20%	0.198	C	C	.	.	H	α-helix	trans	-58.6	-49	174.8	170.9	-97.5	0	0	0	110.4	Y150 F151 N154 V156 E161 I162 I163 K167 H168 S169	Y150-F165 AromaticContact CE1-CE1 3.95Å; Y150-F165 HydrophobicContact CE1-CE1 3.95Å; F151-F165 HydrophobicContact CE1-CD1 4.06Å; F151-F165 HydrophobicContact CE1-CE1 4.36Å; N154-F165 VanDerWaalsContact ND2-CD2 3.34Å; N154-F165 WeakPolarHBondContact ND2-CD2 3.39Å; N154-F165 WeakPolarHBondContact ND2-CE1 3.39Å; N154-F165 WeakPolarHBondContact ND2-CE2 3.34Å; N154-F165 VanDerWaalsContact ND2-CZ 3.26Å; N154-F165 WeakPolarHBondContact ND2-CZ 3.27Å; V156-F165 HydrophobicContact CG1-CB 3.89Å; V156-F165 HydrophobicContact CG1-CG 4.45Å; E161-F165 VanDerWaalsContact O-CB 3.29Å; E161-F165 WeakPolarHBondContact O-CB 3.37Å; E161-F165 PolarHBondContact O-N 2.91Å; I162-F165 WeakPolarHBondContact O-CB 3.46Å; I162-F165 PolarHBondContact O-N 3.14Å; I163-F165 VanDerWaalsContact C-N 3.32Å; F165-K167 PolarHBondContact O-N 2.81Å; F165-H168 PolarHBondContact O-N 3.01Å; F165-S169 WeakPolarHBondContact CE1-OG 3.18Å; F165-S169 VanDerWaalsContact O-CB 3.27Å; F165-S169 WeakPolarHBondContact O-CB 3.27Å; F165-S169 PolarHBondContact O-N 3.04Å; F165-S169 PolarHBondContact O-OG 3.03Å
166	W	72.6	Confident	63.2	Low	0 Å²	0	39 Å²	39	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.1	-46	173.7	-66.7	-29.6	0	0	0	111.7	L98 L115 I130 I134 W147 F151 I162 I163 H168 S169 T170	L98-W166 HydrophobicContact CD1-CH2 3.91Å; L115-W166 HydrophobicContact CD1-CZ3 4.44Å; I130-W166 HydrophobicContact CD1-CD2 4.29Å; I130-W166 HydrophobicContact CD1-CE3 3.97Å; I130-W166 HydrophobicContact CG2-CD2 3.67Å; I130-W166 VanDerWaalsContact CG2-CE2 3.45Å; I130-W166 HydrophobicContact CG2-CE3 3.97Å; I130-W166 HydrophobicContact CG2-CG 4.22Å; I130-W166 HydrophobicContact CG2-CH2 3.91Å; I130-W166 HydrophobicContact CG2-CZ2 3.61Å; I130-W166 HydrophobicContact CG2-CZ3 4.09Å; I134-W166 HydrophobicContact CD1-CZ2 3.79Å; W147-W166 AromaticContact CH2-CH2 3.94Å; W147-W166 HydrophobicContact CH2-CH2 3.94Å; W147-W166 AromaticContact CH2-CZ2 3.89Å; W147-W166 HydrophobicContact CH2-CZ2 3.89Å; W147-W166 AromaticContact CZ3-CH2 3.92Å; W147-W166 HydrophobicContact CZ3-CH2 3.92Å; W147-W166 AromaticContact CZ3-CZ2 3.72Å; W147-W166 HydrophobicContact CZ3-CZ2 3.72Å; F151-W166 HydrophobicContact CE2-CZ2 4.41Å; F151-W166 HydrophobicContact CZ-CZ2 4.02Å; F151-W166 AromaticContact CZ-NE1 3.7Å; I162-W166 HydrophobicContact CG2-CD2 3.84Å; I162-W166 HydrophobicContact CG2-CE3 4.04Å; I162-W166 HydrophobicContact CG2-CH2 3.7Å; I162-W166 HydrophobicContact CG2-CZ2 3.45Å; I162-W166 VanDerWaalsContact CG2-CZ2 3.45Å; I162-W166 HydrophobicContact CG2-CZ3 3.98Å; I162-W166 PolarHBondContact O-N 2.88Å; I163-W166 HydrophobicContact CG1-CE3 4.18Å; I163-W166 HydrophobicContact CG1-CZ3 4.28Å; I163-W166 PolarHBondContact O-N 2.84Å; W166-H168 PolarHBondContact O-N 3.23Å; W166-S169 PolarHBondContact O-N 3.22Å; W166-T170 PolarHBondContact O-N 2.92Å; W166-T170 PolarHBondContact O-OG1 2.79Å
167	K	65.7	Low	61	Low	51 Å²	51	39.7 Å²	39.7	22%	0.222	22%	0.216	C	C	.	.	H	α-helix	trans	-51.2	-44.5	175.6	-177.3	-178.9	178.3	-180	0	112.1	I163 R164 F165 G171 I172 I174 D176	I163-K167 PolarHBondContact O-N 2.98Å; R164-K167 WeakPolarHBondContact O-CB 3.27Å; R164-K167 PolarHBondContact O-N 3.45Å; F165-K167 PolarHBondContact O-N 2.81Å; K167-G171 WeakPolarHBondContact O-CA 3.4Å; K167-G171 PolarHBondContact O-N 3.39Å; K167-I172 WeakPolarHBondContact CA-O 3.15Å; K167-I174 HydrophobicContact CB-CD1 4.14Å; K167-I174 HydrophobicContact CB-CG1 4.36Å; K167-D176 IonicContact NZ-OD1 3.48Å; K167-D176 PolarHBondContact NZ-OD1 3.2Å; K167-D176 IonicContact NZ-OD2 3.88Å; K167-D176 PolarHBondContact NZ-OD2 2.97Å
168	H	57.4	Low	58.8	Low	151 Å²	151	44.1 Å²	44.1	70%	0.699	24%	0.237	S	C	*	.	H	α-helix	trans	-83.1	-36.3	-177.8	-68	-54.7	0	0	0	114.2	R164 F165 W166	R164-H168 PolarHBondContact O-CD2 3.11Å; R164-H168 PolarHBondContact O-N 3.27Å; F165-H168 PolarHBondContact O-N 3.01Å; W166-H168 PolarHBondContact O-N 3.23Å
169	S	59.2	Low	56.7	Low	62 Å²	62	44.8 Å²	44.8	43%	0.434	24%	0.243	S	C	.	.	H	α-helix	trans	-88.6	-37.1	-172.7	67.7	0	0	0	0	113.4	F165 W166	F165-S169 WeakPolarHBondContact CE1-OG 3.18Å; F165-S169 VanDerWaalsContact O-CB 3.27Å; F165-S169 WeakPolarHBondContact O-CB 3.27Å; F165-S169 PolarHBondContact O-N 3.04Å; F165-S169 PolarHBondContact O-OG 3.03Å; W166-S169 PolarHBondContact O-N 3.22Å
170	T	55.5	Low	54.9	Low	34 Å²	34	45.6 Å²	45.6	21%	0.209	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-8.6	178.1	67.7	0	0	0	0	112.3	W166 I172	W166-T170 PolarHBondContact O-N 2.92Å; W166-T170 PolarHBondContact O-OG1 2.79Å; T170-I172 PolarHBondContact O-N 3.4Å; T170-I172 VanDerWaalsContact OG1-CD1 3.24Å; T170-I172 WeakPolarHBondContact OG1-CD1 3.28Å; T170-I172 VanDerWaalsContact OG1-CG1 3.22Å; T170-I172 WeakPolarHBondContact OG1-CG1 3.24Å
171	G	47.1	Very low	53.3	Low	20 Å²	20	44.6 Å²	44.6	21%	0.206	24%	0.244	C	C	.	.			trans	65.7	17.3	-179.8	0	0	0	0	0	113.3	K167 D173	K167-G171 WeakPolarHBondContact O-CA 3.4Å; K167-G171 PolarHBondContact O-N 3.39Å; G171-D173 PolarHBondContact O-N 2.91Å
172	I	50.7	Low	52	Low	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.26	C	S	.	.			trans	-72.7	111.2	175.1	-64.3	173.9	0	0	0	106.9	I122 Q126 I130 K167 T170 I174 V381	I122-I172 HydrophobicContact CG2-CG2 4.46Å; Q126-I172 HydrophobicContact CB-CD1 4.45Å; Q126-I172 HydrophobicContact CB-CG2 4.17Å; Q126-I172 HydrophobicContact CG-CG2 4.17Å; Q126-I172 WeakPolarHBondContact O-CD1 3.45Å; I130-I172 HydrophobicContact CD1-CD1 3.91Å; I130-I172 HydrophobicContact CG1-CD1 3.45Å; I130-I172 VanDerWaalsContact CG1-CD1 3.45Å; K167-I172 WeakPolarHBondContact CA-O 3.15Å; T170-I172 PolarHBondContact O-N 3.4Å; T170-I172 VanDerWaalsContact OG1-CD1 3.24Å; T170-I172 WeakPolarHBondContact OG1-CD1 3.28Å; T170-I172 VanDerWaalsContact OG1-CG1 3.22Å; T170-I172 WeakPolarHBondContact OG1-CG1 3.24Å; I172-I174 VanDerWaalsContact C-N 3.32Å; I172-I174 HydrophobicContact CB-CG1 4.44Å; I172-I174 HydrophobicContact CG2-CG1 3.87Å; I172-I174 WeakPolarHBondContact O-CG1 3.37Å; I172-I174 PolarHBondContact O-N 3.48Å; I172-V381 HydrophobicContact CG1-CB 3.99Å; I172-V381 HydrophobicContact CG1-CG1 3.96Å; I172-V381 HydrophobicContact CG1-CG2 4.12Å
173	D	47.3	Very low	50.5	Low	15 Å²	15	50.5 Å²	50.5	8%	0.08	28%	0.275	C	S	.	.			trans	-72.6	91.9	171.9	173.2	16.5	0	0	0	108.6	G171 G175 D176 K369	G171-D173 PolarHBondContact O-N 2.91Å; D173-G175 PolarHBondContact O-N 3.28Å; D173-D176 WeakPolarHBondContact OD1-CB 3.27Å; D173-D176 PolarHBondContact OD1-N 3.48Å; D173-K369 PolarHBondContact O-NZ 2.96Å; D173-K369 IonicContact OD1-NZ 2.91Å; D173-K369 IonicContact OD2-NZ 3.76Å; D173-K369 PolarHBondContact OD2-NZ 3.2Å
174	I	44	Very low	49.5	Very low	6 Å²	6	51.4 Å²	51.4	3%	0.031	28%	0.279	C	S	.	.			trans	-76.7	73.8	175.4	-48.2	-179.7	0	0	0	108.6	L115 L120 I122 I163 K167 I172	L115-I174 HydrophobicContact CD2-CD1 4.03Å; L115-I174 HydrophobicContact CD2-CG2 3.93Å; L120-I174 HydrophobicContact CB-CG2 3.49Å; L120-I174 VanDerWaalsContact CB-CG2 3.49Å; L120-I174 HydrophobicContact CD1-CG2 3.82Å; L120-I174 HydrophobicContact CD2-CG2 3.73Å; L120-I174 HydrophobicContact CG-CG2 3.83Å; I122-I174 HydrophobicContact CG2-CB 4.43Å; I122-I174 HydrophobicContact CG2-CG1 4.26Å; I122-I174 HydrophobicContact CG2-CG2 3.84Å; I163-I174 HydrophobicContact CG2-CD1 3.66Å; K167-I174 HydrophobicContact CB-CD1 4.14Å; K167-I174 HydrophobicContact CB-CG1 4.36Å; I172-I174 VanDerWaalsContact C-N 3.32Å; I172-I174 HydrophobicContact CB-CG1 4.44Å; I172-I174 HydrophobicContact CG2-CG1 3.87Å; I172-I174 WeakPolarHBondContact O-CG1 3.37Å; I172-I174 PolarHBondContact O-N 3.48Å
175	G	37.5	Very low	48.8	Very low	37 Å²	37	49.1 Å²	49.1	38%	0.381	27%	0.274	S	S	.	.			trans	61.4	49.6	166.1	0	0	0	0	0	115.6	D173 S177	D173-G175 PolarHBondContact O-N 3.28Å; G175-S177 PolarHBondContact O-N 3.4Å
176	D	36.1	Very low	48	Very low	67 Å²	67	52.1 Å²	52.1	36%	0.358	29%	0.289	S	S	.	.			trans	-63.9	86.9	163.9	-79.1	-16.6	0	0	0	109.9	K167 D173 L178	K167-D176 IonicContact NZ-OD1 3.48Å; K167-D176 PolarHBondContact NZ-OD1 3.2Å; K167-D176 IonicContact NZ-OD2 3.88Å; K167-D176 PolarHBondContact NZ-OD2 2.97Å; D173-D176 WeakPolarHBondContact OD1-CB 3.27Å; D173-D176 PolarHBondContact OD1-N 3.48Å; D176-L178 VanDerWaalsContact C-N 3.33Å; D176-L178 PolarHBondContact O-N 3.28Å
177	S	32.6	Very low	47	Very low	26 Å²	26	56.9 Å²	56.9	18%	0.182	32%	0.315	C	S	.	.			trans	-65.8	102.7	156.3	-162.2	0	0	0	0	105.9	G175 T179 I180	G175-S177 PolarHBondContact O-N 3.4Å; S177-T179 PolarHBondContact O-N 3.21Å; S177-T179 PolarHBondContact OG-OG1 3.06Å; S177-I180 PolarHBondContact O-N 2.84Å
178	L	33.4	Very low	46.8	Very low	143 Å²	143	56.8 Å²	56.8	75%	0.749	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.7	-4.8	170.2	-90.4	136.3	0	0	0	115.3	D176	D176-L178 VanDerWaalsContact C-N 3.33Å; D176-L178 PolarHBondContact O-N 3.28Å
179	T	33.6	Very low	47	Very low	63 Å²	63	53.7 Å²	53.7	39%	0.387	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-23.5	-178.3	66.9	0	0	0	0	114.2	S177 K268	S177-T179 PolarHBondContact O-N 3.21Å; S177-T179 PolarHBondContact OG-OG1 3.06Å; T179-K268 PolarHBondContact O-NZ 3.39Å
180	I	38.6	Very low	47	Very low	42 Å²	42	58.7 Å²	58.7	22%	0.215	31%	0.313	C	S	.	.	S	Bend	trans	-90.3	122.3	-179.3	-54.2	175.2	0	0	0	107.7	S177 D182	S177-I180 PolarHBondContact O-N 2.84Å; I180-D182 PolarHBondContact O-N 3.22Å
181	P	38.9	Very low	47.5	Very low	20 Å²	20	60.1 Å²	60.1	13%	0.13	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-57.8	134.4	174.6	-17.7	29.4	0	0	0	110.1	E183 F269	P181-E183 PolarHBondContact O-N 3.29Å; P181-E183 VanDerWaalsContact O-N 3.13Å; P181-F269 HydrophobicContact CB-CD1 4.33Å; P181-F269 HydrophobicContact CB-CE1 3.53Å; P181-F269 HydrophobicContact CB-CZ 4.01Å; P181-F269 HydrophobicContact CG-CE1 4.23Å
182	D	45.3	Very low	48.5	Very low	104 Å²	104	59.7 Å²	59.7	56%	0.556	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-52.1	122.6	170.6	-74.4	-39.3	0	0	0	108.8	I180 F184	I180-D182 PolarHBondContact O-N 3.22Å; D182-F184 PolarHBondContact O-N 3.18Å
183	E	48.6	Very low	49.6	Very low	67 Å²	67	63 Å²	63	31%	0.313	34%	0.336	S	S	.	.			trans	-76.8	94.7	-179.7	-166.8	161.6	-143.7	0	0	107.6	P181 T185 K276 R291	P181-E183 PolarHBondContact O-N 3.29Å; P181-E183 VanDerWaalsContact O-N 3.13Å; E183-T185 PolarHBondContact O-N 3.21Å; E183-K276 IonicContact OE1-NZ 2.71Å; E183-K276 PolarHBondContact OE1-NZ 2.84Å; E183-R291 IonicContact OE2-CZ 2.61Å; E183-R291 IonicContact OE2-NE 2.8Å; E183-R291 IonicContact OE2-NH2 2.71Å; E183-R291 PolarHBondContact OE2-NH2 3.46Å
184	F	54	Low	50.7	Low	31 Å²	31	67.4 Å²	67.4	14%	0.136	35%	0.352	C	S	.	.			trans	-57	126.1	174.8	-59.6	-70.4	0	0	0	109.5	D182 E188 K189 W194 Q197 L198 F269	D182-F184 PolarHBondContact O-N 3.18Å; F184-E188 WeakPolarHBondContact CA-OE2 3.33Å; F184-E188 HydrophobicContact CB-CB 4.25Å; F184-K189 HydrophobicContact CB-CG 4.31Å; F184-K189 WeakPolarHBondContact O-CE 3.47Å; F184-W194 HydrophobicContact CB-CB 4.37Å; F184-W194 HydrophobicContact CD1-CB 3.99Å; F184-W194 HydrophobicContact CD2-CB 4.18Å; F184-W194 HydrophobicContact CE1-CB 4.31Å; F184-W194 HydrophobicContact CE2-CB 4.5Å; F184-W194 HydrophobicContact CG-CB 3.91Å; F184-Q197 HydrophobicContact CE1-CB 4.31Å; F184-L198 HydrophobicContact CE2-CD2 4.37Å; F184-L198 HydrophobicContact CE2-CG 4.47Å; F184-L198 HydrophobicContact CZ-CD2 4.35Å; F184-L198 HydrophobicContact CZ-CG 4.4Å; F184-F269 HydrophobicContact CE2-CE1 4.4Å; F184-F269 HydrophobicContact CE2-CZ 4.33Å
185	T	54.5	Low	52.2	Low	42 Å²	42	72.6 Å²	72.6	26%	0.258	37%	0.371	S	S	.	.			trans	-59	155.8	174	56.7	0	0	0	0	110.8	E183 D187 E188 K189	E183-T185 PolarHBondContact O-N 3.21Å; T185-D187 PolarHBondContact O-N 2.86Å; T185-D187 VanDerWaalsContact O-N 3.17Å; T185-E188 PolarHBondContact N-OE2 2.74Å; T185-E188 PolarHBondContact O-N 3.33Å; T185-E188 VanDerWaalsContact O-N 3.13Å; T185-E188 WeakPolarHBondContact OG1-CB 3.41Å; T185-E188 WeakPolarHBondContact OG1-CG 3.16Å; T185-E188 PolarHBondContact OG1-N 2.95Å; T185-E188 PolarHBondContact OG1-OE2 3.4Å; T185-K189 WeakPolarHBondContact O-CG 3.27Å; T185-K189 PolarHBondContact O-N 3.25Å
186	E	54.8	Low	54.4	Low	114 Å²	114	74.8 Å²	74.8	53%	0.533	37%	0.368	S	S	.	.	H	α-helix	trans	-58.5	-27	174	-71.8	-61.2	127.6	0	0	111.8	K189 K190	E186-K189 IonicContact OE1-NZ 3.78Å; E186-K189 PolarHBondContact OE1-NZ 3.45Å; E186-K190 VanDerWaalsContact O-CG 3.28Å; E186-K190 WeakPolarHBondContact O-CG 3.47Å; E186-K190 PolarHBondContact O-N 3.49Å
187	D	52.3	Low	56.3	Low	100 Å²	100	73.1 Å²	73.1	54%	0.535	36%	0.358	S	S	.	.	H	α-helix	trans	-76.9	-38	176	-59.9	-31.8	0	0	0	112.3	T185 K189 K190 S191	T185-D187 PolarHBondContact O-N 2.86Å; T185-D187 VanDerWaalsContact O-N 3.17Å; D187-K189 VanDerWaalsContact C-N 3.29Å; D187-K189 PolarHBondContact O-N 2.86Å; D187-K190 PolarHBondContact O-N 3.46Å; D187-S191 VanDerWaalsContact O-CB 3.27Å; D187-S191 WeakPolarHBondContact O-CB 3.29Å; D187-S191 PolarHBondContact O-N 2.89Å; D187-S191 PolarHBondContact O-OG 2.84Å
188	E	60.6	Low	58.5	Low	49 Å²	49	74.5 Å²	74.5	23%	0.229	36%	0.363	C	S	.	.	H	α-helix	trans	-64.9	-32.5	170.1	-77.4	168.8	127.8	0	0	112.6	F184 T185 S191 G192 Q193 W194	F184-E188 WeakPolarHBondContact CA-OE2 3.33Å; F184-E188 HydrophobicContact CB-CB 4.25Å; T185-E188 PolarHBondContact N-OE2 2.74Å; T185-E188 PolarHBondContact O-N 3.33Å; T185-E188 VanDerWaalsContact O-N 3.13Å; T185-E188 WeakPolarHBondContact OG1-CB 3.41Å; T185-E188 WeakPolarHBondContact OG1-CG 3.16Å; T185-E188 PolarHBondContact OG1-N 2.95Å; T185-E188 PolarHBondContact OG1-OE2 3.4Å; E188-S191 WeakPolarHBondContact CA-OG 3.18Å; E188-S191 PolarHBondContact O-OG 3.45Å; E188-G192 PolarHBondContact O-N 2.92Å; E188-Q193 PolarHBondContact O-N 2.85Å; E188-W194 PolarHBondContact O-N 3.45Å
189	K	62.8	Low	60.9	Low	86 Å²	86	71.2 Å²	71.2	37%	0.374	35%	0.346	S	S	.	.	H	α-helix	trans	-67.6	-44.4	173.1	-69.6	178.5	-166.7	169.4	0	111.5	F184 T185 E186 D187 W194	F184-K189 HydrophobicContact CB-CG 4.31Å; F184-K189 WeakPolarHBondContact O-CE 3.47Å; T185-K189 WeakPolarHBondContact O-CG 3.27Å; T185-K189 PolarHBondContact O-N 3.25Å; E186-K189 IonicContact OE1-NZ 3.78Å; E186-K189 PolarHBondContact OE1-NZ 3.45Å; D187-K189 VanDerWaalsContact C-N 3.29Å; D187-K189 PolarHBondContact O-N 2.86Å; K189-W194 PolarHBondContact O-NE1 2.99Å
190	K	59	Low	63.2	Low	166 Å²	166	68.2 Å²	68.2	72%	0.722	33%	0.327	S	S	*	.	H	α-helix	trans	-71.4	-39.1	179.2	-73.7	172.1	-173.9	171.2	0	113.4	E186 D187 G192	E186-K190 VanDerWaalsContact O-CG 3.28Å; E186-K190 WeakPolarHBondContact O-CG 3.47Å; E186-K190 PolarHBondContact O-N 3.49Å; D187-K190 PolarHBondContact O-N 3.46Å; K190-G192 PolarHBondContact O-N 3.12Å
191	S	65.3	Low	65.1	Low	65 Å²	65	67.7 Å²	67.7	46%	0.455	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-12	179.7	60.4	0	0	0	0	113.9	D187 E188 Q193	D187-S191 VanDerWaalsContact O-CB 3.27Å; D187-S191 WeakPolarHBondContact O-CB 3.29Å; D187-S191 PolarHBondContact O-N 2.89Å; D187-S191 PolarHBondContact O-OG 2.84Å; E188-S191 WeakPolarHBondContact CA-OG 3.18Å; E188-S191 PolarHBondContact O-OG 3.45Å; S191-Q193 PolarHBondContact O-N 3.09Å
192	G	69.5	Low	67.2	Low	11 Å²	11	68 Å²	68	11%	0.113	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	12.8	-177.5	0	0	0	0	0	113.9	E188 K190 W194 W195	E188-G192 PolarHBondContact O-N 2.92Å; K190-G192 PolarHBondContact O-N 3.12Å; G192-W194 VanDerWaalsContact C-N 3.32Å; G192-W195 PolarHBondContact O-NE1 2.84Å
193	Q	72.3	Confident	69.2	Low	70 Å²	70	65.9 Å²	65.9	33%	0.327	33%	0.327	S	S	.	.	H	α-helix	trans	-68.1	-33.5	174.5	-70.9	-175.6	1.3	0	0	112	E188 S191 W195 R196 Q197	E188-Q193 PolarHBondContact O-N 2.85Å; S191-Q193 PolarHBondContact O-N 3.09Å; Q193-W195 PolarHBondContact O-N 2.94Å; Q193-R196 WeakPolarHBondContact O-CB 3.45Å; Q193-R196 PolarHBondContact O-N 3.27Å; Q193-Q197 WeakPolarHBondContact O-CG 3.43Å; Q193-Q197 PolarHBondContact O-N 2.87Å
194	W	70.7	Confident	70.8	Confident	106 Å²	106	62.7 Å²	62.7	40%	0.402	31%	0.313	S	S	.	.	H	α-helix	trans	-55.4	-48.9	-178.2	74.5	-83.5	0	0	0	113.4	F184 E188 K189 G192 R196 Q197 L198	F184-W194 HydrophobicContact CB-CB 4.37Å; F184-W194 HydrophobicContact CD1-CB 3.99Å; F184-W194 HydrophobicContact CD2-CB 4.18Å; F184-W194 HydrophobicContact CE1-CB 4.31Å; F184-W194 HydrophobicContact CE2-CB 4.5Å; F184-W194 HydrophobicContact CG-CB 3.91Å; E188-W194 PolarHBondContact O-N 3.45Å; K189-W194 PolarHBondContact O-NE1 2.99Å; G192-W194 VanDerWaalsContact C-N 3.32Å; W194-R196 VanDerWaalsContact C-N 3.31Å; W194-R196 PolarHBondContact O-N 3.32Å; W194-Q197 PolarHBondContact O-N 3.22Å; W194-L198 HydrophobicContact CE3-CD1 3.52Å; W194-L198 HydrophobicContact CE3-CG 4.49Å; W194-L198 HydrophobicContact CZ3-CD1 3.59Å; W194-L198 WeakPolarHBondContact O-CG 3.36Å; W194-L198 PolarHBondContact O-N 3.4Å
195	W	76.8	Confident	72	Confident	115 Å²	115	61.8 Å²	61.8	44%	0.436	31%	0.312	S	S	.	.	H	α-helix	trans	-72.4	-28.8	-177.1	69.7	-98.1	0	0	0	111.7	G192 Q193 L199	G192-W195 PolarHBondContact O-NE1 2.84Å; Q193-W195 PolarHBondContact O-N 2.94Å; W195-L199 HydrophobicContact CE3-CD2 4.43Å; W195-L199 HydrophobicContact CZ3-CD2 4.03Å; W195-L199 WeakPolarHBondContact O-CB 3.45Å; W195-L199 PolarHBondContact O-N 3.41Å
196	R	81.7	Confident	73.6	Confident	83 Å²	83	60.8 Å²	60.8	31%	0.313	31%	0.308	S	S	.	.	H	α-helix	trans	-68.1	-42.8	174.6	-65.2	173.7	178.8	-167.6	11.6	110.8	Q193 W194 L199 A200 L472 V474	Q193-R196 WeakPolarHBondContact O-CB 3.45Å; Q193-R196 PolarHBondContact O-N 3.27Å; W194-R196 VanDerWaalsContact C-N 3.31Å; W194-R196 PolarHBondContact O-N 3.32Å; R196-L199 PolarHBondContact O-N 2.97Å; R196-A200 WeakPolarHBondContact O-CB 3.44Å; R196-A200 PolarHBondContact O-N 3.44Å; R196-L472 HydrophobicContact CB-CB 4.22Å; R196-L472 WeakPolarHBondContact CD-O 3.35Å; R196-L472 PolarHBondContact NH1-O 3.24Å; R196-L472 VanDerWaalsContact NH1-O 3.09Å; R196-L472 WeakPolarHBondContact O-CD1 3.18Å; R196-V474 HydrophobicContact CB-CG2 3.54Å
197	Q	77.8	Confident	75.2	Confident	32 Å²	32	58.1 Å²	58.1	15%	0.15	30%	0.299	C	S	.	.	H	α-helix	trans	-64	-44.1	173.8	-70.1	-172.4	25.5	0	0	111.8	F184 Q193 W194 L199 A200 G201 V474	F184-Q197 HydrophobicContact CE1-CB 4.31Å; Q193-Q197 WeakPolarHBondContact O-CG 3.43Å; Q193-Q197 PolarHBondContact O-N 2.87Å; W194-Q197 PolarHBondContact O-N 3.22Å; Q197-L199 VanDerWaalsContact C-N 3.35Å; Q197-L199 PolarHBondContact O-N 2.98Å; Q197-A200 PolarHBondContact O-N 3.34Å; Q197-G201 PolarHBondContact O-N 2.77Å; Q197-V474 HydrophobicContact CG-CG1 3.61Å; Q197-V474 HydrophobicContact CG-CG2 4.2Å
198	L	77.2	Confident	76.8	Confident	55 Å²	55	53.9 Å²	53.9	29%	0.288	28%	0.277	S	S	.	.	H	α-helix	trans	-61.8	-41.2	174.6	-70.6	179.6	0	0	0	112.5	F184 W194 G201 G202 T265 F269	F184-L198 HydrophobicContact CE2-CD2 4.37Å; F184-L198 HydrophobicContact CE2-CG 4.47Å; F184-L198 HydrophobicContact CZ-CD2 4.35Å; F184-L198 HydrophobicContact CZ-CG 4.4Å; W194-L198 HydrophobicContact CE3-CD1 3.52Å; W194-L198 HydrophobicContact CE3-CG 4.49Å; W194-L198 HydrophobicContact CZ3-CD1 3.59Å; W194-L198 WeakPolarHBondContact O-CG 3.36Å; W194-L198 PolarHBondContact O-N 3.4Å; L198-G201 PolarHBondContact O-N 3.41Å; L198-G202 PolarHBondContact O-N 3.32Å; L198-T265 HydrophobicContact CD2-CG2 4.48Å; L198-F269 HydrophobicContact CD2-CE2 3.6Å; L198-F269 HydrophobicContact CD2-CZ 3.83Å
199	L	84.1	Confident	78.1	Confident	75 Å²	75	54.7 Å²	54.7	39%	0.393	28%	0.278	S	S	.	.	H	α-helix	trans	-65.9	-44	177.1	-178.6	61.8	0	0	0	111.4	W195 R196 Q197 G201 G202 I203 L472	W195-L199 HydrophobicContact CE3-CD2 4.43Å; W195-L199 HydrophobicContact CZ3-CD2 4.03Å; W195-L199 WeakPolarHBondContact O-CB 3.45Å; W195-L199 PolarHBondContact O-N 3.41Å; R196-L199 PolarHBondContact O-N 2.97Å; Q197-L199 VanDerWaalsContact C-N 3.35Å; Q197-L199 PolarHBondContact O-N 2.98Å; L199-G201 VanDerWaalsContact C-N 3.35Å; L199-G201 PolarHBondContact O-N 3.34Å; L199-G202 PolarHBondContact O-N 2.89Å; L199-I203 HydrophobicContact CD1-CD1 3.88Å; L199-I203 HydrophobicContact CD1-CG1 4.24Å; L199-I203 HydrophobicContact CG-CD1 3.9Å; L199-I203 WeakPolarHBondContact O-CG1 3.27Å; L199-I203 PolarHBondContact O-N 2.92Å; L199-L472 HydrophobicContact CB-CD1 4.23Å; L199-L472 HydrophobicContact CD2-CD1 4.13Å; L199-L472 HydrophobicContact CD2-CD2 4.1Å; L199-L472 HydrophobicContact CG-CD1 4.19Å
200	A	82.7	Confident	79.5	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-57.3	-48.1	174.1	0	0	0	0	0	111.1	R196 Q197 I203 A204 Y465 M468 K469 L472	R196-A200 WeakPolarHBondContact O-CB 3.44Å; R196-A200 PolarHBondContact O-N 3.44Å; Q197-A200 PolarHBondContact O-N 3.34Å; A200-I203 PolarHBondContact O-N 2.87Å; A200-A204 VanDerWaalsContact O-CB 3.24Å; A200-A204 WeakPolarHBondContact O-CB 3.28Å; A200-A204 PolarHBondContact O-N 2.75Å; A200-Y465 HydrophobicContact CB-CD2 3.9Å; A200-Y465 HydrophobicContact CB-CE2 3.91Å; A200-M468 HydrophobicContact CB-CB 3.71Å; A200-K469 HydrophobicContact CB-CG 4.26Å; A200-L472 HydrophobicContact CB-CD1 4.06Å
201	G	79	Confident	81	Confident	31 Å²	31	48.1 Å²	48.1	32%	0.32	26%	0.262	S	S	.	.	H	α-helix	trans	-62.9	-40.9	176.7	0	0	0	0	0	113	Q197 L198 L199 G205	Q197-G201 PolarHBondContact O-N 2.77Å; L198-G201 PolarHBondContact O-N 3.41Å; L199-G201 VanDerWaalsContact C-N 3.35Å; L199-G201 PolarHBondContact O-N 3.34Å; G201-G205 PolarHBondContact O-N 3.31Å
202	G	81.9	Confident	82.2	Confident	27 Å²	27	45.2 Å²	45.2	28%	0.278	24%	0.241	S	C	.	.	H	α-helix	trans	-63.1	-45.9	176.7	0	0	0	0	0	113	L198 L199 G205 A206	L198-G202 PolarHBondContact O-N 3.32Å; L199-G202 PolarHBondContact O-N 2.89Å; G202-G205 PolarHBondContact O-N 3.21Å; G202-A206 WeakPolarHBondContact O-CB 3.36Å; G202-A206 PolarHBondContact O-N 3.16Å
203	I	86.7	Confident	83.3	Confident	58 Å²	58	44.9 Å²	44.9	30%	0.297	24%	0.238	S	C	.	.	H	α-helix	trans	-66.5	-46.9	177.2	-68.9	167.3	0	0	0	110.4	L199 A200 G205 A206 V207 V464 M468	L199-I203 HydrophobicContact CD1-CD1 3.88Å; L199-I203 HydrophobicContact CD1-CG1 4.24Å; L199-I203 HydrophobicContact CG-CD1 3.9Å; L199-I203 WeakPolarHBondContact O-CG1 3.27Å; L199-I203 PolarHBondContact O-N 2.92Å; A200-I203 PolarHBondContact O-N 2.87Å; I203-G205 VanDerWaalsContact C-N 3.32Å; I203-G205 PolarHBondContact O-N 3.37Å; I203-A206 PolarHBondContact O-N 3.2Å; I203-A206 VanDerWaalsContact O-N 3.12Å; I203-V207 HydrophobicContact CG2-CG2 4.31Å; I203-V207 WeakPolarHBondContact O-CG2 3.45Å; I203-V207 PolarHBondContact O-N 2.82Å; I203-V464 HydrophobicContact CG2-CG1 4.2Å; I203-M468 HydrophobicContact CB-CG 4.36Å; I203-M468 HydrophobicContact CD1-CE 3.56Å; I203-M468 HydrophobicContact CD1-SD 4.37Å; I203-M468 HydrophobicContact CG2-CG 4Å; I203-M468 HydrophobicContact CG2-SD 4.02Å
204	A	82.4	Confident	84.3	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-55.9	-47.1	175.3	0	0	0	0	0	112	A200 A206 V207 S208 S461 V464	A200-A204 VanDerWaalsContact O-CB 3.24Å; A200-A204 WeakPolarHBondContact O-CB 3.28Å; A200-A204 PolarHBondContact O-N 2.75Å; A204-A206 VanDerWaalsContact C-N 3.33Å; A204-A206 PolarHBondContact O-N 2.85Å; A204-V207 PolarHBondContact O-N 2.98Å; A204-S208 VanDerWaalsContact O-CB 3.27Å; A204-S208 WeakPolarHBondContact O-CB 3.13Å; A204-S208 PolarHBondContact O-N 3.22Å; A204-S461 WeakPolarHBondContact CB-O 3.49Å; A204-V464 HydrophobicContact CB-CB 4.08Å; A204-V464 HydrophobicContact CB-CG1 3.97Å
205	G	80.4	Confident	85.3	Confident	11 Å²	11	38.9 Å²	38.9	11%	0.113	22%	0.216	C	C	.	.	H	α-helix	trans	-63.2	-34.9	176.2	0	0	0	0	0	113.6	G201 G202 I203 R209	G201-G205 PolarHBondContact O-N 3.31Å; G202-G205 PolarHBondContact O-N 3.21Å; I203-G205 VanDerWaalsContact C-N 3.32Å; I203-G205 PolarHBondContact O-N 3.37Å; G205-R209 VanDerWaalsContact O-CB 3.29Å; G205-R209 WeakPolarHBondContact O-CB 3.44Å; G205-R209 VanDerWaalsContact O-CG 3.22Å; G205-R209 WeakPolarHBondContact O-CG 3.4Å; G205-R209 PolarHBondContact O-N 3.05Å; G205-R209 VanDerWaalsContact O-N 3.15Å
206	A	87.5	Confident	86	Confident	22 Å²	22	34.1 Å²	34.1	18%	0.182	20%	0.2	C	C	.	.	H	α-helix	trans	-72.2	-44.3	177.3	0	0	0	0	0	112.3	G202 I203 A204 T210 V258 I261	G202-A206 WeakPolarHBondContact O-CB 3.36Å; G202-A206 PolarHBondContact O-N 3.16Å; I203-A206 PolarHBondContact O-N 3.2Å; I203-A206 VanDerWaalsContact O-N 3.12Å; A204-A206 VanDerWaalsContact C-N 3.33Å; A204-A206 PolarHBondContact O-N 2.85Å; A206-T210 WeakPolarHBondContact O-CB 3.43Å; A206-T210 PolarHBondContact O-N 3.44Å; A206-T210 PolarHBondContact O-OG1 2.91Å; A206-V258 HydrophobicContact CB-CG1 3.84Å; A206-I261 HydrophobicContact CB-CD1 4.16Å
207	V	89.3	Confident	86.5	Confident	58 Å²	58	30.4 Å²	30.4	35%	0.352	19%	0.186	S	C	.	.	H	α-helix	trans	-66.5	-45.1	178.5	175.7	0	0	0	0	110.8	I203 A204 T210 S211 I460 V464	I203-V207 HydrophobicContact CG2-CG2 4.31Å; I203-V207 WeakPolarHBondContact O-CG2 3.45Å; I203-V207 PolarHBondContact O-N 2.82Å; A204-V207 PolarHBondContact O-N 2.98Å; V207-T210 PolarHBondContact O-N 2.79Å; V207-S211 WeakPolarHBondContact O-CB 3.32Å; V207-S211 PolarHBondContact O-N 3.31Å; V207-S211 PolarHBondContact O-OG 3.45Å; V207-I460 HydrophobicContact CG1-CG2 4.01Å; V207-V464 HydrophobicContact CB-CG1 4.42Å; V207-V464 HydrophobicContact CB-CG2 4.22Å; V207-V464 HydrophobicContact CG1-CG2 3.86Å; V207-V464 HydrophobicContact CG2-CG1 4.35Å
208	S	85.1	Confident	87.2	Confident	10 Å²	10	28.9 Å²	28.9	7%	0.07	18%	0.178	C	C	.	.	H	α-helix	trans	-60.6	-47.4	176.6	174.3	0	0	0	0	112	A204 T210 S211 T212 A457	A204-S208 VanDerWaalsContact O-CB 3.27Å; A204-S208 WeakPolarHBondContact O-CB 3.13Å; A204-S208 PolarHBondContact O-N 3.22Å; S208-T210 VanDerWaalsContact C-N 3.34Å; S208-T210 PolarHBondContact O-N 2.77Å; S208-S211 PolarHBondContact O-N 2.63Å; S208-T212 PolarHBondContact O-N 3.42Å; S208-T212 PolarHBondContact O-OG1 3.06Å; S208-A457 VanDerWaalsContact OG-CA 3.29Å; S208-A457 WeakPolarHBondContact OG-CA 3.11Å; S208-A457 PolarHBondContact OG-O 3.4Å
209	R	86.9	Confident	87.9	Confident	66 Å²	66	28 Å²	28	25%	0.249	17%	0.173	C	C	.	.	H	α-helix	trans	-63	-38.3	176.7	-77.8	178.8	178.6	104.7	-12.3	112.6	G205 A213 N254 N257 I261	G205-R209 VanDerWaalsContact O-CB 3.29Å; G205-R209 WeakPolarHBondContact O-CB 3.44Å; G205-R209 VanDerWaalsContact O-CG 3.22Å; G205-R209 WeakPolarHBondContact O-CG 3.4Å; G205-R209 PolarHBondContact O-N 3.05Å; G205-R209 VanDerWaalsContact O-N 3.15Å; R209-A213 WeakPolarHBondContact O-CA 3.44Å; R209-A213 WeakPolarHBondContact O-CB 3.39Å; R209-A213 PolarHBondContact O-N 3.31Å; R209-N254 PolarHBondContact O-OD1 3.22Å; R209-N257 WeakPolarHBondContact CD-ND2 3.31Å; R209-N257 WeakPolarHBondContact CD-O 3.44Å; R209-I261 VanDerWaalsContact NH1-CG1 3.26Å
210	T	92.8	Very high	88.2	Confident	52 Å²	52	24.9 Å²	24.9	32%	0.319	16%	0.156	S	C	.	.	H	α-helix	trans	-70.9	-39.8	179.4	-59.8	0	0	0	0	112	A206 V207 S208 T212 A213 W251 N254	A206-T210 WeakPolarHBondContact O-CB 3.43Å; A206-T210 PolarHBondContact O-N 3.44Å; A206-T210 PolarHBondContact O-OG1 2.91Å; V207-T210 PolarHBondContact O-N 2.79Å; S208-T210 VanDerWaalsContact C-N 3.34Å; S208-T210 PolarHBondContact O-N 2.77Å; T210-T212 VanDerWaalsContact C-N 3.3Å; T210-T212 PolarHBondContact O-N 3.27Å; T210-A213 WeakPolarHBondContact O-CB 3.37Å; T210-A213 PolarHBondContact O-N 3.26Å; T210-W251 PolarHBondContact O-NE1 2.95Å; T210-N254 PolarHBondContact OG1-ND2 2.71Å
211	S	90.6	Very high	88.5	Confident	62 Å²	62	25.4 Å²	25.4	43%	0.434	16%	0.158	S	C	.	.	H	α-helix	trans	-65.7	-35.7	177	-56.5	0	0	0	0	111.8	V207 S208	V207-S211 WeakPolarHBondContact O-CB 3.32Å; V207-S211 PolarHBondContact O-N 3.31Å; V207-S211 PolarHBondContact O-OG 3.45Å; S208-S211 PolarHBondContact O-N 2.63Å
212	T	90.2	Very high	89	Confident	4 Å²	4	25.3 Å²	25.3	3%	0.025	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	2.2	-179.2	61.5	0	0	0	0	114.5	S208 T210 P214 L215 D216 K453 P456 A457	S208-T212 PolarHBondContact O-N 3.42Å; S208-T212 PolarHBondContact O-OG1 3.06Å; T210-T212 VanDerWaalsContact C-N 3.3Å; T210-T212 PolarHBondContact O-N 3.27Å; T212-P214 VanDerWaalsContact C-CD 3.48Å; T212-L215 PolarHBondContact O-N 3.45Å; T212-D216 PolarHBondContact O-N 3.45Å; T212-K453 HydrophobicContact CG2-CG 4.1Å; T212-K453 WeakPolarHBondContact OG1-CE 3.36Å; T212-P456 HydrophobicContact CG2-CB 4.32Å; T212-A457 HydrophobicContact CG2-CB 4.01Å
213	A	92.4	Very high	89.3	Confident	5 Å²	5	24 Å²	24	4%	0.041	14%	0.137	C	C	.	.	H	α-helix	trans	-57.6	-39.1	-178.9	0	0	0	0	0	114.2	R209 T210 L215 D216 R217 W251 N254	R209-A213 WeakPolarHBondContact O-CA 3.44Å; R209-A213 WeakPolarHBondContact O-CB 3.39Å; R209-A213 PolarHBondContact O-N 3.31Å; T210-A213 WeakPolarHBondContact O-CB 3.37Å; T210-A213 PolarHBondContact O-N 3.26Å; A213-L215 VanDerWaalsContact C-N 3.33Å; A213-L215 PolarHBondContact O-N 2.9Å; A213-D216 WeakPolarHBondContact O-CB 3.19Å; A213-D216 PolarHBondContact O-N 3.34Å; A213-R217 PolarHBondContact O-N 3.49Å; A213-W251 HydrophobicContact CB-CG 4.3Å; A213-N254 HydrophobicContact CB-CB 3.93Å
214	P	94.4	Very high	89.3	Confident	18 Å²	18	21.6 Å²	21.6	12%	0.117	13%	0.125	C	C	.	.	H	α-helix	trans	-59.5	-40.6	176.4	-27.1	37.2	0	0	0	113.5	T212 L218 F238 L250 W251	T212-P214 VanDerWaalsContact C-CD 3.48Å; P214-L218 WeakPolarHBondContact O-CB 3.43Å; P214-L218 PolarHBondContact O-N 2.85Å; P214-F238 HydrophobicContact CB-CE1 3.93Å; P214-F238 HydrophobicContact CB-CZ 4.49Å; P214-L250 HydrophobicContact CB-CB 4.06Å; P214-L250 HydrophobicContact CB-CD1 4.48Å; P214-L250 HydrophobicContact CG-CB 4.13Å; P214-W251 HydrophobicContact CG-CD2 4.35Å; P214-W251 HydrophobicContact CG-CH2 4.04Å; P214-W251 HydrophobicContact CG-CZ2 3.65Å
215	L	92.2	Very high	89.2	Confident	31 Å²	31	24.1 Å²	24.1	16%	0.162	14%	0.136	C	C	.	.	H	α-helix	trans	-70.5	-37.8	176.3	-70.6	169.2	0	0	0	111.5	T212 A213 L218 K219 F238 M452 K453	T212-L215 PolarHBondContact O-N 3.45Å; A213-L215 VanDerWaalsContact C-N 3.33Å; A213-L215 PolarHBondContact O-N 2.9Å; L215-L218 PolarHBondContact O-N 3.09Å; L215-K219 WeakPolarHBondContact O-CB 3.35Å; L215-K219 PolarHBondContact O-N 3.01Å; L215-F238 HydrophobicContact CD2-CE2 4.37Å; L215-F238 HydrophobicContact CD2-CZ 3.99Å; L215-M452 HydrophobicContact CD1-CB 4.31Å; L215-M452 HydrophobicContact CD2-CB 4.32Å; L215-M452 HydrophobicContact CD2-CE 4.38Å; L215-K453 HydrophobicContact CB-CB 4.06Å; L215-K453 HydrophobicContact CD1-CB 4.01Å
216	D	89.8	Confident	88.3	Confident	16 Å²	16	24 Å²	24	9%	0.086	14%	0.135	C	C	.	.	H	α-helix	trans	-63.3	-43.4	176	-157.9	61.7	0	0	0	111.8	T212 A213 K219 I220 K313 K453	T212-D216 PolarHBondContact O-N 3.45Å; A213-D216 WeakPolarHBondContact O-CB 3.19Å; A213-D216 PolarHBondContact O-N 3.34Å; D216-K219 WeakPolarHBondContact O-CB 3.43Å; D216-K219 PolarHBondContact O-N 3.41Å; D216-I220 WeakPolarHBondContact O-CG1 3.38Å; D216-I220 PolarHBondContact O-N 3.06Å; D216-I220 VanDerWaalsContact O-N 3.14Å; D216-K313 WeakPolarHBondContact OD2-CE 3.22Å; D216-K313 IonicContact OD2-NZ 3.42Å; D216-K313 PolarHBondContact OD2-NZ 2.98Å; D216-K453 HydrophobicContact CB-CD 4.35Å; D216-K453 VanDerWaalsContact CG-NZ 3.29Å; D216-K453 IonicContact OD1-NZ 3.19Å; D216-K453 PolarHBondContact OD1-NZ 3.11Å; D216-K453 IonicContact OD2-NZ 2.87Å
217	R	92.4	Very high	86.8	Confident	4 Å²	4	26 Å²	26	2%	0.015	15%	0.147	C	C	.	.	H	α-helix	trans	-66	-43.4	175.2	-171.9	178.6	178.8	-134.8	-1.9	111.3	A213 K219 I220 M221 M241 S249 A317	A213-R217 PolarHBondContact O-N 3.49Å; R217-K219 VanDerWaalsContact C-N 3.33Å; R217-K219 PolarHBondContact O-N 3.4Å; R217-I220 PolarHBondContact O-N 3.45Å; R217-M221 HydrophobicContact CG-CG 4.44Å; R217-M221 WeakPolarHBondContact O-CG 3.48Å; R217-M221 PolarHBondContact O-N 3.48Å; R217-M241 HydrophobicContact CB-SD 4.46Å; R217-M241 HydrophobicContact CG-SD 3.92Å; R217-S249 VanDerWaalsContact CD-O 3.24Å; R217-S249 WeakPolarHBondContact CD-O 3.26Å; R217-S249 PolarHBondContact NE-O 3.1Å; R217-S249 PolarHBondContact NH1-O 3.39Å; R217-S249 PolarHBondContact NH1-OG 2.99Å; R217-A317 HydrophobicContact CG-CB 4.35Å; R217-A317 PolarHBondContact NE-O 3.48Å; R217-A317 VanDerWaalsContact NE-O 3.14Å
218	L	92.3	Very high	85.2	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-58.9	-45	176.4	177.9	63.9	0	0	0	111.5	P214 L215 I220 M221 M222 I234 F238 M241 P449	P214-L218 WeakPolarHBondContact O-CB 3.43Å; P214-L218 PolarHBondContact O-N 2.85Å; L215-L218 PolarHBondContact O-N 3.09Å; L218-I220 PolarHBondContact O-N 3.1Å; L218-M221 PolarHBondContact O-N 3.28Å; L218-M222 HydrophobicContact CD1-CG 4.11Å; L218-M222 HydrophobicContact CD1-SD 4.11Å; L218-M222 HydrophobicContact CD2-SD 4.45Å; L218-M222 HydrophobicContact CG-CG 4.4Å; L218-M222 HydrophobicContact CG-SD 4Å; L218-M222 WeakPolarHBondContact O-CG 3.4Å; L218-M222 PolarHBondContact O-N 3.11Å; L218-I234 HydrophobicContact CD2-CB 4.26Å; L218-I234 HydrophobicContact CD2-CG1 4.38Å; L218-I234 HydrophobicContact CD2-CG2 3.73Å; L218-F238 HydrophobicContact CB-CE1 4.31Å; L218-F238 HydrophobicContact CB-CZ 4.23Å; L218-F238 HydrophobicContact CD2-CD2 3.89Å; L218-F238 HydrophobicContact CD2-CE1 4.39Å; L218-F238 HydrophobicContact CD2-CE2 3.45Å; L218-F238 VanDerWaalsContact CD2-CE2 3.45Å; L218-F238 HydrophobicContact CD2-CZ 3.73Å; L218-M241 HydrophobicContact CB-CE 4.01Å; L218-M241 HydrophobicContact CD1-CE 4.09Å; L218-P449 HydrophobicContact CD2-CB 4.22Å; L218-P449 HydrophobicContact CD2-CG 3.87Å; L218-P449 HydrophobicContact CG-CB 4.36Å; L218-P449 HydrophobicContact CG-CG 3.98Å
219	K	91.9	Very high	83.5	Confident	38 Å²	38	32.6 Å²	32.6	17%	0.165	18%	0.178	C	C	.	.	H	α-helix	trans	-52.2	-54.9	173.6	171.2	-169.2	174.6	176.4	0	110.7	L215 D216 R217 M221 M222 Q223 P449 N450	L215-K219 WeakPolarHBondContact O-CB 3.35Å; L215-K219 PolarHBondContact O-N 3.01Å; D216-K219 WeakPolarHBondContact O-CB 3.43Å; D216-K219 PolarHBondContact O-N 3.41Å; R217-K219 VanDerWaalsContact C-N 3.33Å; R217-K219 PolarHBondContact O-N 3.4Å; K219-M221 VanDerWaalsContact C-N 3.31Å; K219-M221 PolarHBondContact O-N 3.33Å; K219-M222 PolarHBondContact O-N 2.8Å; K219-Q223 HydrophobicContact CG-CG 4.39Å; K219-Q223 WeakPolarHBondContact O-CB 3.34Å; K219-Q223 VanDerWaalsContact O-CG 3.26Å; K219-Q223 WeakPolarHBondContact O-CG 3.28Å; K219-Q223 PolarHBondContact O-N 3.06Å; K219-P449 HydrophobicContact CB-CB 4.19Å; K219-N450 HydrophobicContact CD-CB 4.01Å; K219-N450 WeakPolarHBondContact CE-OD1 3.25Å; K219-N450 PolarHBondContact NZ-OD1 3.1Å
220	I	90.9	Very high	81.8	Confident	9 Å²	9	37 Å²	37	5%	0.046	21%	0.206	C	C	.	.	H	α-helix	trans	-59.7	-43.3	-178.2	-66.4	167.9	0	0	0	110.8	D216 R217 L218 M222 Q223 V224 T314 A317 V318 T411	D216-I220 WeakPolarHBondContact O-CG1 3.38Å; D216-I220 PolarHBondContact O-N 3.06Å; D216-I220 VanDerWaalsContact O-N 3.14Å; R217-I220 PolarHBondContact O-N 3.45Å; L218-I220 PolarHBondContact O-N 3.1Å; I220-M222 PolarHBondContact O-N 3.45Å; I220-Q223 PolarHBondContact O-N 2.87Å; I220-V224 HydrophobicContact CG2-CG2 4.47Å; I220-V224 WeakPolarHBondContact O-CG2 3.41Å; I220-V224 PolarHBondContact O-N 3.25Å; I220-T314 HydrophobicContact CG2-CG2 4.19Å; I220-A317 HydrophobicContact CB-CB 4.45Å; I220-A317 HydrophobicContact CD1-CB 3.87Å; I220-A317 HydrophobicContact CG2-CB 4.09Å; I220-V318 HydrophobicContact CG2-CG2 3.54Å; I220-T411 HydrophobicContact CG2-CG2 4.19Å
221	M	89.4	Confident	80.1	Confident	10 Å²	10	43.6 Å²	43.6	5%	0.049	23%	0.23	C	C	.	.	H	α-helix	trans	-62.4	-43.9	178.1	-71.6	-62.3	-74.4	0	0	112.3	R217 L218 K219 V224 H225 M232 M241	R217-M221 HydrophobicContact CG-CG 4.44Å; R217-M221 WeakPolarHBondContact O-CG 3.48Å; R217-M221 PolarHBondContact O-N 3.48Å; L218-M221 PolarHBondContact O-N 3.28Å; K219-M221 VanDerWaalsContact C-N 3.31Å; K219-M221 PolarHBondContact O-N 3.33Å; M221-V224 PolarHBondContact O-N 2.93Å; M221-H225 WeakPolarHBondContact O-CB 3.45Å; M221-H225 PolarHBondContact O-N 2.98Å; M221-M232 HydrophobicContact CB-CE 4.2Å; M221-M241 HydrophobicContact CG-SD 4.18Å
222	M	88.8	Confident	78.7	Confident	29 Å²	29	41.8 Å²	41.8	14%	0.143	22%	0.215	C	C	.	.	H	α-helix	trans	-65.7	-38	176.3	-70.7	-179.9	73.3	0	0	112.4	L218 K219 I220 G226 M232 P449	L218-M222 HydrophobicContact CD1-CG 4.11Å; L218-M222 HydrophobicContact CD1-SD 4.11Å; L218-M222 HydrophobicContact CD2-SD 4.45Å; L218-M222 HydrophobicContact CG-CG 4.4Å; L218-M222 HydrophobicContact CG-SD 4Å; L218-M222 WeakPolarHBondContact O-CG 3.4Å; L218-M222 PolarHBondContact O-N 3.11Å; K219-M222 PolarHBondContact O-N 2.8Å; I220-M222 PolarHBondContact O-N 3.45Å; M222-G226 PolarHBondContact O-N 3.43Å; M222-M232 HydrophobicContact CB-CE 4.14Å; M222-M232 WeakPolarHBondContact CE-O 3.14Å; M222-M232 HydrophobicContact CG-CE 3.33Å; M222-P449 HydrophobicContact SD-CG 3.5Å; M222-P449 VanDerWaalsContact SD-CG 3.5Å
223	Q	88.9	Confident	78.2	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-63.9	-40.1	177.5	-76.9	-176.9	-25.7	0	0	112.1	K219 I220 Y404 L408 T411 R412 R445	K219-Q223 HydrophobicContact CG-CG 4.39Å; K219-Q223 WeakPolarHBondContact O-CB 3.34Å; K219-Q223 VanDerWaalsContact O-CG 3.26Å; K219-Q223 WeakPolarHBondContact O-CG 3.28Å; K219-Q223 PolarHBondContact O-N 3.06Å; I220-Q223 PolarHBondContact O-N 2.87Å; Q223-Y404 PolarHBondContact NE2-OH 3.4Å; Q223-L408 HydrophobicContact CB-CD1 3.61Å; Q223-L408 HydrophobicContact CG-CD1 3.52Å; Q223-T411 HydrophobicContact CB-CG2 4.37Å; Q223-T411 PolarHBondContact OE1-OG1 3.48Å; Q223-R412 WeakPolarHBondContact O-CG 3.48Å; Q223-R412 PolarHBondContact O-NE 3.28Å; Q223-R412 PolarHBondContact O-NH2 2.87Å; Q223-R445 WeakPolarHBondContact CG-O 3.17Å
224	V	86.2	Confident	77.8	Confident	6 Å²	6	48.7 Å²	48.7	4%	0.036	25%	0.251	C	S	.	.	H	α-helix	trans	-87.8	-45	-175.2	176.3	0	0	0	0	112.7	I220 M221 V318 T411 A415 L419	I220-V224 HydrophobicContact CG2-CG2 4.47Å; I220-V224 WeakPolarHBondContact O-CG2 3.41Å; I220-V224 PolarHBondContact O-N 3.25Å; M221-V224 PolarHBondContact O-N 2.93Å; V224-V318 HydrophobicContact CB-CG2 4.34Å; V224-V318 HydrophobicContact CG1-CG1 4.1Å; V224-V318 HydrophobicContact CG1-CG2 4.42Å; V224-V318 HydrophobicContact CG2-CG2 3.93Å; V224-T411 HydrophobicContact CG2-CG2 4.2Å; V224-A415 HydrophobicContact CB-CB 4.31Å; V224-A415 HydrophobicContact CG1-CB 3.73Å; V224-A415 HydrophobicContact CG2-CB 3.53Å; V224-L419 HydrophobicContact CG1-CD1 4.14Å; V224-L419 HydrophobicContact CG1-CD2 4.34Å; V224-L419 HydrophobicContact CG1-CG 4.41Å
225	H	79.9	Confident	77.5	Confident	55 Å²	55	55.1 Å²	55.1	26%	0.255	28%	0.277	S	S	.	.	H	α-helix	trans	-97.7	-5.7	-170.8	-67.9	104	0	0	0	115.2	M221 S227 K228	M221-H225 WeakPolarHBondContact O-CB 3.45Å; M221-H225 PolarHBondContact O-N 2.98Å; H225-S227 PolarHBondContact O-N 3.21Å; H225-K228 PolarHBondContact O-N 3.21Å; H225-K228 VanDerWaalsContact O-N 3.08Å
226	G	62.1	Low	77.1	Confident	9 Å²	9	54.8 Å²	54.8	9%	0.093	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-19.9	-174.7	0	0	0	0	0	115.2	M222 R445	M222-G226 PolarHBondContact O-N 3.43Å; G226-R445 VanDerWaalsContact C-CZ 3.42Å; G226-R445 PolarHBondContact O-NH1 3.26Å; G226-R445 PolarHBondContact O-NH2 3.09Å
227	S	56.7	Low	77	Confident	62 Å²	62	54.1 Å²	54.1	43%	0.434	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-24.1	-178.8	-145.4	0	0	0	0	114	H225 E438 R445	H225-S227 PolarHBondContact O-N 3.21Å; S227-E438 WeakPolarHBondContact CB-OE1 3.36Å; S227-E438 PolarHBondContact OG-OE1 3.44Å; S227-R445 VanDerWaalsContact N-NH1 3.14Å
228	K	56	Low	76.9	Confident	151 Å²	151	56.2 Å²	56.2	66%	0.657	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-21.8	-172.3	-69.7	-168.4	177.4	-175.8	0	114.5	H225	H225-K228 PolarHBondContact O-N 3.21Å; H225-K228 VanDerWaalsContact O-N 3.08Å
229	S	49.7	Very low	76.8	Confident	57 Å²	57	64.7 Å²	64.7	40%	0.399	32%	0.319	S	S	.	.	S	Bend	trans	-114.9	119.3	179.7	-162.4	0	0	0	0	108.8	K231	S229-K231 PolarHBondContact O-N 3.1Å
230	D	50.3	Low	76.6	Confident	159 Å²	159	67.3 Å²	67.3	85%	0.85	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.4	124.5	175	-129.1	-17.8	0	0	0	110.3	M232	D230-M232 PolarHBondContact O-N 3.37Å
231	K	56	Low	76.5	Confident	190 Å²	190	67 Å²	67	83%	0.826	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	18	71.4	177.9	-63.6	178.5	-176.9	174.8	0	114.8	S229 N233	S229-K231 PolarHBondContact O-N 3.1Å; K231-N233 PolarHBondContact O-N 3.08Å
232	M	63.2	Low	76.6	Confident	24 Å²	24	69.2 Å²	69.2	12%	0.118	34%	0.344	C	S	.	.			trans	-60.8	100.4	173.7	-167.2	169.2	77.1	0	0	109.4	M221 M222 D230	M221-M232 HydrophobicContact CB-CE 4.2Å; M222-M232 HydrophobicContact CB-CE 4.14Å; M222-M232 WeakPolarHBondContact CE-O 3.14Å; M222-M232 HydrophobicContact CG-CE 3.33Å; D230-M232 PolarHBondContact O-N 3.37Å
233	N	78.1	Confident	76.7	Confident	103 Å²	103	76.7 Å²	76.7	55%	0.551	38%	0.376	S	S	*	.			trans	-73	160.3	172.2	61.2	13.6	0	0	0	109.6	K231 F235 G236 G237	K231-N233 PolarHBondContact O-N 3.08Å; N233-F235 VanDerWaalsContact C-N 3.28Å; N233-F235 PolarHBondContact O-N 2.93Å; N233-G236 PolarHBondContact O-N 3.22Å; N233-G236 VanDerWaalsContact O-N 3.15Å; N233-G236 WeakPolarHBondContact OD1-CA 3.36Å; N233-G236 PolarHBondContact OD1-N 2.96Å; N233-G237 PolarHBondContact O-N 3.3Å
234	I	85.4	Confident	76.6	Confident	50 Å²	50	79.7 Å²	79.7	26%	0.256	39%	0.39	S	S	.	.	H	α-helix	trans	-53.8	-47	-175.3	-69.3	170.3	0	0	0	111.1	L218 G237 F238 T448 P449 M452	L218-I234 HydrophobicContact CD2-CB 4.26Å; L218-I234 HydrophobicContact CD2-CG1 4.38Å; L218-I234 HydrophobicContact CD2-CG2 3.73Å; I234-G237 PolarHBondContact O-N 2.9Å; I234-F238 HydrophobicContact CG2-CD2 3.9Å; I234-F238 HydrophobicContact CG2-CE2 3.76Å; I234-F238 VanDerWaalsContact O-CD2 3.29Å; I234-F238 WeakPolarHBondContact O-CD2 3.08Å; I234-F238 PolarHBondContact O-N 3.02Å; I234-T448 HydrophobicContact CD1-CG2 3.78Å; I234-P449 HydrophobicContact CG1-CG 4.49Å; I234-M452 HydrophobicContact CD1-SD 3.7Å
235	F	86.6	Confident	76.5	Confident	154 Å²	154	80.6 Å²	80.6	68%	0.675	40%	0.4	S	S	*	.	H	α-helix	trans	-65.7	-42	-179.8	-172.1	-98.9	0	0	0	112.7	N233 G237 F238 R239	N233-F235 VanDerWaalsContact C-N 3.28Å; N233-F235 PolarHBondContact O-N 2.93Å; F235-G237 VanDerWaalsContact C-N 3.34Å; F235-F238 PolarHBondContact O-N 3Å; F235-R239 WeakPolarHBondContact O-CB 3.24Å; F235-R239 PolarHBondContact O-N 3.07Å
236	G	85.2	Confident	77	Confident	24 Å²	24	79.6 Å²	79.6	25%	0.247	41%	0.405	C	S	.	.	H	α-helix	trans	-63.6	-39.7	175.8	0	0	0	0	0	112.1	N233 R239 Q240	N233-G236 PolarHBondContact O-N 3.22Å; N233-G236 VanDerWaalsContact O-N 3.15Å; N233-G236 WeakPolarHBondContact OD1-CA 3.36Å; N233-G236 PolarHBondContact OD1-N 2.96Å; G236-R239 PolarHBondContact O-N 3.46Å; G236-Q240 WeakPolarHBondContact O-CB 3.4Å; G236-Q240 PolarHBondContact O-N 3.13Å
237	G	86.7	Confident	78.4	Confident	1 Å²	1	84.8 Å²	84.8	1%	0.01	43%	0.429	C	S	.	.	H	α-helix	trans	-62	-47.4	173.9	0	0	0	0	0	112.4	N233 I234 F235 Q240 M241	N233-G237 PolarHBondContact O-N 3.3Å; I234-G237 PolarHBondContact O-N 2.9Å; F235-G237 VanDerWaalsContact C-N 3.34Å; G237-Q240 PolarHBondContact O-N 3.26Å; G237-M241 WeakPolarHBondContact O-CG 3.36Å; G237-M241 PolarHBondContact O-N 3.24Å
238	F	90.9	Very high	80	Confident	48 Å²	48	92.6 Å²	92.6	21%	0.211	45%	0.449	C	S	.	.	H	α-helix	trans	-60.2	-46.9	173.3	-79.6	-59.7	0	0	0	112.4	P214 L215 L218 I234 F235 Q240 M241 V242 L250	P214-F238 HydrophobicContact CB-CE1 3.93Å; P214-F238 HydrophobicContact CB-CZ 4.49Å; L215-F238 HydrophobicContact CD2-CE2 4.37Å; L215-F238 HydrophobicContact CD2-CZ 3.99Å; L218-F238 HydrophobicContact CB-CE1 4.31Å; L218-F238 HydrophobicContact CB-CZ 4.23Å; L218-F238 HydrophobicContact CD2-CD2 3.89Å; L218-F238 HydrophobicContact CD2-CE1 4.39Å; L218-F238 HydrophobicContact CD2-CE2 3.45Å; L218-F238 VanDerWaalsContact CD2-CE2 3.45Å; L218-F238 HydrophobicContact CD2-CZ 3.73Å; I234-F238 HydrophobicContact CG2-CD2 3.9Å; I234-F238 HydrophobicContact CG2-CE2 3.76Å; I234-F238 VanDerWaalsContact O-CD2 3.29Å; I234-F238 WeakPolarHBondContact O-CD2 3.08Å; I234-F238 PolarHBondContact O-N 3.02Å; F235-F238 PolarHBondContact O-N 3Å; F238-Q240 VanDerWaalsContact C-N 3.31Å; F238-Q240 PolarHBondContact O-N 3.12Å; F238-M241 HydrophobicContact CB-CE 4.46Å; F238-M241 HydrophobicContact CD1-CE 3.33Å; F238-M241 HydrophobicContact CE1-CE 3.76Å; F238-M241 HydrophobicContact CG-CE 4.1Å; F238-M241 PolarHBondContact O-N 2.94Å; F238-V242 WeakPolarHBondContact O-CG2 3.46Å; F238-V242 PolarHBondContact O-N 3.32Å; F238-L250 HydrophobicContact CD1-CD2 3.76Å; F238-L250 HydrophobicContact CE1-CD2 4.21Å
239	R	89.9	Confident	81.6	Confident	179 Å²	179	85.6 Å²	85.6	68%	0.675	42%	0.419	S	S	*	.	H	α-helix	trans	-59.2	-41.6	178.2	-173.2	177.5	-177.2	-178.3	1.5	111.8	F235 G236 K243	F235-R239 WeakPolarHBondContact O-CB 3.24Å; F235-R239 PolarHBondContact O-N 3.07Å; G236-R239 PolarHBondContact O-N 3.46Å; R239-K243 VanDerWaalsContact O-CB 3.22Å; R239-K243 WeakPolarHBondContact O-CB 3.39Å; R239-K243 PolarHBondContact O-N 3.4Å
240	Q	87.1	Confident	83.6	Confident	92 Å²	92	83.9 Å²	83.9	43%	0.43	41%	0.405	S	S	.	.	H	α-helix	trans	-65.7	-46.2	177.6	-177.2	176.5	-3	0	0	111.7	G236 G237 F238 V242 K243 E244	G236-Q240 WeakPolarHBondContact O-CB 3.4Å; G236-Q240 PolarHBondContact O-N 3.13Å; G237-Q240 PolarHBondContact O-N 3.26Å; F238-Q240 VanDerWaalsContact C-N 3.31Å; F238-Q240 PolarHBondContact O-N 3.12Å; Q240-V242 VanDerWaalsContact C-N 3.35Å; Q240-V242 PolarHBondContact O-N 3.3Å; Q240-K243 PolarHBondContact O-N 2.94Å; Q240-E244 WeakPolarHBondContact O-CB 3.17Å; Q240-E244 PolarHBondContact O-N 3.29Å
241	M	89.8	Confident	85.7	Confident	4 Å²	4	81 Å²	81	2%	0.02	38%	0.383	C	S	.	.	H	α-helix	trans	-59.9	-45.3	177.3	-71.1	-173.9	-61.2	0	0	111.7	R217 L218 M221 G237 F238 E244 G245 S249 L250	R217-M241 HydrophobicContact CB-SD 4.46Å; R217-M241 HydrophobicContact CG-SD 3.92Å; L218-M241 HydrophobicContact CB-CE 4.01Å; L218-M241 HydrophobicContact CD1-CE 4.09Å; M221-M241 HydrophobicContact CG-SD 4.18Å; G237-M241 WeakPolarHBondContact O-CG 3.36Å; G237-M241 PolarHBondContact O-N 3.24Å; F238-M241 HydrophobicContact CB-CE 4.46Å; F238-M241 HydrophobicContact CD1-CE 3.33Å; F238-M241 HydrophobicContact CE1-CE 3.76Å; F238-M241 HydrophobicContact CG-CE 4.1Å; F238-M241 PolarHBondContact O-N 2.94Å; M241-E244 PolarHBondContact O-N 3.06Å; M241-G245 PolarHBondContact O-N 3.45Å; M241-G245 VanDerWaalsContact O-N 3.1Å; M241-S249 PolarHBondContact O-OG 3.21Å; M241-L250 HydrophobicContact CB-CD2 3.98Å; M241-L250 HydrophobicContact CE-CD2 3.54Å; M241-L250 HydrophobicContact SD-CD2 4.26Å
242	V	92.2	Very high	87.4	Confident	55 Å²	55	74.7 Å²	74.7	33%	0.333	35%	0.354	S	S	.	.	H	α-helix	trans	-67.1	-38.9	178.4	175.4	0	0	0	0	111.2	F238 Q240 E244 G246 I247 L250	F238-V242 WeakPolarHBondContact O-CG2 3.46Å; F238-V242 PolarHBondContact O-N 3.32Å; Q240-V242 VanDerWaalsContact C-N 3.35Å; Q240-V242 PolarHBondContact O-N 3.3Å; V242-E244 VanDerWaalsContact C-N 3.33Å; V242-E244 PolarHBondContact O-N 3.05Å; V242-G246 WeakPolarHBondContact O-CA 3.34Å; V242-G246 PolarHBondContact O-N 2.96Å; V242-I247 HydrophobicContact CG1-CG1 4.35Å; V242-L250 HydrophobicContact CG2-CD1 4.3Å; V242-L250 HydrophobicContact CG2-CD2 4.16Å; V242-L250 HydrophobicContact CG2-CG 4.31Å
243	K	89.3	Confident	88.6	Confident	186 Å²	186	74 Å²	74	81%	0.809	35%	0.353	S	S	*	.	H	α-helix	trans	-66	-34	176.1	-171.2	177.9	179.4	-176.8	0	112.5	R239 Q240	R239-K243 VanDerWaalsContact O-CB 3.22Å; R239-K243 WeakPolarHBondContact O-CB 3.39Å; R239-K243 PolarHBondContact O-N 3.4Å; Q240-K243 PolarHBondContact O-N 2.94Å
244	E	87.7	Confident	89.3	Confident	65 Å²	65	70.1 Å²	70.1	30%	0.304	33%	0.333	S	S	.	.	H	α-helix	trans	-78.6	-36.1	-178.5	-169.7	-148.6	120.5	0	0	113.6	Q240 M241 V242 R252 K320 T321	Q240-E244 WeakPolarHBondContact O-CB 3.17Å; Q240-E244 PolarHBondContact O-N 3.29Å; M241-E244 PolarHBondContact O-N 3.06Å; V242-E244 VanDerWaalsContact C-N 3.33Å; V242-E244 PolarHBondContact O-N 3.05Å; E244-R252 IonicContact OE1-NH1 2.74Å; E244-R252 PolarHBondContact OE1-NH1 3.13Å; E244-K320 VanDerWaalsContact OE1-CA 3.25Å; E244-K320 WeakPolarHBondContact OE1-CA 3.27Å; E244-T321 PolarHBondContact O-OG1 3.02Å; E244-T321 PolarHBondContact OE1-N 2.98Å; E244-T321 PolarHBondContact OE1-OG1 2.61Å
245	G	83.4	Confident	89.6	Confident	25 Å²	25	69.6 Å²	69.6	26%	0.258	34%	0.339	S	S	.	.	H	α-helix	trans	-144.7	13.9	-170.7	0	0	0	0	0	115.6	M241 S249 T321	M241-G245 PolarHBondContact O-N 3.45Å; M241-G245 VanDerWaalsContact O-N 3.1Å; G245-S249 WeakPolarHBondContact O-CB 3.49Å; G245-T321 VanDerWaalsContact CA-OG1 3.23Å; G245-T321 WeakPolarHBondContact CA-OG1 3.14Å
246	G	90.9	Very high	89.8	Confident	33 Å²	33	62.4 Å²	62.4	34%	0.34	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	-174.4	-175	0	0	0	0	0	113.3	V242 R248 S249	V242-G246 WeakPolarHBondContact O-CA 3.34Å; V242-G246 PolarHBondContact O-N 2.96Å; G246-R248 PolarHBondContact O-N 3.37Å; G246-S249 VanDerWaalsContact O-CB 3.31Å; G246-S249 WeakPolarHBondContact O-CB 3.22Å; G246-S249 PolarHBondContact O-N 2.98Å; G246-S249 PolarHBondContact O-OG 3.38Å
247	I	91.3	Very high	89.8	Confident	119 Å²	119	61.5 Å²	61.5	61%	0.61	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-63	-40.6	-176.5	-63.9	167.1	0	0	0	111.5	V242 S249 L250 W251	V242-I247 HydrophobicContact CG1-CG1 4.35Å; I247-S249 PolarHBondContact O-N 3.22Å; I247-S249 VanDerWaalsContact O-N 3.11Å; I247-L250 WeakPolarHBondContact O-CB 3.29Å; I247-L250 VanDerWaalsContact O-CG 3.32Å; I247-L250 WeakPolarHBondContact O-CG 3.24Å; I247-L250 PolarHBondContact O-N 2.97Å; I247-L250 VanDerWaalsContact O-N 3.09Å; I247-W251 HydrophobicContact CG2-CZ3 4.17Å; I247-W251 WeakPolarHBondContact O-CZ3 3.18Å
248	R	90.2	Very high	90	Very high	225 Å²	225	63.6 Å²	63.6	85%	0.849	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-61	-24	179.1	-69.2	-174.6	179.5	177.8	0.3	112.9	G246 L250 W251	G246-R248 PolarHBondContact O-N 3.37Å; R248-L250 PolarHBondContact O-N 2.71Å; R248-W251 PolarHBondContact O-N 3.04Å
249	S	90.1	Very high	90	Very high	5 Å²	5	66 Å²	66	4%	0.035	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-61.1	-28.4	177.6	77.4	0	0	0	0	112.4	R217 M241 G245 G246 I247 W251 R252	R217-S249 VanDerWaalsContact CD-O 3.24Å; R217-S249 WeakPolarHBondContact CD-O 3.26Å; R217-S249 PolarHBondContact NE-O 3.1Å; R217-S249 PolarHBondContact NH1-O 3.39Å; R217-S249 PolarHBondContact NH1-OG 2.99Å; M241-S249 PolarHBondContact O-OG 3.21Å; G245-S249 WeakPolarHBondContact O-CB 3.49Å; G246-S249 VanDerWaalsContact O-CB 3.31Å; G246-S249 WeakPolarHBondContact O-CB 3.22Å; G246-S249 PolarHBondContact O-N 2.98Å; G246-S249 PolarHBondContact O-OG 3.38Å; I247-S249 PolarHBondContact O-N 3.22Å; I247-S249 VanDerWaalsContact O-N 3.11Å; S249-W251 PolarHBondContact O-N 3.1Å; S249-R252 WeakPolarHBondContact O-CB 3.24Å; S249-R252 PolarHBondContact O-N 3.22Å
250	L	92.5	Very high	90	Very high	20 Å²	20	58.1 Å²	58.1	11%	0.105	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-56.4	-25.7	-178.8	-62.1	177.5	0	0	0	113.1	P214 F238 M241 V242 I247 R248	P214-L250 HydrophobicContact CB-CB 4.06Å; P214-L250 HydrophobicContact CB-CD1 4.48Å; P214-L250 HydrophobicContact CG-CB 4.13Å; F238-L250 HydrophobicContact CD1-CD2 3.76Å; F238-L250 HydrophobicContact CE1-CD2 4.21Å; M241-L250 HydrophobicContact CB-CD2 3.98Å; M241-L250 HydrophobicContact CE-CD2 3.54Å; M241-L250 HydrophobicContact SD-CD2 4.26Å; V242-L250 HydrophobicContact CG2-CD1 4.3Å; V242-L250 HydrophobicContact CG2-CD2 4.16Å; V242-L250 HydrophobicContact CG2-CG 4.31Å; I247-L250 WeakPolarHBondContact O-CB 3.29Å; I247-L250 VanDerWaalsContact O-CG 3.32Å; I247-L250 WeakPolarHBondContact O-CG 3.24Å; I247-L250 PolarHBondContact O-N 2.97Å; I247-L250 VanDerWaalsContact O-N 3.09Å; R248-L250 PolarHBondContact O-N 2.71Å
251	W	93.9	Very high	89.9	Confident	99 Å²	99	54.5 Å²	54.5	38%	0.375	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-96.4	9.4	177.2	-71.4	-95.1	0	0	0	114.4	T210 A213 P214 I247 R248 S249 G253 N254	T210-W251 PolarHBondContact O-NE1 2.95Å; A213-W251 HydrophobicContact CB-CG 4.3Å; P214-W251 HydrophobicContact CG-CD2 4.35Å; P214-W251 HydrophobicContact CG-CH2 4.04Å; P214-W251 HydrophobicContact CG-CZ2 3.65Å; I247-W251 HydrophobicContact CG2-CZ3 4.17Å; I247-W251 WeakPolarHBondContact O-CZ3 3.18Å; R248-W251 PolarHBondContact O-N 3.04Å; S249-W251 PolarHBondContact O-N 3.1Å; W251-G253 PolarHBondContact O-N 3.07Å; W251-N254 HydrophobicContact CB-CB 4.29Å; W251-N254 WeakPolarHBondContact O-CB 3.41Å; W251-N254 PolarHBondContact O-N 3.17Å
252	R	90.8	Very high	89.7	Confident	57 Å²	57	57.7 Å²	57.7	22%	0.215	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	124.5	179.7	-167.5	-179.1	-74.6	156.6	3	110.1	E244 S249 L316 G319 K320 T321	E244-R252 IonicContact OE1-NH1 2.74Å; E244-R252 PolarHBondContact OE1-NH1 3.13Å; S249-R252 WeakPolarHBondContact O-CB 3.24Å; S249-R252 PolarHBondContact O-N 3.22Å; R252-L316 WeakPolarHBondContact CD-O 3.39Å; R252-L316 WeakPolarHBondContact CG-O 3.36Å; R252-G319 PolarHBondContact NH1-O 3.22Å; R252-K320 VanDerWaalsContact NH1-C 3.27Å; R252-T321 VanDerWaalsContact NH1-N 3.13Å; R252-T321 VanDerWaalsContact NH2-CA 3.31Å; R252-T321 PolarHBondContact NH2-OG1 2.71Å
253	G	88.8	Confident	89.6	Confident	11 Å²	11	57.1 Å²	57.1	11%	0.113	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	-10.3	-173.8	0	0	0	0	0	114.9	W251 G255 T256 N257	W251-G253 PolarHBondContact O-N 3.07Å; G253-G255 VanDerWaalsContact C-N 3.31Å; G253-G255 PolarHBondContact O-N 3.25Å; G253-T256 PolarHBondContact O-N 2.96Å; G253-N257 PolarHBondContact O-N 3.43Å
254	N	92.7	Very high	89.5	Confident	21 Å²	21	50.8 Å²	50.8	11%	0.112	28%	0.276	C	S	.	.	H	α-helix	trans	-63.9	-34.8	179.6	-173.4	55.5	0	0	0	112.7	R209 T210 A213 W251 T256 N257 V258	R209-N254 PolarHBondContact O-OD1 3.22Å; T210-N254 PolarHBondContact OG1-ND2 2.71Å; A213-N254 HydrophobicContact CB-CB 3.93Å; W251-N254 HydrophobicContact CB-CB 4.29Å; W251-N254 WeakPolarHBondContact O-CB 3.41Å; W251-N254 PolarHBondContact O-N 3.17Å; N254-T256 VanDerWaalsContact C-N 3.31Å; N254-T256 PolarHBondContact O-N 2.86Å; N254-N257 CarbonylContact O-C 3.56Å; N254-N257 WeakPolarHBondContact O-CA 3.3Å; N254-N257 VanDerWaalsContact O-CB 3.29Å; N254-N257 WeakPolarHBondContact O-CB 3.42Å; N254-N257 PolarHBondContact O-N 2.77Å; N254-V258 PolarHBondContact O-N 2.83Å
255	G	91.4	Very high	89.2	Confident	39 Å²	39	50.2 Å²	50.2	40%	0.402	28%	0.277	S	S	.	.	H	α-helix	trans	-55	-45.6	177.5	0	0	0	0	0	112.5	G253 N257 V258 I259	G253-G255 VanDerWaalsContact C-N 3.31Å; G253-G255 PolarHBondContact O-N 3.25Å; G255-N257 VanDerWaalsContact C-N 3.28Å; G255-N257 PolarHBondContact O-N 3.01Å; G255-V258 PolarHBondContact O-N 3.13Å; G255-I259 WeakPolarHBondContact O-CB 3.46Å; G255-I259 VanDerWaalsContact O-CG1 3.28Å; G255-I259 WeakPolarHBondContact O-CG1 3.29Å; G255-I259 PolarHBondContact O-N 3.38Å
256	T	90.4	Very high	89.3	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.018	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-36	174.7	-47.2	0	0	0	0	112	G253 N254 V258 K260 M309 M312 K313 L316 I327	G253-T256 PolarHBondContact O-N 2.96Å; N254-T256 VanDerWaalsContact C-N 3.31Å; N254-T256 PolarHBondContact O-N 2.86Å; T256-V258 VanDerWaalsContact C-N 3.34Å; T256-K260 WeakPolarHBondContact O-CB 3.31Å; T256-K260 WeakPolarHBondContact O-CG 3.19Å; T256-K260 PolarHBondContact O-N 3.46Å; T256-K260 VanDerWaalsContact O-N 3.16Å; T256-M309 HydrophobicContact CG2-CB 3.9Å; T256-M309 WeakPolarHBondContact CG2-O 3.36Å; T256-M312 HydrophobicContact CG2-CB 4.36Å; T256-K313 HydrophobicContact CG2-CB 4.11Å; T256-L316 WeakPolarHBondContact OG1-CD1 3.21Å; T256-I327 WeakPolarHBondContact OG1-CD1 2.99Å
257	N	86	Confident	89.2	Confident	5 Å²	5	51.6 Å²	51.6	3%	0.027	28%	0.28	C	S	.	.	H	α-helix	trans	-70.6	-27.2	179.7	-162.2	48.9	0	0	0	113.3	R209 G253 N254 G255 K260 K313	R209-N257 WeakPolarHBondContact CD-ND2 3.31Å; R209-N257 WeakPolarHBondContact CD-O 3.44Å; G253-N257 PolarHBondContact O-N 3.43Å; N254-N257 CarbonylContact O-C 3.56Å; N254-N257 WeakPolarHBondContact O-CA 3.3Å; N254-N257 VanDerWaalsContact O-CB 3.29Å; N254-N257 WeakPolarHBondContact O-CB 3.42Å; N254-N257 PolarHBondContact O-N 2.77Å; G255-N257 VanDerWaalsContact C-N 3.28Å; G255-N257 PolarHBondContact O-N 3.01Å; N257-K260 WeakPolarHBondContact O-CG 3.33Å; N257-K260 WeakPolarHBondContact OD1-CE 3.29Å; N257-K313 HydrophobicContact CB-CD 4.16Å; N257-K313 PolarHBondContact OD1-NZ 3.49Å
258	V	90.8	Very high	88.9	Confident	44 Å²	44	49.1 Å²	49.1	27%	0.267	26%	0.264	S	S	.	.	H	α-helix	trans	-86.4	-45.6	174.7	175.6	0	0	0	0	111	A206 N254 G255 T256 K260 I261	A206-V258 HydrophobicContact CB-CG1 3.84Å; N254-V258 PolarHBondContact O-N 2.83Å; G255-V258 PolarHBondContact O-N 3.13Å; T256-V258 VanDerWaalsContact C-N 3.34Å; V258-K260 PolarHBondContact O-N 3.12Å; V258-I261 HydrophobicContact CG1-CD1 4.49Å; V258-I261 WeakPolarHBondContact O-CB 3.42Å; V258-I261 WeakPolarHBondContact O-CD1 3.14Å; V258-I261 WeakPolarHBondContact O-CG1 3.21Å; V258-I261 PolarHBondContact O-N 3.13Å; V258-I261 VanDerWaalsContact O-N 3.17Å
259	I	91.6	Very high	88.5	Confident	99 Å²	99	40.9 Å²	40.9	51%	0.508	24%	0.235	S	C	.	.	H	α-helix	trans	-59.8	-36.1	-179.3	-71.7	167.1	0	0	0	111.5	G255 I261 P263 I327	G255-I259 WeakPolarHBondContact O-CB 3.46Å; G255-I259 VanDerWaalsContact O-CG1 3.28Å; G255-I259 WeakPolarHBondContact O-CG1 3.29Å; G255-I259 PolarHBondContact O-N 3.38Å; I259-I261 PolarHBondContact O-N 3.44Å; I259-P263 WeakPolarHBondContact O-CD 3.13Å; I259-I327 HydrophobicContact CD1-CD1 3.81Å
260	K	89.2	Confident	88.4	Confident	13 Å²	13	47.2 Å²	47.2	6%	0.057	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-19.4	-178.2	73.5	175.6	-168.9	172.3	0	114.3	T256 N257 V258 P263 E264 I306 M309 E310	T256-K260 WeakPolarHBondContact O-CB 3.31Å; T256-K260 WeakPolarHBondContact O-CG 3.19Å; T256-K260 PolarHBondContact O-N 3.46Å; T256-K260 VanDerWaalsContact O-N 3.16Å; N257-K260 WeakPolarHBondContact O-CG 3.33Å; N257-K260 WeakPolarHBondContact OD1-CE 3.29Å; V258-K260 PolarHBondContact O-N 3.12Å; K260-P263 VanDerWaalsContact O-CD 3.29Å; K260-P263 WeakPolarHBondContact O-CD 3.2Å; K260-P263 WeakPolarHBondContact O-CG 3.31Å; K260-E264 WeakPolarHBondContact O-CB 2.94Å; K260-E264 PolarHBondContact O-N 3.42Å; K260-I306 HydrophobicContact CB-CG2 3.97Å; K260-I306 HydrophobicContact CD-CG2 4.18Å; K260-M309 HydrophobicContact CB-CB 4.36Å; K260-M309 HydrophobicContact CB-SD 3.74Å; K260-E310 IonicContact NZ-OE1 3.6Å; K260-E310 PolarHBondContact NZ-OE1 3.25Å; K260-E310 IonicContact NZ-OE2 2.77Å; K260-E310 PolarHBondContact NZ-OE2 3.09Å
261	I	84.5	Confident	88.1	Confident	17 Å²	17	46.3 Å²	46.3	9%	0.087	25%	0.254	C	S	.	.	H	α-helix	trans	-59.1	-55	-174.1	-58.5	172.3	0	0	0	110.7	A206 R209 V258 I259 E264 T265	A206-I261 HydrophobicContact CB-CD1 4.16Å; R209-I261 VanDerWaalsContact NH1-CG1 3.26Å; V258-I261 HydrophobicContact CG1-CD1 4.49Å; V258-I261 WeakPolarHBondContact O-CB 3.42Å; V258-I261 WeakPolarHBondContact O-CD1 3.14Å; V258-I261 WeakPolarHBondContact O-CG1 3.21Å; V258-I261 PolarHBondContact O-N 3.13Å; V258-I261 VanDerWaalsContact O-N 3.17Å; I259-I261 PolarHBondContact O-N 3.44Å; I261-E264 PolarHBondContact O-N 3.13Å; I261-T265 WeakPolarHBondContact O-CB 3.42Å; I261-T265 PolarHBondContact O-N 3.46Å; I261-T265 PolarHBondContact O-OG1 3.1Å
262	A	86.4	Confident	87.6	Confident	71 Å²	71	42.3 Å²	42.3	59%	0.587	24%	0.239	S	C	*	.	H	α-helix	trans	-59.9	-52.1	-177.4	0	0	0	0	0	113.8	E264 T265 A266	A262-E264 VanDerWaalsContact C-N 3.34Å; A262-E264 PolarHBondContact O-N 3.28Å; A262-T265 PolarHBondContact O-N 2.55Å; A262-A266 WeakPolarHBondContact O-CB 3.24Å; A262-A266 PolarHBondContact O-N 2.77Å
263	P	90.6	Very high	87.2	Confident	43 Å²	43	44.1 Å²	44.1	28%	0.279	25%	0.249	S	C	.	.	H	α-helix	trans	-67.8	-32.5	178.4	27.2	-34.6	0	0	0	112.6	I259 K260 A266 V267 I306 M309	I259-P263 WeakPolarHBondContact O-CD 3.13Å; K260-P263 VanDerWaalsContact O-CD 3.29Å; K260-P263 WeakPolarHBondContact O-CD 3.2Å; K260-P263 WeakPolarHBondContact O-CG 3.31Å; P263-A266 PolarHBondContact O-N 3.36Å; P263-V267 WeakPolarHBondContact O-CB 3.35Å; P263-V267 VanDerWaalsContact O-CG2 3.29Å; P263-V267 WeakPolarHBondContact O-CG2 3.24Å; P263-V267 PolarHBondContact O-N 3.49Å; P263-I306 HydrophobicContact CB-CD1 3.85Å; P263-I306 HydrophobicContact CG-CD1 3.89Å; P263-M309 HydrophobicContact CG-CE 4.31Å
264	E	85.6	Confident	87.1	Confident	53 Å²	53	47 Å²	47	25%	0.248	26%	0.26	C	S	.	.	H	α-helix	trans	-61.7	-50	174.9	-176.2	178.7	169.5	0	0	110.8	K260 I261 A262 K268 I306	K260-E264 WeakPolarHBondContact O-CB 2.94Å; K260-E264 PolarHBondContact O-N 3.42Å; I261-E264 PolarHBondContact O-N 3.13Å; A262-E264 VanDerWaalsContact C-N 3.34Å; A262-E264 PolarHBondContact O-N 3.28Å; E264-K268 VanDerWaalsContact O-CB 3.29Å; E264-K268 WeakPolarHBondContact O-CB 3.49Å; E264-K268 PolarHBondContact O-N 3.29Å; E264-I306 HydrophobicContact CB-CD1 4.12Å; E264-I306 HydrophobicContact CB-CG1 3.78Å; E264-I306 HydrophobicContact CG-CG1 4.19Å
265	T	82.1	Confident	86.9	Confident	53 Å²	53	48.7 Å²	48.7	33%	0.325	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-46.7	176.7	-61.6	0	0	0	0	111.3	L198 I261 A262 K268 F269	L198-T265 HydrophobicContact CD2-CG2 4.48Å; I261-T265 WeakPolarHBondContact O-CB 3.42Å; I261-T265 PolarHBondContact O-N 3.46Å; I261-T265 PolarHBondContact O-OG1 3.1Å; A262-T265 PolarHBondContact O-N 2.55Å; T265-K268 PolarHBondContact O-N 2.92Å; T265-F269 HydrophobicContact CG2-CD2 3.56Å; T265-F269 HydrophobicContact CG2-CE2 3.42Å; T265-F269 VanDerWaalsContact CG2-CE2 3.42Å; T265-F269 WeakPolarHBondContact O-CD2 3.22Å; T265-F269 PolarHBondContact O-N 2.72Å
266	A	85.7	Confident	86.3	Confident	59 Å²	59	49.6 Å²	49.6	49%	0.488	26%	0.258	S	S	.	.	H	α-helix	trans	-61	-47.7	-179.6	0	0	0	0	0	112.8	A262 P263 K268 F269 W270	A262-A266 WeakPolarHBondContact O-CB 3.24Å; A262-A266 PolarHBondContact O-N 2.77Å; P263-A266 PolarHBondContact O-N 3.36Å; A266-K268 VanDerWaalsContact C-N 3.34Å; A266-K268 PolarHBondContact O-N 3.43Å; A266-F269 PolarHBondContact O-N 3.4Å; A266-W270 WeakPolarHBondContact O-CB 3.45Å; A266-W270 PolarHBondContact O-N 2.87Å
267	V	88.6	Confident	85.9	Confident	27 Å²	27	56.4 Å²	56.4	16%	0.164	29%	0.287	C	S	.	.	H	α-helix	trans	-66.2	-38.2	177.8	176.3	0	0	0	0	110.8	P263 W270 A271 T301 A302 F305	P263-V267 WeakPolarHBondContact O-CB 3.35Å; P263-V267 VanDerWaalsContact O-CG2 3.29Å; P263-V267 WeakPolarHBondContact O-CG2 3.24Å; P263-V267 PolarHBondContact O-N 3.49Å; V267-W270 HydrophobicContact CG1-CE3 4.43Å; V267-A271 WeakPolarHBondContact O-CB 3.17Å; V267-A271 PolarHBondContact O-N 3.27Å; V267-T301 HydrophobicContact CG1-CG2 4.32Å; V267-A302 HydrophobicContact CB-CB 4.37Å; V267-A302 HydrophobicContact CG1-CB 4.19Å; V267-F305 HydrophobicContact CG1-CB 4.25Å; V267-F305 HydrophobicContact CG1-CD2 3.85Å; V267-F305 HydrophobicContact CG1-CE2 4.48Å; V267-F305 HydrophobicContact CG1-CG 4.12Å; V267-F305 HydrophobicContact CG2-CB 4.37Å; V267-F305 HydrophobicContact CG2-CG 4.45Å
268	K	84.7	Confident	85.9	Confident	67 Å²	67	62.8 Å²	62.8	29%	0.291	32%	0.321	S	S	.	.	H	α-helix	trans	-60.8	-49.3	176.9	-172.2	-177.4	177.3	-172	0	111.1	T179 E264 T265 A266 A271 Y272 A298 A302	T179-K268 PolarHBondContact O-NZ 3.39Å; E264-K268 VanDerWaalsContact O-CB 3.29Å; E264-K268 WeakPolarHBondContact O-CB 3.49Å; E264-K268 PolarHBondContact O-N 3.29Å; T265-K268 PolarHBondContact O-N 2.92Å; A266-K268 VanDerWaalsContact C-N 3.34Å; A266-K268 PolarHBondContact O-N 3.43Å; K268-A271 PolarHBondContact O-N 2.87Å; K268-Y272 VanDerWaalsContact O-CB 3.26Å; K268-Y272 WeakPolarHBondContact O-CB 3.31Å; K268-Y272 PolarHBondContact O-N 2.81Å; K268-A298 HydrophobicContact CG-CB 4.37Å; K268-A302 HydrophobicContact CB-CB 3.84Å
269	F	82.1	Confident	85.3	Confident	52 Å²	52	64.1 Å²	64.1	23%	0.228	33%	0.326	C	S	.	.	H	α-helix	trans	-63.7	-47.8	178.5	-83	-70	0	0	0	112.2	P181 F184 L198 T265 A266 A271 Y272 E273	P181-F269 HydrophobicContact CB-CD1 4.33Å; P181-F269 HydrophobicContact CB-CE1 3.53Å; P181-F269 HydrophobicContact CB-CZ 4.01Å; P181-F269 HydrophobicContact CG-CE1 4.23Å; F184-F269 HydrophobicContact CE2-CE1 4.4Å; F184-F269 HydrophobicContact CE2-CZ 4.33Å; L198-F269 HydrophobicContact CD2-CE2 3.6Å; L198-F269 HydrophobicContact CD2-CZ 3.83Å; T265-F269 HydrophobicContact CG2-CD2 3.56Å; T265-F269 HydrophobicContact CG2-CE2 3.42Å; T265-F269 VanDerWaalsContact CG2-CE2 3.42Å; T265-F269 WeakPolarHBondContact O-CD2 3.22Å; T265-F269 PolarHBondContact O-N 2.72Å; A266-F269 PolarHBondContact O-N 3.4Å; F269-A271 PolarHBondContact O-N 2.71Å; F269-Y272 WeakPolarHBondContact O-CB 3.4Å; F269-Y272 PolarHBondContact O-N 3.44Å; F269-E273 PolarHBondContact O-N 2.86Å
270	W	87.5	Confident	84.3	Confident	138 Å²	138	61.2 Å²	61.2	52%	0.523	31%	0.313	S	S	.	.	H	α-helix	trans	-57.1	-49.3	176.9	167.9	76.4	0	0	0	111.9	A266 V267 Y272 E273 Q274	A266-W270 WeakPolarHBondContact O-CB 3.45Å; A266-W270 PolarHBondContact O-N 2.87Å; V267-W270 HydrophobicContact CG1-CE3 4.43Å; W270-Y272 VanDerWaalsContact C-N 3.33Å; W270-Y272 PolarHBondContact O-N 3.02Å; W270-E273 PolarHBondContact O-N 3.21Å; W270-Q274 HydrophobicContact CD2-CG 4.42Å; W270-Q274 HydrophobicContact CZ2-CG 4.12Å; W270-Q274 WeakPolarHBondContact O-CG 3.16Å; W270-Q274 PolarHBondContact O-N 2.98Å; W270-Q274 VanDerWaalsContact O-N 3.09Å
271	A	87.6	Confident	83.2	Confident	2 Å²	2	67.6 Å²	67.6	2%	0.017	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-39.1	-180	0	0	0	0	0	111.7	V267 K268 F269 E273 Q274 Y275 A298 T301	V267-A271 WeakPolarHBondContact O-CB 3.17Å; V267-A271 PolarHBondContact O-N 3.27Å; K268-A271 PolarHBondContact O-N 2.87Å; F269-A271 PolarHBondContact O-N 2.71Å; A271-E273 PolarHBondContact O-N 2.85Å; A271-Q274 PolarHBondContact O-N 3.28Å; A271-Y275 HydrophobicContact CB-CD2 4.27Å; A271-Y275 HydrophobicContact CB-CE2 3.98Å; A271-Y275 WeakPolarHBondContact O-CD2 3.28Å; A271-Y275 PolarHBondContact O-N 2.89Å; A271-A298 HydrophobicContact CB-CB 4.02Å; A271-T301 HydrophobicContact CB-CG2 3.93Å
272	Y	83.1	Confident	81.5	Confident	15 Å²	15	76.9 Å²	76.9	6%	0.059	39%	0.386	C	S	.	.	H	α-helix	trans	-58.5	-47.4	175.8	-178.5	-101.2	0	0	0	111.6	K268 F269 W270 Q274 Y275 K276 A298	K268-Y272 VanDerWaalsContact O-CB 3.26Å; K268-Y272 WeakPolarHBondContact O-CB 3.31Å; K268-Y272 PolarHBondContact O-N 2.81Å; F269-Y272 WeakPolarHBondContact O-CB 3.4Å; F269-Y272 PolarHBondContact O-N 3.44Å; W270-Y272 VanDerWaalsContact C-N 3.33Å; W270-Y272 PolarHBondContact O-N 3.02Å; Y272-Q274 PolarHBondContact O-N 3.26Å; Y272-Y275 PolarHBondContact O-N 3.05Å; Y272-K276 HydrophobicContact CE1-CD 4.42Å; Y272-K276 WeakPolarHBondContact O-CB 3.47Å; Y272-K276 PolarHBondContact O-N 3.22Å; Y272-A298 HydrophobicContact CD2-CB 4.45Å
273	E	82.1	Confident	80	Confident	94 Å²	94	77.6 Å²	77.6	44%	0.439	40%	0.4	S	S	.	.	H	α-helix	trans	-63	-39.1	176.9	-71.3	-173.9	172.1	0	0	112.8	F269 W270 A271 K277	F269-E273 PolarHBondContact O-N 2.86Å; W270-E273 PolarHBondContact O-N 3.21Å; A271-E273 PolarHBondContact O-N 2.85Å; E273-K277 WeakPolarHBondContact O-CG 3.47Å; E273-K277 PolarHBondContact O-N 3.15Å
274	Q	87.6	Confident	78.3	Confident	71 Å²	71	81.9 Å²	81.9	33%	0.332	42%	0.417	S	S	.	.	H	α-helix	trans	-66.9	-46.9	177.4	-62.5	-43.8	-64	0	0	111.7	W270 A271 Y272 K276 K277 L278	W270-Q274 HydrophobicContact CD2-CG 4.42Å; W270-Q274 HydrophobicContact CZ2-CG 4.12Å; W270-Q274 WeakPolarHBondContact O-CG 3.16Å; W270-Q274 PolarHBondContact O-N 2.98Å; W270-Q274 VanDerWaalsContact O-N 3.09Å; A271-Q274 PolarHBondContact O-N 3.28Å; Y272-Q274 PolarHBondContact O-N 3.26Å; Q274-K276 VanDerWaalsContact C-N 3.31Å; Q274-K276 PolarHBondContact O-N 2.83Å; Q274-K277 PolarHBondContact O-N 2.88Å; Q274-L278 VanDerWaalsContact O-CG 3.32Å; Q274-L278 WeakPolarHBondContact O-CG 3.3Å; Q274-L278 PolarHBondContact O-N 3.25Å
275	Y	87.1	Confident	76.8	Confident	58 Å²	58	85 Å²	85	23%	0.227	43%	0.429	C	S	.	.	H	α-helix	trans	-65.3	-37.3	179.4	-68.9	-49.8	0	0	0	112.4	A271 Y272 L278 L279 M297 A298 T301	A271-Y275 HydrophobicContact CB-CD2 4.27Å; A271-Y275 HydrophobicContact CB-CE2 3.98Å; A271-Y275 WeakPolarHBondContact O-CD2 3.28Å; A271-Y275 PolarHBondContact O-N 2.89Å; Y272-Y275 PolarHBondContact O-N 3.05Å; Y275-L278 HydrophobicContact CD1-CD1 4.39Å; Y275-L278 PolarHBondContact O-N 2.68Å; Y275-L279 WeakPolarHBondContact O-CB 3.47Å; Y275-L279 VanDerWaalsContact O-CG 3.28Å; Y275-L279 WeakPolarHBondContact O-CG 3.41Å; Y275-L279 PolarHBondContact O-N 3.29Å; Y275-M297 HydrophobicContact CD1-CB 4.4Å; Y275-M297 HydrophobicContact CD1-CE 3.42Å; Y275-M297 VanDerWaalsContact CD1-CE 3.42Å; Y275-M297 HydrophobicContact CD1-SD 4.37Å; Y275-M297 HydrophobicContact CD2-CB 3.59Å; Y275-M297 HydrophobicContact CD2-CE 4.19Å; Y275-M297 HydrophobicContact CE1-CB 4.32Å; Y275-M297 HydrophobicContact CE1-CE 4.02Å; Y275-M297 HydrophobicContact CE1-SD 4.4Å; Y275-M297 VanDerWaalsContact CE2-C 3.43Å; Y275-M297 HydrophobicContact CE2-CB 3.5Å; Y275-M297 HydrophobicContact CG-CB 4.07Å; Y275-M297 HydrophobicContact CG-CE 3.52Å; Y275-A298 HydrophobicContact CD2-CB 4.31Å; Y275-T301 PolarHBondContact OH-OG1 2.77Å
276	K	79.3	Confident	75.7	Confident	58 Å²	58	83.4 Å²	83.4	25%	0.252	42%	0.418	S	S	.	.	H	α-helix	trans	-57.9	-50.7	171.4	169.5	169.9	152.3	144.7	0	111.6	E183 Y272 Q274 L278 L279 T280 I286	E183-K276 IonicContact OE1-NZ 2.71Å; E183-K276 PolarHBondContact OE1-NZ 2.84Å; Y272-K276 HydrophobicContact CE1-CD 4.42Å; Y272-K276 WeakPolarHBondContact O-CB 3.47Å; Y272-K276 PolarHBondContact O-N 3.22Å; Q274-K276 VanDerWaalsContact C-N 3.31Å; Q274-K276 PolarHBondContact O-N 2.83Å; K276-L278 VanDerWaalsContact C-N 3.25Å; K276-L278 PolarHBondContact O-N 3.33Å; K276-L279 PolarHBondContact O-N 2.98Å; K276-T280 WeakPolarHBondContact O-CB 3.34Å; K276-T280 PolarHBondContact O-N 3.18Å; K276-T280 VanDerWaalsContact O-N 3.12Å; K276-T280 PolarHBondContact O-OG1 3.25Å; K276-I286 HydrophobicContact CD-CD1 3.24Å; K276-I286 HydrophobicContact CG-CD1 3.41Å; K276-I286 VanDerWaalsContact CG-CD1 3.41Å
277	K	82.8	Confident	74.5	Confident	145 Å²	145	81.6 Å²	81.6	63%	0.63	41%	0.406	S	S	*	.	H	α-helix	trans	-60.9	-32.8	177.1	-73.1	177.8	-175.6	-174.9	0	113.3	E273 Q274	E273-K277 WeakPolarHBondContact O-CG 3.47Å; E273-K277 PolarHBondContact O-N 3.15Å; Q274-K277 PolarHBondContact O-N 2.88Å
278	L	85	Confident	73.1	Confident	139 Å²	139	82.1 Å²	82.1	73%	0.728	41%	0.409	S	S	*	.	H	α-helix	trans	-77.5	-29.4	178.9	-70.9	169.2	0	0	0	113.1	Q274 Y275 K276	Q274-L278 VanDerWaalsContact O-CG 3.32Å; Q274-L278 WeakPolarHBondContact O-CG 3.3Å; Q274-L278 PolarHBondContact O-N 3.25Å; Y275-L278 HydrophobicContact CD1-CD1 4.39Å; Y275-L278 PolarHBondContact O-N 2.68Å; K276-L278 VanDerWaalsContact C-N 3.25Å; K276-L278 PolarHBondContact O-N 3.33Å
279	L	78.1	Confident	72.2	Confident	73 Å²	73	85.8 Å²	85.8	38%	0.382	43%	0.425	S	S	.	.	H	α-helix	trans	-95.7	-3.3	-176.6	-69.2	171.8	0	0	0	113.3	Y275 K276 I293 S294 M297	Y275-L279 WeakPolarHBondContact O-CB 3.47Å; Y275-L279 VanDerWaalsContact O-CG 3.28Å; Y275-L279 WeakPolarHBondContact O-CG 3.41Å; Y275-L279 PolarHBondContact O-N 3.29Å; K276-L279 PolarHBondContact O-N 2.98Å; L279-I293 HydrophobicContact CD1-CB 4.25Å; L279-I293 HydrophobicContact CD1-CG2 3.89Å; L279-S294 WeakPolarHBondContact CD1-OG 3.36Å; L279-M297 HydrophobicContact CD1-CE 3.77Å
280	T	70.9	Confident	71.6	Confident	37 Å²	37	86.6 Å²	86.6	23%	0.227	43%	0.43	C	S	.	.	S	Bend	trans	-122.9	126.5	-178.1	-49.6	0	0	0	0	110.2	K276 Q284 I286	K276-T280 WeakPolarHBondContact O-CB 3.34Å; K276-T280 PolarHBondContact O-N 3.18Å; K276-T280 VanDerWaalsContact O-N 3.12Å; K276-T280 PolarHBondContact O-OG1 3.25Å; T280-Q284 HydrophobicContact CG2-CB 4.46Å; T280-Q284 WeakPolarHBondContact CG2-O 3.33Å; T280-I286 HydrophobicContact CG2-CG1 4.05Å
281	E	65.4	Low	70.7	Confident	148 Å²	148	82.1 Å²	82.1	69%	0.692	41%	0.413	S	S	*	.			trans	-72.5	147	169.5	-69.2	-174	162.8	0	0	110.6	G283 Q284	E281-G283 PolarHBondContact O-N 3.35Å; E281-Q284 PolarHBondContact O-N 3.4Å
282	E	50.4	Low	69.8	Low	211 Å²	211	86.4 Å²	86.4	99%	0.986	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	113.2	-179.3	-77.3	-175.6	162.2	0	0	111
283	G	53.4	Low	69.6	Low	86 Å²	86	88.1 Å²	88.1	89%	0.887	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.6	-4.2	174.8	0	0	0	0	0	116.4	E281	E281-G283 PolarHBondContact O-N 3.35Å
284	Q	55.1	Low	69.4	Low	134 Å²	134	83.7 Å²	83.7	63%	0.626	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-94.3	137.5	174.3	-71.1	-166.5	-16.6	0	0	113	T280 E281	T280-Q284 HydrophobicContact CG2-CB 4.46Å; T280-Q284 WeakPolarHBondContact CG2-O 3.33Å; E281-Q284 PolarHBondContact O-N 3.4Å
285	K	53.6	Low	68.9	Low	117 Å²	117	80.8 Å²	80.8	51%	0.509	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-71.2	142.6	170.1	-71.9	177.6	169	-144.9	0	109	D158 E160	D158-K285 IonicContact OD2-NZ 2.77Å; D158-K285 PolarHBondContact OD2-NZ 3.06Å; E160-K285 WeakPolarHBondContact OE1-CD 3Å; E160-K285 IonicContact OE1-NZ 3.27Å; E160-K285 WeakPolarHBondContact OE2-CE 3.41Å; E160-K285 IonicContact OE2-NZ 3.68Å; E160-K285 PolarHBondContact OE2-NZ 3.17Å
286	I	59.4	Low	68.6	Low	20 Å²	20	80.8 Å²	80.8	10%	0.103	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-83.4	123.6	-167.8	-53.7	166.2	0	0	0	109.8	K276 T280 E290 R291	K276-I286 HydrophobicContact CD-CD1 3.24Å; K276-I286 HydrophobicContact CG-CD1 3.41Å; K276-I286 VanDerWaalsContact CG-CD1 3.41Å; T280-I286 HydrophobicContact CG2-CG1 4.05Å; I286-E290 HydrophobicContact CG2-CB 3.67Å; I286-R291 HydrophobicContact CB-CG 4.26Å; I286-R291 HydrophobicContact CG2-CG 3.58Å
287	G	60.1	Low	68.8	Low	22 Å²	22	81 Å²	81	23%	0.227	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-68.2	156.1	171	0	0	0	0	0	112.4	F289 E290 R291	G287-F289 PolarHBondContact O-N 2.98Å; G287-E290 WeakPolarHBondContact CA-OE2 3.08Å; G287-E290 PolarHBondContact N-OE2 3Å; G287-E290 PolarHBondContact O-N 3.14Å; G287-R291 PolarHBondContact O-N 2.68Å
288	T	60.9	Low	68.9	Low	38 Å²	38	74.1 Å²	74.1	23%	0.233	39%	0.391	C	S	.	.	H	α-helix	trans	-64.6	-27.5	-179.3	-62.3	0	0	0	0	112.7	L118 G119 R291 F292	L118-T288 PolarHBondContact O-OG1 3.19Å; G119-T288 WeakPolarHBondContact CA-OG1 3.31Å; G119-T288 WeakPolarHBondContact O-CB 3.39Å; G119-T288 WeakPolarHBondContact O-CG2 3.33Å; G119-T288 PolarHBondContact O-OG1 3.48Å; T288-R291 PolarHBondContact O-N 3.28Å; T288-F292 VanDerWaalsContact O-CB 3.26Å; T288-F292 WeakPolarHBondContact O-CB 3.26Å; T288-F292 PolarHBondContact O-N 3.4Å
289	F	64.5	Low	68.9	Low	143 Å²	143	68.8 Å²	68.8	63%	0.627	37%	0.369	S	S	*	.	H	α-helix	trans	-66.1	-44.7	175.4	-171.6	-111.1	0	0	0	111.3	G287 R291 F292 I293	G287-F289 PolarHBondContact O-N 2.98Å; F289-R291 PolarHBondContact O-N 3.1Å; F289-F292 PolarHBondContact O-N 3.11Å; F289-I293 HydrophobicContact CD1-CD1 3.69Å; F289-I293 HydrophobicContact CD1-CG1 4.49Å; F289-I293 HydrophobicContact CE1-CD1 3.25Å; F289-I293 HydrophobicContact CE1-CG1 4.27Å; F289-I293 HydrophobicContact CE2-CD1 4.3Å; F289-I293 HydrophobicContact CG-CD1 4.38Å; F289-I293 HydrophobicContact CZ-CD1 3.61Å; F289-I293 HydrophobicContact CZ-CG1 4.3Å; F289-I293 WeakPolarHBondContact O-CG1 3.2Å; F289-I293 PolarHBondContact O-N 3.26Å
290	E	69.7	Low	69.3	Low	69 Å²	69	67.1 Å²	67.1	32%	0.322	37%	0.366	S	S	.	.	H	α-helix	trans	-64.7	-39.7	175.1	-65.3	75.4	-167.2	0	0	111.2	I286 G287 S294	I286-E290 HydrophobicContact CG2-CB 3.67Å; G287-E290 WeakPolarHBondContact CA-OE2 3.08Å; G287-E290 PolarHBondContact N-OE2 3Å; G287-E290 PolarHBondContact O-N 3.14Å; E290-S294 WeakPolarHBondContact O-CB 3.38Å; E290-S294 PolarHBondContact O-N 2.67Å; E290-S294 PolarHBondContact O-OG 3.02Å
291	R	69	Low	70.2	Confident	45 Å²	45	66.6 Å²	66.6	17%	0.17	36%	0.363	C	S	.	.	H	α-helix	trans	-61.7	-43.7	172.5	-72.3	-179	167.2	143.5	-3.3	111.8	E183 I286 G287 T288 F289 S294 G295	E183-R291 IonicContact OE2-CZ 2.61Å; E183-R291 IonicContact OE2-NE 2.8Å; E183-R291 IonicContact OE2-NH2 2.71Å; E183-R291 PolarHBondContact OE2-NH2 3.46Å; I286-R291 HydrophobicContact CB-CG 4.26Å; I286-R291 HydrophobicContact CG2-CG 3.58Å; G287-R291 PolarHBondContact O-N 2.68Å; T288-R291 PolarHBondContact O-N 3.28Å; F289-R291 PolarHBondContact O-N 3.1Å; R291-S294 PolarHBondContact O-N 3.08Å; R291-G295 PolarHBondContact O-N 2.96Å
292	F	69.5	Low	71.4	Confident	91 Å²	91	59.7 Å²	59.7	40%	0.399	33%	0.331	S	S	.	.	H	α-helix	trans	-64.9	-45.7	179.2	176.4	-95.3	0	0	0	111.8	T288 F289 G295 S296	T288-F292 VanDerWaalsContact O-CB 3.26Å; T288-F292 WeakPolarHBondContact O-CB 3.26Å; T288-F292 PolarHBondContact O-N 3.4Å; F289-F292 PolarHBondContact O-N 3.11Å; F292-G295 PolarHBondContact O-N 3.21Å; F292-S296 VanDerWaalsContact O-CB 3.29Å; F292-S296 WeakPolarHBondContact O-CB 3.45Å; F292-S296 PolarHBondContact O-N 3.01Å; F292-S296 PolarHBondContact O-OG 2.89Å
293	I	77.3	Confident	73.2	Confident	52 Å²	52	50.9 Å²	50.9	27%	0.267	29%	0.29	S	S	.	.	H	α-helix	trans	-63	-47.6	175.7	-65.7	175.9	0	0	0	109.6	L279 F289 G295 S296 M297	L279-I293 HydrophobicContact CD1-CB 4.25Å; L279-I293 HydrophobicContact CD1-CG2 3.89Å; F289-I293 HydrophobicContact CD1-CD1 3.69Å; F289-I293 HydrophobicContact CD1-CG1 4.49Å; F289-I293 HydrophobicContact CE1-CD1 3.25Å; F289-I293 HydrophobicContact CE1-CG1 4.27Å; F289-I293 HydrophobicContact CE2-CD1 4.3Å; F289-I293 HydrophobicContact CG-CD1 4.38Å; F289-I293 HydrophobicContact CZ-CD1 3.61Å; F289-I293 HydrophobicContact CZ-CG1 4.3Å; F289-I293 WeakPolarHBondContact O-CG1 3.2Å; F289-I293 PolarHBondContact O-N 3.26Å; I293-G295 VanDerWaalsContact C-N 3.33Å; I293-G295 PolarHBondContact O-N 3.31Å; I293-S296 PolarHBondContact O-N 2.75Å; I293-M297 HydrophobicContact CG2-CE 3.74Å; I293-M297 HydrophobicContact CG2-CG 4.21Å; I293-M297 HydrophobicContact CG2-SD 3.95Å; I293-M297 WeakPolarHBondContact O-CB 3.48Å; I293-M297 VanDerWaalsContact O-CG 3.31Å; I293-M297 WeakPolarHBondContact O-CG 3.26Å; I293-M297 PolarHBondContact O-N 3.12Å
294	S	79.4	Confident	75	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.007	26%	0.261	C	S	.	.	H	α-helix	trans	-57.8	-45.4	177.4	-60.5	0	0	0	0	111.7	L279 E290 R291 A298	L279-S294 WeakPolarHBondContact CD1-OG 3.36Å; E290-S294 WeakPolarHBondContact O-CB 3.38Å; E290-S294 PolarHBondContact O-N 2.67Å; E290-S294 PolarHBondContact O-OG 3.02Å; R291-S294 PolarHBondContact O-N 3.08Å; S294-A298 WeakPolarHBondContact O-CB 3.4Å; S294-A298 PolarHBondContact O-N 3.31Å
295	G	77	Confident	76.8	Confident	9 Å²	9	48.5 Å²	48.5	9%	0.093	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-44.4	177.3	0	0	0	0	0	112.8	R291 F292 I293 A298 G299	R291-G295 PolarHBondContact O-N 2.96Å; F292-G295 PolarHBondContact O-N 3.21Å; I293-G295 VanDerWaalsContact C-N 3.33Å; I293-G295 PolarHBondContact O-N 3.31Å; G295-A298 PolarHBondContact O-N 2.67Å; G295-G299 PolarHBondContact O-N 3.32Å
296	S	79.7	Confident	78.7	Confident	59 Å²	59	43.1 Å²	43.1	41%	0.413	23%	0.234	S	C	.	.	H	α-helix	trans	-65.8	-46.2	179.1	-64	0	0	0	0	111.9	F292 I293 G299 A300	F292-S296 VanDerWaalsContact O-CB 3.29Å; F292-S296 WeakPolarHBondContact O-CB 3.45Å; F292-S296 PolarHBondContact O-N 3.01Å; F292-S296 PolarHBondContact O-OG 2.89Å; I293-S296 PolarHBondContact O-N 2.75Å; S296-G299 PolarHBondContact O-N 2.93Å; S296-A300 PolarHBondContact O-N 2.9Å
297	M	84.3	Confident	80.3	Confident	63 Å²	63	42.2 Å²	42.2	31%	0.31	23%	0.229	S	C	.	.	H	α-helix	trans	-66.1	-40.4	176.4	-66.6	-169	-51.8	0	0	111.4	Y275 L279 I293 G299 A300 T301	Y275-M297 HydrophobicContact CD1-CB 4.4Å; Y275-M297 HydrophobicContact CD1-CE 3.42Å; Y275-M297 VanDerWaalsContact CD1-CE 3.42Å; Y275-M297 HydrophobicContact CD1-SD 4.37Å; Y275-M297 HydrophobicContact CD2-CB 3.59Å; Y275-M297 HydrophobicContact CD2-CE 4.19Å; Y275-M297 HydrophobicContact CE1-CB 4.32Å; Y275-M297 HydrophobicContact CE1-CE 4.02Å; Y275-M297 HydrophobicContact CE1-SD 4.4Å; Y275-M297 VanDerWaalsContact CE2-C 3.43Å; Y275-M297 HydrophobicContact CE2-CB 3.5Å; Y275-M297 HydrophobicContact CG-CB 4.07Å; Y275-M297 HydrophobicContact CG-CE 3.52Å; L279-M297 HydrophobicContact CD1-CE 3.77Å; I293-M297 HydrophobicContact CG2-CE 3.74Å; I293-M297 HydrophobicContact CG2-CG 4.21Å; I293-M297 HydrophobicContact CG2-SD 3.95Å; I293-M297 WeakPolarHBondContact O-CB 3.48Å; I293-M297 VanDerWaalsContact O-CG 3.31Å; I293-M297 WeakPolarHBondContact O-CG 3.26Å; I293-M297 PolarHBondContact O-N 3.12Å; M297-G299 VanDerWaalsContact C-N 3.33Å; M297-G299 PolarHBondContact O-N 3.15Å; M297-A300 PolarHBondContact O-N 2.63Å; M297-T301 WeakPolarHBondContact O-CB 3.4Å; M297-T301 PolarHBondContact O-N 3.18Å; M297-T301 PolarHBondContact O-OG1 2.96Å; M297-T301 VanDerWaalsContact O-OG1 3.14Å
298	A	85.3	Confident	82	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.6	-42.7	174.4	0	0	0	0	0	112.1	K268 A271 Y272 Y275 S294 G295 T301 A302	K268-A298 HydrophobicContact CG-CB 4.37Å; A271-A298 HydrophobicContact CB-CB 4.02Å; Y272-A298 HydrophobicContact CD2-CB 4.45Å; Y275-A298 HydrophobicContact CD2-CB 4.31Å; S294-A298 WeakPolarHBondContact O-CB 3.4Å; S294-A298 PolarHBondContact O-N 3.31Å; G295-A298 PolarHBondContact O-N 2.67Å; A298-T301 PolarHBondContact O-N 3.4Å; A298-A302 WeakPolarHBondContact O-CB 3.37Å; A298-A302 PolarHBondContact O-N 2.91Å
299	G	83.1	Confident	83.5	Confident	27 Å²	27	43.1 Å²	43.1	28%	0.278	23%	0.228	S	C	.	.	H	α-helix	trans	-61	-46.1	174	0	0	0	0	0	112.6	G295 S296 M297 Q303	G295-G299 PolarHBondContact O-N 3.32Å; S296-G299 PolarHBondContact O-N 2.93Å; M297-G299 VanDerWaalsContact C-N 3.33Å; M297-G299 PolarHBondContact O-N 3.15Å; G299-Q303 VanDerWaalsContact O-CB 3.25Å; G299-Q303 WeakPolarHBondContact O-CB 3.37Å; G299-Q303 PolarHBondContact O-N 3.1Å
300	A	86.6	Confident	84.7	Confident	38 Å²	38	37.2 Å²	37.2	31%	0.314	20%	0.202	S	C	.	.	H	α-helix	trans	-62.9	-41.7	176.7	0	0	0	0	0	112.4	S296 M297 Q303 T304	S296-A300 PolarHBondContact O-N 2.9Å; M297-A300 PolarHBondContact O-N 2.63Å; A300-Q303 PolarHBondContact O-N 2.99Å; A300-T304 PolarHBondContact O-N 3.42Å; A300-T304 PolarHBondContact O-OG1 3.48Å
301	T	90.9	Very high	85.8	Confident	25 Å²	25	34 Å²	34	15%	0.153	19%	0.187	C	C	.	.	H	α-helix	trans	-65.4	-50.4	177	-67.6	0	0	0	0	111.2	V267 A271 Y275 M297 A298 Q303 T304 F305	V267-T301 HydrophobicContact CG1-CG2 4.32Å; A271-T301 HydrophobicContact CB-CG2 3.93Å; Y275-T301 PolarHBondContact OH-OG1 2.77Å; M297-T301 WeakPolarHBondContact O-CB 3.4Å; M297-T301 PolarHBondContact O-N 3.18Å; M297-T301 PolarHBondContact O-OG1 2.96Å; M297-T301 VanDerWaalsContact O-OG1 3.14Å; A298-T301 PolarHBondContact O-N 3.4Å; T301-Q303 VanDerWaalsContact C-N 3.26Å; T301-Q303 PolarHBondContact O-N 2.97Å; T301-T304 VanDerWaalsContact O-CB 3.31Å; T301-T304 WeakPolarHBondContact O-CB 3.28Å; T301-T304 PolarHBondContact O-N 2.91Å; T301-F305 HydrophobicContact CG2-CD2 4.08Å; T301-F305 HydrophobicContact CG2-CE2 3.97Å; T301-F305 WeakPolarHBondContact O-CD2 3.42Å; T301-F305 PolarHBondContact O-N 3.23Å; T301-F305 VanDerWaalsContact O-N 3.14Å
302	A	89.3	Confident	87	Confident	4 Å²	4	32.8 Å²	32.8	3%	0.033	18%	0.184	C	C	.	.	H	α-helix	trans	-54.7	-44.9	174.1	0	0	0	0	0	111.5	V267 K268 A298 T304 F305 I306	V267-A302 HydrophobicContact CB-CB 4.37Å; V267-A302 HydrophobicContact CG1-CB 4.19Å; K268-A302 HydrophobicContact CB-CB 3.84Å; A298-A302 WeakPolarHBondContact O-CB 3.37Å; A298-A302 PolarHBondContact O-N 2.91Å; A302-T304 VanDerWaalsContact C-N 3.27Å; A302-T304 PolarHBondContact O-N 3.48Å; A302-F305 PolarHBondContact O-N 3.02Å; A302-I306 WeakPolarHBondContact O-CB 3.47Å; A302-I306 VanDerWaalsContact O-CG1 3.24Å; A302-I306 WeakPolarHBondContact O-CG1 3.37Å; A302-I306 PolarHBondContact O-N 3.27Å
303	Q	88.4	Confident	88.1	Confident	26 Å²	26	29.5 Å²	29.5	12%	0.121	17%	0.169	C	C	.	.	H	α-helix	trans	-61.8	-34.4	178.1	-173.7	60.8	83.4	0	0	112.8	G299 A300 T301 Y307 N350 I354	G299-Q303 VanDerWaalsContact O-CB 3.25Å; G299-Q303 WeakPolarHBondContact O-CB 3.37Å; G299-Q303 PolarHBondContact O-N 3.1Å; A300-Q303 PolarHBondContact O-N 2.99Å; T301-Q303 VanDerWaalsContact C-N 3.26Å; T301-Q303 PolarHBondContact O-N 2.97Å; Q303-Y307 VanDerWaalsContact O-CB 3.3Å; Q303-Y307 WeakPolarHBondContact O-CB 3.19Å; Q303-Y307 PolarHBondContact O-N 3.36Å; Q303-N350 WeakPolarHBondContact CG-ND2 3.48Å; Q303-I354 HydrophobicContact CG-CD1 4.44Å
304	T	92.4	Very high	88.8	Confident	44 Å²	44	27.3 Å²	27.3	27%	0.27	16%	0.159	S	C	.	.	H	α-helix	trans	-66.2	-45.5	176.9	-55	0	0	0	0	111.7	A300 T301 A302 Y344 Y347	A300-T304 PolarHBondContact O-N 3.42Å; A300-T304 PolarHBondContact O-OG1 3.48Å; T301-T304 VanDerWaalsContact O-CB 3.31Å; T301-T304 WeakPolarHBondContact O-CB 3.28Å; T301-T304 PolarHBondContact O-N 2.91Å; A302-T304 VanDerWaalsContact C-N 3.27Å; A302-T304 PolarHBondContact O-N 3.48Å; T304-Y344 HydrophobicContact CG2-CE1 4.45Å; T304-Y344 WeakPolarHBondContact O-CE1 3.29Å; T304-Y344 PolarHBondContact O-OH 3.47Å; T304-Y347 PolarHBondContact OG1-OH 3.46Å
305	F	93.3	Very high	89.4	Confident	125 Å²	125	27.3 Å²	27.3	55%	0.548	16%	0.158	S	C	.	.	H	α-helix	trans	-67.7	-37.1	178.1	-83.9	-93.3	0	0	0	112.3	V267 T301 A302 P308	V267-F305 HydrophobicContact CG1-CB 4.25Å; V267-F305 HydrophobicContact CG1-CD2 3.85Å; V267-F305 HydrophobicContact CG1-CE2 4.48Å; V267-F305 HydrophobicContact CG1-CG 4.12Å; V267-F305 HydrophobicContact CG2-CB 4.37Å; V267-F305 HydrophobicContact CG2-CG 4.45Å; T301-F305 HydrophobicContact CG2-CD2 4.08Å; T301-F305 HydrophobicContact CG2-CE2 3.97Å; T301-F305 WeakPolarHBondContact O-CD2 3.42Å; T301-F305 PolarHBondContact O-N 3.23Å; T301-F305 VanDerWaalsContact O-N 3.14Å; A302-F305 PolarHBondContact O-N 3.02Å; F305-P308 WeakPolarHBondContact O-CD 3.43Å
306	I	92.6	Very high	90.1	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-86.6	-14.1	-175.7	-60.3	-61.8	0	0	0	112.9	K260 P263 E264 A302 P308 M309 E310	K260-I306 HydrophobicContact CB-CG2 3.97Å; K260-I306 HydrophobicContact CD-CG2 4.18Å; P263-I306 HydrophobicContact CB-CD1 3.85Å; P263-I306 HydrophobicContact CG-CD1 3.89Å; E264-I306 HydrophobicContact CB-CD1 4.12Å; E264-I306 HydrophobicContact CB-CG1 3.78Å; E264-I306 HydrophobicContact CG-CG1 4.19Å; A302-I306 WeakPolarHBondContact O-CB 3.47Å; A302-I306 VanDerWaalsContact O-CG1 3.24Å; A302-I306 WeakPolarHBondContact O-CG1 3.37Å; A302-I306 PolarHBondContact O-N 3.27Å; I306-P308 VanDerWaalsContact C-CD 3.43Å; I306-P308 VanDerWaalsContact C-N 3.35Å; I306-M309 HydrophobicContact CG2-CB 4.45Å; I306-M309 WeakPolarHBondContact O-CA 3.45Å; I306-M309 WeakPolarHBondContact O-CB 3.32Å; I306-M309 PolarHBondContact O-N 3.3Å; I306-E310 PolarHBondContact O-N 2.9Å
307	Y	93.4	Very high	90.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-52.8	-40.4	-175.2	-153.3	-92.1	0	0	0	115.1	Q303 M309 E310 V311 F343 Y344 K345 G346 Y347 N350 R410 Q414	Q303-Y307 VanDerWaalsContact O-CB 3.3Å; Q303-Y307 WeakPolarHBondContact O-CB 3.19Å; Q303-Y307 PolarHBondContact O-N 3.36Å; Y307-M309 PolarHBondContact O-N 2.82Å; Y307-E310 WeakPolarHBondContact O-CB 3.32Å; Y307-E310 PolarHBondContact O-N 3.4Å; Y307-V311 HydrophobicContact CD1-CG2 4Å; Y307-V311 HydrophobicContact CE1-CG2 3.68Å; Y307-V311 PolarHBondContact O-N 2.84Å; Y307-V311 VanDerWaalsContact O-N 3.11Å; Y307-F343 VanDerWaalsContact CD1-O 3.27Å; Y307-F343 WeakPolarHBondContact CD1-O 3.47Å; Y307-Y344 HydrophobicContact CD1-CD1 4.05Å; Y307-Y344 HydrophobicContact CD1-CG 4.46Å; Y307-Y344 HydrophobicContact CG-CD1 4.35Å; Y307-K345 WeakPolarHBondContact CE1-O 3.34Å; Y307-K345 PolarHBondContact OH-O 3.31Å; Y307-K345 VanDerWaalsContact OH-O 3.1Å; Y307-G346 WeakPolarHBondContact OH-CA 3.39Å; Y307-G346 PolarHBondContact OH-O 2.82Å; Y307-Y347 HydrophobicContact CD1-CD2 4.28Å; Y307-Y347 AromaticContact CD2-CD2 3.64Å; Y307-Y347 HydrophobicContact CD2-CD2 3.64Å; Y307-Y347 HydrophobicContact CD2-CE2 4.35Å; Y307-Y347 AromaticContact CE2-CD2 3.96Å; Y307-Y347 HydrophobicContact CE2-CD2 3.96Å; Y307-Y347 AromaticContact CG-CD2 3.82Å; Y307-Y347 HydrophobicContact CG-CD2 3.82Å; Y307-Y347 PolarHBondContact OH-N 3.24Å; Y307-Y347 VanDerWaalsContact OH-N 3.13Å; Y307-N350 HydrophobicContact CE2-CB 3.8Å; Y307-R410 PolarHBondContact OH-NE 3.42Å; Y307-Q414 PolarHBondContact OH-NE2 3.44Å; Y307-Q414 VanDerWaalsContact OH-NE2 3.07Å
308	P	94.6	Very high	90.9	Very high	27 Å²	27	22.2 Å²	22.2	18%	0.175	13%	0.126	C	C	.	.	H	α-helix	trans	-55.5	-37.4	174	-28.3	37.6	0	0	0	113.7	F305 I306 V311 M312 F343 Y344	F305-P308 WeakPolarHBondContact O-CD 3.43Å; I306-P308 VanDerWaalsContact C-CD 3.43Å; I306-P308 VanDerWaalsContact C-N 3.35Å; P308-V311 PolarHBondContact O-N 3.5Å; P308-M312 WeakPolarHBondContact O-CG 3.37Å; P308-M312 PolarHBondContact O-N 2.77Å; P308-F343 HydrophobicContact CB-CB 3.99Å; P308-F343 HydrophobicContact CB-CD1 3.87Å; P308-F343 HydrophobicContact CB-CG 4.27Å; P308-F343 HydrophobicContact CG-CB 4.23Å; P308-Y344 HydrophobicContact CG-CE2 3.99Å
309	M	92.4	Very high	90.9	Very high	52 Å²	52	22.3 Å²	22.3	26%	0.256	13%	0.127	S	C	.	.	H	α-helix	trans	-68.5	-35	176	-61.7	-167.9	-174.1	0	0	112	T256 K260 P263 I306 Y307 M312 K313	T256-M309 HydrophobicContact CG2-CB 3.9Å; T256-M309 WeakPolarHBondContact CG2-O 3.36Å; K260-M309 HydrophobicContact CB-CB 4.36Å; K260-M309 HydrophobicContact CB-SD 3.74Å; P263-M309 HydrophobicContact CG-CE 4.31Å; I306-M309 HydrophobicContact CG2-CB 4.45Å; I306-M309 WeakPolarHBondContact O-CA 3.45Å; I306-M309 WeakPolarHBondContact O-CB 3.32Å; I306-M309 PolarHBondContact O-N 3.3Å; Y307-M309 PolarHBondContact O-N 2.82Å; M309-M312 HydrophobicContact CB-CE 4.28Å; M309-M312 HydrophobicContact CG-CE 3.95Å; M309-M312 PolarHBondContact O-N 3.01Å; M309-K313 WeakPolarHBondContact O-CB 3.4Å; M309-K313 PolarHBondContact O-N 2.97Å
310	E	90.2	Very high	91	Very high	20 Å²	20	27.7 Å²	27.7	9%	0.093	14%	0.142	C	C	.	.	H	α-helix	trans	-64.4	-41.4	175	-64	-75.2	-164.1	0	0	111.9	K260 I306 Y307 K313 T314 R410	K260-E310 IonicContact NZ-OE1 3.6Å; K260-E310 PolarHBondContact NZ-OE1 3.25Å; K260-E310 IonicContact NZ-OE2 2.77Å; K260-E310 PolarHBondContact NZ-OE2 3.09Å; I306-E310 PolarHBondContact O-N 2.9Å; Y307-E310 WeakPolarHBondContact O-CB 3.32Å; Y307-E310 PolarHBondContact O-N 3.4Å; E310-K313 WeakPolarHBondContact O-CB 3.14Å; E310-K313 PolarHBondContact O-N 2.92Å; E310-T314 PolarHBondContact O-N 2.93Å; E310-T314 VanDerWaalsContact O-N 3.13Å; E310-T314 PolarHBondContact O-OG1 3.03Å; E310-R410 IonicContact OE1-NH2 3.71Å
311	V	93.3	Very high	90.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.8	-47.8	175	178.5	0	0	0	0	110.3	Y307 P308 K313 T314 R315 F343 Q414	Y307-V311 HydrophobicContact CD1-CG2 4Å; Y307-V311 HydrophobicContact CE1-CG2 3.68Å; Y307-V311 PolarHBondContact O-N 2.84Å; Y307-V311 VanDerWaalsContact O-N 3.11Å; P308-V311 PolarHBondContact O-N 3.5Å; V311-K313 VanDerWaalsContact C-N 3.3Å; V311-K313 PolarHBondContact O-N 3.36Å; V311-T314 PolarHBondContact O-N 2.82Å; V311-R315 HydrophobicContact CG1-CG 4.15Å; V311-R315 WeakPolarHBondContact O-CG 3.39Å; V311-R315 PolarHBondContact O-N 3.47Å; V311-F343 WeakPolarHBondContact CG2-O 3.31Å; V311-Q414 HydrophobicContact CG2-CG 4.12Å
312	M	93.4	Very high	90.3	Very high	20 Å²	20	31.5 Å²	31.5	10%	0.099	18%	0.176	C	C	.	.	H	α-helix	trans	-59.2	-40.7	177.9	-71.3	-172.6	-64.7	0	0	112.3	T256 P308 M309 T314 R315 L316 I327 A331 I334 F343	T256-M312 HydrophobicContact CG2-CB 4.36Å; P308-M312 WeakPolarHBondContact O-CG 3.37Å; P308-M312 PolarHBondContact O-N 2.77Å; M309-M312 HydrophobicContact CB-CE 4.28Å; M309-M312 HydrophobicContact CG-CE 3.95Å; M309-M312 PolarHBondContact O-N 3.01Å; M312-T314 PolarHBondContact O-N 3.46Å; M312-R315 PolarHBondContact O-N 2.89Å; M312-L316 WeakPolarHBondContact O-CB 3.34Å; M312-L316 VanDerWaalsContact O-CG 3.28Å; M312-L316 WeakPolarHBondContact O-CG 3.21Å; M312-L316 PolarHBondContact O-N 2.89Å; M312-I327 HydrophobicContact CE-CG2 4.27Å; M312-I327 HydrophobicContact SD-CG2 4.09Å; M312-A331 HydrophobicContact SD-CB 3.7Å; M312-I334 HydrophobicContact CG-CD1 4.2Å; M312-F343 HydrophobicContact CG-CD1 4.41Å; M312-F343 HydrophobicContact CG-CE1 4.01Å; M312-F343 HydrophobicContact SD-CE1 4.15Å
313	K	92.4	Very high	90.2	Very high	22 Å²	22	34.9 Å²	34.9	10%	0.096	19%	0.191	C	C	.	.	H	α-helix	trans	-55.7	-52.2	174.5	176	-168.7	171.8	-179.7	0	110.8	D216 T256 N257 M309 E310 V311 R315 L316 A317	D216-K313 WeakPolarHBondContact OD2-CE 3.22Å; D216-K313 IonicContact OD2-NZ 3.42Å; D216-K313 PolarHBondContact OD2-NZ 2.98Å; T256-K313 HydrophobicContact CG2-CB 4.11Å; N257-K313 HydrophobicContact CB-CD 4.16Å; N257-K313 PolarHBondContact OD1-NZ 3.49Å; M309-K313 WeakPolarHBondContact O-CB 3.4Å; M309-K313 PolarHBondContact O-N 2.97Å; E310-K313 WeakPolarHBondContact O-CB 3.14Å; E310-K313 PolarHBondContact O-N 2.92Å; V311-K313 VanDerWaalsContact C-N 3.3Å; V311-K313 PolarHBondContact O-N 3.36Å; K313-R315 VanDerWaalsContact C-N 3.35Å; K313-R315 PolarHBondContact O-N 3.41Å; K313-L316 PolarHBondContact O-N 3.39Å; K313-A317 WeakPolarHBondContact O-CB 3.26Å; K313-A317 PolarHBondContact O-N 3.1Å
314	T	92.1	Very high	90.2	Very high	7 Å²	7	35.6 Å²	35.6	4%	0.043	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-42	-179.7	-62.1	0	0	0	0	111.5	I220 E310 V311 M312 A317 V318 T411 Q414 A415	I220-T314 HydrophobicContact CG2-CG2 4.19Å; E310-T314 PolarHBondContact O-N 2.93Å; E310-T314 VanDerWaalsContact O-N 3.13Å; E310-T314 PolarHBondContact O-OG1 3.03Å; V311-T314 PolarHBondContact O-N 2.82Å; M312-T314 PolarHBondContact O-N 3.46Å; T314-A317 PolarHBondContact O-N 2.86Å; T314-V318 HydrophobicContact CG2-CG2 4.38Å; T314-V318 WeakPolarHBondContact O-CB 3.14Å; T314-V318 VanDerWaalsContact O-CG2 3.24Å; T314-V318 WeakPolarHBondContact O-CG2 3.28Å; T314-V318 PolarHBondContact O-N 2.93Å; T314-T411 HydrophobicContact CG2-CG2 3.98Å; T314-Q414 HydrophobicContact CG2-CB 3.81Å; T314-Q414 PolarHBondContact OG1-OE1 2.95Å; T314-A415 HydrophobicContact CG2-CB 4.27Å
315	R	92	Very high	89.9	Confident	1 Å²	1	38.8 Å²	38.8	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-63.6	-43.7	178	-65.7	-71.6	-172.4	160.5	4.9	112.6	V311 M312 K313 G319 I334 E338 Q414 M418	V311-R315 HydrophobicContact CG1-CG 4.15Å; V311-R315 WeakPolarHBondContact O-CG 3.39Å; V311-R315 PolarHBondContact O-N 3.47Å; M312-R315 PolarHBondContact O-N 2.89Å; K313-R315 VanDerWaalsContact C-N 3.35Å; K313-R315 PolarHBondContact O-N 3.41Å; R315-G319 WeakPolarHBondContact O-CA 3.46Å; R315-G319 PolarHBondContact O-N 3.13Å; R315-I334 HydrophobicContact CB-CD1 4.36Å; R315-I334 HydrophobicContact CG-CD1 3.95Å; R315-E338 IonicContact CZ-OE1 3.52Å; R315-E338 IonicContact CZ-OE2 3.43Å; R315-E338 IonicContact NH1-OE1 3.54Å; R315-E338 PolarHBondContact NH1-OE1 2.91Å; R315-E338 VanDerWaalsContact NH2-CD 3.28Å; R315-E338 IonicContact NH2-OE1 2.55Å; R315-E338 PolarHBondContact NH2-OE1 2.69Å; R315-E338 IonicContact NH2-OE2 3.7Å; R315-E338 PolarHBondContact NH2-OE2 3.03Å; R315-Q414 WeakPolarHBondContact CD-O 3.44Å; R315-Q414 PolarHBondContact NE-O 3.04Å; R315-Q414 PolarHBondContact NH2-O 2.64Å; R315-M418 HydrophobicContact CB-SD 4.22Å; R315-M418 VanDerWaalsContact O-SD 3.4Å
316	L	92.3	Very high	89.7	Confident	13 Å²	13	34.3 Å²	34.3	7%	0.068	21%	0.206	C	C	.	.	H	α-helix	trans	-65.4	-42.8	176	-72.5	167.8	0	0	0	111.2	R252 T256 M312 K313 V318 G319 Y324 I327 C330	R252-L316 WeakPolarHBondContact CD-O 3.39Å; R252-L316 WeakPolarHBondContact CG-O 3.36Å; T256-L316 WeakPolarHBondContact OG1-CD1 3.21Å; M312-L316 WeakPolarHBondContact O-CB 3.34Å; M312-L316 VanDerWaalsContact O-CG 3.28Å; M312-L316 WeakPolarHBondContact O-CG 3.21Å; M312-L316 PolarHBondContact O-N 2.89Å; K313-L316 PolarHBondContact O-N 3.39Å; L316-V318 PolarHBondContact O-N 3.45Å; L316-G319 PolarHBondContact O-N 2.99Å; L316-Y324 HydrophobicContact CD2-CD2 4.04Å; L316-Y324 HydrophobicContact CD2-CG 4.15Å; L316-I327 HydrophobicContact CD1-CG1 3.98Å; L316-C330 HydrophobicContact CD2-CB 3.82Å; L316-C330 HydrophobicContact CG-CB 4.15Å
317	A	90.8	Very high	89.7	Confident	2 Å²	2	36.8 Å²	36.8	2%	0.017	22%	0.218	C	C	.	.	H	α-helix	trans	-62.6	-41.4	-179.1	0	0	0	0	0	112.9	R217 I220 K313 T314	R217-A317 HydrophobicContact CG-CB 4.35Å; R217-A317 PolarHBondContact NE-O 3.48Å; R217-A317 VanDerWaalsContact NE-O 3.14Å; I220-A317 HydrophobicContact CB-CB 4.45Å; I220-A317 HydrophobicContact CD1-CB 3.87Å; I220-A317 HydrophobicContact CG2-CB 4.09Å; K313-A317 WeakPolarHBondContact O-CB 3.26Å; K313-A317 PolarHBondContact O-N 3.1Å; T314-A317 PolarHBondContact O-N 2.86Å
318	V	89.6	Confident	89.8	Confident	9 Å²	9	45.3 Å²	45.3	6%	0.055	25%	0.252	C	S	.	.	H	α-helix	trans	-80.5	-30.4	-179.5	175.8	0	0	0	0	112.5	I220 V224 T314 L316 A415 M418	I220-V318 HydrophobicContact CG2-CG2 3.54Å; V224-V318 HydrophobicContact CB-CG2 4.34Å; V224-V318 HydrophobicContact CG1-CG1 4.1Å; V224-V318 HydrophobicContact CG1-CG2 4.42Å; V224-V318 HydrophobicContact CG2-CG2 3.93Å; T314-V318 HydrophobicContact CG2-CG2 4.38Å; T314-V318 WeakPolarHBondContact O-CB 3.14Å; T314-V318 VanDerWaalsContact O-CG2 3.24Å; T314-V318 WeakPolarHBondContact O-CG2 3.28Å; T314-V318 PolarHBondContact O-N 2.93Å; L316-V318 PolarHBondContact O-N 3.45Å; V318-A415 HydrophobicContact CG1-CB 4.5Å; V318-A415 HydrophobicContact CG2-CB 4.21Å; V318-M418 HydrophobicContact CB-SD 3.96Å; V318-M418 HydrophobicContact CG1-CB 4.38Å; V318-M418 HydrophobicContact CG1-SD 3.91Å
319	G	85.9	Confident	89.7	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.01	25%	0.252	C	S	.	.	S	Bend	trans	-60.9	144.8	-175.1	0	0	0	0	0	113.5	R252 R315 L316	R252-G319 PolarHBondContact NH1-O 3.22Å; R315-G319 WeakPolarHBondContact O-CA 3.46Å; R315-G319 PolarHBondContact O-N 3.13Å; L316-G319 PolarHBondContact O-N 2.99Å
320	K	85.4	Confident	89.8	Confident	140 Å²	140	43 Å²	43	61%	0.609	24%	0.239	S	C	*	.	P	Polyproline II helix	trans	-72.3	157.3	179	-66.4	-179.8	-176.7	172.1	0	111.7	E244 R252 G322 Q323	E244-K320 VanDerWaalsContact OE1-CA 3.25Å; E244-K320 WeakPolarHBondContact OE1-CA 3.27Å; R252-K320 VanDerWaalsContact NH1-C 3.27Å; K320-G322 PolarHBondContact O-N 2.87Å; K320-Q323 VanDerWaalsContact O-CB 3.26Å; K320-Q323 WeakPolarHBondContact O-CB 3.34Å; K320-Q323 PolarHBondContact O-N 3.46Å
321	T	82.4	Confident	89.9	Confident	74 Å²	74	43.3 Å²	43.3	45%	0.454	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	125.6	173.8	-55.9	0	0	0	0	111.1	E244 G245 R252	E244-T321 PolarHBondContact O-OG1 3.02Å; E244-T321 PolarHBondContact OE1-N 2.98Å; E244-T321 PolarHBondContact OE1-OG1 2.61Å; G245-T321 VanDerWaalsContact CA-OG1 3.23Å; G245-T321 WeakPolarHBondContact CA-OG1 3.14Å; R252-T321 VanDerWaalsContact NH1-N 3.13Å; R252-T321 VanDerWaalsContact NH2-CA 3.31Å; R252-T321 PolarHBondContact NH2-OG1 2.71Å
322	G	80.4	Confident	90	Very high	70 Å²	70	49 Å²	49	72%	0.722	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.5	-8.2	-178.8	0	0	0	0	0	115.7	K320 Y324	K320-G322 PolarHBondContact O-N 2.87Å; G322-Y324 VanDerWaalsContact C-N 3.34Å; G322-Y324 PolarHBondContact O-N 3.5Å
323	Q	86.6	Confident	90	Very high	74 Å²	74	51.5 Å²	51.5	35%	0.346	28%	0.28	S	S	.	.	S	Bend	trans	-68.2	-33.5	179.8	-173	171	6.5	0	0	112.9	K320 K333 M418	K320-Q323 VanDerWaalsContact O-CB 3.26Å; K320-Q323 WeakPolarHBondContact O-CB 3.34Å; K320-Q323 PolarHBondContact O-N 3.46Å; Q323-K333 PolarHBondContact O-NZ 3.5Å; Q323-M418 VanDerWaalsContact NE2-CE 3.26Å
324	Y	89.3	Confident	90	Very high	42 Å²	42	50.5 Å²	50.5	17%	0.165	28%	0.276	C	S	.	.			trans	-131.6	133.8	175.3	-58	-66	0	0	0	109.7	L316 G322 D329 C330 K333 M418	L316-Y324 HydrophobicContact CD2-CD2 4.04Å; L316-Y324 HydrophobicContact CD2-CG 4.15Å; G322-Y324 VanDerWaalsContact C-N 3.34Å; G322-Y324 PolarHBondContact O-N 3.5Å; Y324-D329 WeakPolarHBondContact CA-OD2 3.48Å; Y324-C330 VanDerWaalsContact CD1-CA 3.48Å; Y324-C330 HydrophobicContact CD1-CB 3.81Å; Y324-C330 HydrophobicContact CE1-CB 4.2Å; Y324-C330 HydrophobicContact CG-CB 3.99Å; Y324-K333 HydrophobicContact CD1-CD 3.71Å; Y324-K333 HydrophobicContact CE1-CB 4.01Å; Y324-K333 HydrophobicContact CE1-CD 3.73Å; Y324-M418 HydrophobicContact CE2-CE 3.75Å
325	S	86.3	Confident	90.1	Very high	111 Å²	111	54.3 Å²	54.3	78%	0.776	30%	0.295	S	S	*	.	S	Bend	trans	-79.8	-20.2	174.1	61.9	0	0	0	0	112.9	D329	S325-D329 PolarHBondContact N-OD2 2.86Å; S325-D329 WeakPolarHBondContact OG-CB 3.25Å; S325-D329 PolarHBondContact OG-OD2 3.35Å
326	G	89.3	Confident	90.2	Very high	30 Å²	30	62.2 Å²	62.2	31%	0.309	33%	0.33	S	S	.	.	S	Bend	trans	177.1	-170.3	178.8	0	0	0	0	0	112.9	D329 C330	G326-D329 PolarHBondContact O-N 3.4Å; G326-C330 WeakPolarHBondContact O-CB 3.22Å; G326-C330 PolarHBondContact O-N 2.77Å
327	I	92.5	Very high	90	Very high	57 Å²	57	68.6 Å²	68.6	29%	0.292	36%	0.359	S	S	.	.	H	α-helix	trans	-62.6	-44.6	-177.9	-56.6	175	0	0	0	111	T256 I259 M312 L316 C330 A331	T256-I327 WeakPolarHBondContact OG1-CD1 2.99Å; I259-I327 HydrophobicContact CD1-CD1 3.81Å; M312-I327 HydrophobicContact CE-CG2 4.27Å; M312-I327 HydrophobicContact SD-CG2 4.09Å; L316-I327 HydrophobicContact CD1-CG1 3.98Å; I327-C330 WeakPolarHBondContact O-CB 3.05Å; I327-C330 PolarHBondContact O-N 2.72Å; I327-A331 PolarHBondContact O-N 2.96Å
328	Y	93.8	Very high	89.9	Confident	180 Å²	180	71.2 Å²	71.2	71%	0.706	37%	0.371	S	S	*	.	H	α-helix	trans	-64.2	-44.7	179.3	177.8	-98.6	0	0	0	112.7	C330 A331 K332	Y328-C330 VanDerWaalsContact C-N 3.3Å; Y328-C330 PolarHBondContact O-N 3.43Å; Y328-A331 WeakPolarHBondContact O-CB 3.45Å; Y328-A331 PolarHBondContact O-N 3.17Å; Y328-K332 HydrophobicContact CE1-CD 4.32Å; Y328-K332 WeakPolarHBondContact O-CB 3.44Å; Y328-K332 PolarHBondContact O-N 3.34Å
329	D	94	Very high	90	Very high	31 Å²	31	72.1 Å²	72.1	17%	0.166	38%	0.382	C	S	.	.	H	α-helix	trans	-63.5	-38.2	176.5	179.6	49.6	0	0	0	111.5	Y324 S325 G326 K332 K333	Y324-D329 WeakPolarHBondContact CA-OD2 3.48Å; S325-D329 PolarHBondContact N-OD2 2.86Å; S325-D329 WeakPolarHBondContact OG-CB 3.25Å; S325-D329 PolarHBondContact OG-OD2 3.35Å; G326-D329 PolarHBondContact O-N 3.4Å; D329-K332 PolarHBondContact O-N 2.95Å; D329-K333 WeakPolarHBondContact O-CB 3.34Å; D329-K333 WeakPolarHBondContact O-CG 3.3Å; D329-K333 PolarHBondContact O-N 3.23Å; D329-K333 VanDerWaalsContact OD1-CE 3.25Å; D329-K333 WeakPolarHBondContact OD1-CE 3.23Å; D329-K333 IonicContact OD1-NZ 2.77Å; D329-K333 PolarHBondContact OD1-NZ 2.99Å; D329-K333 WeakPolarHBondContact OD2-CE 3.36Å; D329-K333 IonicContact OD2-NZ 2.77Å; D329-K333 PolarHBondContact OD2-NZ 3.49Å
330	C	92.8	Very high	90.2	Very high	0 Å²	0	78.2 Å²	78.2	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-59.5	-49	171.2	-173.8	0	0	0	0	111.8	L316 Y324 G326 I327 Y328 K332 K333 I334	L316-C330 HydrophobicContact CD2-CB 3.82Å; L316-C330 HydrophobicContact CG-CB 4.15Å; Y324-C330 VanDerWaalsContact CD1-CA 3.48Å; Y324-C330 HydrophobicContact CD1-CB 3.81Å; Y324-C330 HydrophobicContact CE1-CB 4.2Å; Y324-C330 HydrophobicContact CG-CB 3.99Å; G326-C330 WeakPolarHBondContact O-CB 3.22Å; G326-C330 PolarHBondContact O-N 2.77Å; I327-C330 WeakPolarHBondContact O-CB 3.05Å; I327-C330 PolarHBondContact O-N 2.72Å; Y328-C330 VanDerWaalsContact C-N 3.3Å; Y328-C330 PolarHBondContact O-N 3.43Å; C330-K332 PolarHBondContact O-N 2.92Å; C330-K333 PolarHBondContact O-N 2.8Å; C330-I334 WeakPolarHBondContact O-CD1 3.36Å; C330-I334 WeakPolarHBondContact O-CG1 3.16Å; C330-I334 PolarHBondContact O-N 3.3Å
331	A	94.2	Very high	90.4	Very high	25 Å²	25	74.4 Å²	74.4	21%	0.207	41%	0.413	C	S	.	.	H	α-helix	trans	-59.5	-47.7	177.5	0	0	0	0	0	111.7	M312 I327 Y328 K333 I334 L335 F343	M312-A331 HydrophobicContact SD-CB 3.7Å; I327-A331 PolarHBondContact O-N 2.96Å; Y328-A331 WeakPolarHBondContact O-CB 3.45Å; Y328-A331 PolarHBondContact O-N 3.17Å; A331-K333 PolarHBondContact O-N 2.89Å; A331-I334 PolarHBondContact O-N 2.9Å; A331-L335 WeakPolarHBondContact O-CB 3.33Å; A331-L335 PolarHBondContact O-N 2.91Å; A331-F343 HydrophobicContact CB-CE1 4.45Å; A331-F343 HydrophobicContact CB-CZ 4.37Å
332	K	95.3	Very high	90.8	Very high	121 Å²	121	70.9 Å²	70.9	53%	0.526	39%	0.392	S	S	.	.	H	α-helix	trans	-60.3	-44.2	179.6	-175.1	177	-179.3	175.9	0	112	Y328 D329 C330 L335 K336	Y328-K332 HydrophobicContact CE1-CD 4.32Å; Y328-K332 WeakPolarHBondContact O-CB 3.44Å; Y328-K332 PolarHBondContact O-N 3.34Å; D329-K332 PolarHBondContact O-N 2.95Å; C330-K332 PolarHBondContact O-N 2.92Å; K332-L335 PolarHBondContact O-N 3.33Å; K332-K336 VanDerWaalsContact O-CB 3.28Å; K332-K336 WeakPolarHBondContact O-CB 3.21Å; K332-K336 PolarHBondContact O-N 2.91Å
333	K	93.5	Very high	91.4	Very high	71 Å²	71	68.6 Å²	68.6	31%	0.309	36%	0.362	S	S	.	.	H	α-helix	trans	-67.5	-42.7	178.3	-78.3	168.8	174.5	164.2	0	112.1	Q323 Y324 D329 C330 A331 L335 K336 H337	Q323-K333 PolarHBondContact O-NZ 3.5Å; Y324-K333 HydrophobicContact CD1-CD 3.71Å; Y324-K333 HydrophobicContact CE1-CB 4.01Å; Y324-K333 HydrophobicContact CE1-CD 3.73Å; D329-K333 WeakPolarHBondContact O-CB 3.34Å; D329-K333 WeakPolarHBondContact O-CG 3.3Å; D329-K333 PolarHBondContact O-N 3.23Å; D329-K333 VanDerWaalsContact OD1-CE 3.25Å; D329-K333 WeakPolarHBondContact OD1-CE 3.23Å; D329-K333 IonicContact OD1-NZ 2.77Å; D329-K333 PolarHBondContact OD1-NZ 2.99Å; D329-K333 WeakPolarHBondContact OD2-CE 3.36Å; D329-K333 IonicContact OD2-NZ 2.77Å; D329-K333 PolarHBondContact OD2-NZ 3.49Å; C330-K333 PolarHBondContact O-N 2.8Å; A331-K333 PolarHBondContact O-N 2.89Å; K333-L335 VanDerWaalsContact C-N 3.35Å; K333-K336 PolarHBondContact O-N 3Å; K333-H337 WeakPolarHBondContact O-CB 3.38Å; K333-H337 PolarHBondContact O-CD2 3.37Å; K333-H337 PolarHBondContact O-N 2.73Å
334	I	92.3	Very high	91.8	Very high	2 Å²	2	70 Å²	70	1%	0.01	37%	0.365	C	S	.	.	H	α-helix	trans	-59.5	-48.8	175.3	-68	165.8	0	0	0	109.9	M312 R315 C330 A331 K336 H337 E338 G339 A342 F343	M312-I334 HydrophobicContact CG-CD1 4.2Å; R315-I334 HydrophobicContact CB-CD1 4.36Å; R315-I334 HydrophobicContact CG-CD1 3.95Å; C330-I334 WeakPolarHBondContact O-CD1 3.36Å; C330-I334 WeakPolarHBondContact O-CG1 3.16Å; C330-I334 PolarHBondContact O-N 3.3Å; A331-I334 PolarHBondContact O-N 2.9Å; I334-K336 PolarHBondContact O-N 3.15Å; I334-H337 PolarHBondContact O-N 2.9Å; I334-E338 WeakPolarHBondContact O-CA 3.41Å; I334-E338 PolarHBondContact O-N 3.47Å; I334-G339 PolarHBondContact O-N 3.07Å; I334-A342 HydrophobicContact CG2-CB 3.62Å; I334-F343 HydrophobicContact CB-CE1 4.33Å; I334-F343 HydrophobicContact CB-CE2 4.25Å; I334-F343 HydrophobicContact CB-CZ 3.87Å; I334-F343 HydrophobicContact CD1-CE1 4.31Å; I334-F343 HydrophobicContact CG2-CD1 4.41Å; I334-F343 HydrophobicContact CG2-CD2 4.04Å; I334-F343 HydrophobicContact CG2-CE1 4.07Å; I334-F343 HydrophobicContact CG2-CE2 3.66Å; I334-F343 HydrophobicContact CG2-CG 4.41Å; I334-F343 HydrophobicContact CG2-CZ 3.68Å
335	L	94.1	Very high	91.9	Very high	87 Å²	87	70.4 Å²	70.4	46%	0.455	37%	0.368	S	S	.	.	H	α-helix	trans	-61.6	-43.9	-179.9	-176.2	60.5	0	0	0	112.1	A331 K332 K333 G339 L340 F343	A331-L335 WeakPolarHBondContact O-CB 3.33Å; A331-L335 PolarHBondContact O-N 2.91Å; K332-L335 PolarHBondContact O-N 3.33Å; K333-L335 VanDerWaalsContact C-N 3.35Å; L335-G339 WeakPolarHBondContact O-CA 3.2Å; L335-G339 PolarHBondContact O-N 2.81Å; L335-L340 HydrophobicContact CD1-CD2 3.53Å; L335-L340 HydrophobicContact CD1-CG 3.8Å; L335-F343 HydrophobicContact CB-CE2 4.17Å; L335-F343 HydrophobicContact CD1-CE2 4.45Å
336	K	93	Very high	92.1	Very high	167 Å²	167	65.2 Å²	65.2	73%	0.726	33%	0.332	S	S	*	.	H	α-helix	trans	-68.7	-37.8	-178.4	-173.2	178.2	179.4	-177.3	0	113.2	K332 K333 I334	K332-K336 VanDerWaalsContact O-CB 3.28Å; K332-K336 WeakPolarHBondContact O-CB 3.21Å; K332-K336 PolarHBondContact O-N 2.91Å; K333-K336 PolarHBondContact O-N 3Å; I334-K336 PolarHBondContact O-N 3.15Å
337	H	89.4	Confident	92.2	Very high	146 Å²	146	66.5 Å²	66.5	68%	0.676	33%	0.328	S	S	*	.	H	α-helix	trans	-99.3	-31	-172.3	-69.3	-71.9	0	0	0	114.5	K333 I334	K333-H337 WeakPolarHBondContact O-CB 3.38Å; K333-H337 PolarHBondContact O-CD2 3.37Å; K333-H337 PolarHBondContact O-N 2.73Å; I334-H337 PolarHBondContact O-N 2.9Å
338	E	88.3	Confident	92.2	Very high	58 Å²	58	67.9 Å²	67.9	27%	0.271	34%	0.339	S	S	.	.	H	α-helix	trans	-120	-11.6	-174.7	-58.1	-175.5	-124.5	0	0	113.7	R315 I334 A342 K345 A417	R315-E338 IonicContact CZ-OE1 3.52Å; R315-E338 IonicContact CZ-OE2 3.43Å; R315-E338 IonicContact NH1-OE1 3.54Å; R315-E338 PolarHBondContact NH1-OE1 2.91Å; R315-E338 VanDerWaalsContact NH2-CD 3.28Å; R315-E338 IonicContact NH2-OE1 2.55Å; R315-E338 PolarHBondContact NH2-OE1 2.69Å; R315-E338 IonicContact NH2-OE2 3.7Å; R315-E338 PolarHBondContact NH2-OE2 3.03Å; I334-E338 WeakPolarHBondContact O-CA 3.41Å; I334-E338 PolarHBondContact O-N 3.47Å; E338-A342 HydrophobicContact CB-CB 3.39Å; E338-A342 HydrophobicContact CG-CB 4.36Å; E338-K345 IonicContact OE2-NZ 3.59Å; E338-K345 PolarHBondContact OE2-NZ 3.07Å; E338-A417 HydrophobicContact CG-CB 4.23Å; E338-A417 VanDerWaalsContact OE1-CB 3.31Å; E338-A417 WeakPolarHBondContact OE1-CB 3.15Å; E338-A417 WeakPolarHBondContact OE2-CB 3.26Å
339	G	90.5	Very high	92.1	Very high	27 Å²	27	59.4 Å²	59.4	28%	0.278	31%	0.306	S	S	.	.			trans	76.5	-175.8	-178.3	0	0	0	0	0	114.5	I334 L335 G341 A342	I334-G339 PolarHBondContact O-N 3.07Å; L335-G339 WeakPolarHBondContact O-CA 3.2Å; L335-G339 PolarHBondContact O-N 2.81Å; G339-G341 PolarHBondContact O-N 3.1Å; G339-A342 VanDerWaalsContact O-CB 3.32Å; G339-A342 WeakPolarHBondContact O-CB 3.27Å; G339-A342 PolarHBondContact O-N 2.79Å
340	L	91	Very high	91.9	Very high	130 Å²	130	58.4 Å²	58.4	68%	0.681	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-66	-35.5	-174.7	-72.1	169.9	0	0	0	113.4	L335 A342 F343	L335-L340 HydrophobicContact CD1-CD2 3.53Å; L335-L340 HydrophobicContact CD1-CG 3.8Å; L340-A342 PolarHBondContact O-N 3.29Å; L340-A342 VanDerWaalsContact O-N 3.09Å; L340-F343 PolarHBondContact O-N 3.49Å
341	G	89.3	Confident	91.7	Very high	59 Å²	59	61.1 Å²	61.1	61%	0.608	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-61.5	-20.8	179.7	0	0	0	0	0	113.8	G339 F343 Y344	G339-G341 PolarHBondContact O-N 3.1Å; G341-F343 VanDerWaalsContact C-N 3.29Å; G341-F343 PolarHBondContact O-N 2.79Å; G341-Y344 PolarHBondContact O-N 2.79Å
342	A	90.9	Very high	91.5	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.008	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-64.5	-32.5	178.1	0	0	0	0	0	113.1	I334 E338 G339 L340 Y344 K345	I334-A342 HydrophobicContact CG2-CB 3.62Å; E338-A342 HydrophobicContact CB-CB 3.39Å; E338-A342 HydrophobicContact CG-CB 4.36Å; G339-A342 VanDerWaalsContact O-CB 3.32Å; G339-A342 WeakPolarHBondContact O-CB 3.27Å; G339-A342 PolarHBondContact O-N 2.79Å; L340-A342 PolarHBondContact O-N 3.29Å; L340-A342 VanDerWaalsContact O-N 3.09Å; A342-Y344 PolarHBondContact O-N 3.23Å; A342-K345 PolarHBondContact O-N 3.29Å
343	F	93.4	Very high	91.1	Very high	22 Å²	22	58.6 Å²	58.6	10%	0.096	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-69.3	-12.4	178.2	-69.9	-83.1	0	0	0	113.4	Y307 P308 V311 M312 A331 I334 L335 L340 G341	Y307-F343 VanDerWaalsContact CD1-O 3.27Å; Y307-F343 WeakPolarHBondContact CD1-O 3.47Å; P308-F343 HydrophobicContact CB-CB 3.99Å; P308-F343 HydrophobicContact CB-CD1 3.87Å; P308-F343 HydrophobicContact CB-CG 4.27Å; P308-F343 HydrophobicContact CG-CB 4.23Å; V311-F343 WeakPolarHBondContact CG2-O 3.31Å; M312-F343 HydrophobicContact CG-CD1 4.41Å; M312-F343 HydrophobicContact CG-CE1 4.01Å; M312-F343 HydrophobicContact SD-CE1 4.15Å; A331-F343 HydrophobicContact CB-CE1 4.45Å; A331-F343 HydrophobicContact CB-CZ 4.37Å; I334-F343 HydrophobicContact CB-CE1 4.33Å; I334-F343 HydrophobicContact CB-CE2 4.25Å; I334-F343 HydrophobicContact CB-CZ 3.87Å; I334-F343 HydrophobicContact CD1-CE1 4.31Å; I334-F343 HydrophobicContact CG2-CD1 4.41Å; I334-F343 HydrophobicContact CG2-CD2 4.04Å; I334-F343 HydrophobicContact CG2-CE1 4.07Å; I334-F343 HydrophobicContact CG2-CE2 3.66Å; I334-F343 HydrophobicContact CG2-CG 4.41Å; I334-F343 HydrophobicContact CG2-CZ 3.68Å; L335-F343 HydrophobicContact CB-CE2 4.17Å; L335-F343 HydrophobicContact CD1-CE2 4.45Å; L340-F343 PolarHBondContact O-N 3.49Å; G341-F343 VanDerWaalsContact C-N 3.29Å; G341-F343 PolarHBondContact O-N 2.79Å
344	Y	94.2	Very high	90.6	Very high	102 Å²	102	58.5 Å²	58.5	40%	0.4	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-114.4	11.8	178.4	-69.9	-90.9	0	0	0	113.3	T304 Y307 P308 G341 A342 G346 Y347	T304-Y344 HydrophobicContact CG2-CE1 4.45Å; T304-Y344 WeakPolarHBondContact O-CE1 3.29Å; T304-Y344 PolarHBondContact O-OH 3.47Å; Y307-Y344 HydrophobicContact CD1-CD1 4.05Å; Y307-Y344 HydrophobicContact CD1-CG 4.46Å; Y307-Y344 HydrophobicContact CG-CD1 4.35Å; P308-Y344 HydrophobicContact CG-CE2 3.99Å; G341-Y344 PolarHBondContact O-N 2.79Å; A342-Y344 PolarHBondContact O-N 3.23Å; Y344-G346 PolarHBondContact O-N 3.06Å; Y344-Y347 HydrophobicContact CD1-CD2 4.38Å; Y344-Y347 WeakPolarHBondContact O-CB 3.11Å; Y344-Y347 PolarHBondContact O-N 3.46Å; Y344-Y347 VanDerWaalsContact O-N 3.1Å
345	K	91.4	Very high	90	Very high	51 Å²	51	64.5 Å²	64.5	22%	0.222	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	125.3	174.8	-80.9	-176.1	179.2	175	0	111	Y307 E338 A342 Q414	Y307-K345 WeakPolarHBondContact CE1-O 3.34Å; Y307-K345 PolarHBondContact OH-O 3.31Å; Y307-K345 VanDerWaalsContact OH-O 3.1Å; E338-K345 IonicContact OE2-NZ 3.59Å; E338-K345 PolarHBondContact OE2-NZ 3.07Å; A342-K345 PolarHBondContact O-N 3.29Å; K345-Q414 WeakPolarHBondContact O-CG 3.48Å
346	G	90.6	Very high	89.5	Confident	3 Å²	3	62.8 Å²	62.8	3%	0.031	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	8	-177.7	0	0	0	0	0	114.3	Y307 Y344 P349 N350	Y307-G346 WeakPolarHBondContact OH-CA 3.39Å; Y307-G346 PolarHBondContact OH-O 2.82Å; Y344-G346 PolarHBondContact O-N 3.06Å; G346-P349 WeakPolarHBondContact O-CD 3.41Å; G346-P349 VanDerWaalsContact O-CG 3.3Å; G346-P349 WeakPolarHBondContact O-CG 2.97Å; G346-N350 WeakPolarHBondContact O-CB 3.16Å; G346-N350 PolarHBondContact O-N 2.94Å; G346-N350 VanDerWaalsContact O-N 3.11Å
347	Y	92.1	Very high	89	Confident	56 Å²	56	58.1 Å²	58.1	22%	0.22	31%	0.311	C	S	.	.	H	α-helix	trans	-62.9	-41.9	-179.3	-178.9	-105.9	0	0	0	112.7	T304 Y307 Y344 N350 L351	T304-Y347 PolarHBondContact OG1-OH 3.46Å; Y307-Y347 HydrophobicContact CD1-CD2 4.28Å; Y307-Y347 AromaticContact CD2-CD2 3.64Å; Y307-Y347 HydrophobicContact CD2-CD2 3.64Å; Y307-Y347 HydrophobicContact CD2-CE2 4.35Å; Y307-Y347 AromaticContact CE2-CD2 3.96Å; Y307-Y347 HydrophobicContact CE2-CD2 3.96Å; Y307-Y347 AromaticContact CG-CD2 3.82Å; Y307-Y347 HydrophobicContact CG-CD2 3.82Å; Y307-Y347 PolarHBondContact OH-N 3.24Å; Y307-Y347 VanDerWaalsContact OH-N 3.13Å; Y344-Y347 HydrophobicContact CD1-CD2 4.38Å; Y344-Y347 WeakPolarHBondContact O-CB 3.11Å; Y344-Y347 PolarHBondContact O-N 3.46Å; Y344-Y347 VanDerWaalsContact O-N 3.1Å; Y347-N350 VanDerWaalsContact O-CB 3.26Å; Y347-N350 WeakPolarHBondContact O-CB 3.13Å; Y347-N350 PolarHBondContact O-N 2.84Å; Y347-L351 HydrophobicContact CD1-CD1 4.14Å; Y347-L351 HydrophobicContact CE1-CD1 3.4Å; Y347-L351 HydrophobicContact CE1-CG 4.03Å; Y347-L351 HydrophobicContact CE2-CD1 4.38Å; Y347-L351 HydrophobicContact CE2-CD2 4.31Å; Y347-L351 HydrophobicContact CE2-CG 4.23Å; Y347-L351 PolarHBondContact O-N 2.9Å
348	V	91.9	Very high	88.4	Confident	86 Å²	86	53.1 Å²	53.1	52%	0.521	30%	0.295	S	S	.	.	H	α-helix	trans	-60.5	-55.8	176.9	177.5	0	0	0	0	112.9	N350 L351 L352 M427	V348-N350 PolarHBondContact O-N 2.98Å; V348-L351 PolarHBondContact O-N 3.15Å; V348-L352 HydrophobicContact CG1-CD1 3.92Å; V348-L352 HydrophobicContact CG1-CG 4.42Å; V348-L352 WeakPolarHBondContact O-CG 3.5Å; V348-L352 PolarHBondContact O-N 3.37Å; V348-M427 HydrophobicContact CG1-SD 4.16Å
349	P	92	Very high	87.8	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.013	30%	0.303	C	S	.	.	H	α-helix	trans	-63.2	-24.5	176.9	22	-31.7	0	0	0	112.7	G346 G353 L406 V409 R410 M413 M427	G346-P349 WeakPolarHBondContact O-CD 3.41Å; G346-P349 VanDerWaalsContact O-CG 3.3Å; G346-P349 WeakPolarHBondContact O-CG 2.97Å; P349-G353 PolarHBondContact O-N 3.31Å; P349-G353 VanDerWaalsContact O-N 3.1Å; P349-L406 HydrophobicContact CB-CD2 4.35Å; P349-V409 HydrophobicContact CB-CG1 4.27Å; P349-V409 HydrophobicContact CG-CG1 4.33Å; P349-R410 HydrophobicContact CB-CB 4.4Å; P349-R410 HydrophobicContact CG-CB 4.22Å; P349-M413 HydrophobicContact CG-SD 3.88Å; P349-M427 HydrophobicContact CB-CG 4.12Å; P349-M427 HydrophobicContact CB-SD 3.76Å; P349-M427 HydrophobicContact CG-CG 4.21Å; P349-M427 HydrophobicContact CG-SD 4.17Å
350	N	90.3	Very high	87.5	Confident	11 Å²	11	54 Å²	54	6%	0.059	30%	0.304	C	S	.	.	H	α-helix	trans	-63.4	-56.1	171.4	179.8	57.2	0	0	0	112	Q303 Y307 G346 Y347 V348 L352 G353 I354 R410	Q303-N350 WeakPolarHBondContact CG-ND2 3.48Å; Y307-N350 HydrophobicContact CE2-CB 3.8Å; G346-N350 WeakPolarHBondContact O-CB 3.16Å; G346-N350 PolarHBondContact O-N 2.94Å; G346-N350 VanDerWaalsContact O-N 3.11Å; Y347-N350 VanDerWaalsContact O-CB 3.26Å; Y347-N350 WeakPolarHBondContact O-CB 3.13Å; Y347-N350 PolarHBondContact O-N 2.84Å; V348-N350 PolarHBondContact O-N 2.98Å; N350-L352 VanDerWaalsContact C-N 3.34Å; N350-L352 PolarHBondContact O-N 2.98Å; N350-G353 PolarHBondContact O-N 2.92Å; N350-G353 VanDerWaalsContact O-N 3.09Å; N350-I354 WeakPolarHBondContact O-CG1 3.46Å; N350-I354 PolarHBondContact O-N 2.78Å; N350-R410 HydrophobicContact CB-CG 4.34Å; N350-R410 PolarHBondContact OD1-NH1 2.98Å
351	L	88.3	Confident	87	Confident	56 Å²	56	48.9 Å²	48.9	29%	0.293	28%	0.278	S	S	.	.	H	α-helix	trans	-60.7	-44.1	-179.2	-70.4	-176.1	0	0	0	112	Y347 V348 G353 I354	Y347-L351 HydrophobicContact CD1-CD1 4.14Å; Y347-L351 HydrophobicContact CE1-CD1 3.4Å; Y347-L351 HydrophobicContact CE1-CG 4.03Å; Y347-L351 HydrophobicContact CE2-CD1 4.38Å; Y347-L351 HydrophobicContact CE2-CD2 4.31Å; Y347-L351 HydrophobicContact CE2-CG 4.23Å; Y347-L351 PolarHBondContact O-N 2.9Å; V348-L351 PolarHBondContact O-N 3.15Å; L351-G353 PolarHBondContact O-N 3.4Å; L351-I354 HydrophobicContact CD2-CD1 4.33Å; L351-I354 PolarHBondContact O-N 3.32Å
352	L	90.3	Very high	86.3	Confident	83 Å²	83	48.9 Å²	48.9	44%	0.435	26%	0.264	S	S	.	.	H	α-helix	trans	-62.5	-27.8	176.9	-68.7	176.9	0	0	0	112.7	V348 N350 P356 L406 M427	V348-L352 HydrophobicContact CG1-CD1 3.92Å; V348-L352 HydrophobicContact CG1-CG 4.42Å; V348-L352 WeakPolarHBondContact O-CG 3.5Å; V348-L352 PolarHBondContact O-N 3.37Å; N350-L352 VanDerWaalsContact C-N 3.34Å; N350-L352 PolarHBondContact O-N 2.98Å; L352-P356 WeakPolarHBondContact O-CD 3.37Å; L352-L406 HydrophobicContact CB-CD1 4.04Å; L352-M427 HydrophobicContact CD1-CE 4.14Å; L352-M427 HydrophobicContact CD1-SD 4.16Å
353	G	85.4	Confident	85.6	Confident	10 Å²	10	51.6 Å²	51.6	10%	0.103	29%	0.286	C	S	.	.	H	α-helix	trans	-79.4	-26.4	178.4	0	0	0	0	0	113.9	P349 N350 L351 Y357 S403	P349-G353 PolarHBondContact O-N 3.31Å; P349-G353 VanDerWaalsContact O-N 3.1Å; N350-G353 PolarHBondContact O-N 2.92Å; N350-G353 VanDerWaalsContact O-N 3.09Å; L351-G353 PolarHBondContact O-N 3.4Å; G353-Y357 VanDerWaalsContact O-CB 3.3Å; G353-Y357 WeakPolarHBondContact O-CB 3.29Å; G353-Y357 PolarHBondContact O-N 2.89Å; G353-S403 WeakPolarHBondContact O-CB 3.47Å
354	I	82.8	Confident	85.1	Confident	69 Å²	69	52.2 Å²	52.2	35%	0.354	29%	0.291	S	S	.	.	H	α-helix	trans	-66.1	-42.4	-179.4	-68.8	167.4	0	0	0	110.9	Q303 N350 L351 Y357 A358	Q303-I354 HydrophobicContact CG-CD1 4.44Å; N350-I354 WeakPolarHBondContact O-CG1 3.46Å; N350-I354 PolarHBondContact O-N 2.78Å; L351-I354 HydrophobicContact CD2-CD1 4.33Å; L351-I354 PolarHBondContact O-N 3.32Å; I354-Y357 PolarHBondContact O-N 3.05Å; I354-A358 WeakPolarHBondContact O-CB 3.5Å; I354-A358 PolarHBondContact O-N 3.48Å
355	I	80.2	Confident	84.4	Confident	129 Å²	129	48.3 Å²	48.3	66%	0.662	28%	0.276	S	S	*	.	H	α-helix	trans	-63.5	-53	-174.4	-59.9	168.1	0	0	0	111.8	Y357 A358 G359	I355-Y357 VanDerWaalsContact C-N 3.31Å; I355-Y357 PolarHBondContact O-N 2.8Å; I355-A358 PolarHBondContact O-N 3.33Å; I355-G359 PolarHBondContact O-N 3.33Å
356	P	83.9	Confident	83.6	Confident	50 Å²	50	50.3 Å²	50.3	33%	0.325	29%	0.286	S	S	.	.	H	α-helix	trans	-65.3	-34.8	177.3	-20.2	32.9	0	0	0	112.6	L352 I360	L352-P356 WeakPolarHBondContact O-CD 3.37Å; P356-I360 WeakPolarHBondContact O-CB 3.38Å; P356-I360 WeakPolarHBondContact O-CD1 3.3Å; P356-I360 VanDerWaalsContact O-CG1 3.3Å; P356-I360 WeakPolarHBondContact O-CG1 3.34Å; P356-I360 PolarHBondContact O-N 2.88Å; P356-I360 VanDerWaalsContact O-N 3.1Å
357	Y	82.9	Confident	83.2	Confident	69 Å²	69	56 Å²	56	27%	0.271	32%	0.315	S	S	.	.	H	α-helix	trans	-58.5	-56.4	175.5	173.4	-94.4	0	0	0	110.5	G353 I354 I355 I360 D361 S396 G399 Q400	G353-Y357 VanDerWaalsContact O-CB 3.3Å; G353-Y357 WeakPolarHBondContact O-CB 3.29Å; G353-Y357 PolarHBondContact O-N 2.89Å; I354-Y357 PolarHBondContact O-N 3.05Å; I355-Y357 VanDerWaalsContact C-N 3.31Å; I355-Y357 PolarHBondContact O-N 2.8Å; Y357-I360 PolarHBondContact O-N 3.45Å; Y357-D361 WeakPolarHBondContact O-CB 3.22Å; Y357-D361 PolarHBondContact O-N 2.91Å; Y357-D361 PolarHBondContact OH-OD2 2.97Å; Y357-S396 PolarHBondContact OH-OG 3.01Å; Y357-G399 VanDerWaalsContact CD2-C 3.47Å; Y357-Q400 HydrophobicContact CD2-CG 4.25Å; Y357-Q400 HydrophobicContact CE2-CG 3.82Å
358	A	76.3	Confident	82.5	Confident	41 Å²	41	55.8 Å²	55.8	34%	0.339	32%	0.318	S	S	.	.	H	α-helix	trans	-65	-42.8	-176.2	0	0	0	0	0	112.3	I354 I355 L362	I354-A358 WeakPolarHBondContact O-CB 3.5Å; I354-A358 PolarHBondContact O-N 3.48Å; I355-A358 PolarHBondContact O-N 3.33Å; A358-L362 WeakPolarHBondContact O-CB 3.43Å; A358-L362 PolarHBondContact O-N 2.78Å
359	G	76.8	Confident	81.6	Confident	43 Å²	43	52.7 Å²	52.7	44%	0.443	30%	0.297	S	S	.	.	H	α-helix	trans	-63.7	-42.2	179.8	0	0	0	0	0	113.1	I355 A363	I355-G359 PolarHBondContact O-N 3.33Å; G359-A363 VanDerWaalsContact O-CB 3.27Å; G359-A363 WeakPolarHBondContact O-CB 3.38Å; G359-A363 PolarHBondContact O-N 3.46Å
360	I	84.4	Confident	80.7	Confident	60 Å²	60	55.3 Å²	55.3	31%	0.308	32%	0.315	S	S	.	.	H	α-helix	trans	-75.3	-40.6	179.3	-67.1	168	0	0	0	111.2	P356 Y357 L362 A363 V364 C398 A402	P356-I360 WeakPolarHBondContact O-CB 3.38Å; P356-I360 WeakPolarHBondContact O-CD1 3.3Å; P356-I360 VanDerWaalsContact O-CG1 3.3Å; P356-I360 WeakPolarHBondContact O-CG1 3.34Å; P356-I360 PolarHBondContact O-N 2.88Å; P356-I360 VanDerWaalsContact O-N 3.1Å; Y357-I360 PolarHBondContact O-N 3.45Å; I360-L362 VanDerWaalsContact C-N 3.34Å; I360-L362 PolarHBondContact O-N 3.02Å; I360-A363 PolarHBondContact O-N 3.39Å; I360-V364 HydrophobicContact CG2-CG2 3.95Å; I360-V364 VanDerWaalsContact O-CB 3.28Å; I360-V364 WeakPolarHBondContact O-CB 3.45Å; I360-V364 VanDerWaalsContact O-CG2 3.22Å; I360-V364 WeakPolarHBondContact O-CG2 3.36Å; I360-V364 PolarHBondContact O-N 3.26Å; I360-C398 HydrophobicContact CG2-CB 4.09Å; I360-A402 HydrophobicContact CD1-CB 3.2Å
361	D	79.4	Confident	80.1	Confident	24 Å²	24	61.5 Å²	61.5	13%	0.128	34%	0.339	C	S	.	.	H	α-helix	trans	-57.9	-48.6	176	-171.9	28.7	0	0	0	110.3	Y357 Y365 S395 S396	Y357-D361 WeakPolarHBondContact O-CB 3.22Å; Y357-D361 PolarHBondContact O-N 2.91Å; Y357-D361 PolarHBondContact OH-OD2 2.97Å; D361-Y365 WeakPolarHBondContact O-CB 3.27Å; D361-Y365 PolarHBondContact O-N 2.94Å; D361-S395 VanDerWaalsContact O-CB 3.26Å; D361-S395 WeakPolarHBondContact O-CB 3.33Å; D361-S395 VanDerWaalsContact OD1-CB 3.28Å; D361-S395 WeakPolarHBondContact OD1-CB 3.36Å; D361-S395 PolarHBondContact OD1-OG 2.89Å; D361-S396 VanDerWaalsContact OD1-CA 3.22Å; D361-S396 WeakPolarHBondContact OD1-CA 3.24Å; D361-S396 PolarHBondContact OD1-N 3.5Å; D361-S396 PolarHBondContact OD1-OG 3.09Å; D361-S396 VanDerWaalsContact OD1-OG 3.11Å; D361-S396 PolarHBondContact OD2-OG 3.35Å
362	L	75.4	Confident	79.6	Confident	59 Å²	59	61.3 Å²	61.3	31%	0.309	33%	0.334	S	S	.	.	H	α-helix	trans	-62.9	-51.8	177.5	-174.3	65.1	0	0	0	112.2	A358 I360 V364 Y365 E366	A358-L362 WeakPolarHBondContact O-CB 3.43Å; A358-L362 PolarHBondContact O-N 2.78Å; I360-L362 VanDerWaalsContact C-N 3.34Å; I360-L362 PolarHBondContact O-N 3.02Å; L362-V364 VanDerWaalsContact C-N 3.35Å; L362-V364 PolarHBondContact O-N 3.5Å; L362-Y365 PolarHBondContact O-N 2.93Å; L362-E366 HydrophobicContact CD1-CG 4.37Å; L362-E366 WeakPolarHBondContact O-CG 3.33Å; L362-E366 PolarHBondContact O-N 2.85Å
363	A	76.2	Confident	78.6	Confident	57 Å²	57	57.8 Å²	57.8	47%	0.471	32%	0.316	S	S	.	.	H	α-helix	trans	-61.8	-41.2	-176.9	0	0	0	0	0	112.7	G359 I360 L367	G359-A363 VanDerWaalsContact O-CB 3.27Å; G359-A363 WeakPolarHBondContact O-CB 3.38Å; G359-A363 PolarHBondContact O-N 3.46Å; I360-A363 PolarHBondContact O-N 3.39Å; A363-L367 VanDerWaalsContact O-CB 3.29Å; A363-L367 WeakPolarHBondContact O-CB 3.46Å; A363-L367 PolarHBondContact O-N 3.18Å
364	V	83.2	Confident	77.9	Confident	35 Å²	35	61.7 Å²	61.7	21%	0.212	33%	0.334	C	S	.	.	H	α-helix	trans	-72.3	-38.4	178.2	175.6	0	0	0	0	110.8	I360 L362 L367 L368 C398	I360-V364 HydrophobicContact CG2-CG2 3.95Å; I360-V364 VanDerWaalsContact O-CB 3.28Å; I360-V364 WeakPolarHBondContact O-CB 3.45Å; I360-V364 VanDerWaalsContact O-CG2 3.22Å; I360-V364 WeakPolarHBondContact O-CG2 3.36Å; I360-V364 PolarHBondContact O-N 3.26Å; L362-V364 VanDerWaalsContact C-N 3.35Å; L362-V364 PolarHBondContact O-N 3.5Å; V364-L367 PolarHBondContact O-N 3.45Å; V364-L368 HydrophobicContact CG1-CD1 3.75Å; V364-L368 HydrophobicContact CG1-CG 4.11Å; V364-L368 WeakPolarHBondContact O-CB 3.44Å; V364-L368 WeakPolarHBondContact O-CG 3.06Å; V364-L368 PolarHBondContact O-N 2.8Å; V364-C398 HydrophobicContact CG1-CB 4.43Å; V364-C398 HydrophobicContact CG2-CB 4.18Å
365	Y	79.5	Confident	77.5	Confident	21 Å²	21	62.2 Å²	62.2	8%	0.082	34%	0.338	C	S	.	.	H	α-helix	trans	-59.8	-51.1	176.2	177.8	-98.8	0	0	0	111.2	D361 L362 L367 L368 K369 C391	D361-Y365 WeakPolarHBondContact O-CB 3.27Å; D361-Y365 PolarHBondContact O-N 2.94Å; L362-Y365 PolarHBondContact O-N 2.93Å; Y365-L367 PolarHBondContact O-N 3.2Å; Y365-L368 PolarHBondContact O-N 2.97Å; Y365-K369 HydrophobicContact CE1-CD 4.02Å; Y365-K369 VanDerWaalsContact O-CB 3.27Å; Y365-K369 WeakPolarHBondContact O-CB 3.45Å; Y365-K369 PolarHBondContact O-N 3.18Å; Y365-C391 HydrophobicContact CD2-CB 3.99Å; Y365-C391 HydrophobicContact CE2-CB 4.01Å
366	E	74.4	Confident	77.1	Confident	92 Å²	92	62 Å²	62	43%	0.43	33%	0.332	S	S	.	.	H	α-helix	trans	-60.6	-45.6	178.4	-72.4	180	177.7	0	0	111.2	L362 L368 K369 S370	L362-E366 HydrophobicContact CD1-CG 4.37Å; L362-E366 WeakPolarHBondContact O-CG 3.33Å; L362-E366 PolarHBondContact O-N 2.85Å; E366-L368 PolarHBondContact O-N 2.85Å; E366-K369 PolarHBondContact O-N 2.87Å; E366-S370 WeakPolarHBondContact O-CB 3.41Å; E366-S370 PolarHBondContact O-N 3.33Å; E366-S370 PolarHBondContact O-OG 2.84Å; E366-S370 VanDerWaalsContact O-OG 3.05Å
367	L	80.6	Confident	76.1	Confident	123 Å²	123	61 Å²	61	64%	0.644	33%	0.329	S	S	*	.	H	α-helix	trans	-59.6	-46.4	177.3	-178.6	65.3	0	0	0	112.3	A363 V364 Y365 Y371	A363-L367 VanDerWaalsContact O-CB 3.29Å; A363-L367 WeakPolarHBondContact O-CB 3.46Å; A363-L367 PolarHBondContact O-N 3.18Å; V364-L367 PolarHBondContact O-N 3.45Å; Y365-L367 PolarHBondContact O-N 3.2Å; L367-Y371 WeakPolarHBondContact O-CB 3.39Å; L367-Y371 PolarHBondContact O-N 3.25Å
368	L	79.4	Confident	74.6	Confident	52 Å²	52	66.4 Å²	66.4	27%	0.272	35%	0.354	S	S	.	.	H	α-helix	trans	-67.3	-40	179.9	-71.5	175	0	0	0	111.8	V364 Y365 E366 W372 C391 L394	V364-L368 HydrophobicContact CG1-CD1 3.75Å; V364-L368 HydrophobicContact CG1-CG 4.11Å; V364-L368 WeakPolarHBondContact O-CB 3.44Å; V364-L368 WeakPolarHBondContact O-CG 3.06Å; V364-L368 PolarHBondContact O-N 2.8Å; Y365-L368 PolarHBondContact O-N 2.97Å; E366-L368 PolarHBondContact O-N 2.85Å; L368-W372 WeakPolarHBondContact O-CB 3.27Å; L368-W372 PolarHBondContact O-N 2.94Å; L368-C391 HydrophobicContact CB-CB 4.21Å; L368-L394 HydrophobicContact CD1-CB 3.69Å; L368-L394 HydrophobicContact CD1-CD1 4.15Å
369	K	72.4	Confident	73.2	Confident	21 Å²	21	72.3 Å²	72.3	9%	0.091	38%	0.379	C	S	.	.	H	α-helix	trans	-65.2	-50.7	177.8	-180	-179.6	168.9	-173.7	0	110.7	D173 Y365 E366 Y371 W372 L373 L388	D173-K369 PolarHBondContact O-NZ 2.96Å; D173-K369 IonicContact OD1-NZ 2.91Å; D173-K369 IonicContact OD2-NZ 3.76Å; D173-K369 PolarHBondContact OD2-NZ 3.2Å; Y365-K369 HydrophobicContact CE1-CD 4.02Å; Y365-K369 VanDerWaalsContact O-CB 3.27Å; Y365-K369 WeakPolarHBondContact O-CB 3.45Å; Y365-K369 PolarHBondContact O-N 3.18Å; E366-K369 PolarHBondContact O-N 2.87Å; K369-Y371 PolarHBondContact O-N 2.72Å; K369-W372 PolarHBondContact O-N 3.28Å; K369-L373 HydrophobicContact CG-CD1 4.14Å; K369-L373 WeakPolarHBondContact O-CG 3.37Å; K369-L373 PolarHBondContact O-N 3.12Å; K369-L388 HydrophobicContact CD-CD2 4.49Å
370	S	72.6	Confident	71.7	Confident	56 Å²	56	73.4 Å²	73.4	39%	0.392	38%	0.38	S	S	.	.	H	α-helix	trans	-60.9	-44.9	177.9	-61	0	0	0	0	111.4	E366 W372 L373 D374	E366-S370 WeakPolarHBondContact O-CB 3.41Å; E366-S370 PolarHBondContact O-N 3.33Å; E366-S370 PolarHBondContact O-OG 2.84Å; E366-S370 VanDerWaalsContact O-OG 3.05Å; S370-W372 VanDerWaalsContact C-N 3.29Å; S370-W372 PolarHBondContact O-N 2.94Å; S370-L373 PolarHBondContact O-N 3.42Å; S370-L373 VanDerWaalsContact O-N 3.17Å; S370-D374 WeakPolarHBondContact O-CB 3.34Å; S370-D374 PolarHBondContact O-N 2.84Å
371	Y	77.8	Confident	70	Confident	141 Å²	141	71.2 Å²	71.2	55%	0.553	37%	0.369	S	S	*	.	H	α-helix	trans	-58.5	-39.5	175.6	179.8	-95.2	0	0	0	113	L367 K369 N375 F376	L367-Y371 WeakPolarHBondContact O-CB 3.39Å; L367-Y371 PolarHBondContact O-N 3.25Å; K369-Y371 PolarHBondContact O-N 2.72Å; Y371-N375 WeakPolarHBondContact CD2-ND2 3.29Å; Y371-N375 VanDerWaalsContact CE2-ND2 3.25Å; Y371-N375 WeakPolarHBondContact CE2-ND2 3.45Å; Y371-N375 PolarHBondContact O-N 3.32Å; Y371-N375 PolarHBondContact O-ND2 2.94Å; Y371-F376 HydrophobicContact CE1-CE2 4.45Å
372	W	77.3	Confident	68.7	Low	53 Å²	53	73.4 Å²	73.4	20%	0.201	38%	0.381	C	S	.	.	H	α-helix	trans	-67	-45.6	176.7	-173.5	92.4	0	0	0	111.5	L368 K369 S370 N375 F376 A377 P383 V387	L368-W372 WeakPolarHBondContact O-CB 3.27Å; L368-W372 PolarHBondContact O-N 2.94Å; K369-W372 PolarHBondContact O-N 3.28Å; S370-W372 VanDerWaalsContact C-N 3.29Å; S370-W372 PolarHBondContact O-N 2.94Å; W372-N375 PolarHBondContact O-N 3.5Å; W372-F376 AromaticContact CD1-CD2 4Å; W372-F376 HydrophobicContact CD2-CB 4.21Å; W372-F376 HydrophobicContact CG-CD2 4.4Å; W372-F376 HydrophobicContact CZ2-CB 4.11Å; W372-F376 WeakPolarHBondContact O-CB 3.45Å; W372-F376 PolarHBondContact O-N 3.07Å; W372-A377 HydrophobicContact CZ3-CB 3.98Å; W372-P383 HydrophobicContact CD2-CB 4.04Å; W372-P383 HydrophobicContact CE3-CB 3.68Å; W372-P383 HydrophobicContact CE3-CG 3.82Å; W372-P383 VanDerWaalsContact CH2-CA 3.47Å; W372-P383 HydrophobicContact CH2-CB 4.3Å; W372-P383 HydrophobicContact CZ3-CB 3.86Å; W372-P383 HydrophobicContact CZ3-CG 4.02Å; W372-V387 HydrophobicContact CB-CG1 4.4Å; W372-V387 HydrophobicContact CD2-CG1 3.98Å; W372-V387 HydrophobicContact CG-CG1 3.72Å; W372-V387 HydrophobicContact CZ2-CG2 4.3Å
373	L	70.3	Confident	67.9	Low	9 Å²	9	71 Å²	71	5%	0.047	37%	0.37	C	S	.	.	H	α-helix	trans	-58.3	-50.2	178.2	-70.9	169.7	0	0	0	110.7	K369 S370 N375 A377 V381 P383	K369-L373 HydrophobicContact CG-CD1 4.14Å; K369-L373 WeakPolarHBondContact O-CG 3.37Å; K369-L373 PolarHBondContact O-N 3.12Å; S370-L373 PolarHBondContact O-N 3.42Å; S370-L373 VanDerWaalsContact O-N 3.17Å; L373-N375 VanDerWaalsContact C-N 3.25Å; L373-N375 PolarHBondContact O-N 3.36Å; L373-A377 HydrophobicContact CD2-CB 4.14Å; L373-A377 WeakPolarHBondContact O-CB 3.39Å; L373-A377 PolarHBondContact O-N 2.89Å; L373-V381 HydrophobicContact CD2-CG1 4.34Å; L373-V381 WeakPolarHBondContact CD2-O 3.42Å; L373-P383 HydrophobicContact CD2-CG 4.19Å
374	D	70.8	Confident	67.1	Low	91 Å²	91	69.6 Å²	69.6	49%	0.487	36%	0.36	S	S	.	.	H	α-helix	trans	-62.6	-28.9	-176	-65.8	-23.7	0	0	0	113.7	S370	S370-D374 WeakPolarHBondContact O-CB 3.34Å; S370-D374 PolarHBondContact O-N 2.84Å
375	N	73.5	Confident	66.3	Low	80 Å²	80	71.5 Å²	71.5	43%	0.428	37%	0.372	S	S	.	.	H	α-helix	trans	-107.8	-25.9	-172.1	-68.1	-72	0	0	0	114.4	Y371 W372 L373	Y371-N375 WeakPolarHBondContact CD2-ND2 3.29Å; Y371-N375 VanDerWaalsContact CE2-ND2 3.25Å; Y371-N375 WeakPolarHBondContact CE2-ND2 3.45Å; Y371-N375 PolarHBondContact O-N 3.32Å; Y371-N375 PolarHBondContact O-ND2 2.94Å; W372-N375 PolarHBondContact O-N 3.5Å; L373-N375 VanDerWaalsContact C-N 3.25Å; L373-N375 PolarHBondContact O-N 3.36Å
376	F	71.3	Confident	65.6	Low	125 Å²	125	77.5 Å²	77.5	55%	0.548	40%	0.402	S	S	.	.	H	α-helix	trans	-125.7	-13.5	-169.2	-60.8	-81.4	0	0	0	114.3	Y371 W372 K378	Y371-F376 HydrophobicContact CE1-CE2 4.45Å; W372-F376 AromaticContact CD1-CD2 4Å; W372-F376 HydrophobicContact CD2-CB 4.21Å; W372-F376 HydrophobicContact CG-CD2 4.4Å; W372-F376 HydrophobicContact CZ2-CB 4.11Å; W372-F376 WeakPolarHBondContact O-CB 3.45Å; W372-F376 PolarHBondContact O-N 3.07Å; F376-K378 VanDerWaalsContact C-N 3.27Å; F376-K378 PolarHBondContact O-N 3.36Å
377	A	63.9	Low	65.6	Low	30 Å²	30	75 Å²	75	25%	0.248	39%	0.394	C	S	.	.			trans	-81.3	68	176.4	0	0	0	0	0	111.7	W372 L373 S380	W372-A377 HydrophobicContact CZ3-CB 3.98Å; L373-A377 HydrophobicContact CD2-CB 4.14Å; L373-A377 WeakPolarHBondContact O-CB 3.39Å; L373-A377 PolarHBondContact O-N 2.89Å; A377-S380 VanDerWaalsContact CB-O 3.31Å; A377-S380 WeakPolarHBondContact CB-O 3.17Å
378	K	52	Low	65	Low	182 Å²	182	71 Å²	71	79%	0.791	37%	0.372	S	S	*	.	S	Bend	trans	-76.9	-31.6	176	-73.8	-172.9	177.5	-177.9	0	113.7	F376	F376-K378 VanDerWaalsContact C-N 3.27Å; F376-K378 PolarHBondContact O-N 3.36Å
379	D	45.3	Very low	64.6	Low	164 Å²	164	71.4 Å²	71.4	88%	0.877	38%	0.375	S	S	*	.	S	Bend	trans	-136.9	0.4	-174.9	-62.3	-59	0	0	0	113.9
380	S	45.9	Very low	64.7	Low	66 Å²	66	71.9 Å²	71.9	46%	0.462	39%	0.385	S	S	.	.			trans	-153.5	127.3	179.6	67.3	0	0	0	0	112.5	A377 N382	A377-S380 VanDerWaalsContact CB-O 3.31Å; A377-S380 WeakPolarHBondContact CB-O 3.17Å; S380-N382 PolarHBondContact O-N 3.41Å
381	V	48.5	Very low	64.9	Low	14 Å²	14	69.8 Å²	69.8	9%	0.085	37%	0.37	C	S	.	.	S	Bend	trans	-77.1	-6.2	177.8	-141.8	0	0	0	0	113.5	Q126 L129 I172 L373 P383	Q126-V381 HydrophobicContact CG-CG1 3.64Å; L129-V381 HydrophobicContact CB-CG2 3.98Å; L129-V381 HydrophobicContact CD1-CB 3.98Å; L129-V381 HydrophobicContact CD1-CG1 3.6Å; L129-V381 HydrophobicContact CD1-CG2 3.24Å; L129-V381 HydrophobicContact CD2-CG2 4.12Å; L129-V381 HydrophobicContact CG-CG2 3.95Å; I172-V381 HydrophobicContact CG1-CB 3.99Å; I172-V381 HydrophobicContact CG1-CG1 3.96Å; I172-V381 HydrophobicContact CG1-CG2 4.12Å; L373-V381 HydrophobicContact CD2-CG1 4.34Å; L373-V381 WeakPolarHBondContact CD2-O 3.42Å; V381-P383 WeakPolarHBondContact O-CD 3.47Å
382	N	53.1	Low	64.9	Low	70 Å²	70	63.6 Å²	63.6	37%	0.374	35%	0.35	S	S	.	.			trans	-93.4	114.3	178.3	-167.4	-22.2	0	0	0	108.2	S380 G384	S380-N382 PolarHBondContact O-N 3.41Å; N382-G384 PolarHBondContact O-N 3.19Å; N382-G384 VanDerWaalsContact OD1-CA 3.31Å; N382-G384 WeakPolarHBondContact OD1-CA 3.38Å; N382-G384 PolarHBondContact OD1-N 3.07Å
383	P	58.2	Low	64.9	Low	10 Å²	10	62 Å²	62	7%	0.065	35%	0.348	C	S	.	.			trans	-57.1	-16.1	171.1	-20.2	33.7	0	0	0	112.7	W372 L373 V381 V387 L388	W372-P383 HydrophobicContact CD2-CB 4.04Å; W372-P383 HydrophobicContact CE3-CB 3.68Å; W372-P383 HydrophobicContact CE3-CG 3.82Å; W372-P383 VanDerWaalsContact CH2-CA 3.47Å; W372-P383 HydrophobicContact CH2-CB 4.3Å; W372-P383 HydrophobicContact CZ3-CB 3.86Å; W372-P383 HydrophobicContact CZ3-CG 4.02Å; L373-P383 HydrophobicContact CD2-CG 4.19Å; V381-P383 WeakPolarHBondContact O-CD 3.47Å; P383-V387 HydrophobicContact CB-CB 3.63Å; P383-V387 HydrophobicContact CB-CG1 3.6Å; P383-V387 HydrophobicContact CB-CG2 4.49Å; P383-V387 WeakPolarHBondContact O-CB 3.44Å; P383-V387 WeakPolarHBondContact O-CG2 3.34Å; P383-L388 HydrophobicContact CB-CD2 4.14Å; P383-L388 HydrophobicContact CB-CG 4.17Å; P383-L388 HydrophobicContact CG-CD2 3.86Å; P383-L388 HydrophobicContact CG-CG 4.32Å
384	G	60.1	Low	65.6	Low	27 Å²	27	66.5 Å²	66.5	28%	0.278	37%	0.372	S	S	.	.	H	α-helix	trans	79.2	151.6	-170.5	0	0	0	0	0	109.3	N382 M386 V387 L388	N382-G384 PolarHBondContact O-N 3.19Å; N382-G384 VanDerWaalsContact OD1-CA 3.31Å; N382-G384 WeakPolarHBondContact OD1-CA 3.38Å; N382-G384 PolarHBondContact OD1-N 3.07Å; G384-M386 PolarHBondContact O-N 3.5Å; G384-M386 VanDerWaalsContact O-N 3.09Å; G384-V387 PolarHBondContact O-N 2.98Å; G384-L388 PolarHBondContact O-N 2.82Å; G384-L388 VanDerWaalsContact O-N 3.1Å
385	V	64.6	Low	66.2	Low	75 Å²	75	62.2 Å²	62.2	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-52.9	-37.3	-177.5	178.8	0	0	0	0	111.4	L389 Y462	V385-L389 HydrophobicContact CG1-CD1 3.83Å; V385-L389 HydrophobicContact CG1-CG 4.16Å; V385-L389 VanDerWaalsContact O-CB 3.29Å; V385-L389 WeakPolarHBondContact O-CB 3.48Å; V385-L389 WeakPolarHBondContact O-CG 3.19Å; V385-L389 PolarHBondContact O-N 2.87Å; V385-Y462 HydrophobicContact CG1-CE2 4.17Å
386	M	66.7	Low	66.6	Low	147 Å²	147	59.7 Å²	59.7	72%	0.724	34%	0.337	S	S	*	.	H	α-helix	trans	-68.1	-37.4	-179.4	-67.9	-62.1	173.4	0	0	113.9	G384 L389 G390	G384-M386 PolarHBondContact O-N 3.5Å; G384-M386 VanDerWaalsContact O-N 3.09Å; M386-L389 HydrophobicContact SD-CD1 4.49Å; M386-G390 PolarHBondContact O-N 3.46Å
387	V	73.6	Confident	67.3	Low	40 Å²	40	55.4 Å²	55.4	24%	0.242	32%	0.321	C	S	.	.	H	α-helix	trans	-73.2	-43	177.1	177.1	0	0	0	0	109.9	W372 P383 G384 L389 G390 C391	W372-V387 HydrophobicContact CB-CG1 4.4Å; W372-V387 HydrophobicContact CD2-CG1 3.98Å; W372-V387 HydrophobicContact CG-CG1 3.72Å; W372-V387 HydrophobicContact CZ2-CG2 4.3Å; P383-V387 HydrophobicContact CB-CB 3.63Å; P383-V387 HydrophobicContact CB-CG1 3.6Å; P383-V387 HydrophobicContact CB-CG2 4.49Å; P383-V387 WeakPolarHBondContact O-CB 3.44Å; P383-V387 WeakPolarHBondContact O-CG2 3.34Å; G384-V387 PolarHBondContact O-N 2.98Å; V387-L389 VanDerWaalsContact C-N 3.31Å; V387-L389 PolarHBondContact O-N 3.48Å; V387-G390 CarbonylContact O-C 3.04Å; V387-G390 WeakPolarHBondContact O-CA 3.49Å; V387-G390 PolarHBondContact O-N 3.05Å; V387-C391 WeakPolarHBondContact O-CB 3.43Å; V387-C391 PolarHBondContact O-N 3.32Å; V387-C391 PolarHBondContact O-SG 2.94Å; V387-C391 VanDerWaalsContact O-SG 3.33Å
388	L	68.8	Low	68.4	Low	38 Å²	38	56.4 Å²	56.4	20%	0.199	33%	0.326	C	S	.	.	H	α-helix	trans	-58.8	-43.5	175.1	-65.6	173.3	0	0	0	111.5	K369 P383 G384 G390 C391 G392	K369-L388 HydrophobicContact CD-CD2 4.49Å; P383-L388 HydrophobicContact CB-CD2 4.14Å; P383-L388 HydrophobicContact CB-CG 4.17Å; P383-L388 HydrophobicContact CG-CD2 3.86Å; P383-L388 HydrophobicContact CG-CG 4.32Å; G384-L388 PolarHBondContact O-N 2.82Å; G384-L388 VanDerWaalsContact O-N 3.1Å; L388-G390 VanDerWaalsContact C-N 3.33Å; L388-G390 PolarHBondContact O-N 2.85Å; L388-C391 PolarHBondContact O-N 3.34Å; L388-G392 PolarHBondContact O-N 2.94Å
389	L	69.1	Low	70	Confident	61 Å²	61	47.7 Å²	47.7	32%	0.319	29%	0.288	S	S	.	.	H	α-helix	trans	-63.2	-37.9	173.3	-72.7	176.2	0	0	0	112.2	V385 M386 V387 A393 V458	V385-L389 HydrophobicContact CG1-CD1 3.83Å; V385-L389 HydrophobicContact CG1-CG 4.16Å; V385-L389 VanDerWaalsContact O-CB 3.29Å; V385-L389 WeakPolarHBondContact O-CB 3.48Å; V385-L389 WeakPolarHBondContact O-CG 3.19Å; V385-L389 PolarHBondContact O-N 2.87Å; M386-L389 HydrophobicContact SD-CD1 4.49Å; V387-L389 VanDerWaalsContact C-N 3.31Å; V387-L389 PolarHBondContact O-N 3.48Å; L389-A393 WeakPolarHBondContact O-CB 3.25Å; L389-A393 PolarHBondContact O-N 3.05Å; L389-V458 HydrophobicContact CD2-CG1 3.96Å
390	G	76.1	Confident	72	Confident	31 Å²	31	41.7 Å²	41.7	32%	0.32	26%	0.255	S	S	.	.	H	α-helix	trans	-64.7	-50	175	0	0	0	0	0	112.6	M386 V387 L388 G392 A393 L394	M386-G390 PolarHBondContact O-N 3.46Å; V387-G390 CarbonylContact O-C 3.04Å; V387-G390 WeakPolarHBondContact O-CA 3.49Å; V387-G390 PolarHBondContact O-N 3.05Å; L388-G390 VanDerWaalsContact C-N 3.33Å; L388-G390 PolarHBondContact O-N 2.85Å; G390-G392 PolarHBondContact O-N 3.32Å; G390-A393 PolarHBondContact O-N 3.47Å; G390-L394 WeakPolarHBondContact O-CB 3.43Å; G390-L394 WeakPolarHBondContact O-CG 3.35Å; G390-L394 PolarHBondContact O-N 3Å
391	C	77	Confident	74.1	Confident	11 Å²	11	41.8 Å²	41.8	7%	0.074	25%	0.25	C	C	.	.	H	α-helix	trans	-56.9	-49.2	174.7	-68.3	0	0	0	0	110.7	Y365 L368 V387 L388 L394 S395	Y365-C391 HydrophobicContact CD2-CB 3.99Å; Y365-C391 HydrophobicContact CE2-CB 4.01Å; L368-C391 HydrophobicContact CB-CB 4.21Å; V387-C391 WeakPolarHBondContact O-CB 3.43Å; V387-C391 PolarHBondContact O-N 3.32Å; V387-C391 PolarHBondContact O-SG 2.94Å; V387-C391 VanDerWaalsContact O-SG 3.33Å; L388-C391 PolarHBondContact O-N 3.34Å; C391-L394 PolarHBondContact O-N 3.35Å; C391-S395 VanDerWaalsContact O-CB 3.32Å; C391-S395 WeakPolarHBondContact O-CB 3.33Å; C391-S395 PolarHBondContact O-N 3.14Å; C391-S395 PolarHBondContact O-OG 3.44Å
392	G	76.2	Confident	76.1	Confident	12 Å²	12	43.5 Å²	43.5	12%	0.124	27%	0.265	C	S	.	.	H	α-helix	trans	-62.8	-41.3	177.4	0	0	0	0	0	113.3	L388 G390 S395 S396	L388-G392 PolarHBondContact O-N 2.94Å; G390-G392 PolarHBondContact O-N 3.32Å; G392-S395 WeakPolarHBondContact CA-OG 3.2Å; G392-S395 PolarHBondContact O-OG 2.92Å; G392-S396 WeakPolarHBondContact O-CB 3.45Å; G392-S396 PolarHBondContact O-N 2.8Å; G392-S396 PolarHBondContact O-OG 3.31Å; G392-S396 VanDerWaalsContact O-OG 3.1Å
393	A	78.9	Confident	77.9	Confident	20 Å²	20	40.7 Å²	40.7	17%	0.165	25%	0.251	C	S	.	.	H	α-helix	trans	-65.4	-41.4	177.2	0	0	0	0	0	112.1	L389 G390 T397 L455	L389-A393 WeakPolarHBondContact O-CB 3.25Å; L389-A393 PolarHBondContact O-N 3.05Å; G390-A393 PolarHBondContact O-N 3.47Å; A393-T397 VanDerWaalsContact O-CB 3.31Å; A393-T397 WeakPolarHBondContact O-CB 3.31Å; A393-T397 PolarHBondContact O-N 3.1Å; A393-T397 VanDerWaalsContact O-N 3.08Å; A393-T397 PolarHBondContact O-OG1 3.31Å; A393-L455 HydrophobicContact CB-CD2 4.48Å
394	L	83.8	Confident	79.5	Confident	103 Å²	103	40.4 Å²	40.4	54%	0.539	25%	0.249	S	C	.	.	H	α-helix	trans	-68.9	-46.2	177.9	-71.8	172.7	0	0	0	111.6	L368 G390 C391 S396 T397 C398	L368-L394 HydrophobicContact CD1-CB 3.69Å; L368-L394 HydrophobicContact CD1-CD1 4.15Å; G390-L394 WeakPolarHBondContact O-CB 3.43Å; G390-L394 WeakPolarHBondContact O-CG 3.35Å; G390-L394 PolarHBondContact O-N 3Å; C391-L394 PolarHBondContact O-N 3.35Å; L394-S396 PolarHBondContact O-N 3.33Å; L394-T397 WeakPolarHBondContact O-CB 3.22Å; L394-T397 PolarHBondContact O-N 2.89Å; L394-C398 PolarHBondContact O-N 3.12Å; L394-C398 PolarHBondContact O-SG 3.33Å; L394-C398 VanDerWaalsContact O-SG 3.4Å
395	S	83.2	Confident	81.1	Confident	1 Å²	1	40 Å²	40	1%	0.007	24%	0.242	C	C	.	.	H	α-helix	trans	-61.6	-45.5	178.3	70.1	0	0	0	0	111.8	D361 C391 G392 T397 C398 G399	D361-S395 VanDerWaalsContact O-CB 3.26Å; D361-S395 WeakPolarHBondContact O-CB 3.33Å; D361-S395 VanDerWaalsContact OD1-CB 3.28Å; D361-S395 WeakPolarHBondContact OD1-CB 3.36Å; D361-S395 PolarHBondContact OD1-OG 2.89Å; C391-S395 VanDerWaalsContact O-CB 3.32Å; C391-S395 WeakPolarHBondContact O-CB 3.33Å; C391-S395 PolarHBondContact O-N 3.14Å; C391-S395 PolarHBondContact O-OG 3.44Å; G392-S395 WeakPolarHBondContact CA-OG 3.2Å; G392-S395 PolarHBondContact O-OG 2.92Å; S395-T397 VanDerWaalsContact C-N 3.26Å; S395-T397 PolarHBondContact O-N 3.39Å; S395-C398 WeakPolarHBondContact O-CB 3.41Å; S395-C398 PolarHBondContact O-N 2.79Å; S395-C398 VanDerWaalsContact O-N 3.12Å; S395-G399 PolarHBondContact O-N 3.48Å
396	S	82.3	Confident	82.5	Confident	26 Å²	26	38.5 Å²	38.5	18%	0.182	23%	0.231	C	C	.	.	H	α-helix	trans	-65.7	-31.4	178.3	-74.9	0	0	0	0	111.8	Y357 D361 G392 L394 Q400	Y357-S396 PolarHBondContact OH-OG 3.01Å; D361-S396 VanDerWaalsContact OD1-CA 3.22Å; D361-S396 WeakPolarHBondContact OD1-CA 3.24Å; D361-S396 PolarHBondContact OD1-N 3.5Å; D361-S396 PolarHBondContact OD1-OG 3.09Å; D361-S396 VanDerWaalsContact OD1-OG 3.11Å; D361-S396 PolarHBondContact OD2-OG 3.35Å; G392-S396 WeakPolarHBondContact O-CB 3.45Å; G392-S396 PolarHBondContact O-N 2.8Å; G392-S396 PolarHBondContact O-OG 3.31Å; G392-S396 VanDerWaalsContact O-OG 3.1Å; L394-S396 PolarHBondContact O-N 3.33Å; S396-Q400 VanDerWaalsContact O-CB 3.26Å; S396-Q400 WeakPolarHBondContact O-CB 3.5Å; S396-Q400 VanDerWaalsContact O-CG 3.24Å; S396-Q400 WeakPolarHBondContact O-CG 3.41Å; S396-Q400 PolarHBondContact O-N 3.44Å; S396-Q400 PolarHBondContact O-NE2 3.27Å
397	T	85.5	Confident	83.6	Confident	35 Å²	35	33.1 Å²	33.1	22%	0.215	21%	0.209	C	C	.	.	H	α-helix	trans	-67.5	-44.2	173.7	-63.4	0	0	0	0	110.9	A393 L394 S395 Q400 L401 F451	A393-T397 VanDerWaalsContact O-CB 3.31Å; A393-T397 WeakPolarHBondContact O-CB 3.31Å; A393-T397 PolarHBondContact O-N 3.1Å; A393-T397 VanDerWaalsContact O-N 3.08Å; A393-T397 PolarHBondContact O-OG1 3.31Å; L394-T397 WeakPolarHBondContact O-CB 3.22Å; L394-T397 PolarHBondContact O-N 2.89Å; S395-T397 VanDerWaalsContact C-N 3.26Å; S395-T397 PolarHBondContact O-N 3.39Å; T397-Q400 WeakPolarHBondContact O-CB 3.36Å; T397-Q400 PolarHBondContact O-N 3.21Å; T397-L401 HydrophobicContact CG2-CD1 4.47Å; T397-L401 WeakPolarHBondContact O-CG 3.39Å; T397-L401 PolarHBondContact O-N 2.83Å; T397-F451 HydrophobicContact CG2-CD1 4Å; T397-F451 HydrophobicContact CG2-CE1 3.37Å; T397-F451 HydrophobicContact CG2-CZ 3.69Å
398	C	87.6	Confident	84.5	Confident	51 Å²	51	31.2 Å²	31.2	35%	0.345	20%	0.198	S	C	.	.	H	α-helix	trans	-63	-46.6	175.3	-69.7	0	0	0	0	112.1	I360 V364 L394 S395 Q400 L401 A402	I360-C398 HydrophobicContact CG2-CB 4.09Å; V364-C398 HydrophobicContact CG1-CB 4.43Å; V364-C398 HydrophobicContact CG2-CB 4.18Å; L394-C398 PolarHBondContact O-N 3.12Å; L394-C398 PolarHBondContact O-SG 3.33Å; L394-C398 VanDerWaalsContact O-SG 3.4Å; S395-C398 WeakPolarHBondContact O-CB 3.41Å; S395-C398 PolarHBondContact O-N 2.79Å; S395-C398 VanDerWaalsContact O-N 3.12Å; C398-Q400 VanDerWaalsContact C-N 3.3Å; C398-Q400 PolarHBondContact O-N 3.04Å; C398-L401 WeakPolarHBondContact O-CB 3.38Å; C398-L401 PolarHBondContact O-N 2.77Å; C398-A402 PolarHBondContact O-N 2.77Å; C398-A402 VanDerWaalsContact O-N 3.15Å
399	G	86.4	Confident	85.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-40.8	174.5	0	0	0	0	0	112	Y357 S395 A402 S403	Y357-G399 VanDerWaalsContact CD2-C 3.47Å; S395-G399 PolarHBondContact O-N 3.48Å; G399-A402 PolarHBondContact O-N 3.02Å; G399-S403 WeakPolarHBondContact O-CB 3.45Å; G399-S403 PolarHBondContact O-N 2.86Å; G399-S403 VanDerWaalsContact O-N 3.1Å; G399-S403 PolarHBondContact O-OG 3.2Å
400	Q	85.8	Confident	86.8	Confident	37 Å²	37	28.3 Å²	28.3	17%	0.173	18%	0.18	C	C	.	.	H	α-helix	trans	-62.7	-42.7	174.5	-84.6	166.2	60.2	0	0	112.1	Y357 S396 T397 C398 A402 S403 Y404 N450	Y357-Q400 HydrophobicContact CD2-CG 4.25Å; Y357-Q400 HydrophobicContact CE2-CG 3.82Å; S396-Q400 VanDerWaalsContact O-CB 3.26Å; S396-Q400 WeakPolarHBondContact O-CB 3.5Å; S396-Q400 VanDerWaalsContact O-CG 3.24Å; S396-Q400 WeakPolarHBondContact O-CG 3.41Å; S396-Q400 PolarHBondContact O-N 3.44Å; S396-Q400 PolarHBondContact O-NE2 3.27Å; T397-Q400 WeakPolarHBondContact O-CB 3.36Å; T397-Q400 PolarHBondContact O-N 3.21Å; C398-Q400 VanDerWaalsContact C-N 3.3Å; C398-Q400 PolarHBondContact O-N 3.04Å; Q400-A402 PolarHBondContact O-N 3.47Å; Q400-S403 PolarHBondContact O-N 2.8Å; Q400-S403 PolarHBondContact O-OG 3.27Å; Q400-Y404 WeakPolarHBondContact O-CA 3.44Å; Q400-Y404 WeakPolarHBondContact O-CB 3.29Å; Q400-Y404 PolarHBondContact O-N 3.09Å; Q400-N450 PolarHBondContact OE1-ND2 2.88Å
401	L	90.9	Very high	87.5	Confident	69 Å²	69	27.6 Å²	27.6	36%	0.361	17%	0.169	S	C	.	.	H	α-helix	trans	-58.4	-48.9	178	-78.4	163.7	0	0	0	111.5	T397 C398 S403 Y404 Y444 I447 F451	T397-L401 HydrophobicContact CG2-CD1 4.47Å; T397-L401 WeakPolarHBondContact O-CG 3.39Å; T397-L401 PolarHBondContact O-N 2.83Å; C398-L401 WeakPolarHBondContact O-CB 3.38Å; C398-L401 PolarHBondContact O-N 2.77Å; L401-S403 PolarHBondContact O-N 2.98Å; L401-Y404 PolarHBondContact O-N 2.98Å; L401-Y444 WeakPolarHBondContact O-CE1 3.44Å; L401-I447 HydrophobicContact CD2-CD1 3.46Å; L401-I447 VanDerWaalsContact CD2-CD1 3.46Å; L401-I447 HydrophobicContact CG-CD1 4.46Å; L401-F451 HydrophobicContact CD1-CZ 4.37Å; L401-F451 HydrophobicContact CD2-CE2 4.28Å; L401-F451 HydrophobicContact CD2-CZ 3.83Å; L401-F451 HydrophobicContact CG-CZ 3.87Å
402	A	90.8	Very high	88.2	Confident	49 Å²	49	28.2 Å²	28.2	41%	0.405	17%	0.17	S	C	.	.	H	α-helix	trans	-65.8	-40	-178.2	0	0	0	0	0	113.2	I360 C398 G399 Q400	I360-A402 HydrophobicContact CD1-CB 3.2Å; C398-A402 PolarHBondContact O-N 2.77Å; C398-A402 VanDerWaalsContact O-N 3.15Å; G399-A402 PolarHBondContact O-N 3.02Å; Q400-A402 PolarHBondContact O-N 3.47Å
403	S	90.9	Very high	88.9	Confident	12 Å²	12	28.9 Å²	28.9	8%	0.084	17%	0.17	C	C	.	.	H	α-helix	trans	-87.5	-8.3	-179.1	60.3	0	0	0	0	114	G353 G399 Q400 L401 P405 L406 A407	G353-S403 WeakPolarHBondContact O-CB 3.47Å; G399-S403 WeakPolarHBondContact O-CB 3.45Å; G399-S403 PolarHBondContact O-N 2.86Å; G399-S403 VanDerWaalsContact O-N 3.1Å; G399-S403 PolarHBondContact O-OG 3.2Å; Q400-S403 PolarHBondContact O-N 2.8Å; Q400-S403 PolarHBondContact O-OG 3.27Å; L401-S403 PolarHBondContact O-N 2.98Å; S403-P405 VanDerWaalsContact C-CD 3.46Å; S403-L406 PolarHBondContact O-N 3.35Å; S403-L406 VanDerWaalsContact O-N 3.11Å; S403-A407 PolarHBondContact O-N 2.84Å; S403-A407 VanDerWaalsContact O-N 3.1Å
404	Y	91.4	Very high	89.5	Confident	4 Å²	4	28.1 Å²	28.1	2%	0.016	16%	0.163	C	C	.	.	H	α-helix	trans	-55.9	-42	-175	-157.2	-89.2	0	0	0	114.1	Q223 Q400 L401 L406 A407 L408 L443 Y444 R445 G446 I447 N450	Q223-Y404 PolarHBondContact NE2-OH 3.4Å; Q400-Y404 WeakPolarHBondContact O-CA 3.44Å; Q400-Y404 WeakPolarHBondContact O-CB 3.29Å; Q400-Y404 PolarHBondContact O-N 3.09Å; L401-Y404 PolarHBondContact O-N 2.98Å; Y404-L406 VanDerWaalsContact C-N 3.26Å; Y404-L406 PolarHBondContact O-N 3.45Å; Y404-A407 WeakPolarHBondContact O-CB 3.41Å; Y404-A407 PolarHBondContact O-N 3.25Å; Y404-A407 VanDerWaalsContact O-N 3.09Å; Y404-L408 HydrophobicContact CE1-CB 4.47Å; Y404-L408 PolarHBondContact O-N 3.41Å; Y404-L443 VanDerWaalsContact CD1-O 3.24Å; Y404-L443 WeakPolarHBondContact CD1-O 3.37Å; Y404-Y444 HydrophobicContact CD1-CD1 4Å; Y404-Y444 HydrophobicContact CD1-CG 4.47Å; Y404-Y444 HydrophobicContact CG-CD1 4.22Å; Y404-R445 WeakPolarHBondContact CE1-O 3.49Å; Y404-R445 PolarHBondContact OH-O 3.24Å; Y404-G446 WeakPolarHBondContact OH-CA 3.16Å; Y404-G446 PolarHBondContact OH-O 2.89Å; Y404-I447 HydrophobicContact CD2-CB 4.44Å; Y404-I447 HydrophobicContact CD2-CD1 4.07Å; Y404-I447 HydrophobicContact CD2-CG1 4.07Å; Y404-I447 HydrophobicContact CE1-CB 4.27Å; Y404-I447 HydrophobicContact CE2-CB 3.96Å; Y404-I447 HydrophobicContact CE2-CD1 4.42Å; Y404-I447 HydrophobicContact CE2-CG1 3.94Å; Y404-I447 HydrophobicContact CG-CD1 4.22Å; Y404-I447 PolarHBondContact OH-N 3.34Å; Y404-N450 HydrophobicContact CE2-CB 4.49Å
405	P	93.9	Very high	89.7	Confident	19 Å²	19	23.2 Å²	23.2	12%	0.123	14%	0.138	C	C	.	.	H	α-helix	trans	-56.6	-40.4	178	-27.8	37.5	0	0	0	112.9	S403 L408 V409 F431 L443 Y444	S403-P405 VanDerWaalsContact C-CD 3.46Å; P405-L408 PolarHBondContact O-N 3.24Å; P405-V409 VanDerWaalsContact O-CG2 3.31Å; P405-V409 WeakPolarHBondContact O-CG2 3.21Å; P405-V409 PolarHBondContact O-N 3.13Å; P405-V409 VanDerWaalsContact O-N 3.08Å; P405-F431 HydrophobicContact CB-CE2 4.36Å; P405-L443 HydrophobicContact CB-CB 4.16Å; P405-L443 HydrophobicContact CB-CD1 4.32Å; P405-L443 HydrophobicContact CB-CD2 4.32Å; P405-L443 HydrophobicContact CG-CB 4.33Å; P405-Y444 HydrophobicContact CG-CE1 4.39Å; P405-Y444 HydrophobicContact CG-CE2 4.35Å
406	L	93.1	Very high	89.7	Confident	43 Å²	43	23.7 Å²	23.7	23%	0.225	14%	0.14	C	C	.	.	H	α-helix	trans	-71.3	-37.9	177	-68.1	172.1	0	0	0	111.4	P349 L352 S403 Y404 L408 V409 R410	P349-L406 HydrophobicContact CB-CD2 4.35Å; L352-L406 HydrophobicContact CB-CD1 4.04Å; S403-L406 PolarHBondContact O-N 3.35Å; S403-L406 VanDerWaalsContact O-N 3.11Å; Y404-L406 VanDerWaalsContact C-N 3.26Å; Y404-L406 PolarHBondContact O-N 3.45Å; L406-L408 VanDerWaalsContact C-N 3.35Å; L406-L408 PolarHBondContact O-N 3.35Å; L406-V409 PolarHBondContact O-N 3.16Å; L406-R410 WeakPolarHBondContact O-CB 3.43Å; L406-R410 PolarHBondContact O-N 2.96Å
407	A	90.8	Very high	89.5	Confident	33 Å²	33	24.5 Å²	24.5	27%	0.273	15%	0.148	S	C	.	.	H	α-helix	trans	-62.9	-38.8	174.2	0	0	0	0	0	112.6	S403 Y404 T411	S403-A407 PolarHBondContact O-N 2.84Å; S403-A407 VanDerWaalsContact O-N 3.1Å; Y404-A407 WeakPolarHBondContact O-CB 3.41Å; Y404-A407 PolarHBondContact O-N 3.25Å; Y404-A407 VanDerWaalsContact O-N 3.09Å; A407-T411 PolarHBondContact O-N 3.17Å; A407-T411 VanDerWaalsContact O-N 3.08Å; A407-T411 PolarHBondContact O-OG1 3.19Å
408	L	91.8	Very high	89	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.7	-49.5	173.9	-179.1	77.9	0	0	0	111	Q223 Y404 P405 L406 R410 T411 R412 I434 G442 L443 R445	Q223-L408 HydrophobicContact CB-CD1 3.61Å; Q223-L408 HydrophobicContact CG-CD1 3.52Å; Y404-L408 HydrophobicContact CE1-CB 4.47Å; Y404-L408 PolarHBondContact O-N 3.41Å; P405-L408 PolarHBondContact O-N 3.24Å; L406-L408 VanDerWaalsContact C-N 3.35Å; L406-L408 PolarHBondContact O-N 3.35Å; L408-R410 VanDerWaalsContact C-N 3.33Å; L408-R410 PolarHBondContact O-N 3.09Å; L408-T411 PolarHBondContact O-N 3.39Å; L408-R412 PolarHBondContact O-N 2.75Å; L408-I434 HydrophobicContact CD2-CD1 4.14Å; L408-G442 WeakPolarHBondContact CD2-O 3.27Å; L408-L443 VanDerWaalsContact CD2-CA 3.49Å; L408-L443 WeakPolarHBondContact CD2-O 3.07Å; L408-R445 HydrophobicContact CD1-CB 4.4Å
409	V	93	Very high	88.3	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.006	14%	0.139	C	C	.	.	H	α-helix	trans	-59.5	-45.2	179.7	170.8	0	0	0	0	110.5	P349 P405 L406 T411 R412 M413 M427 L430 F431 I434	P349-V409 HydrophobicContact CB-CG1 4.27Å; P349-V409 HydrophobicContact CG-CG1 4.33Å; P405-V409 VanDerWaalsContact O-CG2 3.31Å; P405-V409 WeakPolarHBondContact O-CG2 3.21Å; P405-V409 PolarHBondContact O-N 3.13Å; P405-V409 VanDerWaalsContact O-N 3.08Å; L406-V409 PolarHBondContact O-N 3.16Å; V409-T411 PolarHBondContact O-N 3.19Å; V409-R412 PolarHBondContact O-N 2.83Å; V409-M413 HydrophobicContact CG1-CG 4.35Å; V409-M413 HydrophobicContact CG1-SD 4.07Å; V409-M413 WeakPolarHBondContact O-CB 3.35Å; V409-M413 VanDerWaalsContact O-CG 3.29Å; V409-M413 WeakPolarHBondContact O-CG 3.39Å; V409-M413 PolarHBondContact O-N 2.84Å; V409-M427 HydrophobicContact CG1-CB 4.48Å; V409-M427 HydrophobicContact CG1-CG 3.72Å; V409-L430 HydrophobicContact CG1-CD2 4.27Å; V409-F431 HydrophobicContact CG2-CB 4.34Å; V409-F431 HydrophobicContact CG2-CD2 3.98Å; V409-I434 HydrophobicContact CG2-CD1 4.12Å
410	R	93.1	Very high	87.2	Confident	37 Å²	37	32 Å²	32	14%	0.14	18%	0.177	C	C	.	.	H	α-helix	trans	-50.7	-55.3	172	175.7	-170.5	179.5	-174.3	-2.4	110.9	Y307 E310 P349 N350 L406 L408 R412 M413 Q414	Y307-R410 PolarHBondContact OH-NE 3.42Å; E310-R410 IonicContact OE1-NH2 3.71Å; P349-R410 HydrophobicContact CB-CB 4.4Å; P349-R410 HydrophobicContact CG-CB 4.22Å; N350-R410 HydrophobicContact CB-CG 4.34Å; N350-R410 PolarHBondContact OD1-NH1 2.98Å; L406-R410 WeakPolarHBondContact O-CB 3.43Å; L406-R410 PolarHBondContact O-N 2.96Å; L408-R410 VanDerWaalsContact C-N 3.33Å; L408-R410 PolarHBondContact O-N 3.09Å; R410-R412 PolarHBondContact O-N 3.02Å; R410-M413 PolarHBondContact O-N 2.84Å; R410-Q414 VanDerWaalsContact O-CG 3.31Å; R410-Q414 WeakPolarHBondContact O-CG 3.03Å; R410-Q414 PolarHBondContact O-N 3.28Å
411	T	91.4	Very high	86.2	Confident	16 Å²	16	34.2 Å²	34.2	10%	0.098	21%	0.21	C	C	.	.	H	α-helix	trans	-64.4	-40.5	-174.7	-52.6	0	0	0	0	112.1	I220 Q223 V224 T314 A407 L408 V409 Q414 A415	I220-T411 HydrophobicContact CG2-CG2 4.19Å; Q223-T411 HydrophobicContact CB-CG2 4.37Å; Q223-T411 PolarHBondContact OE1-OG1 3.48Å; V224-T411 HydrophobicContact CG2-CG2 4.2Å; T314-T411 HydrophobicContact CG2-CG2 3.98Å; A407-T411 PolarHBondContact O-N 3.17Å; A407-T411 VanDerWaalsContact O-N 3.08Å; A407-T411 PolarHBondContact O-OG1 3.19Å; L408-T411 PolarHBondContact O-N 3.39Å; V409-T411 PolarHBondContact O-N 3.19Å; T411-Q414 PolarHBondContact O-N 3.04Å; T411-A415 PolarHBondContact O-N 3.29Å
412	R	91.4	Very high	85	Confident	25 Å²	25	32.1 Å²	32.1	9%	0.094	20%	0.201	C	C	.	.	H	α-helix	trans	-67.4	-38.4	176.1	-75.6	-170	179.5	-164.5	9.7	112.6	Q223 L408 V409 R410 Q414 A415 Q416 L430 E438	Q223-R412 WeakPolarHBondContact O-CG 3.48Å; Q223-R412 PolarHBondContact O-NE 3.28Å; Q223-R412 PolarHBondContact O-NH2 2.87Å; L408-R412 PolarHBondContact O-N 2.75Å; V409-R412 PolarHBondContact O-N 2.83Å; R410-R412 PolarHBondContact O-N 3.02Å; R412-Q414 VanDerWaalsContact C-N 3.33Å; R412-A415 PolarHBondContact O-N 3.46Å; R412-Q416 WeakPolarHBondContact O-CB 3.34Å; R412-Q416 PolarHBondContact O-N 3.47Å; R412-L430 HydrophobicContact CB-CD2 3.71Å; R412-E438 IonicContact CZ-OE1 3.57Å; R412-E438 IonicContact CZ-OE2 2.98Å; R412-E438 IonicContact NH1-OE1 2.77Å; R412-E438 PolarHBondContact NH1-OE1 3.12Å; R412-E438 IonicContact NH1-OE2 3.8Å; R412-E438 IonicContact NH2-OE1 3.18Å; R412-E438 PolarHBondContact NH2-OE1 3.24Å; R412-E438 IonicContact NH2-OE2 2.87Å; R412-E438 PolarHBondContact NH2-OE2 2.95Å
413	M	91.4	Very high	84.2	Confident	26 Å²	26	33.3 Å²	33.3	13%	0.128	21%	0.205	C	C	.	.	H	α-helix	trans	-62.6	-41.1	173.4	-73.1	-176.4	73.3	0	0	111.5	P349 V409 R410 A415 Q416 M427 L430	P349-M413 HydrophobicContact CG-SD 3.88Å; V409-M413 HydrophobicContact CG1-CG 4.35Å; V409-M413 HydrophobicContact CG1-SD 4.07Å; V409-M413 WeakPolarHBondContact O-CB 3.35Å; V409-M413 VanDerWaalsContact O-CG 3.29Å; V409-M413 WeakPolarHBondContact O-CG 3.39Å; V409-M413 PolarHBondContact O-N 2.84Å; R410-M413 PolarHBondContact O-N 2.84Å; M413-A415 VanDerWaalsContact C-N 3.29Å; M413-A415 PolarHBondContact O-N 2.89Å; M413-Q416 WeakPolarHBondContact O-CB 3.28Å; M413-Q416 PolarHBondContact O-N 3.12Å; M413-M427 HydrophobicContact SD-CB 3.96Å; M413-M427 HydrophobicContact SD-CG 4.46Å; M413-L430 HydrophobicContact CB-CD2 4.49Å; M413-L430 HydrophobicContact CG-CD2 3.54Å
414	Q	91.3	Very high	83.6	Confident	3 Å²	3	37.5 Å²	37.5	1%	0.014	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-34.5	176.5	-71.7	179	-14.8	0	0	112.3	Y307 V311 T314 R315 K345 R410 T411 R412	Y307-Q414 PolarHBondContact OH-NE2 3.44Å; Y307-Q414 VanDerWaalsContact OH-NE2 3.07Å; V311-Q414 HydrophobicContact CG2-CG 4.12Å; T314-Q414 HydrophobicContact CG2-CB 3.81Å; T314-Q414 PolarHBondContact OG1-OE1 2.95Å; R315-Q414 WeakPolarHBondContact CD-O 3.44Å; R315-Q414 PolarHBondContact NE-O 3.04Å; R315-Q414 PolarHBondContact NH2-O 2.64Å; K345-Q414 WeakPolarHBondContact O-CG 3.48Å; R410-Q414 VanDerWaalsContact O-CG 3.31Å; R410-Q414 WeakPolarHBondContact O-CG 3.03Å; R410-Q414 PolarHBondContact O-N 3.28Å; T411-Q414 PolarHBondContact O-N 3.04Å; R412-Q414 VanDerWaalsContact C-N 3.33Å
415	A	88.4	Confident	83.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-91	-4.9	-179.9	0	0	0	0	0	114.4	V224 T314 V318 T411 R412 M413 A417 M418	V224-A415 HydrophobicContact CB-CB 4.31Å; V224-A415 HydrophobicContact CG1-CB 3.73Å; V224-A415 HydrophobicContact CG2-CB 3.53Å; T314-A415 HydrophobicContact CG2-CB 4.27Å; V318-A415 HydrophobicContact CG1-CB 4.5Å; V318-A415 HydrophobicContact CG2-CB 4.21Å; T411-A415 PolarHBondContact O-N 3.29Å; R412-A415 PolarHBondContact O-N 3.46Å; M413-A415 VanDerWaalsContact C-N 3.29Å; M413-A415 PolarHBondContact O-N 2.89Å; A415-A417 VanDerWaalsContact C-N 3.35Å; A415-A417 PolarHBondContact O-N 3.31Å; A415-M418 VanDerWaalsContact O-CB 3.3Å; A415-M418 WeakPolarHBondContact O-CB 3.12Å; A415-M418 PolarHBondContact O-N 3.43Å
416	Q	82.9	Confident	82.9	Confident	12 Å²	12	43.7 Å²	43.7	6%	0.056	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-60.2	-37.5	-164	-169.1	161.6	15.4	0	0	114.5	R412 M413 M418 L419 P423 L425	R412-Q416 WeakPolarHBondContact O-CB 3.34Å; R412-Q416 PolarHBondContact O-N 3.47Å; M413-Q416 WeakPolarHBondContact O-CB 3.28Å; M413-Q416 PolarHBondContact O-N 3.12Å; Q416-M418 PolarHBondContact O-N 3.04Å; Q416-L419 PolarHBondContact O-N 3.04Å; Q416-P423 PolarHBondContact NE2-O 2.82Å; Q416-L425 PolarHBondContact OE1-O 3.46Å
417	A	77.2	Confident	82.8	Confident	43 Å²	43	44 Å²	44	36%	0.355	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-79.1	-0.5	178.5	0	0	0	0	0	113.8	E338 A415	E338-A417 HydrophobicContact CG-CB 4.23Å; E338-A417 VanDerWaalsContact OE1-CB 3.31Å; E338-A417 WeakPolarHBondContact OE1-CB 3.15Å; E338-A417 WeakPolarHBondContact OE2-CB 3.26Å; A415-A417 VanDerWaalsContact C-N 3.35Å; A415-A417 PolarHBondContact O-N 3.31Å
418	M	75.6	Confident	82.9	Confident	30 Å²	30	45.6 Å²	45.6	15%	0.148	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-86.5	-17.1	168.9	-52.9	-154	73	0	0	112.6	R315 V318 Q323 Y324 A415 Q416 E420	R315-M418 HydrophobicContact CB-SD 4.22Å; R315-M418 VanDerWaalsContact O-SD 3.4Å; V318-M418 HydrophobicContact CB-SD 3.96Å; V318-M418 HydrophobicContact CG1-CB 4.38Å; V318-M418 HydrophobicContact CG1-SD 3.91Å; Q323-M418 VanDerWaalsContact NE2-CE 3.26Å; Y324-M418 HydrophobicContact CE2-CE 3.75Å; A415-M418 VanDerWaalsContact O-CB 3.3Å; A415-M418 WeakPolarHBondContact O-CB 3.12Å; A415-M418 PolarHBondContact O-N 3.43Å; Q416-M418 PolarHBondContact O-N 3.04Å; M418-E420 PolarHBondContact O-N 3.21Å
419	L	72.8	Confident	82.9	Confident	40 Å²	40	46.7 Å²	46.7	21%	0.209	27%	0.273	C	S	.	.	S	Bend	trans	-92.2	94.9	-177.2	-67.5	170.7	0	0	0	109.8	V224 Q416 G421 S422	V224-L419 HydrophobicContact CG1-CD1 4.14Å; V224-L419 HydrophobicContact CG1-CD2 4.34Å; V224-L419 HydrophobicContact CG1-CG 4.41Å; Q416-L419 PolarHBondContact O-N 3.04Å; L419-G421 PolarHBondContact O-N 2.97Å; L419-S422 PolarHBondContact O-N 3.39Å
420	E	63.1	Low	82.7	Confident	172 Å²	172	47.2 Å²	47.2	80%	0.804	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	131.6	174.7	-69.2	172	-176.5	0	0	111.3	M418 S422	M418-E420 PolarHBondContact O-N 3.21Å; E420-S422 PolarHBondContact O-N 2.77Å
421	G	64.2	Low	82.7	Confident	85 Å²	85	49 Å²	49	88%	0.876	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	4.6	177.7	0	0	0	0	0	116.4	L419	L419-G421 PolarHBondContact O-N 2.97Å
422	S	66.2	Low	82.7	Confident	24 Å²	24	56.8 Å²	56.8	17%	0.168	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-94.8	129.8	176	-65.9	0	0	0	0	112	L419 E420	L419-S422 PolarHBondContact O-N 3.39Å; E420-S422 PolarHBondContact O-N 2.77Å
423	P	73.7	Confident	82.6	Confident	75 Å²	75	59.2 Å²	59.2	49%	0.487	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-59.1	142.1	174.2	23.8	-33.1	0	0	0	110	Q416 L425	Q416-P423 PolarHBondContact NE2-O 2.82Å; P423-L425 HydrophobicContact CB-CD2 4.3Å; P423-L425 HydrophobicContact CG-CD2 4.25Å; P423-L425 HydrophobicContact CG-CG 4.33Å; P423-L425 PolarHBondContact O-N 3.47Å
424	Q	78.6	Confident	82.5	Confident	100 Å²	100	58 Å²	58	47%	0.467	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-71.6	117.6	169.2	-61.3	-65.9	-55.8	0	0	107.6
425	L	84.1	Confident	82.5	Confident	45 Å²	45	61 Å²	61	24%	0.236	33%	0.332	C	S	.	.			trans	-116.8	140.8	-172.7	-64.8	174.9	0	0	0	107.6	Q416 P423 L430 R433	Q416-L425 PolarHBondContact OE1-O 3.46Å; P423-L425 HydrophobicContact CB-CD2 4.3Å; P423-L425 HydrophobicContact CG-CD2 4.25Å; P423-L425 HydrophobicContact CG-CG 4.33Å; P423-L425 PolarHBondContact O-N 3.47Å; L425-L430 HydrophobicContact CB-CB 4.31Å; L425-R433 HydrophobicContact CD1-CB 4.33Å
426	N	88.1	Confident	82.6	Confident	107 Å²	107	65.6 Å²	65.6	57%	0.572	36%	0.363	S	S	*	.			trans	-69.9	171.7	168	62.7	22.5	0	0	0	110.7	V428 G429 L430	N426-V428 VanDerWaalsContact C-N 3.32Å; N426-V428 PolarHBondContact O-N 2.85Å; N426-G429 PolarHBondContact O-N 2.78Å; N426-G429 PolarHBondContact OD1-N 2.9Å; N426-L430 WeakPolarHBondContact O-CB 3.36Å; N426-L430 PolarHBondContact O-N 3.26Å
427	M	90.8	Very high	82.8	Confident	49 Å²	49	71.9 Å²	71.9	24%	0.241	39%	0.39	C	S	.	.	H	α-helix	trans	-51	-49	-177.9	-175.3	-171.9	75.3	0	0	112.5	V348 P349 L352 V409 M413 L430 F431	V348-M427 HydrophobicContact CG1-SD 4.16Å; P349-M427 HydrophobicContact CB-CG 4.12Å; P349-M427 HydrophobicContact CB-SD 3.76Å; P349-M427 HydrophobicContact CG-CG 4.21Å; P349-M427 HydrophobicContact CG-SD 4.17Å; L352-M427 HydrophobicContact CD1-CE 4.14Å; L352-M427 HydrophobicContact CD1-SD 4.16Å; V409-M427 HydrophobicContact CG1-CB 4.48Å; V409-M427 HydrophobicContact CG1-CG 3.72Å; M413-M427 HydrophobicContact SD-CB 3.96Å; M413-M427 HydrophobicContact SD-CG 4.46Å; M427-L430 PolarHBondContact O-N 2.99Å; M427-F431 WeakPolarHBondContact O-CB 3.39Å; M427-F431 PolarHBondContact O-N 3.4Å
428	V	92.4	Very high	83.2	Confident	68 Å²	68	71.5 Å²	71.5	41%	0.412	38%	0.381	S	S	.	.	H	α-helix	trans	-65.8	-44.4	-178.1	177.8	0	0	0	0	111.4	N426 L430 F431 R432	N426-V428 VanDerWaalsContact C-N 3.32Å; N426-V428 PolarHBondContact O-N 2.85Å; V428-L430 VanDerWaalsContact C-N 3.33Å; V428-L430 PolarHBondContact O-N 3.19Å; V428-F431 PolarHBondContact O-N 2.82Å; V428-R432 WeakPolarHBondContact O-CB 3.28Å; V428-R432 WeakPolarHBondContact O-CG 3.4Å; V428-R432 PolarHBondContact O-N 3.23Å
429	G	91.2	Very high	83.8	Confident	22 Å²	22	71.3 Å²	71.3	23%	0.227	39%	0.387	C	S	.	.	H	α-helix	trans	-63.6	-39.8	177.8	0	0	0	0	0	112.2	N426 R433	N426-G429 PolarHBondContact O-N 2.78Å; N426-G429 PolarHBondContact OD1-N 2.9Å; G429-R433 VanDerWaalsContact O-CB 3.27Å; G429-R433 WeakPolarHBondContact O-CB 3.27Å; G429-R433 PolarHBondContact O-N 3.18Å
430	L	89.8	Confident	84.6	Confident	13 Å²	13	74.9 Å²	74.9	7%	0.068	41%	0.405	C	S	.	.	H	α-helix	trans	-68.1	-44.2	176.4	-174.3	59.5	0	0	0	111.8	V409 R412 M413 L425 N426 M427 V428 R433 I434	V409-L430 HydrophobicContact CG1-CD2 4.27Å; R412-L430 HydrophobicContact CB-CD2 3.71Å; M413-L430 HydrophobicContact CB-CD2 4.49Å; M413-L430 HydrophobicContact CG-CD2 3.54Å; L425-L430 HydrophobicContact CB-CB 4.31Å; N426-L430 WeakPolarHBondContact O-CB 3.36Å; N426-L430 PolarHBondContact O-N 3.26Å; M427-L430 PolarHBondContact O-N 2.99Å; V428-L430 VanDerWaalsContact C-N 3.33Å; V428-L430 PolarHBondContact O-N 3.19Å; L430-R433 PolarHBondContact O-N 2.89Å; L430-I434 HydrophobicContact CD1-CD1 4.49Å; L430-I434 HydrophobicContact CG-CD1 4.15Å; L430-I434 WeakPolarHBondContact O-CD1 3.33Å; L430-I434 VanDerWaalsContact O-CG1 3.24Å; L430-I434 WeakPolarHBondContact O-CG1 3.46Å; L430-I434 PolarHBondContact O-N 3.45Å
431	F	92.3	Very high	85.8	Confident	75 Å²	75	71.4 Å²	71.4	33%	0.329	40%	0.398	S	S	.	.	H	α-helix	trans	-59.4	-49.4	176.1	-174	-97.6	0	0	0	111.7	P405 V409 M427 V428 R433 I434 I435 L443	P405-F431 HydrophobicContact CB-CE2 4.36Å; V409-F431 HydrophobicContact CG2-CB 4.34Å; V409-F431 HydrophobicContact CG2-CD2 3.98Å; M427-F431 WeakPolarHBondContact O-CB 3.39Å; M427-F431 PolarHBondContact O-N 3.4Å; V428-F431 PolarHBondContact O-N 2.82Å; F431-R433 VanDerWaalsContact C-N 3.33Å; F431-R433 PolarHBondContact O-N 2.77Å; F431-I434 PolarHBondContact O-N 2.62Å; F431-I435 HydrophobicContact CD1-CD1 3.73Å; F431-I435 HydrophobicContact CE1-CD1 3.24Å; F431-I435 HydrophobicContact CE1-CG1 4.41Å; F431-I435 HydrophobicContact CE2-CD1 4.47Å; F431-I435 HydrophobicContact CZ-CD1 3.68Å; F431-I435 PolarHBondContact O-N 2.88Å; F431-I435 VanDerWaalsContact O-N 3.08Å; F431-L443 HydrophobicContact CD2-CD2 3.78Å; F431-L443 HydrophobicContact CE2-CD1 3.79Å; F431-L443 HydrophobicContact CE2-CD2 3.68Å; F431-L443 HydrophobicContact CE2-CG 4.42Å; F431-L443 HydrophobicContact CZ-CD1 4.02Å
432	R	92.1	Very high	86.8	Confident	179 Å²	179	67.5 Å²	67.5	68%	0.675	36%	0.357	S	S	*	.	H	α-helix	trans	-59.3	-42.2	175.4	-73.5	-179.6	-173.5	163	2.7	112.2	V428 I434 I435 S436	V428-R432 WeakPolarHBondContact O-CB 3.28Å; V428-R432 WeakPolarHBondContact O-CG 3.4Å; V428-R432 PolarHBondContact O-N 3.23Å; R432-I434 VanDerWaalsContact C-N 3.34Å; R432-I434 PolarHBondContact O-N 2.91Å; R432-I435 PolarHBondContact O-N 3.5Å; R432-S436 WeakPolarHBondContact O-CB 3.44Å; R432-S436 PolarHBondContact O-N 2.97Å; R432-S436 PolarHBondContact O-OG 2.65Å
433	R	89.4	Confident	88	Confident	76 Å²	76	66.8 Å²	66.8	29%	0.287	35%	0.352	S	S	.	.	H	α-helix	trans	-64	-37.1	177.7	178.5	175.9	171.8	177.6	-1.2	112.6	L425 G429 L430 F431 S436 K437	L425-R433 HydrophobicContact CD1-CB 4.33Å; G429-R433 VanDerWaalsContact O-CB 3.27Å; G429-R433 WeakPolarHBondContact O-CB 3.27Å; G429-R433 PolarHBondContact O-N 3.18Å; L430-R433 PolarHBondContact O-N 2.89Å; F431-R433 VanDerWaalsContact C-N 3.33Å; F431-R433 PolarHBondContact O-N 2.77Å; R433-S436 PolarHBondContact O-OG 3.06Å; R433-K437 HydrophobicContact CG-CD 4.42Å; R433-K437 WeakPolarHBondContact O-CB 3.41Å; R433-K437 PolarHBondContact O-N 2.97Å
434	I	89.4	Confident	88.8	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-65.2	-49.6	176.4	-66.5	161.4	0	0	0	109.3	L408 V409 L430 F431 R432 S436 K437 E438 G439 L443	L408-I434 HydrophobicContact CD2-CD1 4.14Å; V409-I434 HydrophobicContact CG2-CD1 4.12Å; L430-I434 HydrophobicContact CD1-CD1 4.49Å; L430-I434 HydrophobicContact CG-CD1 4.15Å; L430-I434 WeakPolarHBondContact O-CD1 3.33Å; L430-I434 VanDerWaalsContact O-CG1 3.24Å; L430-I434 WeakPolarHBondContact O-CG1 3.46Å; L430-I434 PolarHBondContact O-N 3.45Å; F431-I434 PolarHBondContact O-N 2.62Å; R432-I434 VanDerWaalsContact C-N 3.34Å; R432-I434 PolarHBondContact O-N 2.91Å; I434-S436 VanDerWaalsContact C-N 3.33Å; I434-S436 PolarHBondContact O-N 3.36Å; I434-K437 PolarHBondContact O-N 3.38Å; I434-E438 HydrophobicContact CG2-CB 4.44Å; I434-E438 WeakPolarHBondContact O-CA 3.34Å; I434-E438 WeakPolarHBondContact O-CB 3.35Å; I434-E438 PolarHBondContact O-N 3.4Å; I434-G439 PolarHBondContact O-N 2.92Å; I434-L443 HydrophobicContact CB-CD2 4.26Å; I434-L443 HydrophobicContact CD1-CD2 4.36Å; I434-L443 HydrophobicContact CG2-CD2 3.78Å; I434-L443 HydrophobicContact CG2-CG 4.11Å
435	I	91.1	Very high	89.2	Confident	66 Å²	66	66 Å²	66	34%	0.338	34%	0.335	S	S	.	.	H	α-helix	trans	-61.3	-43	179.8	-66.8	175.7	0	0	0	111.1	F431 R432 G439 L443	F431-I435 HydrophobicContact CD1-CD1 3.73Å; F431-I435 HydrophobicContact CE1-CD1 3.24Å; F431-I435 HydrophobicContact CE1-CG1 4.41Å; F431-I435 HydrophobicContact CE2-CD1 4.47Å; F431-I435 HydrophobicContact CZ-CD1 3.68Å; F431-I435 PolarHBondContact O-N 2.88Å; F431-I435 VanDerWaalsContact O-N 3.08Å; R432-I435 PolarHBondContact O-N 3.5Å; I435-G439 WeakPolarHBondContact O-CA 3.41Å; I435-G439 PolarHBondContact O-N 3.16Å; I435-L443 HydrophobicContact CD1-CD1 4.34Å; I435-L443 HydrophobicContact CG1-CD1 4.15Å
436	S	89.9	Confident	89.3	Confident	96 Å²	96	64.1 Å²	64.1	67%	0.671	33%	0.326	S	S	*	.	H	α-helix	trans	-72.2	-32.4	-177.5	68	0	0	0	0	114.2	R432 R433 I434	R432-S436 WeakPolarHBondContact O-CB 3.44Å; R432-S436 PolarHBondContact O-N 2.97Å; R432-S436 PolarHBondContact O-OG 2.65Å; R433-S436 PolarHBondContact O-OG 3.06Å; I434-S436 VanDerWaalsContact C-N 3.33Å; I434-S436 PolarHBondContact O-N 3.36Å
437	K	87.8	Confident	89.3	Confident	143 Å²	143	60.2 Å²	60.2	62%	0.622	31%	0.305	S	S	*	.	H	α-helix	trans	-96.5	-32.8	-178.5	-68.5	-159	172	-158.9	0	114.8	R433 I434	R433-K437 HydrophobicContact CG-CD 4.42Å; R433-K437 WeakPolarHBondContact O-CB 3.41Å; R433-K437 PolarHBondContact O-N 2.97Å; I434-K437 PolarHBondContact O-N 3.38Å
438	E	84.8	Confident	89.2	Confident	35 Å²	35	61.6 Å²	61.6	16%	0.164	32%	0.316	C	S	.	.	H	α-helix	trans	-120.6	-6.6	-170	-57.6	174.9	-156	0	0	112.5	S227 R412 I434 G442 R445	S227-E438 WeakPolarHBondContact CB-OE1 3.36Å; S227-E438 PolarHBondContact OG-OE1 3.44Å; R412-E438 IonicContact CZ-OE1 3.57Å; R412-E438 IonicContact CZ-OE2 2.98Å; R412-E438 IonicContact NH1-OE1 2.77Å; R412-E438 PolarHBondContact NH1-OE1 3.12Å; R412-E438 IonicContact NH1-OE2 3.8Å; R412-E438 IonicContact NH2-OE1 3.18Å; R412-E438 PolarHBondContact NH2-OE1 3.24Å; R412-E438 IonicContact NH2-OE2 2.87Å; R412-E438 PolarHBondContact NH2-OE2 2.95Å; I434-E438 HydrophobicContact CG2-CB 4.44Å; I434-E438 WeakPolarHBondContact O-CA 3.34Å; I434-E438 WeakPolarHBondContact O-CB 3.35Å; I434-E438 PolarHBondContact O-N 3.4Å; E438-G442 PolarHBondContact O-N 2.83Å; E438-R445 IonicContact OE1-NH1 2.86Å; E438-R445 PolarHBondContact OE1-NH1 3.3Å; E438-R445 IonicContact OE2-CZ 3.23Å; E438-R445 IonicContact OE2-NE 3.05Å; E438-R445 IonicContact OE2-NH1 3.89Å; E438-R445 PolarHBondContact OE2-NH1 3.18Å
439	G	88.1	Confident	88.9	Confident	26 Å²	26	58.3 Å²	58.3	27%	0.268	30%	0.297	S	S	.	.	H	α-helix	trans	68.9	-176.1	-174	0	0	0	0	0	113.3	I434 I435 P441 G442	I434-G439 PolarHBondContact O-N 2.92Å; I435-G439 WeakPolarHBondContact O-CA 3.41Å; I435-G439 PolarHBondContact O-N 3.16Å; G439-P441 VanDerWaalsContact C-CD 3.47Å; G439-G442 PolarHBondContact O-N 2.76Å; G439-G442 VanDerWaalsContact O-N 3.13Å
440	I	88.8	Confident	88.6	Confident	115 Å²	115	58 Å²	58	59%	0.59	29%	0.289	S	S	*	.	H	α-helix	trans	-58.5	-40.6	175.3	-60.7	173.6	0	0	0	112.2	G442 L443	I440-G442 PolarHBondContact O-N 3.16Å; I440-G442 VanDerWaalsContact O-N 3.13Å; I440-L443 WeakPolarHBondContact O-CB 3.24Å; I440-L443 PolarHBondContact O-N 3.35Å
441	P	88.4	Confident	88.4	Confident	100 Å²	100	60.5 Å²	60.5	65%	0.649	30%	0.3	S	S	*	.	H	α-helix	trans	-59.9	-25.6	176.5	-25.3	36	0	0	0	113.7	G439 L443 Y444	G439-P441 VanDerWaalsContact C-CD 3.47Å; P441-L443 PolarHBondContact O-N 3.49Å; P441-Y444 PolarHBondContact O-N 3.36Å; P441-Y444 VanDerWaalsContact O-N 3.12Å
442	G	86.3	Confident	88.2	Confident	2 Å²	2	61.3 Å²	61.3	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-57.9	-32.2	173.9	0	0	0	0	0	113.5	L408 E438 G439 I440 Y444 R445	L408-G442 WeakPolarHBondContact CD2-O 3.27Å; E438-G442 PolarHBondContact O-N 2.83Å; G439-G442 PolarHBondContact O-N 2.76Å; G439-G442 VanDerWaalsContact O-N 3.13Å; I440-G442 PolarHBondContact O-N 3.16Å; I440-G442 VanDerWaalsContact O-N 3.13Å; G442-Y444 PolarHBondContact O-N 3.18Å; G442-R445 PolarHBondContact O-N 3.09Å
443	L	90.5	Very high	87.8	Confident	10 Å²	10	54.4 Å²	54.4	5%	0.052	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-19.5	178.4	-66.6	170.2	0	0	0	113.3	Y404 P405 L408 F431 I434 I435 I440 P441	Y404-L443 VanDerWaalsContact CD1-O 3.24Å; Y404-L443 WeakPolarHBondContact CD1-O 3.37Å; P405-L443 HydrophobicContact CB-CB 4.16Å; P405-L443 HydrophobicContact CB-CD1 4.32Å; P405-L443 HydrophobicContact CB-CD2 4.32Å; P405-L443 HydrophobicContact CG-CB 4.33Å; L408-L443 VanDerWaalsContact CD2-CA 3.49Å; L408-L443 WeakPolarHBondContact CD2-O 3.07Å; F431-L443 HydrophobicContact CD2-CD2 3.78Å; F431-L443 HydrophobicContact CE2-CD1 3.79Å; F431-L443 HydrophobicContact CE2-CD2 3.68Å; F431-L443 HydrophobicContact CE2-CG 4.42Å; F431-L443 HydrophobicContact CZ-CD1 4.02Å; I434-L443 HydrophobicContact CB-CD2 4.26Å; I434-L443 HydrophobicContact CD1-CD2 4.36Å; I434-L443 HydrophobicContact CG2-CD2 3.78Å; I434-L443 HydrophobicContact CG2-CG 4.11Å; I435-L443 HydrophobicContact CD1-CD1 4.34Å; I435-L443 HydrophobicContact CG1-CD1 4.15Å; I440-L443 WeakPolarHBondContact O-CB 3.24Å; I440-L443 PolarHBondContact O-N 3.35Å; P441-L443 PolarHBondContact O-N 3.49Å
444	Y	91	Very high	87.2	Confident	83 Å²	83	51.9 Å²	51.9	33%	0.325	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	13.4	-176.1	-66.5	-87.5	0	0	0	113.7	L401 Y404 P405 P441 G442 G446 I447	L401-Y444 WeakPolarHBondContact O-CE1 3.44Å; Y404-Y444 HydrophobicContact CD1-CD1 4Å; Y404-Y444 HydrophobicContact CD1-CG 4.47Å; Y404-Y444 HydrophobicContact CG-CD1 4.22Å; P405-Y444 HydrophobicContact CG-CE1 4.39Å; P405-Y444 HydrophobicContact CG-CE2 4.35Å; P441-Y444 PolarHBondContact O-N 3.36Å; P441-Y444 VanDerWaalsContact O-N 3.12Å; G442-Y444 PolarHBondContact O-N 3.18Å; Y444-G446 PolarHBondContact O-N 3.38Å; Y444-I447 HydrophobicContact CD1-CD1 4.01Å; Y444-I447 VanDerWaalsContact O-CB 3.29Å; Y444-I447 WeakPolarHBondContact O-CB 3.24Å; Y444-I447 VanDerWaalsContact O-CG2 3.22Å; Y444-I447 WeakPolarHBondContact O-CG2 3.43Å; Y444-I447 PolarHBondContact O-N 3.42Å
445	R	88	Confident	86.5	Confident	76 Å²	76	57.9 Å²	57.9	29%	0.287	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	134.7	179.1	-81.5	-177.7	164.8	176.1	-13.3	112.3	Q223 G226 S227 Y404 L408 E438 G442	Q223-R445 WeakPolarHBondContact CG-O 3.17Å; G226-R445 VanDerWaalsContact C-CZ 3.42Å; G226-R445 PolarHBondContact O-NH1 3.26Å; G226-R445 PolarHBondContact O-NH2 3.09Å; S227-R445 VanDerWaalsContact N-NH1 3.14Å; Y404-R445 WeakPolarHBondContact CE1-O 3.49Å; Y404-R445 PolarHBondContact OH-O 3.24Å; L408-R445 HydrophobicContact CD1-CB 4.4Å; E438-R445 IonicContact OE1-NH1 2.86Å; E438-R445 PolarHBondContact OE1-NH1 3.3Å; E438-R445 IonicContact OE2-CZ 3.23Å; E438-R445 IonicContact OE2-NE 3.05Å; E438-R445 IonicContact OE2-NH1 3.89Å; E438-R445 PolarHBondContact OE2-NH1 3.18Å; G442-R445 PolarHBondContact O-N 3.09Å
446	G	85.9	Confident	86.1	Confident	4 Å²	4	57.4 Å²	57.4	4%	0.041	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	4.9	-178.3	0	0	0	0	0	114.8	Y404 Y444 T448 P449 N450	Y404-G446 WeakPolarHBondContact OH-CA 3.16Å; Y404-G446 PolarHBondContact OH-O 2.89Å; Y444-G446 PolarHBondContact O-N 3.38Å; G446-T448 VanDerWaalsContact C-N 3.32Å; G446-T448 PolarHBondContact O-N 2.82Å; G446-P449 WeakPolarHBondContact O-CD 3.48Å; G446-N450 PolarHBondContact O-N 2.98Å
447	I	87.8	Confident	85.5	Confident	25 Å²	25	53.7 Å²	53.7	13%	0.128	28%	0.282	C	S	.	.	H	α-helix	trans	-67.7	-32.2	-179.3	-163.5	165.1	0	0	0	112.6	L401 Y404 Y444 N450 F451	L401-I447 HydrophobicContact CD2-CD1 3.46Å; L401-I447 VanDerWaalsContact CD2-CD1 3.46Å; L401-I447 HydrophobicContact CG-CD1 4.46Å; Y404-I447 HydrophobicContact CD2-CB 4.44Å; Y404-I447 HydrophobicContact CD2-CD1 4.07Å; Y404-I447 HydrophobicContact CD2-CG1 4.07Å; Y404-I447 HydrophobicContact CE1-CB 4.27Å; Y404-I447 HydrophobicContact CE2-CB 3.96Å; Y404-I447 HydrophobicContact CE2-CD1 4.42Å; Y404-I447 HydrophobicContact CE2-CG1 3.94Å; Y404-I447 HydrophobicContact CG-CD1 4.22Å; Y404-I447 PolarHBondContact OH-N 3.34Å; Y444-I447 HydrophobicContact CD1-CD1 4.01Å; Y444-I447 VanDerWaalsContact O-CB 3.29Å; Y444-I447 WeakPolarHBondContact O-CB 3.24Å; Y444-I447 VanDerWaalsContact O-CG2 3.22Å; Y444-I447 WeakPolarHBondContact O-CG2 3.43Å; Y444-I447 PolarHBondContact O-N 3.42Å; I447-N450 WeakPolarHBondContact O-CA 3.22Å; I447-N450 VanDerWaalsContact O-CB 3.27Å; I447-N450 WeakPolarHBondContact O-CB 3.3Å; I447-N450 PolarHBondContact O-N 2.97Å; I447-N450 VanDerWaalsContact O-N 3.16Å; I447-F451 HydrophobicContact CD1-CE2 3.67Å; I447-F451 HydrophobicContact CD1-CZ 3.62Å; I447-F451 HydrophobicContact CG1-CD2 3.99Å; I447-F451 HydrophobicContact CG1-CE1 4.31Å; I447-F451 HydrophobicContact CG1-CE2 3.53Å; I447-F451 HydrophobicContact CG1-CZ 3.71Å; I447-F451 PolarHBondContact O-N 3.07Å
448	T	87.9	Confident	84.7	Confident	78 Å²	78	49.6 Å²	49.6	48%	0.479	27%	0.268	S	S	.	.	H	α-helix	trans	-63.8	-53.2	179.7	-43.8	0	0	0	0	112.5	I234 G446 N450 F451 M452	I234-T448 HydrophobicContact CD1-CG2 3.78Å; G446-T448 VanDerWaalsContact C-N 3.32Å; G446-T448 PolarHBondContact O-N 2.82Å; T448-N450 PolarHBondContact O-N 3.41Å; T448-F451 PolarHBondContact O-N 3.35Å; T448-M452 HydrophobicContact CG2-SD 4.43Å; T448-M452 WeakPolarHBondContact O-CG 3.39Å; T448-M452 PolarHBondContact O-N 3.06Å
449	P	86.8	Confident	84.2	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.1	-31.7	171.5	-22.4	28.7	0	0	0	113.7	L218 K219 M222 I234 G446 K453	L218-P449 HydrophobicContact CD2-CB 4.22Å; L218-P449 HydrophobicContact CD2-CG 3.87Å; L218-P449 HydrophobicContact CG-CB 4.36Å; L218-P449 HydrophobicContact CG-CG 3.98Å; K219-P449 HydrophobicContact CB-CB 4.19Å; M222-P449 HydrophobicContact SD-CG 3.5Å; M222-P449 VanDerWaalsContact SD-CG 3.5Å; I234-P449 HydrophobicContact CG1-CG 4.49Å; G446-P449 WeakPolarHBondContact O-CD 3.48Å; P449-K453 WeakPolarHBondContact O-CB 3.1Å; P449-K453 PolarHBondContact O-N 2.9Å
450	N	85.3	Confident	83.9	Confident	14 Å²	14	51 Å²	51	8%	0.075	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-48.9	177.3	-172.5	74.6	0	0	0	111.1	K219 Q400 Y404 G446 I447 T448 K453 V454	K219-N450 HydrophobicContact CD-CB 4.01Å; K219-N450 WeakPolarHBondContact CE-OD1 3.25Å; K219-N450 PolarHBondContact NZ-OD1 3.1Å; Q400-N450 PolarHBondContact OE1-ND2 2.88Å; Y404-N450 HydrophobicContact CE2-CB 4.49Å; G446-N450 PolarHBondContact O-N 2.98Å; I447-N450 WeakPolarHBondContact O-CA 3.22Å; I447-N450 VanDerWaalsContact O-CB 3.27Å; I447-N450 WeakPolarHBondContact O-CB 3.3Å; I447-N450 PolarHBondContact O-N 2.97Å; I447-N450 VanDerWaalsContact O-N 3.16Å; T448-N450 PolarHBondContact O-N 3.41Å; N450-K453 WeakPolarHBondContact O-CB 3.32Å; N450-K453 PolarHBondContact O-N 3.37Å; N450-V454 WeakPolarHBondContact O-CG2 3.19Å; N450-V454 PolarHBondContact O-N 3.3Å
451	F	85.6	Confident	83.4	Confident	67 Å²	67	47.4 Å²	47.4	29%	0.294	26%	0.264	S	S	.	.	H	α-helix	trans	-67.1	-39.5	176.3	-68.3	-34.3	0	0	0	113.6	T397 L401 I447 T448 K453 V454	T397-F451 HydrophobicContact CG2-CD1 4Å; T397-F451 HydrophobicContact CG2-CE1 3.37Å; T397-F451 HydrophobicContact CG2-CZ 3.69Å; L401-F451 HydrophobicContact CD1-CZ 4.37Å; L401-F451 HydrophobicContact CD2-CE2 4.28Å; L401-F451 HydrophobicContact CD2-CZ 3.83Å; L401-F451 HydrophobicContact CG-CZ 3.87Å; I447-F451 HydrophobicContact CD1-CE2 3.67Å; I447-F451 HydrophobicContact CD1-CZ 3.62Å; I447-F451 HydrophobicContact CG1-CD2 3.99Å; I447-F451 HydrophobicContact CG1-CE1 4.31Å; I447-F451 HydrophobicContact CG1-CE2 3.53Å; I447-F451 HydrophobicContact CG1-CZ 3.71Å; I447-F451 PolarHBondContact O-N 3.07Å; T448-F451 PolarHBondContact O-N 3.35Å; F451-K453 PolarHBondContact O-N 3.11Å; F451-K453 VanDerWaalsContact O-N 3.1Å; F451-V454 PolarHBondContact O-N 3.31Å; F451-V454 VanDerWaalsContact O-N 3.1Å
452	M	86.6	Confident	82.8	Confident	91 Å²	91	47 Å²	47	45%	0.448	25%	0.25	S	S	.	.	H	α-helix	trans	-57.8	-26.8	174.5	-71.2	179	67.5	0	0	112.7	L215 I234 T448 P456	L215-M452 HydrophobicContact CD1-CB 4.31Å; L215-M452 HydrophobicContact CD2-CB 4.32Å; L215-M452 HydrophobicContact CD2-CE 4.38Å; I234-M452 HydrophobicContact CD1-SD 3.7Å; T448-M452 HydrophobicContact CG2-SD 4.43Å; T448-M452 WeakPolarHBondContact O-CG 3.39Å; T448-M452 PolarHBondContact O-N 3.06Å; M452-P456 WeakPolarHBondContact O-CD 3.44Å; M452-P456 WeakPolarHBondContact O-CG 3.35Å
453	K	84.3	Confident	82.5	Confident	35 Å²	35	50.9 Å²	50.9	15%	0.152	27%	0.273	C	S	.	.	H	α-helix	trans	-82.2	-29.2	178.9	160.1	172.8	171	176.8	0	113.4	T212 L215 D216 P449 N450 F451 P456 A457	T212-K453 HydrophobicContact CG2-CG 4.1Å; T212-K453 WeakPolarHBondContact OG1-CE 3.36Å; L215-K453 HydrophobicContact CB-CB 4.06Å; L215-K453 HydrophobicContact CD1-CB 4.01Å; D216-K453 HydrophobicContact CB-CD 4.35Å; D216-K453 VanDerWaalsContact CG-NZ 3.29Å; D216-K453 IonicContact OD1-NZ 3.19Å; D216-K453 PolarHBondContact OD1-NZ 3.11Å; D216-K453 IonicContact OD2-NZ 2.87Å; P449-K453 WeakPolarHBondContact O-CB 3.1Å; P449-K453 PolarHBondContact O-N 2.9Å; N450-K453 WeakPolarHBondContact O-CB 3.32Å; N450-K453 PolarHBondContact O-N 3.37Å; F451-K453 PolarHBondContact O-N 3.11Å; F451-K453 VanDerWaalsContact O-N 3.1Å; K453-P456 WeakPolarHBondContact O-CD 3.42Å; K453-A457 HydrophobicContact CG-CB 4.42Å; K453-A457 WeakPolarHBondContact O-CB 3.38Å; K453-A457 PolarHBondContact O-N 3Å
454	V	77.1	Confident	82.2	Confident	23 Å²	23	51.7 Å²	51.7	14%	0.139	28%	0.278	C	S	.	.	H	α-helix	trans	-60.2	-55.9	-170.3	175.1	0	0	0	0	111.7	N450 F451 A457 V458	N450-V454 WeakPolarHBondContact O-CG2 3.19Å; N450-V454 PolarHBondContact O-N 3.3Å; F451-V454 PolarHBondContact O-N 3.31Å; F451-V454 VanDerWaalsContact O-N 3.1Å; V454-A457 PolarHBondContact O-N 3.19Å; V454-V458 WeakPolarHBondContact O-CG2 3.39Å; V454-V458 PolarHBondContact O-N 2.76Å
455	L	75.4	Confident	81.7	Confident	126 Å²	126	50.6 Å²	50.6	66%	0.66	27%	0.274	S	S	*	.	H	α-helix	trans	-62.5	-48.1	-176.6	-66.5	173.9	0	0	0	112.9	A393 A457 V458 G459	A393-L455 HydrophobicContact CB-CD2 4.48Å; L455-A457 VanDerWaalsContact C-N 3.31Å; L455-A457 PolarHBondContact O-N 3.07Å; L455-V458 PolarHBondContact O-N 3.36Å; L455-G459 PolarHBondContact O-N 2.79Å
456	P	81.2	Confident	81.1	Confident	56 Å²	56	49.4 Å²	49.4	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-60.8	-38.2	174.5	-25	35	0	0	0	113.2	T212 M452 K453 I460	T212-P456 HydrophobicContact CG2-CB 4.32Å; M452-P456 WeakPolarHBondContact O-CD 3.44Å; M452-P456 WeakPolarHBondContact O-CG 3.35Å; K453-P456 WeakPolarHBondContact O-CD 3.42Å; P456-I460 HydrophobicContact CB-CD1 4.5Å; P456-I460 VanDerWaalsContact O-CB 3.28Å; P456-I460 WeakPolarHBondContact O-CB 3.4Å; P456-I460 WeakPolarHBondContact O-CD1 3.34Å; P456-I460 WeakPolarHBondContact O-CG1 3.33Å; P456-I460 PolarHBondContact O-N 3.13Å
457	A	77.9	Confident	81	Confident	19 Å²	19	53.2 Å²	53.2	16%	0.157	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-45.5	179.6	0	0	0	0	0	111.7	S208 T212 K453 V454 L455 S461	S208-A457 VanDerWaalsContact OG-CA 3.29Å; S208-A457 WeakPolarHBondContact OG-CA 3.11Å; S208-A457 PolarHBondContact OG-O 3.4Å; T212-A457 HydrophobicContact CG2-CB 4.01Å; K453-A457 HydrophobicContact CG-CB 4.42Å; K453-A457 WeakPolarHBondContact O-CB 3.38Å; K453-A457 PolarHBondContact O-N 3Å; V454-A457 PolarHBondContact O-N 3.19Å; L455-A457 VanDerWaalsContact C-N 3.31Å; L455-A457 PolarHBondContact O-N 3.07Å; A457-S461 VanDerWaalsContact O-CB 3.24Å; A457-S461 WeakPolarHBondContact O-CB 3.05Å; A457-S461 PolarHBondContact O-N 3.32Å
458	V	71.4	Confident	80.9	Confident	56 Å²	56	53.8 Å²	53.8	34%	0.339	29%	0.294	S	S	.	.	H	α-helix	trans	-65.7	-50.7	178.7	174	0	0	0	0	110.5	L389 V454 L455 I460 S461 Y462	L389-V458 HydrophobicContact CD2-CG1 3.96Å; V454-V458 WeakPolarHBondContact O-CG2 3.39Å; V454-V458 PolarHBondContact O-N 2.76Å; L455-V458 PolarHBondContact O-N 3.36Å; V458-I460 PolarHBondContact O-N 3.38Å; V458-S461 PolarHBondContact O-N 2.82Å; V458-Y462 WeakPolarHBondContact O-CB 3.19Å; V458-Y462 PolarHBondContact O-N 3.19Å
459	G	74	Confident	80.4	Confident	36 Å²	36	51.9 Å²	51.9	37%	0.371	28%	0.279	S	S	.	.	H	α-helix	trans	-61.1	-45.6	-178.6	0	0	0	0	0	113.3	L455 Y462 V463	L455-G459 PolarHBondContact O-N 2.79Å; G459-Y462 PolarHBondContact O-N 3.2Å; G459-V463 WeakPolarHBondContact O-CG2 3.21Å; G459-V463 PolarHBondContact O-N 2.8Å
460	I	81.6	Confident	80.1	Confident	55 Å²	55	57.5 Å²	57.5	28%	0.282	31%	0.305	S	S	.	.	H	α-helix	trans	-65.5	-43	178	-66.3	168	0	0	0	110.6	V207 P456 V458 Y462 V464	V207-I460 HydrophobicContact CG1-CG2 4.01Å; P456-I460 HydrophobicContact CB-CD1 4.5Å; P456-I460 VanDerWaalsContact O-CB 3.28Å; P456-I460 WeakPolarHBondContact O-CB 3.4Å; P456-I460 WeakPolarHBondContact O-CD1 3.34Å; P456-I460 WeakPolarHBondContact O-CG1 3.33Å; P456-I460 PolarHBondContact O-N 3.13Å; V458-I460 PolarHBondContact O-N 3.38Å; I460-Y462 VanDerWaalsContact C-N 3.31Å; I460-Y462 PolarHBondContact O-N 2.97Å; I460-V464 HydrophobicContact CG2-CG2 4.15Å; I460-V464 WeakPolarHBondContact O-CB 3.38Å; I460-V464 WeakPolarHBondContact O-CG2 3.36Å; I460-V464 PolarHBondContact O-N 3.38Å
461	S	79	Confident	80.1	Confident	40 Å²	40	62.1 Å²	62.1	28%	0.28	33%	0.334	S	S	.	.	H	α-helix	trans	-61.4	-43.2	178.8	-165.9	0	0	0	0	111	A204 A457 V458 Y465	A204-S461 WeakPolarHBondContact CB-O 3.49Å; A457-S461 VanDerWaalsContact O-CB 3.24Å; A457-S461 WeakPolarHBondContact O-CB 3.05Å; A457-S461 PolarHBondContact O-N 3.32Å; V458-S461 PolarHBondContact O-N 2.82Å; S461-Y465 WeakPolarHBondContact O-CB 3.32Å; S461-Y465 PolarHBondContact O-N 2.75Å
462	Y	76.3	Confident	80	Confident	92 Å²	92	60.8 Å²	60.8	36%	0.361	33%	0.33	S	S	.	.	H	α-helix	trans	-62.4	-53.4	178.6	178.6	-101.1	0	0	0	112	V385 V458 G459 I460 V464 Y465 E466	V385-Y462 HydrophobicContact CG1-CE2 4.17Å; V458-Y462 WeakPolarHBondContact O-CB 3.19Å; V458-Y462 PolarHBondContact O-N 3.19Å; G459-Y462 PolarHBondContact O-N 3.2Å; I460-Y462 VanDerWaalsContact C-N 3.31Å; I460-Y462 PolarHBondContact O-N 2.97Å; Y462-V464 VanDerWaalsContact C-N 3.3Å; Y462-V464 PolarHBondContact O-N 3.21Å; Y462-Y465 PolarHBondContact O-N 3.24Å; Y462-Y465 VanDerWaalsContact O-N 3.12Å; Y462-E466 HydrophobicContact CD1-CG 4.48Å; Y462-E466 HydrophobicContact CD2-CG 4.31Å; Y462-E466 HydrophobicContact CE1-CG 4.06Å; Y462-E466 HydrophobicContact CE2-CG 3.85Å; Y462-E466 PolarHBondContact O-N 3.27Å
463	V	80	Confident	79.4	Confident	82 Å²	82	58.1 Å²	58.1	50%	0.497	33%	0.325	S	S	.	.	H	α-helix	trans	-59.2	-42.7	-179.5	172.2	0	0	0	0	111.5	G459 N467	G459-V463 WeakPolarHBondContact O-CG2 3.21Å; G459-V463 PolarHBondContact O-N 2.8Å; V463-N467 WeakPolarHBondContact O-CB 3.35Å; V463-N467 VanDerWaalsContact O-CG 3.23Å; V463-N467 PolarHBondContact O-N 3.41Å; V463-N467 VanDerWaalsContact O-N 3.13Å; V463-N467 PolarHBondContact O-ND2 3.09Å
464	V	84	Confident	78.6	Confident	27 Å²	27	57.3 Å²	57.3	16%	0.164	32%	0.323	C	S	.	.	H	α-helix	trans	-68.4	-41.3	177.9	178.1	0	0	0	0	110.7	I203 A204 V207 I460 Y462 N467 M468	I203-V464 HydrophobicContact CG2-CG1 4.2Å; A204-V464 HydrophobicContact CB-CB 4.08Å; A204-V464 HydrophobicContact CB-CG1 3.97Å; V207-V464 HydrophobicContact CB-CG1 4.42Å; V207-V464 HydrophobicContact CB-CG2 4.22Å; V207-V464 HydrophobicContact CG1-CG2 3.86Å; V207-V464 HydrophobicContact CG2-CG1 4.35Å; I460-V464 HydrophobicContact CG2-CG2 4.15Å; I460-V464 WeakPolarHBondContact O-CB 3.38Å; I460-V464 WeakPolarHBondContact O-CG2 3.36Å; I460-V464 PolarHBondContact O-N 3.38Å; Y462-V464 VanDerWaalsContact C-N 3.3Å; Y462-V464 PolarHBondContact O-N 3.21Å; V464-N467 PolarHBondContact O-N 2.74Å; V464-M468 HydrophobicContact CG1-CG 3.97Å; V464-M468 VanDerWaalsContact O-CB 3.27Å; V464-M468 WeakPolarHBondContact O-CB 3.41Å; V464-M468 WeakPolarHBondContact O-CG 3.5Å; V464-M468 PolarHBondContact O-N 3.04Å
465	Y	79.3	Confident	77.4	Confident	61 Å²	61	59.4 Å²	59.4	24%	0.239	34%	0.336	C	S	.	.	H	α-helix	trans	-61.1	-48.3	179.2	-177.5	-111.6	0	0	0	112	A200 S461 Y462 M468 K469	A200-Y465 HydrophobicContact CB-CD2 3.9Å; A200-Y465 HydrophobicContact CB-CE2 3.91Å; S461-Y465 WeakPolarHBondContact O-CB 3.32Å; S461-Y465 PolarHBondContact O-N 2.75Å; Y462-Y465 PolarHBondContact O-N 3.24Å; Y462-Y465 VanDerWaalsContact O-N 3.12Å; Y465-M468 PolarHBondContact O-N 3.21Å; Y465-K469 HydrophobicContact CD1-CD 3.88Å; Y465-K469 HydrophobicContact CE1-CD 3.35Å; Y465-K469 HydrophobicContact CE1-CG 4.22Å; Y465-K469 HydrophobicContact CE2-CD 4.21Å; Y465-K469 HydrophobicContact CE2-CG 4.28Å; Y465-K469 WeakPolarHBondContact O-CG 3.44Å; Y465-K469 PolarHBondContact O-N 2.84Å
466	E	76	Confident	75.5	Confident	50 Å²	50	61 Å²	61	23%	0.234	34%	0.34	C	S	.	.	H	α-helix	trans	-61.9	-46.4	178.2	-70.6	-57	125.4	0	0	111.8	Y462 M468 K469 Q470	Y462-E466 HydrophobicContact CD1-CG 4.48Å; Y462-E466 HydrophobicContact CD2-CG 4.31Å; Y462-E466 HydrophobicContact CE1-CG 4.06Å; Y462-E466 HydrophobicContact CE2-CG 3.85Å; Y462-E466 PolarHBondContact O-N 3.27Å; E466-M468 VanDerWaalsContact C-N 3.32Å; E466-M468 PolarHBondContact O-N 3.25Å; E466-K469 PolarHBondContact O-N 2.93Å; E466-Q470 WeakPolarHBondContact O-CG 3.37Å; E466-Q470 PolarHBondContact O-N 2.99Å
467	N	83.9	Confident	73.1	Confident	84 Å²	84	71.3 Å²	71.3	45%	0.449	38%	0.379	S	S	.	.	H	α-helix	trans	-62.8	-38.8	176.5	-72.8	-20.2	0	0	0	112.2	V463 V464 Q470 T471	V463-N467 WeakPolarHBondContact O-CB 3.35Å; V463-N467 VanDerWaalsContact O-CG 3.23Å; V463-N467 PolarHBondContact O-N 3.41Å; V463-N467 VanDerWaalsContact O-N 3.13Å; V463-N467 PolarHBondContact O-ND2 3.09Å; V464-N467 PolarHBondContact O-N 2.74Å; N467-Q470 PolarHBondContact O-N 3.34Å; N467-T471 WeakPolarHBondContact O-CB 3.42Å; N467-T471 PolarHBondContact O-N 2.8Å; N467-T471 PolarHBondContact O-OG1 2.89Å
468	M	85.2	Confident	72.9	Confident	37 Å²	37	74 Å²	74	18%	0.182	39%	0.39	C	S	.	.	H	α-helix	trans	-70.6	-37.3	177.9	-72.8	-54.6	-48.5	0	0	112	A200 I203 V464 Y465 E466 Q470 T471 L472	A200-M468 HydrophobicContact CB-CB 3.71Å; I203-M468 HydrophobicContact CB-CG 4.36Å; I203-M468 HydrophobicContact CD1-CE 3.56Å; I203-M468 HydrophobicContact CD1-SD 4.37Å; I203-M468 HydrophobicContact CG2-CG 4Å; I203-M468 HydrophobicContact CG2-SD 4.02Å; V464-M468 HydrophobicContact CG1-CG 3.97Å; V464-M468 VanDerWaalsContact O-CB 3.27Å; V464-M468 WeakPolarHBondContact O-CB 3.41Å; V464-M468 WeakPolarHBondContact O-CG 3.5Å; V464-M468 PolarHBondContact O-N 3.04Å; Y465-M468 PolarHBondContact O-N 3.21Å; E466-M468 VanDerWaalsContact C-N 3.32Å; E466-M468 PolarHBondContact O-N 3.25Å; M468-Q470 VanDerWaalsContact C-N 3.35Å; M468-T471 PolarHBondContact O-N 3.25Å; M468-L472 HydrophobicContact CE-CD1 3.95Å; M468-L472 HydrophobicContact CE-CD2 4.49Å; M468-L472 HydrophobicContact CE-CG 4.05Å; M468-L472 VanDerWaalsContact O-CB 3.27Å; M468-L472 WeakPolarHBondContact O-CB 3.25Å; M468-L472 VanDerWaalsContact O-CG 3.25Å; M468-L472 WeakPolarHBondContact O-CG 3Å; M468-L472 PolarHBondContact O-N 3.3Å
469	K	77.3	Confident	72.9	Confident	39 Å²	39	74.9 Å²	74.9	17%	0.17	39%	0.393	C	S	.	.	H	α-helix	trans	-60.4	-44.5	173.1	-81.6	-178.3	62.3	-177.9	0	111.7	A200 Y465 E466 G473 V474	A200-K469 HydrophobicContact CB-CG 4.26Å; Y465-K469 HydrophobicContact CD1-CD 3.88Å; Y465-K469 HydrophobicContact CE1-CD 3.35Å; Y465-K469 HydrophobicContact CE1-CG 4.22Å; Y465-K469 HydrophobicContact CE2-CD 4.21Å; Y465-K469 HydrophobicContact CE2-CG 4.28Å; Y465-K469 WeakPolarHBondContact O-CG 3.44Å; Y465-K469 PolarHBondContact O-N 2.84Å; E466-K469 PolarHBondContact O-N 2.93Å; K469-G473 PolarHBondContact O-N 3.38Å; K469-V474 HydrophobicContact CB-CB 4.14Å; K469-V474 HydrophobicContact CG-CB 4.23Å; K469-V474 HydrophobicContact CG-CG1 4.28Å; K469-V474 PolarHBondContact O-N 2.94Å
470	Q	80.7	Confident	72.9	Confident	118 Å²	118	77.1 Å²	77.1	55%	0.551	39%	0.394	S	S	*	.	H	α-helix	trans	-63.1	-46.1	175.2	-68.4	176.8	12	0	0	111.4	E466 N467 M468 L472 G473	E466-Q470 WeakPolarHBondContact O-CG 3.37Å; E466-Q470 PolarHBondContact O-N 2.99Å; N467-Q470 PolarHBondContact O-N 3.34Å; M468-Q470 VanDerWaalsContact C-N 3.35Å; Q470-L472 PolarHBondContact O-N 2.84Å; Q470-G473 PolarHBondContact O-N 2.69Å
471	T	85.8	Confident	72.4	Confident	111 Å²	111	78.4 Å²	78.4	68%	0.681	40%	0.401	S	S	*	.	H	α-helix	trans	-66.8	-36.5	-178	-54.5	0	0	0	0	112.6	N467 M468 G473	N467-T471 WeakPolarHBondContact O-CB 3.42Å; N467-T471 PolarHBondContact O-N 2.8Å; N467-T471 PolarHBondContact O-OG1 2.89Å; M468-T471 PolarHBondContact O-N 3.25Å; T471-G473 PolarHBondContact O-N 3.01Å
472	L	82.8	Confident	72	Confident	39 Å²	39	80.8 Å²	80.8	20%	0.204	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	1.2	178.2	-65.3	170.8	0	0	0	112.8	R196 L199 A200 M468 Q470 V474	R196-L472 HydrophobicContact CB-CB 4.22Å; R196-L472 WeakPolarHBondContact CD-O 3.35Å; R196-L472 PolarHBondContact NH1-O 3.24Å; R196-L472 VanDerWaalsContact NH1-O 3.09Å; R196-L472 WeakPolarHBondContact O-CD1 3.18Å; L199-L472 HydrophobicContact CB-CD1 4.23Å; L199-L472 HydrophobicContact CD2-CD1 4.13Å; L199-L472 HydrophobicContact CD2-CD2 4.1Å; L199-L472 HydrophobicContact CG-CD1 4.19Å; A200-L472 HydrophobicContact CB-CD1 4.06Å; M468-L472 HydrophobicContact CE-CD1 3.95Å; M468-L472 HydrophobicContact CE-CD2 4.49Å; M468-L472 HydrophobicContact CE-CG 4.05Å; M468-L472 VanDerWaalsContact O-CB 3.27Å; M468-L472 WeakPolarHBondContact O-CB 3.25Å; M468-L472 VanDerWaalsContact O-CG 3.25Å; M468-L472 WeakPolarHBondContact O-CG 3Å; M468-L472 PolarHBondContact O-N 3.3Å; Q470-L472 PolarHBondContact O-N 2.84Å; L472-V474 VanDerWaalsContact C-N 3.33Å; L472-V474 HydrophobicContact CB-CG2 4.27Å; L472-V474 PolarHBondContact O-N 3.4Å
473	G	74.3	Confident	71.7	Confident	34 Å²	34	80 Å²	80	35%	0.351	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	35.9	179.3	0	0	0	0	0	113.2	K469 Q470 T471	K469-G473 PolarHBondContact O-N 3.38Å; Q470-G473 PolarHBondContact O-N 2.69Å; T471-G473 PolarHBondContact O-N 3.01Å
474	V	67.9	Low	71.1	Confident	19 Å²	19	79.9 Å²	79.9	12%	0.115	41%	0.406	C	S	.	.	S	Bend	trans	-79.9	-31.1	171.9	177.7	0	0	0	0	110.5	R196 Q197 K469 L472	R196-V474 HydrophobicContact CB-CG2 3.54Å; Q197-V474 HydrophobicContact CG-CG1 3.61Å; Q197-V474 HydrophobicContact CG-CG2 4.2Å; K469-V474 HydrophobicContact CB-CB 4.14Å; K469-V474 HydrophobicContact CG-CB 4.23Å; K469-V474 HydrophobicContact CG-CG1 4.28Å; K469-V474 PolarHBondContact O-N 2.94Å; L472-V474 VanDerWaalsContact C-N 3.33Å; L472-V474 HydrophobicContact CB-CG2 4.27Å; L472-V474 PolarHBondContact O-N 3.4Å
475	T	51.7	Low	70.1	Confident	66 Å²	66	83.9 Å²	83.9	41%	0.405	42%	0.424	S	S	.	.	S	Bend	trans	-118.1	114.2	171.6	18.8	0	0	0	0	107.8
476	Q	36.2	Very low	69.3	Low	159 Å²	159	85.8 Å²	85.8	74%	0.743	44%	0.44	S	S	*	.			trans	-75.3	145	166.9	-77.2	-171.2	13.8	0	0	109.4
477	K	30.3	Very low	68.7	Low	274 Å²	274	89.1 Å²	89.1	100%	1.191	46%	0.458	S	S	*	.			trans	-64.2	0	178.3	-94	-175.3	174.5	-179	0	112.6

Retrieved 477 of 477 residues in 126.6 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).