Z4YJK0_MOUSE Loading...

Rho GTPase activating protein 36

AlphaFold DB , UniProt , Accession Z4YJK0, Species MOUSE (Mus musculus, Mouse), Gene Arhgap36, Length 533 aa.

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(Predicted Aligned Error values between residue pairs)

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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	37.5	Very low	32.5	Very low	182 Å²	182	114.4 Å²	114.4	90%	0.897	62%	0.615	S	S	*	*				0	-38.4	0	-69.3	-60.6	-94.6	0	0	113.5	M4	M1-M4 HydrophobicContact SD-CE 3.94Å
2	A	32	Very low	32.7	Very low	69 Å²	69	112.2 Å²	112.2	57%	0.57	62%	0.624	S	S	*	*	H	α-helix	trans	-65.8	-41.8	173.6	0	0	0	0	0	113.7	M4 L5 D6	A2-M4 VanDerWaalsContact C-N 3.33Å; A2-M4 PolarHBondContact O-N 3.03Å; A2-L5 PolarHBondContact O-N 3.09Å; A2-D6 PolarHBondContact O-N 2.69Å; A2-D6 VanDerWaalsContact O-N 3.16Å
3	W	26.7	Very low	33	Very low	216 Å²	216	114.8 Å²	114.8	82%	0.818	63%	0.625	S	S	*	*	H	α-helix	trans	-63.6	-31.5	177.5	-92.9	62.6	0	0	0	114.7	L5 D6 C7	W3-L5 VanDerWaalsContact C-N 3.35Å; W3-D6 PolarHBondContact O-N 3.26Å; W3-C7 PolarHBondContact O-N 3.11Å; W3-C7 PolarHBondContact O-SG 2.84Å
4	M	27.3	Very low	32.5	Very low	123 Å²	123	118.1 Å²	118.1	61%	0.606	63%	0.634	S	S	*	*	H	α-helix	trans	-72	-31.4	176.9	-101.9	-172.2	-80.4	0	0	112.2	M1 A2 L8	M1-M4 HydrophobicContact SD-CE 3.94Å; A2-M4 VanDerWaalsContact C-N 3.33Å; A2-M4 PolarHBondContact O-N 3.03Å; M4-L8 WeakPolarHBondContact O-CB 3.44Å; M4-L8 WeakPolarHBondContact O-CD1 3.37Å; M4-L8 WeakPolarHBondContact O-CG 3.48Å; M4-L8 PolarHBondContact O-N 3.02Å
5	L	35.7	Very low	32.4	Very low	113 Å²	113	117.7 Å²	117.7	59%	0.592	64%	0.641	S	S	*	*	H	α-helix	trans	-73.1	-35.1	174.8	-76.9	160.8	0	0	0	111.5	A2 W3 L8 F9	A2-L5 PolarHBondContact O-N 3.09Å; W3-L5 VanDerWaalsContact C-N 3.35Å; L5-L8 PolarHBondContact O-N 3.11Å; L5-F9 WeakPolarHBondContact O-CB 3.42Å; L5-F9 PolarHBondContact O-N 3.48Å
6	D	33.2	Very low	32.1	Very low	107 Å²	107	124.8 Å²	124.8	57%	0.572	66%	0.655	S	S	*	*	H	α-helix	trans	-68.3	-38.8	172.9	-71.7	-30.3	0	0	0	112	A2 W3 F9 A10	A2-D6 PolarHBondContact O-N 2.69Å; A2-D6 VanDerWaalsContact O-N 3.16Å; W3-D6 PolarHBondContact O-N 3.26Å; D6-F9 PolarHBondContact O-N 3.12Å; D6-A10 WeakPolarHBondContact O-CB 3.49Å; D6-A10 PolarHBondContact O-N 3.4Å
7	C	30.8	Very low	32	Very low	76 Å²	76	124.9 Å²	124.9	51%	0.514	67%	0.665	S	S	.	*	H	α-helix	trans	-68.4	-35.3	173.7	-67.7	0	0	0	0	113	W3 A10 S11	W3-C7 PolarHBondContact O-N 3.11Å; W3-C7 PolarHBondContact O-SG 2.84Å; C7-A10 PolarHBondContact O-N 2.85Å; C7-S11 WeakPolarHBondContact O-CB 3.39Å; C7-S11 PolarHBondContact O-N 3.22Å
8	L	32.7	Very low	31.7	Very low	117 Å²	117	131.3 Å²	131.3	61%	0.613	68%	0.679	S	S	*	*	H	α-helix	trans	-69.7	-34.4	172.8	-81.8	160.8	0	0	0	112	M4 L5 A12	M4-L8 WeakPolarHBondContact O-CB 3.44Å; M4-L8 WeakPolarHBondContact O-CD1 3.37Å; M4-L8 WeakPolarHBondContact O-CG 3.48Å; M4-L8 PolarHBondContact O-N 3.02Å; L5-L8 PolarHBondContact O-N 3.11Å; L8-A12 WeakPolarHBondContact O-CB 3.33Å; L8-A12 PolarHBondContact O-N 3.19Å; L8-A12 VanDerWaalsContact O-N 3.13Å
9	F	36.1	Very low	31.8	Very low	110 Å²	110	136.4 Å²	136.4	48%	0.482	69%	0.688	S	S	.	*	H	α-helix	trans	-67.9	-36	172.2	-116.1	-91.7	0	0	0	112.5	L5 D6	L5-F9 WeakPolarHBondContact O-CB 3.42Å; L5-F9 PolarHBondContact O-N 3.48Å; D6-F9 PolarHBondContact O-N 3.12Å
10	A	34.1	Very low	31.7	Very low	66 Å²	66	134.9 Å²	134.9	55%	0.545	69%	0.686	S	S	.	*	H	α-helix	trans	-71.8	-40.7	175.5	0	0	0	0	0	112.3	D6 C7 F13	D6-A10 WeakPolarHBondContact O-CB 3.49Å; D6-A10 PolarHBondContact O-N 3.4Å; C7-A10 PolarHBondContact O-N 2.85Å; A10-F13 PolarHBondContact O-N 3.41Å
11	S	31.3	Very low	31.8	Very low	79 Å²	79	133.5 Å²	133.5	55%	0.552	69%	0.688	S	S	*	*	H	α-helix	trans	-73.3	-31.1	-178.6	-177.6	0	0	0	0	113.5	C7 F13	C7-S11 WeakPolarHBondContact O-CB 3.39Å; C7-S11 PolarHBondContact O-N 3.22Å; S11-F13 PolarHBondContact O-N 3.35Å
12	A	34.8	Very low	32	Very low	88 Å²	88	127.5 Å²	127.5	73%	0.727	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-8.3	173	0	0	0	0	0	113.8	L8	L8-A12 WeakPolarHBondContact O-CB 3.33Å; L8-A12 PolarHBondContact O-N 3.19Å; L8-A12 VanDerWaalsContact O-N 3.13Å
13	F	36.8	Very low	32.6	Very low	146 Å²	146	127.5 Å²	127.5	64%	0.64	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	5.6	-178.2	-106.8	-89.5	0	0	0	113.9	A10 S11 P15	A10-F13 PolarHBondContact O-N 3.41Å; S11-F13 PolarHBondContact O-N 3.35Å; F13-P15 WeakPolarHBondContact O-CD 3.37Å
14	E	26.8	Very low	33	Very low	161 Å²	161	119.2 Å²	119.2	75%	0.752	63%	0.633	S	S	*	*			trans	-82.1	115.7	174.9	-137.9	167.8	-158.9	0	0	110.3	R16	E14-R16 PolarHBondContact O-N 2.77Å
15	P	30.7	Very low	33.2	Very low	113 Å²	113	115.2 Å²	115.2	73%	0.734	62%	0.624	S	S	*	*			trans	-79.4	121.5	-169.9	29.6	-31.5	0	0	0	111.1	F13	F13-P15 WeakPolarHBondContact O-CD 3.37Å
16	R	27.1	Very low	33	Very low	230 Å²	230	113.7 Å²	113.7	87%	0.868	63%	0.627	S	S	*	*			trans	-57.2	139.6	153.8	-70.3	-173.6	178.6	-172.8	-0.6	108.3	E14 R18	E14-R16 PolarHBondContact O-N 2.77Å; R16-R18 VanDerWaalsContact C-N 3.32Å; R16-R18 PolarHBondContact O-N 3.23Å
17	P	29.7	Very low	33	Very low	127 Å²	127	114.5 Å²	114.5	83%	0.825	64%	0.639	S	S	*	*	S	Bend	trans	-78.2	80.2	-166.1	32.8	-35	0	0	0	110.9
18	R	26.7	Very low	33.1	Very low	241 Å²	241	114 Å²	114	91%	0.909	65%	0.646	S	S	*	*			trans	-142.1	95.7	152.7	-72.2	-164.5	176.2	175.1	-1.8	107.6	R16 V20	R16-R18 VanDerWaalsContact C-N 3.32Å; R16-R18 PolarHBondContact O-N 3.23Å; R18-V20 PolarHBondContact O-N 3.39Å
19	R	34.9	Very low	33.4	Very low	227 Å²	227	117.4 Å²	117.4	86%	0.857	66%	0.659	S	S	*	*			trans	-61.1	120	-174	-65.7	175.9	173.8	-164.5	-0.2	111.9
20	V	29.9	Very low	33	Very low	106 Å²	106	119.9 Å²	119.9	64%	0.642	68%	0.677	S	S	*	*			trans	-146.7	117.4	147	-176.5	0	0	0	0	107.6	R18 V22 L444	R18-V20 PolarHBondContact O-N 3.39Å; V20-V22 PolarHBondContact O-N 2.8Å; V20-L444 HydrophobicContact CG1-CD2 4.35Å
21	S	32.9	Very low	32.9	Very low	106 Å²	106	123 Å²	123	74%	0.741	70%	0.695	S	S	*	*			trans	-66.8	123.8	173.3	48.2	0	0	0	0	109.5
22	V	42.8	Very low	32.9	Very low	56 Å²	56	125.8 Å²	125.8	34%	0.339	70%	0.704	S	S	.	*			trans	-106.5	92.6	-179.6	-175	0	0	0	0	107.7	V20 L444	V20-V22 PolarHBondContact O-N 2.8Å; V22-L444 HydrophobicContact CG1-CD2 4.33Å; V22-L444 HydrophobicContact CG1-CG 4.16Å; V22-L444 HydrophobicContact CG2-CD1 4.42Å; V22-L444 HydrophobicContact CG2-CD2 3.7Å; V22-L444 HydrophobicContact CG2-CG 4.25Å
23	L	42.8	Very low	33.2	Very low	70 Å²	70	132.7 Å²	132.7	37%	0.366	71%	0.711	S	S	.	*	S	Bend	trans	163.9	95.5	147.8	-87.2	160.3	0	0	0	106.8	M35	L23-M35 HydrophobicContact CD1-CE 3.66Å
24	G	36.3	Very low	33.4	Very low	41 Å²	41	129.5 Å²	129.5	42%	0.423	71%	0.707	S	S	.	*			trans	39.3	92.4	163.1	0	0	0	0	0	118.3
25	G	31.9	Very low	34.8	Very low	39 Å²	39	125 Å²	125	40%	0.402	69%	0.687	S	S	.	*			trans	-158.1	128.9	159.2	0	0	0	0	0	108.8
26	A	29.7	Very low	36.6	Very low	81 Å²	81	124 Å²	124	67%	0.669	68%	0.675	S	S	*	*			trans	-66.7	145.5	168.2	0	0	0	0	0	108.9	G28	A26-G28 PolarHBondContact O-N 2.8Å
27	P	34.2	Very low	39.2	Very low	125 Å²	125	117.6 Å²	117.6	81%	0.812	66%	0.656	S	S	*	*			trans	-79.9	85.4	-175.4	32.3	-31.6	0	0	0	110.3
28	G	32.1	Very low	41.7	Very low	65 Å²	65	112.6 Å²	112.6	67%	0.67	62%	0.623	S	S	*	*			trans	-110.4	128.9	159.9	0	0	0	0	0	108.7	A26 N30	A26-G28 PolarHBondContact O-N 2.8Å; G28-N30 PolarHBondContact O-N 3.47Å
29	Q	39.5	Very low	44.5	Very low	189 Å²	189	103.2 Å²	103.2	88%	0.883	60%	0.595	S	S	*	*			trans	-49.4	122.2	-177.8	-68.7	167.2	-34.7	0	0	112.1
30	N	28.6	Very low	46.9	Very low	161 Å²	161	92.7 Å²	92.7	86%	0.861	56%	0.555	S	S	*	*			trans	-160	131.6	149.8	-91.8	-29.3	0	0	0	110.2	G28 D32	G28-N30 PolarHBondContact O-N 3.47Å; N30-D32 PolarHBondContact O-N 2.86Å
31	S	31.4	Very low	49.2	Very low	132 Å²	132	88.8 Å²	88.8	92%	0.923	53%	0.53	S	S	*	.	S	Bend	trans	-82.7	55.9	-176.8	54.7	0	0	0	0	112.5
32	D	31.7	Very low	51.4	Low	138 Å²	138	86 Å²	86	74%	0.738	51%	0.51	S	S	*	.			trans	-145.4	114.6	163.9	-154.9	1.2	0	0	0	108.9	N30 S34	N30-D32 PolarHBondContact O-N 2.86Å; D32-S34 PolarHBondContact O-N 3.18Å
33	R	39.8	Very low	53.1	Low	233 Å²	233	84 Å²	84	88%	0.879	50%	0.498	S	S	*	.			trans	-78.7	54.2	-176.2	-73.2	-179	176.8	171.2	1.2	110.8
34	S	41.3	Very low	54.6	Low	79 Å²	79	80.8 Å²	80.8	55%	0.552	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-74.8	129.6	165.2	-169.1	0	0	0	0	107.9	D32 D36	D32-S34 PolarHBondContact O-N 3.18Å; S34-D36 PolarHBondContact O-N 3.16Å
35	M	57.4	Low	56.4	Low	67 Å²	67	79.4 Å²	79.4	33%	0.33	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-63.6	120.5	168.3	-84	167.7	125.5	0	0	107.7	L23 P418 K422	L23-M35 HydrophobicContact CD1-CE 3.66Å; M35-P418 HydrophobicContact CB-CB 3.52Å; M35-P418 HydrophobicContact SD-CB 4.38Å; M35-K422 WeakPolarHBondContact SD-CE 3.22Å; M35-K422 HydrophobicContact SD-CG 4.36Å
36	D	68.6	Low	58.5	Low	91 Å²	91	78.1 Å²	78.1	49%	0.487	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-59.7	149.4	178.5	-66.2	-27.8	0	0	0	111.1	S34 Q421	S34-D36 PolarHBondContact O-N 3.16Å; D36-Q421 PolarHBondContact O-NE2 3.4Å
37	M	80.6	Confident	60.9	Low	96 Å²	96	75.5 Å²	75.5	47%	0.473	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-68.9	139.5	177.4	-58.9	-165.7	-171.5	0	0	110.3	Q415	M37-Q415 HydrophobicContact CB-CB 3.98Å; M37-Q415 HydrophobicContact CB-CG 4.45Å; M37-Q415 HydrophobicContact SD-CB 4.12Å
38	V	82.8	Confident	63.2	Low	21 Å²	21	70.1 Å²	70.1	13%	0.127	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.3	-174.9	173.2	0	0	0	0	109.5	I40 S42 L43 V416 Q421	V38-I40 PolarHBondContact O-N 2.93Å; V38-S42 WeakPolarHBondContact CG1-OG 3.4Å; V38-L43 HydrophobicContact CG1-CD2 4.08Å; V38-V416 PolarHBondContact N-O 2.8Å; V38-V416 PolarHBondContact O-N 3.46Å; V38-Q421 VanDerWaalsContact CG2-NE2 3.3Å
39	S	85.4	Confident	65.6	Low	45 Å²	45	68.1 Å²	68.1	32%	0.315	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	137.2	175.2	175.6	0	0	0	0	111.4	H41 S42 F414	S39-H41 PolarHBondContact O-N 2.59Å; S39-H41 VanDerWaalsContact O-N 3.08Å; S39-H41 PolarHBondContact OG-N 3.37Å; S39-S42 PolarHBondContact O-N 3.32Å; S39-S42 PolarHBondContact O-OG 3.03Å; S39-F414 WeakPolarHBondContact CA-O 3.02Å
40	I	84.4	Confident	67.7	Low	5 Å²	5	59.9 Å²	59.9	3%	0.026	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-56.4	-26	174.9	60.3	166.5	0	0	0	112.4	V38 S42 L43 R48 L51 Y322 F414 V416	V38-I40 PolarHBondContact O-N 2.93Å; I40-S42 VanDerWaalsContact C-N 3.27Å; I40-S42 PolarHBondContact O-N 3.42Å; I40-L43 WeakPolarHBondContact O-CB 3.37Å; I40-L43 PolarHBondContact O-N 3.11Å; I40-R48 VanDerWaalsContact C-NH2 3.26Å; I40-R48 VanDerWaalsContact O-CZ 3.3Å; I40-R48 PolarHBondContact O-NE 3.27Å; I40-R48 PolarHBondContact O-NH2 3.27Å; I40-L51 HydrophobicContact CG2-CD2 3.91Å; I40-Y322 HydrophobicContact CG2-CD1 3.88Å; I40-Y322 HydrophobicContact CG2-CE1 3.54Å; I40-F414 HydrophobicContact CD1-CB 4.28Å; I40-F414 HydrophobicContact CD1-CD1 3.68Å; I40-F414 HydrophobicContact CD1-CG 4.46Å; I40-F414 HydrophobicContact CG1-CB 4.14Å; I40-F414 HydrophobicContact CG1-CD1 4.44Å; I40-F414 PolarHBondContact N-O 2.93Å; I40-V416 HydrophobicContact CG2-CG2 3.61Å
41	H	79.2	Confident	70.5	Confident	25 Å²	25	52.4 Å²	52.4	12%	0.116	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-67.3	-24.1	178.1	-69.9	94.9	0	0	0	114.1	S39 L43 R48 Q221 D330 E333	S39-H41 PolarHBondContact O-N 2.59Å; S39-H41 VanDerWaalsContact O-N 3.08Å; S39-H41 PolarHBondContact OG-N 3.37Å; H41-L43 VanDerWaalsContact C-N 3.33Å; H41-R48 VanDerWaalsContact CA-NH2 3.27Å; H41-R48 PolarHBondContact CD2-NH2 2.98Å; H41-Q221 VanDerWaalsContact CD2-CG 3.42Å; H41-Q221 WeakPolarHBondContact CD2-CG 3.29Å; H41-Q221 PolarHBondContact CD2-NE2 3.35Å; H41-D330 IonicContact CD2-OD1 2.78Å; H41-D330 IonicContact CE1-OD1 3.88Å; H41-D330 VanDerWaalsContact NE2-CG 3.34Å; H41-D330 IonicContact NE2-OD1 3.95Å; H41-D330 PolarHBondContact NE2-OD1 3.49Å; H41-D330 IonicContact NE2-OD2 3.99Å; H41-E333 IonicContact CE1-OE1 2.88Å; H41-E333 IonicContact CE1-OE2 2.7Å; H41-E333 PolarHBondContact CE1-OE2 2.98Å; H41-E333 IonicContact ND1-OE1 3.8Å; H41-E333 IonicContact ND1-OE2 3.34Å; H41-E333 PolarHBondContact ND1-OE2 3.29Å
42	S	78.8	Confident	73.2	Confident	46 Å²	46	46.7 Å²	46.7	32%	0.322	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-81	-17.1	178.2	72	0	0	0	0	113.5	V38 S39 I40	V38-S42 WeakPolarHBondContact CG1-OG 3.4Å; S39-S42 PolarHBondContact O-N 3.32Å; S39-S42 PolarHBondContact O-OG 3.03Å; I40-S42 VanDerWaalsContact C-N 3.27Å; I40-S42 PolarHBondContact O-N 3.42Å
43	L	79.2	Confident	75.8	Confident	16 Å²	16	41.3 Å²	41.3	8%	0.084	21%	0.209	C	C	.	.	S	Bend	trans	-76.9	143.6	-174.3	-59.5	-179.3	0	0	0	111.8	V38 I40 H41 E47 R48 L51 P218 V416	V38-L43 HydrophobicContact CG1-CD2 4.08Å; I40-L43 WeakPolarHBondContact O-CB 3.37Å; I40-L43 PolarHBondContact O-N 3.11Å; H41-L43 VanDerWaalsContact C-N 3.33Å; L43-E47 HydrophobicContact CB-CB 3.91Å; L43-E47 HydrophobicContact CD2-CB 4.26Å; L43-E47 HydrophobicContact CG-CB 4.48Å; L43-R48 HydrophobicContact CB-CG 3.85Å; L43-R48 HydrophobicContact CD1-CG 4.46Å; L43-L51 HydrophobicContact CD1-CD2 3.94Å; L43-P218 WeakPolarHBondContact O-CA 3.34Å; L43-V416 HydrophobicContact CD1-CG2 3.99Å
44	S	74.3	Confident	78	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.014	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-68.3	165	170.5	61.4	0	0	0	0	112.4	L46 E47 R48 N217	S44-L46 PolarHBondContact O-N 3.08Å; S44-E47 WeakPolarHBondContact CB-OE2 3.07Å; S44-E47 PolarHBondContact N-OE2 3.38Å; S44-E47 PolarHBondContact O-N 3.15Å; S44-E47 VanDerWaalsContact O-N 3.15Å; S44-E47 VanDerWaalsContact OG-CG 3.29Å; S44-E47 WeakPolarHBondContact OG-CG 3.2Å; S44-E47 PolarHBondContact OG-N 3Å; S44-E47 PolarHBondContact OG-OE2 3.35Å; S44-R48 PolarHBondContact O-N 3.03Å; S44-N217 WeakPolarHBondContact CA-O 3.36Å
45	E	73.2	Confident	80.3	Confident	11 Å²	11	26.4 Å²	26.4	5%	0.051	14%	0.141	C	C	.	.	H	α-helix	trans	-56.5	-40.5	175	-69.8	-178.9	157.7	0	0	112.9	L49 Q195 M214 S215 N217 I219	E45-L49 WeakPolarHBondContact O-CB 3.38Å; E45-L49 PolarHBondContact O-N 3.27Å; E45-Q195 WeakPolarHBondContact OE1-CB 3.29Å; E45-Q195 VanDerWaalsContact OE1-CD 3.25Å; E45-Q195 WeakPolarHBondContact OE1-CG 3.4Å; E45-Q195 PolarHBondContact OE1-NE2 2.92Å; E45-M214 HydrophobicContact CB-CB 4.15Å; E45-S215 WeakPolarHBondContact CG-OG 3.36Å; E45-S215 WeakPolarHBondContact OE2-CB 3.49Å; E45-S215 PolarHBondContact OE2-N 3.01Å; E45-S215 PolarHBondContact OE2-OG 2.7Å; E45-N217 PolarHBondContact N-O 3.04Å; E45-I219 HydrophobicContact CB-CD1 4.37Å; E45-I219 HydrophobicContact CB-CG1 4.42Å; E45-I219 HydrophobicContact CG-CD1 3.61Å; E45-I219 HydrophobicContact CG-CG1 3.42Å; E45-I219 VanDerWaalsContact CG-CG1 3.42Å
46	L	75.7	Confident	81.6	Confident	13 Å²	13	25.3 Å²	25.3	7%	0.068	13%	0.133	C	C	.	.	H	α-helix	trans	-63.6	-45.6	177.2	-178.6	62.6	0	0	0	111	S44 L49 K50 M214 L216 V428 A435	S44-L46 PolarHBondContact O-N 3.08Å; L46-L49 PolarHBondContact O-N 3.27Å; L46-K50 HydrophobicContact CD1-CG 4.42Å; L46-K50 WeakPolarHBondContact O-CG 3.31Å; L46-K50 PolarHBondContact O-N 3.12Å; L46-M214 HydrophobicContact CB-CB 4.15Å; L46-M214 HydrophobicContact CD1-CB 4.47Å; L46-M214 HydrophobicContact CD1-SD 4.23Å; L46-L216 HydrophobicContact CB-CD2 4.21Å; L46-L216 HydrophobicContact CD2-CD2 3.82Å; L46-V428 HydrophobicContact CD2-CG1 4.02Å; L46-A435 HydrophobicContact CD2-CB 3.68Å
47	E	81.3	Confident	82.4	Confident	25 Å²	25	25.8 Å²	25.8	12%	0.117	13%	0.132	C	C	.	.	H	α-helix	trans	-64.3	-44.3	177.7	-73.9	168.3	121.5	0	0	111.8	L43 S44 L49 K50 L51 V428 I439	L43-E47 HydrophobicContact CB-CB 3.91Å; L43-E47 HydrophobicContact CD2-CB 4.26Å; L43-E47 HydrophobicContact CG-CB 4.48Å; S44-E47 WeakPolarHBondContact CB-OE2 3.07Å; S44-E47 PolarHBondContact N-OE2 3.38Å; S44-E47 PolarHBondContact O-N 3.15Å; S44-E47 VanDerWaalsContact O-N 3.15Å; S44-E47 VanDerWaalsContact OG-CG 3.29Å; S44-E47 WeakPolarHBondContact OG-CG 3.2Å; S44-E47 PolarHBondContact OG-N 3Å; S44-E47 PolarHBondContact OG-OE2 3.35Å; E47-L49 VanDerWaalsContact C-N 3.34Å; E47-L49 PolarHBondContact O-N 3.28Å; E47-K50 PolarHBondContact O-N 3.47Å; E47-L51 VanDerWaalsContact O-CB 3.28Å; E47-L51 WeakPolarHBondContact O-CB 3.07Å; E47-L51 PolarHBondContact O-N 2.88Å; E47-V428 HydrophobicContact CG-CG2 4.45Å; E47-I439 HydrophobicContact CG-CD1 3.87Å; E47-I439 VanDerWaalsContact OE1-CG2 3.32Å; E47-I439 WeakPolarHBondContact OE1-CG2 3.43Å
48	R	82.4	Confident	82.7	Confident	13 Å²	13	23.3 Å²	23.3	5%	0.049	12%	0.12	C	C	.	.	H	α-helix	trans	-61.2	-42.5	175.5	-78.3	-168	168.5	-148.8	2.5	111.3	I40 H41 L43 S44 L51 Q52 D330	I40-R48 VanDerWaalsContact C-NH2 3.26Å; I40-R48 VanDerWaalsContact O-CZ 3.3Å; I40-R48 PolarHBondContact O-NE 3.27Å; I40-R48 PolarHBondContact O-NH2 3.27Å; H41-R48 VanDerWaalsContact CA-NH2 3.27Å; H41-R48 PolarHBondContact CD2-NH2 2.98Å; L43-R48 HydrophobicContact CB-CG 3.85Å; L43-R48 HydrophobicContact CD1-CG 4.46Å; S44-R48 PolarHBondContact O-N 3.03Å; R48-L51 WeakPolarHBondContact O-CB 3.22Å; R48-L51 PolarHBondContact O-N 3.1Å; R48-Q52 WeakPolarHBondContact O-CG 3.44Å; R48-Q52 PolarHBondContact O-N 2.81Å; R48-D330 IonicContact CZ-OD1 2.94Å; R48-D330 IonicContact NH1-OD1 3.57Å; R48-D330 PolarHBondContact NH1-OD1 3.14Å; R48-D330 IonicContact NH1-OD2 2.76Å; R48-D330 IonicContact NH2-OD1 3.98Å; R48-D330 PolarHBondContact NH2-OD1 3.28Å
49	L	81.3	Confident	82.8	Confident	23 Å²	23	22.3 Å²	22.3	12%	0.12	11%	0.114	C	C	.	.	H	α-helix	trans	-62.4	-48	176.5	-170.7	156.6	0	0	0	111.4	E45 L46 E47 L51 Q52 E53 M214	E45-L49 WeakPolarHBondContact O-CB 3.38Å; E45-L49 PolarHBondContact O-N 3.27Å; L46-L49 PolarHBondContact O-N 3.27Å; E47-L49 VanDerWaalsContact C-N 3.34Å; E47-L49 PolarHBondContact O-N 3.28Å; L49-L51 VanDerWaalsContact C-N 3.25Å; L49-L51 PolarHBondContact O-N 2.93Å; L49-Q52 PolarHBondContact O-N 3.47Å; L49-E53 HydrophobicContact CD2-CG 4.15Å; L49-E53 WeakPolarHBondContact CD2-OE1 3.28Å; L49-E53 PolarHBondContact O-N 2.74Å; L49-M214 HydrophobicContact CD1-CE 3.27Å; L49-M214 HydrophobicContact CD1-CG 4.13Å; L49-M214 HydrophobicContact CD1-SD 3.97Å
50	K	83.7	Confident	82.7	Confident	16 Å²	16	23.3 Å²	23.3	7%	0.07	12%	0.117	C	C	.	.	H	α-helix	trans	-63.6	-32.3	176.8	-67.5	-47	-176.4	-172.6	0	112.3	L46 E47 Q52 E53 T54 V424 R427 V428	L46-K50 HydrophobicContact CD1-CG 4.42Å; L46-K50 WeakPolarHBondContact O-CG 3.31Å; L46-K50 PolarHBondContact O-N 3.12Å; E47-K50 PolarHBondContact O-N 3.47Å; K50-Q52 VanDerWaalsContact C-N 3.35Å; K50-E53 WeakPolarHBondContact CD-OE2 3.26Å; K50-E53 IonicContact NZ-OE1 2.71Å; K50-E53 PolarHBondContact NZ-OE1 3.43Å; K50-E53 IonicContact NZ-OE2 2.77Å; K50-E53 PolarHBondContact NZ-OE2 3.41Å; K50-E53 WeakPolarHBondContact O-CB 3.31Å; K50-E53 PolarHBondContact O-N 3.15Å; K50-T54 WeakPolarHBondContact O-CG2 3.34Å; K50-T54 PolarHBondContact O-N 3.21Å; K50-V424 HydrophobicContact CB-CG1 4.06Å; K50-R427 HydrophobicContact CD-CB 4.38Å; K50-V428 HydrophobicContact CB-CG2 4.04Å; K50-V428 HydrophobicContact CG-CG2 3.77Å
51	L	88.6	Confident	82.7	Confident	4 Å²	4	26.6 Å²	26.6	2%	0.021	15%	0.145	C	C	.	.	H	α-helix	trans	-63.6	-37.1	170.7	-176.8	71.3	0	0	0	112.2	I40 L43 E47 R48 L49 T54 A55 Y322 V416 I420 V424	I40-L51 HydrophobicContact CG2-CD2 3.91Å; L43-L51 HydrophobicContact CD1-CD2 3.94Å; E47-L51 VanDerWaalsContact O-CB 3.28Å; E47-L51 WeakPolarHBondContact O-CB 3.07Å; E47-L51 PolarHBondContact O-N 2.88Å; R48-L51 WeakPolarHBondContact O-CB 3.22Å; R48-L51 PolarHBondContact O-N 3.1Å; L49-L51 VanDerWaalsContact C-N 3.25Å; L49-L51 PolarHBondContact O-N 2.93Å; L51-T54 WeakPolarHBondContact CA-OG1 3.33Å; L51-T54 PolarHBondContact O-N 2.91Å; L51-T54 PolarHBondContact O-OG1 3.11Å; L51-A55 VanDerWaalsContact O-CB 3.29Å; L51-A55 WeakPolarHBondContact O-CB 2.88Å; L51-A55 PolarHBondContact O-N 2.97Å; L51-Y322 HydrophobicContact CD1-CD2 3.92Å; L51-Y322 HydrophobicContact CD1-CE2 4.27Å; L51-Y322 HydrophobicContact CD1-CG 4.3Å; L51-Y322 HydrophobicContact CD2-CD1 3.88Å; L51-Y322 HydrophobicContact CD2-CD2 4.27Å; L51-Y322 HydrophobicContact CD2-CE1 4.35Å; L51-Y322 HydrophobicContact CD2-CG 3.84Å; L51-Y322 HydrophobicContact CG-CD2 4.1Å; L51-Y322 HydrophobicContact CG-CG 3.96Å; L51-V416 HydrophobicContact CD1-CG1 3.82Å; L51-V416 HydrophobicContact CD1-CG2 4.18Å; L51-V416 HydrophobicContact CD2-CG2 3.81Å; L51-I420 HydrophobicContact CD1-CG2 3.45Å; L51-I420 VanDerWaalsContact CD1-CG2 3.45Å; L51-V424 HydrophobicContact CB-CG2 4.04Å; L51-V424 HydrophobicContact CD1-CG2 3.72Å
52	Q	88.4	Confident	82.7	Confident	11 Å²	11	30 Å²	30	5%	0.051	16%	0.157	C	C	.	.	H	α-helix	trans	-69.2	-40.2	175	-35.3	-154.6	-68.3	0	0	111.2	R48 L49 K50 T54 A55 Y56 L207 Y322 M324	R48-Q52 WeakPolarHBondContact O-CG 3.44Å; R48-Q52 PolarHBondContact O-N 2.81Å; L49-Q52 PolarHBondContact O-N 3.47Å; K50-Q52 VanDerWaalsContact C-N 3.35Å; Q52-T54 VanDerWaalsContact C-N 3.34Å; Q52-A55 PolarHBondContact O-N 2.61Å; Q52-Y56 VanDerWaalsContact O-CB 3.32Å; Q52-Y56 WeakPolarHBondContact O-CB 3.43Å; Q52-Y56 PolarHBondContact O-N 3.33Å; Q52-L207 HydrophobicContact CB-CD2 4.19Å; Q52-Y322 VanDerWaalsContact CG-O 3.28Å; Q52-Y322 WeakPolarHBondContact CG-O 3.19Å; Q52-Y322 PolarHBondContact NE2-O 3.3Å; Q52-M324 PolarHBondContact NE2-O 2.92Å
53	E	84.8	Confident	82.5	Confident	25 Å²	25	35.1 Å²	35.1	12%	0.117	18%	0.176	C	C	.	.	H	α-helix	trans	-59.9	-45.2	173.1	-69.1	176.6	-170.6	0	0	110.8	L49 K50 Y56 H57 L207	L49-E53 HydrophobicContact CD2-CG 4.15Å; L49-E53 WeakPolarHBondContact CD2-OE1 3.28Å; L49-E53 PolarHBondContact O-N 2.74Å; K50-E53 WeakPolarHBondContact CD-OE2 3.26Å; K50-E53 IonicContact NZ-OE1 2.71Å; K50-E53 PolarHBondContact NZ-OE1 3.43Å; K50-E53 IonicContact NZ-OE2 2.77Å; K50-E53 PolarHBondContact NZ-OE2 3.41Å; K50-E53 WeakPolarHBondContact O-CB 3.31Å; K50-E53 PolarHBondContact O-N 3.15Å; E53-Y56 PolarHBondContact O-N 3.48Å; E53-H57 PolarHBondContact O-CD2 2.81Å; E53-H57 PolarHBondContact O-N 3.03Å; E53-H57 VanDerWaalsContact O-N 3.1Å; E53-L207 HydrophobicContact CG-CD2 4.33Å
54	T	87.4	Confident	81.9	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.5	-47.6	177.7	65.5	0	0	0	0	111	K50 L51 Q52 Y56 H57 E58 V424	K50-T54 WeakPolarHBondContact O-CG2 3.34Å; K50-T54 PolarHBondContact O-N 3.21Å; L51-T54 WeakPolarHBondContact CA-OG1 3.33Å; L51-T54 PolarHBondContact O-N 2.91Å; L51-T54 PolarHBondContact O-OG1 3.11Å; Q52-T54 VanDerWaalsContact C-N 3.34Å; T54-Y56 VanDerWaalsContact C-N 3.35Å; T54-Y56 PolarHBondContact O-N 3.28Å; T54-H57 PolarHBondContact O-N 3.49Å; T54-E58 PolarHBondContact O-N 3.28Å; T54-V424 HydrophobicContact CG2-CB 4.46Å; T54-V424 HydrophobicContact CG2-CG2 3.67Å
55	A	87.9	Confident	81.4	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.2	-41.7	-178.7	0	0	0	0	0	111.8	L51 Q52 E58 L59 L319 Y322	L51-A55 VanDerWaalsContact O-CB 3.29Å; L51-A55 WeakPolarHBondContact O-CB 2.88Å; L51-A55 PolarHBondContact O-N 2.97Å; Q52-A55 PolarHBondContact O-N 2.61Å; A55-E58 PolarHBondContact O-N 2.73Å; A55-L59 WeakPolarHBondContact O-CB 3.43Å; A55-L59 VanDerWaalsContact O-CG 3.28Å; A55-L59 WeakPolarHBondContact O-CG 3.42Å; A55-L59 PolarHBondContact O-N 3.19Å; A55-L319 HydrophobicContact CB-CB 4.48Å; A55-L319 HydrophobicContact CB-CD2 4.15Å; A55-Y322 HydrophobicContact CB-CD2 4.48Å
56	Y	86.6	Confident	80.6	Confident	44 Å²	44	39.3 Å²	39.3	17%	0.173	20%	0.202	C	C	.	.	H	α-helix	trans	-58.1	-49.9	174.7	175.8	-100.9	0	0	0	111.7	Q52 E53 T54 E58 L59 V60 L65 F68 P70 L207	Q52-Y56 VanDerWaalsContact O-CB 3.32Å; Q52-Y56 WeakPolarHBondContact O-CB 3.43Å; Q52-Y56 PolarHBondContact O-N 3.33Å; E53-Y56 PolarHBondContact O-N 3.48Å; T54-Y56 VanDerWaalsContact C-N 3.35Å; T54-Y56 PolarHBondContact O-N 3.28Å; Y56-E58 VanDerWaalsContact C-N 3.35Å; Y56-E58 PolarHBondContact O-N 3.14Å; Y56-L59 PolarHBondContact O-N 3.37Å; Y56-V60 HydrophobicContact CD1-CG2 4.41Å; Y56-V60 HydrophobicContact CD2-CG2 4.31Å; Y56-V60 HydrophobicContact CE1-CG2 3.98Å; Y56-V60 HydrophobicContact CE2-CG2 3.87Å; Y56-V60 VanDerWaalsContact O-CG2 3.29Å; Y56-V60 WeakPolarHBondContact O-CG2 3.19Å; Y56-V60 PolarHBondContact O-N 3.22Å; Y56-L65 HydrophobicContact CD2-CD1 3.7Å; Y56-L65 HydrophobicContact CE2-CD1 4.01Å; Y56-F68 HydrophobicContact CD2-CD1 4.27Å; Y56-F68 HydrophobicContact CD2-CE1 4.05Å; Y56-F68 AromaticContact CE2-CD1 3.86Å; Y56-F68 HydrophobicContact CE2-CD1 3.86Å; Y56-F68 AromaticContact CE2-CE1 3.88Å; Y56-F68 HydrophobicContact CE2-CE1 3.88Å; Y56-P70 HydrophobicContact CE2-CG 4.31Å; Y56-P70 WeakPolarHBondContact OH-CD 3.03Å; Y56-P70 WeakPolarHBondContact OH-CG 3.4Å; Y56-L207 HydrophobicContact CD2-CD1 3.89Å; Y56-L207 HydrophobicContact CE2-CD1 4.42Å; Y56-L207 HydrophobicContact CG-CD1 4.04Å
57	H	84.9	Confident	79.6	Confident	100 Å²	100	42.4 Å²	42.4	46%	0.463	22%	0.217	S	C	.	.	H	α-helix	trans	-62.7	-39.8	179.3	-74.7	-62.6	0	0	0	112.8	E53 T54 A61 R427	E53-H57 PolarHBondContact O-CD2 2.81Å; E53-H57 PolarHBondContact O-N 3.03Å; E53-H57 VanDerWaalsContact O-N 3.1Å; T54-H57 PolarHBondContact O-N 3.49Å; H57-A61 WeakPolarHBondContact O-CB 3.42Å; H57-A61 PolarHBondContact O-N 3.5Å; H57-R427 PolarHBondContact CD2-NH2 3.32Å
58	E	86.2	Confident	78.6	Confident	45 Å²	45	42.2 Å²	42.2	21%	0.21	22%	0.215	C	C	.	.	H	α-helix	trans	-66.4	-43.6	176.2	-75.7	-162.6	-162.7	0	0	112.5	T54 A55 Y56 V60 A61 R62 L319	T54-E58 PolarHBondContact O-N 3.28Å; A55-E58 PolarHBondContact O-N 2.73Å; Y56-E58 VanDerWaalsContact C-N 3.35Å; Y56-E58 PolarHBondContact O-N 3.14Å; E58-V60 VanDerWaalsContact C-N 3.34Å; E58-V60 PolarHBondContact O-N 3.02Å; E58-A61 PolarHBondContact O-N 2.87Å; E58-R62 WeakPolarHBondContact O-CB 3.23Å; E58-R62 VanDerWaalsContact O-CG 3.31Å; E58-R62 WeakPolarHBondContact O-CG 3.26Å; E58-R62 PolarHBondContact O-N 3.18Å; E58-R62 IonicContact OE2-NH2 3.48Å; E58-R62 PolarHBondContact OE2-NH2 3.47Å; E58-L319 HydrophobicContact CB-CD1 4.03Å; E58-L319 HydrophobicContact CB-CD2 4.36Å
59	L	85.4	Confident	77.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.1	-36.1	178.8	-75.1	170.3	0	0	0	112.4	A55 Y56 R62 H63 F64 L65 L319 L320 L323	A55-L59 WeakPolarHBondContact O-CB 3.43Å; A55-L59 VanDerWaalsContact O-CG 3.28Å; A55-L59 WeakPolarHBondContact O-CG 3.42Å; A55-L59 PolarHBondContact O-N 3.19Å; Y56-L59 PolarHBondContact O-N 3.37Å; L59-R62 PolarHBondContact O-N 3.42Å; L59-H63 PolarHBondContact O-N 3.09Å; L59-F64 HydrophobicContact CD2-CB 3.95Å; L59-F64 HydrophobicContact CD2-CG 4.41Å; L59-F64 PolarHBondContact O-N 2.97Å; L59-L65 HydrophobicContact CB-CD1 3.38Å; L59-L65 HydrophobicContact CB-CG 3.75Å; L59-L65 HydrophobicContact CD1-CD1 3.98Å; L59-L65 HydrophobicContact CD1-CG 4.4Å; L59-L65 HydrophobicContact CG-CD1 4.34Å; L59-L319 HydrophobicContact CD1-CB 4.01Å; L59-L319 HydrophobicContact CD2-CB 3.78Å; L59-L319 HydrophobicContact CD2-CD1 4.06Å; L59-L319 HydrophobicContact CG-CB 3.77Å; L59-L319 HydrophobicContact CG-CD1 4.21Å; L59-L320 HydrophobicContact CD1-CD2 3.83Å; L59-L320 HydrophobicContact CD1-CG 4.32Å; L59-L320 HydrophobicContact CD2-CD2 4.44Å; L59-L320 HydrophobicContact CD2-CG 4.44Å; L59-L323 HydrophobicContact CD1-CD2 4.09Å
60	V	83.8	Confident	76.1	Confident	65 Å²	65	46.8 Å²	46.8	39%	0.394	24%	0.236	S	C	.	.	H	α-helix	trans	-64.6	-46.5	172.1	170.7	0	0	0	0	110.6	Y56 E58 R62 H63 L65	Y56-V60 HydrophobicContact CD1-CG2 4.41Å; Y56-V60 HydrophobicContact CD2-CG2 4.31Å; Y56-V60 HydrophobicContact CE1-CG2 3.98Å; Y56-V60 HydrophobicContact CE2-CG2 3.87Å; Y56-V60 VanDerWaalsContact O-CG2 3.29Å; Y56-V60 WeakPolarHBondContact O-CG2 3.19Å; Y56-V60 PolarHBondContact O-N 3.22Å; E58-V60 VanDerWaalsContact C-N 3.34Å; E58-V60 PolarHBondContact O-N 3.02Å; V60-R62 PolarHBondContact O-N 2.81Å; V60-H63 PolarHBondContact O-N 2.81Å; V60-L65 HydrophobicContact CG2-CB 4.18Å; V60-L65 HydrophobicContact CG2-CD1 4.1Å
61	A	83.3	Confident	74.3	Confident	74 Å²	74	52 Å²	52	61%	0.612	27%	0.265	S	S	*	.	H	α-helix	trans	-60.4	-35.9	177.8	0	0	0	0	0	112.4	H57 E58 H63	H57-A61 WeakPolarHBondContact O-CB 3.42Å; H57-A61 PolarHBondContact O-N 3.5Å; E58-A61 PolarHBondContact O-N 2.87Å; A61-H63 VanDerWaalsContact C-N 3.26Å; A61-H63 PolarHBondContact O-N 2.82Å; A61-H63 PolarHBondContact O-ND1 2.77Å; A61-H63 VanDerWaalsContact O-ND1 3.13Å
62	R	80.4	Confident	72.3	Confident	98 Å²	98	60.6 Å²	60.6	37%	0.37	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	5.2	175.8	-64.9	180	-168.5	-160.5	9.5	114	E58 L59 V60 F64 S315	E58-R62 WeakPolarHBondContact O-CB 3.23Å; E58-R62 VanDerWaalsContact O-CG 3.31Å; E58-R62 WeakPolarHBondContact O-CG 3.26Å; E58-R62 PolarHBondContact O-N 3.18Å; E58-R62 IonicContact OE2-NH2 3.48Å; E58-R62 PolarHBondContact OE2-NH2 3.47Å; L59-R62 PolarHBondContact O-N 3.42Å; V60-R62 PolarHBondContact O-N 2.81Å; R62-F64 HydrophobicContact CB-CD2 3.48Å; R62-F64 VanDerWaalsContact CB-CD2 3.48Å; R62-F64 HydrophobicContact CB-CE2 3.82Å; R62-F64 WeakPolarHBondContact O-CD2 3.33Å; R62-F64 PolarHBondContact O-N 3.22Å; R62-S315 PolarHBondContact NH1-OG 3.37Å
63	H	72.8	Confident	70.3	Confident	153 Å²	153	61.5 Å²	61.5	71%	0.708	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	17.6	179.8	-59.6	72.7	0	0	0	115.8	L59 V60 A61 L65	L59-H63 PolarHBondContact O-N 3.09Å; V60-H63 PolarHBondContact O-N 2.81Å; A61-H63 VanDerWaalsContact C-N 3.26Å; A61-H63 PolarHBondContact O-N 2.82Å; A61-H63 PolarHBondContact O-ND1 2.77Å; A61-H63 VanDerWaalsContact O-ND1 3.13Å; H63-L65 VanDerWaalsContact C-N 3.34Å
64	F	68.3	Low	68.1	Low	33 Å²	33	66.2 Å²	66.2	15%	0.145	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-17.8	178.7	-80.5	-76.9	0	0	0	114.3	L59 R62 S301 L304 L308 A316	L59-F64 HydrophobicContact CD2-CB 3.95Å; L59-F64 HydrophobicContact CD2-CG 4.41Å; L59-F64 PolarHBondContact O-N 2.97Å; R62-F64 HydrophobicContact CB-CD2 3.48Å; R62-F64 VanDerWaalsContact CB-CD2 3.48Å; R62-F64 HydrophobicContact CB-CE2 3.82Å; R62-F64 WeakPolarHBondContact O-CD2 3.33Å; R62-F64 PolarHBondContact O-N 3.22Å; F64-S301 PolarHBondContact O-OG 3.43Å; F64-L304 HydrophobicContact CD1-CB 4.47Å; F64-L308 HydrophobicContact CE1-CD1 3.45Å; F64-L308 VanDerWaalsContact CE1-CD1 3.45Å; F64-L308 HydrophobicContact CE1-CD2 3.86Å; F64-L308 HydrophobicContact CE1-CG 4.02Å; F64-L308 HydrophobicContact CE2-CD1 4.39Å; F64-L308 HydrophobicContact CZ-CD1 3.27Å; F64-L308 HydrophobicContact CZ-CD2 3.58Å; F64-L308 HydrophobicContact CZ-CG 3.97Å; F64-A316 HydrophobicContact CZ-CB 4.42Å
65	L	62.6	Low	65.8	Low	9 Å²	9	70.9 Å²	70.9	5%	0.047	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	28.4	-178.6	-68.5	172.6	0	0	0	112.6	Y56 L59 V60 H63 E67 F68 L298 S301 L323	Y56-L65 HydrophobicContact CD2-CD1 3.7Å; Y56-L65 HydrophobicContact CE2-CD1 4.01Å; L59-L65 HydrophobicContact CB-CD1 3.38Å; L59-L65 HydrophobicContact CB-CG 3.75Å; L59-L65 HydrophobicContact CD1-CD1 3.98Å; L59-L65 HydrophobicContact CD1-CG 4.4Å; L59-L65 HydrophobicContact CG-CD1 4.34Å; V60-L65 HydrophobicContact CG2-CB 4.18Å; V60-L65 HydrophobicContact CG2-CD1 4.1Å; H63-L65 VanDerWaalsContact C-N 3.34Å; L65-E67 PolarHBondContact O-N 2.75Å; L65-F68 HydrophobicContact CB-CB 4.1Å; L65-F68 HydrophobicContact CD1-CD1 4.25Å; L65-F68 HydrophobicContact CD2-CB 3.56Å; L65-F68 HydrophobicContact CD2-CD1 3.93Å; L65-F68 HydrophobicContact CD2-CG 3.9Å; L65-F68 HydrophobicContact CG-CB 4.36Å; L65-F68 PolarHBondContact O-N 2.86Å; L65-F68 VanDerWaalsContact O-N 3.1Å; L65-L298 HydrophobicContact CD2-CD2 4.26Å; L65-S301 WeakPolarHBondContact CD2-OG 3.03Å; L65-L323 HydrophobicContact CD1-CD2 4.17Å; L65-L323 HydrophobicContact CD2-CD2 4.31Å
66	S	56.4	Low	63.5	Low	74 Å²	74	75 Å²	75	52%	0.517	39%	0.387	S	S	.	.	S	Bend	trans	-54.1	-24	-178.3	52.8	0	0	0	0	114.3
67	E	55.1	Low	61.2	Low	78 Å²	78	80.3 Å²	80.3	36%	0.364	42%	0.419	S	S	.	.	S	Bend	trans	-106.2	-21.7	178.4	-72.8	162.6	-161.8	0	0	114.2	L65 K69 K390	L65-E67 PolarHBondContact O-N 2.75Å; E67-K69 PolarHBondContact O-N 3.43Å; E67-K69 VanDerWaalsContact O-N 3.16Å; E67-K390 WeakPolarHBondContact OE1-CE 3.43Å; E67-K390 IonicContact OE1-NZ 2.72Å; E67-K390 PolarHBondContact OE1-NZ 3.37Å
68	F	59.8	Low	59.5	Low	21 Å²	21	79.4 Å²	79.4	9%	0.092	41%	0.411	C	S	.	.			trans	-80.6	100.5	-179.3	179.3	-97.5	0	0	0	109.7	Y56 L65 I203 L207 D297 L298 L323	Y56-F68 HydrophobicContact CD2-CD1 4.27Å; Y56-F68 HydrophobicContact CD2-CE1 4.05Å; Y56-F68 AromaticContact CE2-CD1 3.86Å; Y56-F68 HydrophobicContact CE2-CD1 3.86Å; Y56-F68 AromaticContact CE2-CE1 3.88Å; Y56-F68 HydrophobicContact CE2-CE1 3.88Å; L65-F68 HydrophobicContact CB-CB 4.1Å; L65-F68 HydrophobicContact CD1-CD1 4.25Å; L65-F68 HydrophobicContact CD2-CB 3.56Å; L65-F68 HydrophobicContact CD2-CD1 3.93Å; L65-F68 HydrophobicContact CD2-CG 3.9Å; L65-F68 HydrophobicContact CG-CB 4.36Å; L65-F68 PolarHBondContact O-N 2.86Å; L65-F68 VanDerWaalsContact O-N 3.1Å; F68-I203 HydrophobicContact CZ-CB 4.23Å; F68-I203 HydrophobicContact CZ-CG2 3.82Å; F68-L207 HydrophobicContact CE1-CD1 4.37Å; F68-D297 HydrophobicContact CD2-CB 4.01Å; F68-D297 WeakPolarHBondContact CD2-O 3.49Å; F68-D297 HydrophobicContact CE2-CB 3.73Å; F68-L298 HydrophobicContact CD2-CD2 3.97Å; F68-L298 HydrophobicContact CE2-CD2 4.03Å; F68-L298 HydrophobicContact CG-CD2 4.37Å; F68-L298 HydrophobicContact CZ-CD2 4.47Å; F68-L323 HydrophobicContact CE1-CD2 4.43Å
69	K	56.5	Low	57.2	Low	117 Å²	117	81.1 Å²	81.1	51%	0.509	43%	0.427	S	S	.	.			trans	-100.1	116.6	173.9	-66.4	-175	178	-173.4	0	109	E67 D71 R72	E67-K69 PolarHBondContact O-N 3.43Å; E67-K69 VanDerWaalsContact O-N 3.16Å; K69-D71 PolarHBondContact O-N 3.31Å; K69-D71 VanDerWaalsContact O-N 3.13Å; K69-R72 HydrophobicContact CB-CB 4.12Å; K69-R72 HydrophobicContact CB-CG 4.13Å; K69-R72 WeakPolarHBondContact O-CB 2.83Å; K69-R72 PolarHBondContact O-N 3.21Å
70	P	55.8	Low	55.3	Low	15 Å²	15	86.1 Å²	86.1	10%	0.097	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-59.7	-26	176.9	25.4	-34.3	0	0	0	112	Y56 R72 A73 L207	Y56-P70 HydrophobicContact CE2-CG 4.31Å; Y56-P70 WeakPolarHBondContact OH-CD 3.03Å; Y56-P70 WeakPolarHBondContact OH-CG 3.4Å; P70-R72 VanDerWaalsContact C-N 3.34Å; P70-A73 VanDerWaalsContact O-CB 3.3Å; P70-A73 WeakPolarHBondContact O-CB 3.18Å; P70-A73 PolarHBondContact O-N 3.17Å; P70-L207 HydrophobicContact CB-CD1 4.5Å
71	D	46.4	Very low	53.8	Low	127 Å²	127	84.9 Å²	84.9	68%	0.679	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-74.9	-19.2	177.2	-52.5	-37	0	0	0	113.7	K69 A73	K69-D71 PolarHBondContact O-N 3.31Å; K69-D71 VanDerWaalsContact O-N 3.13Å; D71-A73 VanDerWaalsContact C-N 3.26Å
72	R	44.9	Very low	52.3	Low	183 Å²	183	84.3 Å²	84.3	69%	0.691	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-82.3	-2.7	172	-85.1	-173.3	174.9	177.8	-1.8	113.1	K69 P70 L74	K69-R72 HydrophobicContact CB-CB 4.12Å; K69-R72 HydrophobicContact CB-CG 4.13Å; K69-R72 WeakPolarHBondContact O-CB 2.83Å; K69-R72 PolarHBondContact O-N 3.21Å; P70-R72 VanDerWaalsContact C-N 3.34Å; R72-L74 PolarHBondContact O-N 3.37Å
73	A	46.1	Very low	50.9	Low	30 Å²	30	86 Å²	86	25%	0.248	44%	0.444	C	S	.	.			trans	-67.7	72.5	159.6	0	0	0	0	0	107.5	P70 D71	P70-A73 VanDerWaalsContact O-CB 3.3Å; P70-A73 WeakPolarHBondContact O-CB 3.18Å; P70-A73 PolarHBondContact O-N 3.17Å; D71-A73 VanDerWaalsContact C-N 3.26Å
74	L	38.7	Very low	50.1	Low	125 Å²	125	83.3 Å²	83.3	65%	0.654	43%	0.431	S	S	*	.			trans	-44.9	142.8	168.6	-114.5	82.1	0	0	0	106	R72 T76	R72-L74 PolarHBondContact O-N 3.37Å; L74-T76 PolarHBondContact O-N 2.95Å
75	P	40.4	Very low	49.6	Very low	97 Å²	97	83 Å²	83	63%	0.63	43%	0.428	S	S	*	.			trans	-57.8	89.5	149.7	27.5	-27	0	0	0	104	D77	P75-D77 PolarHBondContact O-N 3.09Å
76	T	39.1	Very low	49.2	Very low	87 Å²	87	85.7 Å²	85.7	53%	0.534	44%	0.44	S	S	.	.			trans	-47.5	123.4	149.1	6.6	0	0	0	0	101.6	L74 R78	L74-T76 PolarHBondContact O-N 2.95Å; T76-R78 WeakPolarHBondContact O-CG 3.46Å; T76-R78 PolarHBondContact O-N 2.99Å
77	D	37.8	Very low	49.2	Very low	155 Å²	155	85.7 Å²	85.7	83%	0.829	43%	0.433	S	S	*	.			trans	-42.9	97	169.6	-85.4	-40	0	0	0	106.8	P75 P79	P75-D77 PolarHBondContact O-N 3.09Å; D77-P79 HydrophobicContact CB-CG 4.41Å; D77-P79 WeakPolarHBondContact O-CD 3.34Å
78	R	48.9	Very low	49.2	Very low	81 Å²	81	82.9 Å²	82.9	31%	0.306	42%	0.421	S	S	.	.			trans	-105.7	43.2	168.6	-69.9	-175.5	-177.3	-159.1	-0.7	106.6	T76 N80 S200	T76-R78 WeakPolarHBondContact O-CG 3.46Å; T76-R78 PolarHBondContact O-N 2.99Å; R78-N80 PolarHBondContact O-N 3.19Å; R78-S200 PolarHBondContact NH1-O 3.38Å
79	P	38.2	Very low	48.9	Very low	82 Å²	82	82.4 Å²	82.4	53%	0.532	42%	0.419	S	S	.	.			trans	-63.5	129.1	168.5	32.9	-31.9	0	0	0	104.6	D77 T81	D77-P79 HydrophobicContact CB-CG 4.41Å; D77-P79 WeakPolarHBondContact O-CD 3.34Å; P79-T81 PolarHBondContact O-N 3.35Å
80	N	46.4	Very low	48.8	Very low	105 Å²	105	81.2 Å²	81.2	56%	0.561	41%	0.411	S	S	*	.	S	Bend	trans	85.5	-3.7	160.8	-40.5	-20	0	0	0	118	R78 K84	R78-N80 PolarHBondContact O-N 3.19Å; N80-K84 WeakPolarHBondContact O-CA 3.43Å; N80-K84 WeakPolarHBondContact O-CB 3.46Å; N80-K84 PolarHBondContact O-N 2.93Å
81	T	52.7	Low	48.7	Very low	38 Å²	38	83.2 Å²	83.2	23%	0.233	43%	0.434	C	S	.	.	H	α-helix	trans	-71.4	-48	175.3	25.3	0	0	0	0	112.7	P79 K84 W85	P79-T81 PolarHBondContact O-N 3.35Å; T81-K84 CarbonylContact O-C 3.57Å; T81-K84 PolarHBondContact O-N 2.87Å; T81-W85 WeakPolarHBondContact O-CB 3.29Å; T81-W85 PolarHBondContact O-N 3.1Å
82	L	50.1	Low	48.7	Very low	63 Å²	63	81.7 Å²	81.7	33%	0.33	42%	0.423	S	S	.	.	H	α-helix	trans	-65.3	-45.2	177.8	-85	165.9	0	0	0	112	K84 W85 F86 S197	L82-K84 VanDerWaalsContact C-N 3.34Å; L82-W85 HydrophobicContact CD2-CE3 3.85Å; L82-W85 HydrophobicContact CD2-CZ3 4.17Å; L82-W85 PolarHBondContact O-N 2.96Å; L82-F86 HydrophobicContact CD2-CE2 4.49Å; L82-F86 WeakPolarHBondContact O-CD2 3.47Å; L82-F86 PolarHBondContact O-N 3.03Å; L82-S197 WeakPolarHBondContact CD2-O 3.35Å
83	E	52	Low	48.7	Very low	132 Å²	132	75.6 Å²	75.6	62%	0.617	40%	0.404	S	S	*	.	H	α-helix	trans	-63.8	-39.8	175.8	-70.3	-175.3	166.6	0	0	111.6	F86 L87	E83-F86 CarbonylContact O-C 3.59Å; E83-F86 PolarHBondContact O-N 3.33Å; E83-L87 WeakPolarHBondContact O-CB 3.43Å; E83-L87 WeakPolarHBondContact O-CG 3.31Å; E83-L87 PolarHBondContact O-N 3.17Å
84	K	55.5	Low	48.6	Very low	98 Å²	98	86 Å²	86	43%	0.426	44%	0.437	S	S	.	.	H	α-helix	trans	-63.9	-40.3	171.5	-174.6	176.3	-174.8	178.8	0	112	N80 T81 L82 F86 L87 M88	N80-K84 WeakPolarHBondContact O-CA 3.43Å; N80-K84 WeakPolarHBondContact O-CB 3.46Å; N80-K84 PolarHBondContact O-N 2.93Å; T81-K84 CarbonylContact O-C 3.57Å; T81-K84 PolarHBondContact O-N 2.87Å; L82-K84 VanDerWaalsContact C-N 3.34Å; K84-F86 VanDerWaalsContact C-N 3.34Å; K84-L87 CarbonylContact O-C 3.6Å; K84-L87 PolarHBondContact O-N 2.99Å; K84-M88 HydrophobicContact CG-CG 4.42Å; K84-M88 WeakPolarHBondContact O-CB 3.43Å; K84-M88 WeakPolarHBondContact O-CG 3.36Å; K84-M88 PolarHBondContact O-N 3.44Å
85	W	57.7	Low	48.7	Very low	26 Å²	26	84.2 Å²	84.2	10%	0.098	44%	0.44	C	S	.	.	H	α-helix	trans	-64.1	-40.8	173.9	-63.5	-7.8	0	0	0	111.2	T81 L82 L87 M88 L89 E106 E107 V110 S200	T81-W85 WeakPolarHBondContact O-CB 3.29Å; T81-W85 PolarHBondContact O-N 3.1Å; L82-W85 HydrophobicContact CD2-CE3 3.85Å; L82-W85 HydrophobicContact CD2-CZ3 4.17Å; L82-W85 PolarHBondContact O-N 2.96Å; W85-L87 VanDerWaalsContact C-N 3.35Å; W85-M88 PolarHBondContact O-N 3.01Å; W85-L89 VanDerWaalsContact O-CB 3.26Å; W85-L89 WeakPolarHBondContact O-CB 3.34Å; W85-L89 WeakPolarHBondContact O-CD1 3.34Å; W85-L89 VanDerWaalsContact O-CG 3.23Å; W85-L89 WeakPolarHBondContact O-CG 3.12Å; W85-L89 PolarHBondContact O-N 3.34Å; W85-E106 HydrophobicContact CH2-CB 3.95Å; W85-E107 HydrophobicContact CZ2-CG 3.54Å; W85-V110 HydrophobicContact CB-CG1 4.31Å; W85-V110 HydrophobicContact CD2-CG2 4.27Å; W85-V110 HydrophobicContact CE3-CG2 4.07Å; W85-V110 HydrophobicContact CG-CG1 4.27Å; W85-V110 HydrophobicContact CZ3-CG2 4.36Å; W85-S200 VanDerWaalsContact CH2-CB 3.44Å; W85-S200 WeakPolarHBondContact CZ3-OG 3.36Å
86	F	55.3	Low	49.3	Very low	66 Å²	66	80.9 Å²	80.9	29%	0.289	42%	0.421	S	S	.	.	H	α-helix	trans	-62.9	-40.5	172.3	-79.8	-64.1	0	0	0	111.7	L82 E83 K84 R90 L194	L82-F86 HydrophobicContact CD2-CE2 4.49Å; L82-F86 WeakPolarHBondContact O-CD2 3.47Å; L82-F86 PolarHBondContact O-N 3.03Å; E83-F86 CarbonylContact O-C 3.59Å; E83-F86 PolarHBondContact O-N 3.33Å; K84-F86 VanDerWaalsContact C-N 3.34Å; F86-R90 WeakPolarHBondContact O-CB 3.49Å; F86-R90 PolarHBondContact O-N 3.19Å; F86-L194 HydrophobicContact CE1-CD2 4.25Å
87	L	56.2	Low	50.3	Low	73 Å²	73	80.4 Å²	80.4	38%	0.382	42%	0.421	S	S	.	.	H	α-helix	trans	-65.9	-41.1	175.2	-72.1	165	0	0	0	112	E83 K84 W85 R90 G91 Q92	E83-L87 WeakPolarHBondContact O-CB 3.43Å; E83-L87 WeakPolarHBondContact O-CG 3.31Å; E83-L87 PolarHBondContact O-N 3.17Å; K84-L87 CarbonylContact O-C 3.6Å; K84-L87 PolarHBondContact O-N 2.99Å; W85-L87 VanDerWaalsContact C-N 3.35Å; L87-R90 CarbonylContact O-C 3.6Å; L87-R90 PolarHBondContact O-N 3.46Å; L87-G91 PolarHBondContact O-N 3.48Å; L87-G91 VanDerWaalsContact O-N 3.11Å; L87-Q92 HydrophobicContact CD2-CB 4.1Å; L87-Q92 PolarHBondContact O-N 2.9Å
88	M	55.5	Low	51.7	Low	19 Å²	19	74.8 Å²	74.8	9%	0.094	39%	0.391	C	S	.	.	H	α-helix	trans	-62.9	-49.6	174.2	-75.6	-66.2	-60.3	0	0	111.4	K84 W85 R90 G91 D93 A96 L98	K84-M88 HydrophobicContact CG-CG 4.42Å; K84-M88 WeakPolarHBondContact O-CB 3.43Å; K84-M88 WeakPolarHBondContact O-CG 3.36Å; K84-M88 PolarHBondContact O-N 3.44Å; W85-M88 PolarHBondContact O-N 3.01Å; M88-R90 PolarHBondContact O-N 3.49Å; M88-G91 PolarHBondContact O-N 2.86Å; M88-D93 HydrophobicContact SD-CB 3.84Å; M88-A96 HydrophobicContact CE-CB 3.47Å; M88-A96 VanDerWaalsContact CE-CB 3.47Å; M88-A96 HydrophobicContact CG-CB 4.42Å; M88-A96 HydrophobicContact SD-CB 3.42Å; M88-A96 WeakPolarHBondContact SD-CB 3.5Å; M88-L98 HydrophobicContact CE-CD2 3.84Å
89	L	53.5	Low	53.2	Low	11 Å²	11	76 Å²	76	6%	0.058	40%	0.398	C	S	.	.	H	α-helix	trans	-63	-29.9	175.9	-75.9	164	0	0	0	112.7	W85 G91 T114 K117 I193	W85-L89 VanDerWaalsContact O-CB 3.26Å; W85-L89 WeakPolarHBondContact O-CB 3.34Å; W85-L89 WeakPolarHBondContact O-CD1 3.34Å; W85-L89 VanDerWaalsContact O-CG 3.23Å; W85-L89 WeakPolarHBondContact O-CG 3.12Å; W85-L89 PolarHBondContact O-N 3.34Å; L89-G91 VanDerWaalsContact C-N 3.27Å; L89-T114 HydrophobicContact CD2-CG2 3.69Å; L89-T114 HydrophobicContact CG-CG2 4.11Å; L89-K117 PolarHBondContact O-NZ 3.23Å; L89-I193 HydrophobicContact CD1-CG2 3.56Å; L89-I193 HydrophobicContact CD2-CD1 4.29Å; L89-I193 HydrophobicContact CD2-CG1 4.32Å; L89-I193 HydrophobicContact CD2-CG2 3.53Å; L89-I193 HydrophobicContact CG-CG2 4.14Å
90	R	53.4	Low	55.3	Low	93 Å²	93	72.5 Å²	72.5	35%	0.351	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-4.2	175.4	-164.7	-175.5	-88.9	-167.6	-1	112.4	F86 L87 M88 Q92 F154	F86-R90 WeakPolarHBondContact O-CB 3.49Å; F86-R90 PolarHBondContact O-N 3.19Å; L87-R90 CarbonylContact O-C 3.6Å; L87-R90 PolarHBondContact O-N 3.46Å; M88-R90 PolarHBondContact O-N 3.49Å; R90-Q92 VanDerWaalsContact C-N 3.26Å; R90-Q92 HydrophobicContact CB-CG 4.39Å; R90-Q92 HydrophobicContact CG-CG 4.11Å; R90-Q92 PolarHBondContact O-N 3.29Å; R90-F154 PolarHBondContact NH2-O 3.06Å
91	G	53	Low	57.2	Low	56 Å²	56	67.8 Å²	67.8	58%	0.577	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	20.8	179.9	0	0	0	0	0	114	L87 M88 L89	L87-G91 PolarHBondContact O-N 3.48Å; L87-G91 VanDerWaalsContact O-N 3.11Å; M88-G91 PolarHBondContact O-N 2.86Å; L89-G91 VanDerWaalsContact C-N 3.27Å
92	Q	47	Very low	58.6	Low	95 Å²	95	68 Å²	68	44%	0.444	36%	0.36	S	S	.	.			trans	-88.4	-17.6	-178.8	-70	-166.5	-71.8	0	0	113.4	L87 R90	L87-Q92 HydrophobicContact CD2-CB 4.1Å; L87-Q92 PolarHBondContact O-N 2.9Å; R90-Q92 VanDerWaalsContact C-N 3.26Å; R90-Q92 HydrophobicContact CB-CG 4.39Å; R90-Q92 HydrophobicContact CG-CG 4.11Å; R90-Q92 PolarHBondContact O-N 3.29Å
93	D	45.5	Very low	60.2	Low	55 Å²	55	66.3 Å²	66.3	29%	0.294	35%	0.351	S	S	.	.			trans	-114.6	118.4	177	-165	-2.1	0	0	0	109.8	M88 A95	M88-D93 HydrophobicContact SD-CB 3.84Å; D93-A95 PolarHBondContact OD1-N 3.45Å; D93-A95 VanDerWaalsContact OD1-N 3.15Å
94	R	44.3	Very low	61.7	Low	250 Å²	250	62.3 Å²	62.3	94%	0.943	33%	0.33	S	S	*	.			trans	-92.3	-2.4	179.3	-71.9	-174.8	176.9	-177.1	-1.8	112.4
95	A	40.5	Very low	63.1	Low	86 Å²	86	57.6 Å²	57.6	71%	0.711	31%	0.31	S	S	*	.			trans	-112.5	8.6	-163	0	0	0	0	0	115.8	D93 S97	D93-A95 PolarHBondContact OD1-N 3.45Å; D93-A95 VanDerWaalsContact OD1-N 3.15Å; A95-S97 PolarHBondContact O-N 3.06Å
96	A	52.8	Low	64.1	Low	27 Å²	27	57.5 Å²	57.5	22%	0.223	31%	0.31	C	S	.	.			trans	-84.8	116.4	169.6	0	0	0	0	0	109.6	M88 L98	M88-A96 HydrophobicContact CE-CB 3.47Å; M88-A96 VanDerWaalsContact CE-CB 3.47Å; M88-A96 HydrophobicContact CG-CB 4.42Å; M88-A96 HydrophobicContact SD-CB 3.42Å; M88-A96 WeakPolarHBondContact SD-CB 3.5Å; A96-L98 PolarHBondContact O-N 3.48Å
97	S	59.1	Low	65.1	Low	77 Å²	77	56.1 Å²	56.1	54%	0.538	31%	0.305	S	S	.	.			trans	-55.5	112.9	165.6	59.1	0	0	0	0	108.3	A95 K99	A95-S97 PolarHBondContact O-N 3.06Å; S97-K99 PolarHBondContact O-N 3.18Å
98	L	68.3	Low	66.3	Low	38 Å²	38	52.8 Å²	52.8	20%	0.199	29%	0.287	C	S	.	.			trans	-73.9	53.7	-179.6	-64.4	168.4	0	0	0	110.8	M88 A96 N111 R115 D262	M88-L98 HydrophobicContact CE-CD2 3.84Å; A96-L98 PolarHBondContact O-N 3.48Å; L98-N111 HydrophobicContact CD2-CB 4.11Å; L98-R115 HydrophobicContact CD1-CG 3.78Å; L98-R115 PolarHBondContact O-NH1 3.05Å; L98-D262 VanDerWaalsContact O-O 3.07Å
99	K	79.4	Confident	67.4	Low	105 Å²	105	52.3 Å²	52.3	46%	0.457	29%	0.285	S	S	.	.			trans	-65	154.8	-179.4	-64.3	-176.6	178.6	-171.6	0	110.5	S97 I103 N111	S97-K99 PolarHBondContact O-N 3.18Å; K99-I103 HydrophobicContact CB-CG2 4.43Å; K99-I103 WeakPolarHBondContact O-CD1 3.24Å; K99-N111 PolarHBondContact O-ND2 3.05Å
100	T	82.6	Confident	68.4	Low	9 Å²	9	52.1 Å²	52.1	6%	0.055	29%	0.285	C	S	.	.			trans	-108.1	-35	169.4	48.1	0	0	0	0	111.3	V108 F261 D262	T100-V108 VanDerWaalsContact O-CG2 3.29Å; T100-V108 WeakPolarHBondContact O-CG2 3.23Å; T100-F261 VanDerWaalsContact CG2-O 3.29Å; T100-F261 WeakPolarHBondContact CG2-O 3.41Å; T100-F261 PolarHBondContact OG1-O 3.37Å; T100-D262 PolarHBondContact N-OD1 3.47Å; T100-D262 PolarHBondContact OG1-N 3.35Å; T100-D262 PolarHBondContact OG1-OD1 3.41Å
101	F	87	Confident	69.6	Low	6 Å²	6	48.7 Å²	48.7	3%	0.026	27%	0.273	C	S	.	.	S	Bend	trans	-93.6	152.3	-178.5	-65.8	-94.2	0	0	0	112.7	I103 I226 R258 F261 D262 L281 F285	F101-I103 PolarHBondContact O-N 2.91Å; F101-I226 HydrophobicContact CE1-CD1 3.8Å; F101-I226 HydrophobicContact CE2-CD1 3.81Å; F101-I226 HydrophobicContact CZ-CD1 3.17Å; F101-R258 HydrophobicContact CD1-CG 4.39Å; F101-R258 HydrophobicContact CD2-CG 3.57Å; F101-R258 HydrophobicContact CE1-CG 4.39Å; F101-R258 HydrophobicContact CE2-CB 4.09Å; F101-R258 HydrophobicContact CE2-CG 3.59Å; F101-R258 HydrophobicContact CG-CG 4Å; F101-R258 HydrophobicContact CZ-CB 4.27Å; F101-R258 HydrophobicContact CZ-CG 4Å; F101-F261 HydrophobicContact CE2-CB 3.85Å; F101-D262 PolarHBondContact N-OD1 2.85Å; F101-L281 HydrophobicContact CE1-CD1 4.15Å; F101-L281 HydrophobicContact CZ-CD1 3.64Å; F101-L281 HydrophobicContact CZ-CG 4.22Å; F101-F285 HydrophobicContact CD1-CB 4.36Å; F101-F285 HydrophobicContact CD1-CD2 4.22Å; F101-F285 HydrophobicContact CE1-CB 3.85Å; F101-F285 HydrophobicContact CE1-CD2 4.18Å
102	G	82.8	Confident	70.8	Confident	43 Å²	43	46.5 Å²	46.5	44%	0.443	25%	0.248	S	C	.	.	S	Bend	trans	71.4	7.4	174.3	0	0	0	0	0	116	E288	G102-E288 WeakPolarHBondContact CA-O 3.39Å
103	I	83.8	Confident	71.9	Confident	27 Å²	27	42.6 Å²	42.6	14%	0.138	23%	0.23	C	C	.	.	S	Bend	trans	-113.6	-179.5	178.8	60.5	164.9	0	0	0	110.9	K99 F101 E107 V108 N111 K290	K99-I103 HydrophobicContact CB-CG2 4.43Å; K99-I103 WeakPolarHBondContact O-CD1 3.24Å; F101-I103 PolarHBondContact O-N 2.91Å; I103-E107 HydrophobicContact CD1-CB 3.98Å; I103-V108 HydrophobicContact CD1-CB 4.39Å; I103-V108 HydrophobicContact CD1-CG2 3.67Å; I103-V108 HydrophobicContact CG1-CG2 3.56Å; I103-N111 WeakPolarHBondContact CD1-ND2 3.09Å; I103-K290 PolarHBondContact O-N 2.95Å
104	R	82.5	Confident	72.9	Confident	48 Å²	48	40.3 Å²	40.3	18%	0.181	22%	0.218	C	C	.	.			trans	-78.8	148.6	177.8	-65.8	-179.4	157	163.3	-3.3	111.3	E106 E107 V108 K290 D291	R104-E106 PolarHBondContact O-N 2.84Å; R104-E107 HydrophobicContact CB-CB 4.32Å; R104-E107 HydrophobicContact CB-CG 4.1Å; R104-E107 WeakPolarHBondContact O-CA 3.32Å; R104-E107 WeakPolarHBondContact O-CB 3.18Å; R104-E107 PolarHBondContact O-N 2.86Å; R104-V108 WeakPolarHBondContact O-CG2 3.33Å; R104-V108 PolarHBondContact O-N 3.04Å; R104-K290 HydrophobicContact CG-CB 4.17Å; R104-K290 HydrophobicContact CG-CD 4.03Å; R104-K290 HydrophobicContact CG-CG 4.45Å; R104-D291 WeakPolarHBondContact CD-OD2 3.47Å; R104-D291 IonicContact CZ-OD2 3.46Å; R104-D291 IonicContact NE-OD1 3.76Å; R104-D291 IonicContact NE-OD2 2.73Å; R104-D291 PolarHBondContact NE-OD2 3.24Å; R104-D291 IonicContact NH2-OD1 3.85Å; R104-D291 IonicContact NH2-OD2 3.57Å
105	L	84.5	Confident	74.2	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-55.3	-41	179.4	-175.2	63.6	0	0	0	112.3	E107 V108 L109 P224 F285 M289 L293 C327 H328	L105-E107 VanDerWaalsContact C-N 3.31Å; L105-E107 PolarHBondContact O-N 3.35Å; L105-V108 PolarHBondContact O-N 3.08Å; L105-L109 WeakPolarHBondContact O-CG 3.42Å; L105-L109 PolarHBondContact O-N 3.29Å; L105-P224 HydrophobicContact CD1-CG 3.34Å; L105-F285 HydrophobicContact CD1-CZ 4.28Å; L105-M289 HydrophobicContact CB-SD 4.38Å; L105-M289 HydrophobicContact CD1-SD 4.26Å; L105-L293 HydrophobicContact CD2-CD1 4.03Å; L105-C327 HydrophobicContact CD2-CB 4.21Å; L105-H328 HydrophobicContact CD2-CB 4.44Å
106	E	78.4	Confident	75.6	Confident	24 Å²	24	29.5 Å²	29.5	11%	0.112	16%	0.159	C	C	.	.	H	α-helix	trans	-65.9	-35.9	178	-54.5	83.3	176.6	0	0	111.9	W85 R104 V110 H328	W85-E106 HydrophobicContact CH2-CB 3.95Å; R104-E106 PolarHBondContact O-N 2.84Å; E106-V110 WeakPolarHBondContact O-CG2 3.3Å; E106-V110 PolarHBondContact O-N 3.27Å; E106-V110 VanDerWaalsContact O-N 3.14Å; E106-H328 IonicContact OE1-CD2 3.55Å; E106-H328 IonicContact OE1-CE1 4Å; E106-H328 IonicContact OE1-NE2 2.85Å; E106-H328 PolarHBondContact OE1-NE2 3.05Å
107	E	77.4	Confident	76.1	Confident	37 Å²	37	30 Å²	30	17%	0.173	16%	0.156	C	C	.	.	H	α-helix	trans	-70.7	-37.7	176.6	-67.5	173.4	-175.3	0	0	111.4	W85 I103 R104 L105 L109 V110 N111	W85-E107 HydrophobicContact CZ2-CG 3.54Å; I103-E107 HydrophobicContact CD1-CB 3.98Å; R104-E107 HydrophobicContact CB-CB 4.32Å; R104-E107 HydrophobicContact CB-CG 4.1Å; R104-E107 WeakPolarHBondContact O-CA 3.32Å; R104-E107 WeakPolarHBondContact O-CB 3.18Å; R104-E107 PolarHBondContact O-N 2.86Å; L105-E107 VanDerWaalsContact C-N 3.31Å; L105-E107 PolarHBondContact O-N 3.35Å; E107-L109 VanDerWaalsContact C-N 3.33Å; E107-L109 PolarHBondContact O-N 2.95Å; E107-V110 PolarHBondContact O-N 2.86Å; E107-N111 WeakPolarHBondContact O-CB 3.15Å; E107-N111 PolarHBondContact O-N 3.25Å; E107-N111 PolarHBondContact O-OD1 3.38Å
108	V	81.9	Confident	76.3	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.012	15%	0.154	C	C	.	.	H	α-helix	trans	-57	-48.6	173.7	180	0	0	0	0	110.3	T100 I103 R104 L105 V110 N111 E112 P224 F285	T100-V108 VanDerWaalsContact O-CG2 3.29Å; T100-V108 WeakPolarHBondContact O-CG2 3.23Å; I103-V108 HydrophobicContact CD1-CB 4.39Å; I103-V108 HydrophobicContact CD1-CG2 3.67Å; I103-V108 HydrophobicContact CG1-CG2 3.56Å; R104-V108 WeakPolarHBondContact O-CG2 3.33Å; R104-V108 PolarHBondContact O-N 3.04Å; L105-V108 PolarHBondContact O-N 3.08Å; V108-V110 PolarHBondContact O-N 2.88Å; V108-N111 PolarHBondContact O-N 3.26Å; V108-E112 WeakPolarHBondContact O-CB 3.36Å; V108-E112 PolarHBondContact O-N 3.17Å; V108-P224 HydrophobicContact CG1-CB 4.09Å; V108-F285 HydrophobicContact CG2-CE2 4.29Å; V108-F285 HydrophobicContact CG2-CZ 4.49Å
109	L	78.6	Confident	76	Confident	9 Å²	9	33.9 Å²	33.9	5%	0.047	16%	0.16	C	C	.	.	H	α-helix	trans	-63.3	-41	-179.8	-69	170.5	0	0	0	112.1	L105 E107 E112 L113 L196 Q222 P224 C327	L105-L109 WeakPolarHBondContact O-CG 3.42Å; L105-L109 PolarHBondContact O-N 3.29Å; E107-L109 VanDerWaalsContact C-N 3.33Å; E107-L109 PolarHBondContact O-N 2.95Å; L109-E112 PolarHBondContact O-N 3.43Å; L109-L113 VanDerWaalsContact O-CG 3.3Å; L109-L113 WeakPolarHBondContact O-CG 3.4Å; L109-L113 PolarHBondContact O-N 3.43Å; L109-L196 HydrophobicContact CD1-CD2 4.03Å; L109-Q222 HydrophobicContact CD1-CB 4.05Å; L109-P224 HydrophobicContact CD2-CB 4.4Å; L109-P224 HydrophobicContact CD2-CG 4.03Å; L109-P224 HydrophobicContact CG-CG 4.42Å; L109-C327 HydrophobicContact CD1-CB 3.75Å
110	V	73.3	Confident	75.1	Confident	8 Å²	8	32.5 Å²	32.5	5%	0.048	16%	0.156	C	C	.	.	H	α-helix	trans	-65.7	-41.2	175.3	173.4	0	0	0	0	111.2	W85 E106 E107 V108 E112 L113 T114	W85-V110 HydrophobicContact CB-CG1 4.31Å; W85-V110 HydrophobicContact CD2-CG2 4.27Å; W85-V110 HydrophobicContact CE3-CG2 4.07Å; W85-V110 HydrophobicContact CG-CG1 4.27Å; W85-V110 HydrophobicContact CZ3-CG2 4.36Å; E106-V110 WeakPolarHBondContact O-CG2 3.3Å; E106-V110 PolarHBondContact O-N 3.27Å; E106-V110 VanDerWaalsContact O-N 3.14Å; E107-V110 PolarHBondContact O-N 2.86Å; V108-V110 PolarHBondContact O-N 2.88Å; V110-E112 VanDerWaalsContact C-N 3.32Å; V110-E112 PolarHBondContact O-N 3.48Å; V110-L113 PolarHBondContact O-N 3.03Å; V110-T114 HydrophobicContact CG1-CG2 4.47Å; V110-T114 WeakPolarHBondContact O-CB 3.47Å; V110-T114 WeakPolarHBondContact O-CG2 3.49Å; V110-T114 PolarHBondContact O-N 3.48Å; V110-T114 PolarHBondContact O-OG1 2.79Å
111	N	79.2	Confident	73.6	Confident	20 Å²	20	35.9 Å²	35.9	11%	0.107	17%	0.173	C	C	.	.	H	α-helix	trans	-63.8	-38.1	175.9	-73.1	-8.1	0	0	0	111.8	L98 K99 I103 E107 V108 T114 R115	L98-N111 HydrophobicContact CD2-CB 4.11Å; K99-N111 PolarHBondContact O-ND2 3.05Å; I103-N111 WeakPolarHBondContact CD1-ND2 3.09Å; E107-N111 WeakPolarHBondContact O-CB 3.15Å; E107-N111 PolarHBondContact O-N 3.25Å; E107-N111 PolarHBondContact O-OD1 3.38Å; V108-N111 PolarHBondContact O-N 3.26Å; N111-T114 VanDerWaalsContact C-OG1 3.29Å; N111-T114 VanDerWaalsContact CA-OG1 3.24Å; N111-T114 WeakPolarHBondContact CA-OG1 3.24Å; N111-T114 PolarHBondContact O-OG1 2.98Å; N111-R115 VanDerWaalsContact O-CG 3.31Å; N111-R115 WeakPolarHBondContact O-CG 3.3Å; N111-R115 PolarHBondContact O-N 3.06Å; N111-R115 PolarHBondContact O-NE 2.76Å
112	E	77.8	Confident	72	Confident	10 Å²	10	38.9 Å²	38.9	5%	0.047	19%	0.192	C	C	.	.	H	α-helix	trans	-66.6	-45.9	175.9	-166.6	-177.4	141.9	0	0	112.1	V108 L109 V110 T114 R115 R116 P224 Q225	V108-E112 WeakPolarHBondContact O-CB 3.36Å; V108-E112 PolarHBondContact O-N 3.17Å; L109-E112 PolarHBondContact O-N 3.43Å; V110-E112 VanDerWaalsContact C-N 3.32Å; V110-E112 PolarHBondContact O-N 3.48Å; E112-T114 PolarHBondContact O-N 3.5Å; E112-R115 WeakPolarHBondContact O-CB 3.43Å; E112-R115 PolarHBondContact O-N 3.03Å; E112-R116 WeakPolarHBondContact O-CG 3.48Å; E112-R116 PolarHBondContact O-N 2.98Å; E112-R116 IonicContact OE1-CZ 3.36Å; E112-R116 IonicContact OE1-NE 3.48Å; E112-R116 PolarHBondContact OE1-NE 2.94Å; E112-R116 IonicContact OE1-NH2 2.65Å; E112-R116 PolarHBondContact OE1-NH2 3.5Å; E112-P224 WeakPolarHBondContact OE2-CA 3.28Å; E112-Q225 VanDerWaalsContact CD-CB 3.45Å; E112-Q225 VanDerWaalsContact CD-CD 3.5Å; E112-Q225 HydrophobicContact CG-CB 4.38Å; E112-Q225 HydrophobicContact CG-CG 4.39Å; E112-Q225 VanDerWaalsContact OE1-CB 3.28Å; E112-Q225 WeakPolarHBondContact OE1-CB 3.5Å; E112-Q225 WeakPolarHBondContact OE1-CG 3.44Å; E112-Q225 PolarHBondContact OE1-N 2.85Å; E112-Q225 PolarHBondContact OE1-NE2 3.48Å; E112-Q225 PolarHBondContact OE1-OE1 3Å; E112-Q225 PolarHBondContact OE2-N 3.46Å
113	L	70.1	Confident	70.4	Confident	14 Å²	14	40.1 Å²	40.1	7%	0.073	19%	0.192	C	C	.	.	H	α-helix	trans	-65.3	-39.2	177.8	-72.2	166.7	0	0	0	112.6	L109 V110 R115 R116 K117 I193 L196	L109-L113 VanDerWaalsContact O-CG 3.3Å; L109-L113 WeakPolarHBondContact O-CG 3.4Å; L109-L113 PolarHBondContact O-N 3.43Å; V110-L113 PolarHBondContact O-N 3.03Å; L113-R115 VanDerWaalsContact C-N 3.3Å; L113-R115 PolarHBondContact O-N 2.59Å; L113-R116 PolarHBondContact O-N 2.91Å; L113-K117 WeakPolarHBondContact O-CB 3.14Å; L113-K117 PolarHBondContact O-N 3.27Å; L113-I193 HydrophobicContact CB-CD1 4.37Å; L113-I193 HydrophobicContact CB-CG1 4.03Å; L113-I193 HydrophobicContact CD1-CG1 3.8Å; L113-I193 HydrophobicContact CD2-CG1 4.21Å; L113-I193 HydrophobicContact CG-CG1 4.25Å; L113-L196 HydrophobicContact CD1-CD1 3.16Å
114	T	67.7	Low	68.5	Low	6 Å²	6	42.6 Å²	42.6	4%	0.037	21%	0.209	C	C	.	.	H	α-helix	trans	-63.1	-38.1	173.7	47.2	0	0	0	0	111.5	L89 V110 N111 E112 Q118	L89-T114 HydrophobicContact CD2-CG2 3.69Å; L89-T114 HydrophobicContact CG-CG2 4.11Å; V110-T114 HydrophobicContact CG1-CG2 4.47Å; V110-T114 WeakPolarHBondContact O-CB 3.47Å; V110-T114 WeakPolarHBondContact O-CG2 3.49Å; V110-T114 PolarHBondContact O-N 3.48Å; V110-T114 PolarHBondContact O-OG1 2.79Å; N111-T114 VanDerWaalsContact C-OG1 3.29Å; N111-T114 VanDerWaalsContact CA-OG1 3.24Å; N111-T114 WeakPolarHBondContact CA-OG1 3.24Å; N111-T114 PolarHBondContact O-OG1 2.98Å; E112-T114 PolarHBondContact O-N 3.5Å; T114-Q118 WeakPolarHBondContact O-CG 3.47Å; T114-Q118 PolarHBondContact O-N 3.19Å
115	R	71.3	Confident	66.6	Low	20 Å²	20	45.9 Å²	45.9	8%	0.075	23%	0.227	C	C	.	.	H	α-helix	trans	-65	-49.4	173.4	-77.4	-176.9	-80	-143.4	-2.2	113	L98 N111 E112 L113 K117 Q118 R119 F261 D262	L98-R115 HydrophobicContact CD1-CG 3.78Å; L98-R115 PolarHBondContact O-NH1 3.05Å; N111-R115 VanDerWaalsContact O-CG 3.31Å; N111-R115 WeakPolarHBondContact O-CG 3.3Å; N111-R115 PolarHBondContact O-N 3.06Å; N111-R115 PolarHBondContact O-NE 2.76Å; E112-R115 WeakPolarHBondContact O-CB 3.43Å; E112-R115 PolarHBondContact O-N 3.03Å; L113-R115 VanDerWaalsContact C-N 3.3Å; L113-R115 PolarHBondContact O-N 2.59Å; R115-K117 VanDerWaalsContact C-N 3.26Å; R115-K117 PolarHBondContact O-N 3.07Å; R115-Q118 PolarHBondContact O-N 3.29Å; R115-Q118 VanDerWaalsContact O-N 3.09Å; R115-R119 WeakPolarHBondContact O-CG 3.46Å; R115-R119 PolarHBondContact O-N 3.19Å; R115-F261 PolarHBondContact NH1-O 2.64Å; R115-D262 PolarHBondContact NH1-O 2.99Å
116	R	69.6	Low	64.6	Low	89 Å²	89	51.8 Å²	51.8	34%	0.336	26%	0.255	S	S	.	.	H	α-helix	trans	-54.3	-46.8	176.6	-70.5	-175.6	-170.6	-175.8	3.8	110.8	E112 L113 Q118 R119 E120 Q225	E112-R116 WeakPolarHBondContact O-CG 3.48Å; E112-R116 PolarHBondContact O-N 2.98Å; E112-R116 IonicContact OE1-CZ 3.36Å; E112-R116 IonicContact OE1-NE 3.48Å; E112-R116 PolarHBondContact OE1-NE 2.94Å; E112-R116 IonicContact OE1-NH2 2.65Å; E112-R116 PolarHBondContact OE1-NH2 3.5Å; L113-R116 PolarHBondContact O-N 2.91Å; R116-Q118 PolarHBondContact O-N 2.73Å; R116-R119 WeakPolarHBondContact O-CB 3.42Å; R116-R119 PolarHBondContact O-N 2.67Å; R116-R119 VanDerWaalsContact O-N 3.17Å; R116-E120 PolarHBondContact O-N 2.98Å; R116-Q225 VanDerWaalsContact NH2-NE2 3.14Å
117	K	62.3	Low	63.2	Low	37 Å²	37	54.9 Å²	54.9	16%	0.161	28%	0.275	C	S	.	.	H	α-helix	trans	-61	-42.7	175.3	-175.5	-179.9	177.7	-179.6	0	113.6	L89 L113 R115 R119 E120 L121	L89-K117 PolarHBondContact O-NZ 3.23Å; L113-K117 WeakPolarHBondContact O-CB 3.14Å; L113-K117 PolarHBondContact O-N 3.27Å; R115-K117 VanDerWaalsContact C-N 3.26Å; R115-K117 PolarHBondContact O-N 3.07Å; K117-R119 VanDerWaalsContact C-N 3.26Å; K117-R119 PolarHBondContact O-N 3.42Å; K117-E120 PolarHBondContact O-N 3.49Å; K117-L121 HydrophobicContact CG-CD1 4.14Å; K117-L121 VanDerWaalsContact O-CG 3.26Å; K117-L121 WeakPolarHBondContact O-CG 3.48Å; K117-L121 PolarHBondContact O-N 3.41Å
118	Q	63.9	Low	61.6	Low	106 Å²	106	58.2 Å²	58.2	50%	0.495	29%	0.291	S	S	.	.	H	α-helix	trans	-63.9	-33.9	177.2	-77.4	176.6	-7.3	0	0	112.2	T114 R115 R116 L121 T122	T114-Q118 WeakPolarHBondContact O-CG 3.47Å; T114-Q118 PolarHBondContact O-N 3.19Å; R115-Q118 PolarHBondContact O-N 3.29Å; R115-Q118 VanDerWaalsContact O-N 3.09Å; R116-Q118 PolarHBondContact O-N 2.73Å; Q118-L121 PolarHBondContact O-N 2.9Å; Q118-T122 PolarHBondContact O-N 3.49Å; Q118-T122 PolarHBondContact O-OG1 3.02Å
119	R	62.3	Low	59.7	Low	91 Å²	91	64.4 Å²	64.4	34%	0.343	32%	0.324	S	S	.	.	H	α-helix	trans	-71.9	-34.8	175.9	-69.6	179.1	-179.8	-171.4	2.1	113.3	R115 R116 K117 L121 T122 P123 G264 D266	R115-R119 WeakPolarHBondContact O-CG 3.46Å; R115-R119 PolarHBondContact O-N 3.19Å; R116-R119 WeakPolarHBondContact O-CB 3.42Å; R116-R119 PolarHBondContact O-N 2.67Å; R116-R119 VanDerWaalsContact O-N 3.17Å; K117-R119 VanDerWaalsContact C-N 3.26Å; K117-R119 PolarHBondContact O-N 3.42Å; R119-L121 VanDerWaalsContact C-N 3.31Å; R119-T122 VanDerWaalsContact CA-OG1 3.31Å; R119-T122 WeakPolarHBondContact CA-OG1 2.94Å; R119-T122 PolarHBondContact O-OG1 2.56Å; R119-P123 WeakPolarHBondContact O-CD 3.21Å; R119-G264 PolarHBondContact NH2-O 2.87Å; R119-D266 IonicContact NH1-OD2 2.91Å; R119-D266 PolarHBondContact NH1-OD2 3.48Å
120	E	59.5	Low	58.2	Low	76 Å²	76	70.5 Å²	70.5	36%	0.355	36%	0.355	S	S	.	.	H	α-helix	trans	-67.4	-34.2	173	-71.3	161.1	-174.3	0	0	111.8	R116 K117 P123 N186 L189	R116-E120 PolarHBondContact O-N 2.98Å; K117-E120 PolarHBondContact O-N 3.49Å; E120-P123 WeakPolarHBondContact O-CD 3.27Å; E120-N186 PolarHBondContact OE2-OD1 3.45Å; E120-L189 VanDerWaalsContact OE1-CD1 3.29Å; E120-L189 WeakPolarHBondContact OE1-CD1 3.39Å
121	L	52.4	Low	56.8	Low	81 Å²	81	75.9 Å²	75.9	42%	0.424	38%	0.384	S	S	.	.	H	α-helix	trans	-78.4	-26.7	-178.7	-66.7	170.9	0	0	0	113.6	K117 Q118 R119 T124 M125	K117-L121 HydrophobicContact CG-CD1 4.14Å; K117-L121 VanDerWaalsContact O-CG 3.26Å; K117-L121 WeakPolarHBondContact O-CG 3.48Å; K117-L121 PolarHBondContact O-N 3.41Å; Q118-L121 PolarHBondContact O-N 2.9Å; R119-L121 VanDerWaalsContact C-N 3.31Å; L121-T124 PolarHBondContact O-N 3.29Å; L121-T124 PolarHBondContact O-OG1 3.43Å; L121-M125 PolarHBondContact O-N 2.82Å
122	T	51.8	Low	55	Low	69 Å²	69	77.9 Å²	77.9	42%	0.423	41%	0.409	S	S	.	.	H	α-helix	trans	-67.3	-42.5	-177.3	21.1	0	0	0	0	115.5	Q118 R119 T124 M125 Q126	Q118-T122 PolarHBondContact O-N 3.49Å; Q118-T122 PolarHBondContact O-OG1 3.02Å; R119-T122 VanDerWaalsContact CA-OG1 3.31Å; R119-T122 WeakPolarHBondContact CA-OG1 2.94Å; R119-T122 PolarHBondContact O-OG1 2.56Å; T122-T124 VanDerWaalsContact C-N 3.33Å; T122-T124 PolarHBondContact O-N 3.31Å; T122-M125 PolarHBondContact O-N 3.32Å; T122-Q126 PolarHBondContact O-N 3.15Å
123	P	50	Low	53.5	Low	68 Å²	68	82.5 Å²	82.5	44%	0.442	44%	0.443	S	S	.	.	H	α-helix	trans	-69.7	-30.5	176.1	25.7	-32.6	0	0	0	112.1	R119 E120 M125 Q126 V127	R119-P123 WeakPolarHBondContact O-CD 3.21Å; E120-P123 WeakPolarHBondContact O-CD 3.27Å; P123-M125 PolarHBondContact O-N 2.95Å; P123-Q126 PolarHBondContact O-N 3.45Å; P123-V127 VanDerWaalsContact O-CG2 3.31Å; P123-V127 WeakPolarHBondContact O-CG2 3.5Å; P123-V127 PolarHBondContact O-N 3.46Å; P123-V127 VanDerWaalsContact O-N 3.1Å
124	T	43.4	Very low	52	Low	80 Å²	80	87.9 Å²	87.9	49%	0.491	48%	0.476	S	S	.	.	H	α-helix	trans	-65	-24.7	175	63.9	0	0	0	0	113.2	L121 T122	L121-T124 PolarHBondContact O-N 3.29Å; L121-T124 PolarHBondContact O-OG1 3.43Å; T122-T124 VanDerWaalsContact C-N 3.33Å; T122-T124 PolarHBondContact O-N 3.31Å
125	M	43.2	Very low	50.5	Low	116 Å²	116	91.2 Å²	91.2	57%	0.571	51%	0.511	S	S	*	.	H	α-helix	trans	-81.7	-40.5	173.5	-65.9	-173.2	66.3	0	0	112.6	L121 T122 P123 E128 D129	L121-M125 PolarHBondContact O-N 2.82Å; T122-M125 PolarHBondContact O-N 3.32Å; P123-M125 PolarHBondContact O-N 2.95Å; M125-E128 PolarHBondContact O-N 2.87Å; M125-D129 PolarHBondContact O-N 3.44Å
126	Q	43.2	Very low	49.1	Very low	125 Å²	125	101.8 Å²	101.8	58%	0.584	55%	0.551	S	S	*	*	H	α-helix	trans	-71.7	-30.2	-177.6	-67.3	180	15.1	0	0	113.2	T122 P123 E128 D129 I130	T122-Q126 PolarHBondContact O-N 3.15Å; P123-Q126 PolarHBondContact O-N 3.45Å; Q126-E128 VanDerWaalsContact C-N 3.33Å; Q126-D129 PolarHBondContact O-N 3.39Å; Q126-I130 PolarHBondContact O-N 2.75Å
127	V	48.3	Very low	47.7	Very low	89 Å²	89	109 Å²	109	54%	0.539	58%	0.578	S	S	.	*	H	α-helix	trans	-70.9	-27.2	175.8	174.6	0	0	0	0	112.2	P123 N131	P123-V127 VanDerWaalsContact O-CG2 3.31Å; P123-V127 WeakPolarHBondContact O-CG2 3.5Å; P123-V127 PolarHBondContact O-N 3.46Å; P123-V127 VanDerWaalsContact O-N 3.1Å; V127-N131 PolarHBondContact O-ND2 3.38Å
128	E	43	Very low	46.7	Very low	106 Å²	106	119 Å²	119	50%	0.495	62%	0.615	S	S	.	*	H	α-helix	trans	-77.5	-31.5	173.9	-74.3	-169.5	157.7	0	0	112.4	M125 Q126 G132 V143	M125-E128 PolarHBondContact O-N 2.87Å; Q126-E128 VanDerWaalsContact C-N 3.33Å; E128-G132 PolarHBondContact O-N 2.86Å; E128-V143 WeakPolarHBondContact OE2-CG2 3.43Å
129	D	43.6	Very low	45.3	Very low	133 Å²	133	125 Å²	125	71%	0.711	63%	0.633	S	S	*	*	H	α-helix	trans	-71.6	-34.3	179.3	-75.5	-24.9	0	0	0	112.9	M125 Q126	M125-D129 PolarHBondContact O-N 3.44Å; Q126-D129 PolarHBondContact O-N 3.39Å
130	I	45.9	Very low	44.3	Very low	136 Å²	136	123.2 Å²	123.2	70%	0.697	64%	0.643	S	S	*	*	H	α-helix	trans	-73	-33.3	176.9	-62.2	170.5	0	0	0	111.4	Q126 G132	Q126-I130 PolarHBondContact O-N 2.75Å; I130-G132 VanDerWaalsContact C-N 3.33Å
131	N	43.3	Very low	43.9	Very low	122 Å²	122	124.2 Å²	124.2	65%	0.652	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	5.2	179.1	-73	-27.5	0	0	0	113.7	V127	V127-N131 PolarHBondContact O-ND2 3.38Å
132	G	42.3	Very low	43.4	Very low	62 Å²	62	123.8 Å²	123.8	64%	0.639	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-4.5	-174.4	0	0	0	0	0	116.5	E128 I130	E128-G132 PolarHBondContact O-N 2.86Å; I130-G132 VanDerWaalsContact C-N 3.33Å
133	S	46.3	Very low	42.7	Very low	107 Å²	107	123.1 Å²	123.1	75%	0.748	65%	0.647	S	S	*	*	S	Bend	trans	-90.8	-6.4	-172.9	75.8	0	0	0	0	115.6
134	T	39.3	Very low	42.2	Very low	127 Å²	127	126.3 Å²	126.3	78%	0.779	66%	0.656	S	S	*	*	S	Bend	trans	-136.5	106.6	175.1	50.2	0	0	0	0	112
135	G	35	Very low	42.3	Very low	75 Å²	75	129 Å²	129	77%	0.773	66%	0.657	S	S	*	*			trans	123.1	70.9	165.7	0	0	0	0	0	115.5	R137	G135-R137 PolarHBondContact O-N 3.23Å
136	R	42.3	Very low	41.9	Very low	242 Å²	242	128.8 Å²	128.8	91%	0.913	66%	0.656	S	S	*	*			trans	-60.8	106.6	155.6	-89	-177.8	169.6	-171.7	-2.7	108.7
137	R	39.4	Very low	41.6	Very low	240 Å²	240	128 Å²	128	91%	0.906	66%	0.655	S	S	*	*	S	Bend		165.1	127	126.8	-87.1	159.5	-177.3	-169.9	2.2	111.6	G135	G135-R137 PolarHBondContact O-N 3.23Å
138	R	41.8	Very low	41.3	Very low	249 Å²	249	124.9 Å²	124.9	94%	0.94	64%	0.641	S	S	*	*			trans	67.9	76.8	165.5	-67.4	-176.5	171.4	177.3	-1.7	117.9
139	R	34.8	Very low	41.4	Very low	232 Å²	232	128 Å²	128	88%	0.875	65%	0.648	S	S	*	*			trans	-146.1	99.1	143.8	-112.7	177	178.5	-170.4	-0.3	108.5	N141	R139-N141 PolarHBondContact O-N 2.86Å; R139-N141 VanDerWaalsContact O-N 3.09Å
140	G	41.8	Very low	41	Very low	52 Å²	52	124.1 Å²	124.1	54%	0.536	63%	0.627	S	S	.	*			trans	-62.3	112.7	-177.5	0	0	0	0	0	111	V142 R145	G140-V142 PolarHBondContact O-N 3.46Å; G140-V142 VanDerWaalsContact O-N 3.11Å; G140-R145 PolarHBondContact O-NE 3.02Å; G140-R145 PolarHBondContact O-NH2 3.13Å
141	N	49.9	Very low	40.7	Very low	98 Å²	98	124.9 Å²	124.9	52%	0.524	62%	0.621	S	S	.	*			trans	6.1	87.7	167.4	-60.5	-3.7	0	0	0	114.5	R139 V143 Q144 R145	R139-N141 PolarHBondContact O-N 2.86Å; R139-N141 VanDerWaalsContact O-N 3.09Å; N141-V143 PolarHBondContact O-N 3.31Å; N141-Q144 HydrophobicContact CB-CB 3.5Å; N141-Q144 VanDerWaalsContact CB-CB 3.5Å; N141-Q144 PolarHBondContact ND2-OE1 3.18Å; N141-Q144 PolarHBondContact O-N 3.14Å; N141-Q144 VanDerWaalsContact O-N 3.12Å; N141-R145 PolarHBondContact O-N 3.19Å
142	V	43.3	Very low	40.5	Very low	72 Å²	72	127.1 Å²	127.1	44%	0.436	62%	0.62	S	S	.	*	H	α-helix	trans	-57.9	-40.5	172.4	176.2	0	0	0	0	109.2	G140 Q144 R145 M146	G140-V142 PolarHBondContact O-N 3.46Å; G140-V142 VanDerWaalsContact O-N 3.11Å; V142-Q144 PolarHBondContact O-N 3.46Å; V142-R145 CarbonylContact O-C 3.51Å; V142-R145 WeakPolarHBondContact O-CA 3.33Å; V142-R145 WeakPolarHBondContact O-CB 3.39Å; V142-R145 PolarHBondContact O-N 3.13Å; V142-R145 VanDerWaalsContact O-N 3.11Å; V142-M146 WeakPolarHBondContact O-CB 3.38Å; V142-M146 PolarHBondContact O-N 3.37Å
143	V	37.2	Very low	40.3	Very low	55 Å²	55	132.7 Å²	132.7	33%	0.333	63%	0.627	S	S	.	*	H	α-helix	trans	-54.8	-45.3	172.5	-180	0	0	0	0	112.2	E128 N141 R145 M146 L147	E128-V143 WeakPolarHBondContact OE2-CG2 3.43Å; N141-V143 PolarHBondContact O-N 3.31Å; V143-R145 PolarHBondContact O-N 2.85Å; V143-M146 PolarHBondContact O-N 3.33Å; V143-L147 HydrophobicContact CG1-CD1 3.47Å; V143-L147 VanDerWaalsContact CG1-CD1 3.47Å; V143-L147 WeakPolarHBondContact O-CB 3.42Å; V143-L147 WeakPolarHBondContact O-CD1 3.48Å; V143-L147 PolarHBondContact O-N 2.94Å
144	Q	38	Very low	39.8	Very low	134 Å²	134	130 Å²	130	63%	0.626	60%	0.602	S	S	*	*	H	α-helix	trans	-73.1	-28.8	179	-159.3	166.2	-5.3	0	0	112.5	N141 V142 G148	N141-Q144 HydrophobicContact CB-CB 3.5Å; N141-Q144 VanDerWaalsContact CB-CB 3.5Å; N141-Q144 PolarHBondContact ND2-OE1 3.18Å; N141-Q144 PolarHBondContact O-N 3.14Å; N141-Q144 VanDerWaalsContact O-N 3.12Å; V142-Q144 PolarHBondContact O-N 3.46Å; Q144-G148 WeakPolarHBondContact O-CA 3.18Å; Q144-G148 PolarHBondContact O-N 3.45Å
145	R	46.3	Very low	39.6	Very low	137 Å²	137	127.8 Å²	127.8	52%	0.517	59%	0.591	S	S	.	*	H	α-helix	trans	-71.8	-34.7	169	-88.3	-176.3	-79.6	148.3	-8.9	112.4	G140 N141 V142 V143 G148 R149	G140-R145 PolarHBondContact O-NE 3.02Å; G140-R145 PolarHBondContact O-NH2 3.13Å; N141-R145 PolarHBondContact O-N 3.19Å; V142-R145 CarbonylContact O-C 3.51Å; V142-R145 WeakPolarHBondContact O-CA 3.33Å; V142-R145 WeakPolarHBondContact O-CB 3.39Å; V142-R145 PolarHBondContact O-N 3.13Å; V142-R145 VanDerWaalsContact O-N 3.11Å; V143-R145 PolarHBondContact O-N 2.85Å; R145-G148 CarbonylContact O-C 3.59Å; R145-R149 WeakPolarHBondContact O-CB 3.18Å; R145-R149 WeakPolarHBondContact O-CG 3.43Å; R145-R149 PolarHBondContact O-N 2.89Å
146	M	35.8	Very low	39.5	Very low	112 Å²	112	133.1 Å²	133.1	55%	0.552	59%	0.588	S	S	*	*	H	α-helix	trans	-75	-48	179.1	-141.5	177.8	-176.9	0	0	110.7	V142 V143 G148 R149 M150	V142-M146 WeakPolarHBondContact O-CB 3.38Å; V142-M146 PolarHBondContact O-N 3.37Å; V143-M146 PolarHBondContact O-N 3.33Å; M146-G148 VanDerWaalsContact C-N 3.28Å; M146-G148 PolarHBondContact O-N 2.97Å; M146-R149 PolarHBondContact O-N 2.97Å; M146-M150 PolarHBondContact O-N 3.24Å
147	L	37	Very low	38.9	Very low	107 Å²	107	133.1 Å²	133.1	56%	0.56	59%	0.588	S	S	*	*	H	α-helix	trans	-60.1	-37.3	168	-89	111.8	0	0	0	111.9	V143 M150 R151	V143-L147 HydrophobicContact CG1-CD1 3.47Å; V143-L147 VanDerWaalsContact CG1-CD1 3.47Å; V143-L147 WeakPolarHBondContact O-CB 3.42Å; V143-L147 WeakPolarHBondContact O-CD1 3.48Å; V143-L147 PolarHBondContact O-N 2.94Å; L147-M150 PolarHBondContact O-N 3.05Å; L147-R151 WeakPolarHBondContact O-CB 3.35Å; L147-R151 PolarHBondContact O-N 2.75Å
148	G	40.5	Very low	39.1	Very low	24 Å²	24	130.8 Å²	130.8	25%	0.247	58%	0.58	C	S	.	*	H	α-helix	trans	-70.5	-30.7	174.8	0	0	0	0	0	114.1	Q144 R145 M146 R152	Q144-G148 WeakPolarHBondContact O-CA 3.18Å; Q144-G148 PolarHBondContact O-N 3.45Å; R145-G148 CarbonylContact O-C 3.59Å; M146-G148 VanDerWaalsContact C-N 3.28Å; M146-G148 PolarHBondContact O-N 2.97Å; G148-R152 WeakPolarHBondContact O-CG 3.04Å; G148-R152 PolarHBondContact O-N 3.31Å; G148-R152 VanDerWaalsContact O-N 3.16Å; G148-R152 PolarHBondContact O-NE 3.11Å
149	R	44.7	Very low	38.6	Very low	171 Å²	171	126.2 Å²	126.2	65%	0.645	57%	0.574	S	S	*	*	H	α-helix	trans	-72.7	-42.8	170.8	-83.3	-178	-173.7	-163.2	2.2	110.5	R145 M146 R152 F153	R145-R149 WeakPolarHBondContact O-CB 3.18Å; R145-R149 WeakPolarHBondContact O-CG 3.43Å; R145-R149 PolarHBondContact O-N 2.89Å; M146-R149 PolarHBondContact O-N 2.97Å; R149-R152 PolarHBondContact O-N 3.44Å; R149-F153 PolarHBondContact O-N 2.94Å
150	M	36.8	Very low	38.1	Very low	52 Å²	52	122.9 Å²	122.9	26%	0.256	57%	0.568	S	S	.	*	H	α-helix	trans	-60.1	-47.9	172.1	-102.3	177.6	-78.5	0	0	111.8	M146 L147 R152 F153 F154	M146-M150 PolarHBondContact O-N 3.24Å; L147-M150 PolarHBondContact O-N 3.05Å; M150-R152 VanDerWaalsContact C-N 3.29Å; M150-R152 PolarHBondContact O-N 2.73Å; M150-F153 WeakPolarHBondContact O-CB 3.41Å; M150-F153 PolarHBondContact O-N 3.16Å; M150-F153 VanDerWaalsContact O-N 3.11Å; M150-F154 HydrophobicContact CB-CD2 4.41Å; M150-F154 HydrophobicContact CB-CE2 4.36Å; M150-F154 HydrophobicContact CG-CE2 4.1Å; M150-F154 WeakPolarHBondContact O-CD2 3.47Å; M150-F154 PolarHBondContact O-N 2.77Å
151	R	38.1	Very low	37.6	Very low	152 Å²	152	124.7 Å²	124.7	57%	0.574	57%	0.57	S	S	*	*	H	α-helix	trans	-57	-42.7	175.7	-110.1	-176.1	174.2	-155.2	-1.3	111.6	L147 F154 S155	L147-R151 WeakPolarHBondContact O-CB 3.35Å; L147-R151 PolarHBondContact O-N 2.75Å; R151-F154 PolarHBondContact O-N 2.71Å; R151-S155 WeakPolarHBondContact O-CB 3.44Å; R151-S155 PolarHBondContact O-N 2.94Å; R151-S155 PolarHBondContact O-OG 3.34Å
152	R	40.7	Very low	36.5	Very low	169 Å²	169	124.4 Å²	124.4	64%	0.638	57%	0.572	S	S	*	*	H	α-helix	trans	-65.6	-38.2	176.3	-81.1	-177.3	-74.6	167.7	-7.3	112.8	G148 R149 M150 S155	G148-R152 WeakPolarHBondContact O-CG 3.04Å; G148-R152 PolarHBondContact O-N 3.31Å; G148-R152 VanDerWaalsContact O-N 3.16Å; G148-R152 PolarHBondContact O-NE 3.11Å; R149-R152 PolarHBondContact O-N 3.44Å; M150-R152 VanDerWaalsContact C-N 3.29Å; M150-R152 PolarHBondContact O-N 2.73Å; R152-S155 PolarHBondContact O-N 2.95Å
153	F	36.6	Very low	35.9	Very low	179 Å²	179	127.2 Å²	127.2	79%	0.785	58%	0.584	S	S	*	*	H	α-helix	trans	-64.1	-43.1	174.7	-103	-90.4	0	0	0	112.4	R149 M150 S155	R149-F153 PolarHBondContact O-N 2.94Å; M150-F153 WeakPolarHBondContact O-CB 3.41Å; M150-F153 PolarHBondContact O-N 3.16Å; M150-F153 VanDerWaalsContact O-N 3.11Å; F153-S155 VanDerWaalsContact C-N 3.34Å; F153-S155 PolarHBondContact O-N 3.06Å
154	F	35.7	Very low	35.6	Very low	51 Å²	51	128.3 Å²	128.3	22%	0.224	59%	0.592	C	S	.	*	H	α-helix	trans	-81.4	-6.5	177.9	-66.8	-70	0	0	0	114.6	R90 M150 R151 L190	R90-F154 PolarHBondContact NH2-O 3.06Å; M150-F154 HydrophobicContact CB-CD2 4.41Å; M150-F154 HydrophobicContact CB-CE2 4.36Å; M150-F154 HydrophobicContact CG-CE2 4.1Å; M150-F154 WeakPolarHBondContact O-CD2 3.47Å; M150-F154 PolarHBondContact O-N 2.77Å; R151-F154 PolarHBondContact O-N 2.71Å; F154-L190 HydrophobicContact CE1-CD2 4.35Å; F154-L190 HydrophobicContact CZ-CD2 3.86Å
155	S	35.4	Very low	35.5	Very low	80 Å²	80	133.2 Å²	133.2	56%	0.559	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	0.1	179.3	-57.2	0	0	0	0	113.5	R151 R152 F153 R157	R151-S155 WeakPolarHBondContact O-CB 3.44Å; R151-S155 PolarHBondContact O-N 2.94Å; R151-S155 PolarHBondContact O-OG 3.34Å; R152-S155 PolarHBondContact O-N 2.95Å; F153-S155 VanDerWaalsContact C-N 3.34Å; F153-S155 PolarHBondContact O-N 3.06Å; S155-R157 PolarHBondContact O-N 3.39Å; S155-R157 VanDerWaalsContact O-N 3.08Å
156	R	34.2	Very low	35.2	Very low	188 Å²	188	135 Å²	135	71%	0.709	62%	0.619	S	S	*	*	S	Bend	trans	-74.8	103.9	177.4	-147	176	-173.4	-164.5	-3.5	108.4	R158	R156-R158 PolarHBondContact O-N 3.19Å; R156-R158 VanDerWaalsContact O-N 3.15Å
157	R	29.6	Very low	35.1	Very low	242 Å²	242	137.5 Å²	137.5	91%	0.913	63%	0.627	S	S	*	*			trans	-43.3	123.3	170.8	-99.2	-173	177.9	-138.1	1.7	108.8	S155 N159	S155-R157 PolarHBondContact O-N 3.39Å; S155-R157 VanDerWaalsContact O-N 3.08Å; R157-N159 PolarHBondContact O-N 2.73Å
158	R	43.9	Very low	35	Very low	191 Å²	191	136.8 Å²	136.8	72%	0.721	63%	0.628	S	S	*	*	S	Bend	trans	-48.8	110.1	164.6	-84.9	178.3	173.8	178.1	-0.6	107.8	R156	R156-R158 PolarHBondContact O-N 3.19Å; R156-R158 VanDerWaalsContact O-N 3.15Å
159	N	29.9	Very low	35	Very low	152 Å²	152	147.4 Å²	147.4	81%	0.813	66%	0.66	S	S	*	*	S	Bend	trans	171.7	68.6	146	-82.9	-12.2	0	0	0	107.6	R157	R157-N159 PolarHBondContact O-N 2.73Å
160	E	23.8	Very low	34.5	Very low	163 Å²	163	151.1 Å²	151.1	76%	0.762	67%	0.674	S	S	*	*			trans	165.1	121.2	154.4	-99	171.7	-172.6	0	0	109.5	T162	E160-T162 PolarHBondContact O-N 3.28Å
161	P	33.1	Very low	34.1	Very low	89 Å²	89	152.1 Å²	152.1	58%	0.578	70%	0.698	S	S	*	*			trans	-86.7	98	159.8	32.5	-24	0	0	0	107.4	K213	P161-K213 HydrophobicContact CG-CD 3.63Å
162	T	25.6	Very low	33.8	Very low	92 Å²	92	156.5 Å²	156.5	56%	0.564	72%	0.715	S	S	*	*			trans	-77.5	131.7	158.6	-12	0	0	0	0	107.2	E160	E160-T162 PolarHBondContact O-N 3.28Å
163	L	30.1	Very low	33.7	Very low	131 Å²	131	160.5 Å²	160.5	69%	0.686	73%	0.73	S	S	*	*			trans	-45.2	147.9	164.5	-69.1	164.5	0	0	0	109.5	R165	L163-R165 PolarHBondContact O-N 2.71Å; L163-R165 VanDerWaalsContact O-N 3.12Å
164	P	32.6	Very low	33.3	Very low	78 Å²	78	155.2 Å²	155.2	51%	0.506	73%	0.725	S	S	.	*			trans	-47.6	127	167.5	-22.4	31.4	0	0	0	108.3	E166 F167	P164-E166 PolarHBondContact O-N 2.97Å; P164-F167 PolarHBondContact O-N 3.47Å
165	R	36.2	Very low	33.2	Very low	237 Å²	237	158 Å²	158	89%	0.894	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	2.2	-175.9	-144.1	178.3	-176.3	-166.2	0.9	113	L163	L163-R165 PolarHBondContact O-N 2.71Å; L163-R165 VanDerWaalsContact O-N 3.12Å
166	E	38.8	Very low	33	Very low	174 Å²	174	160.6 Å²	160.6	81%	0.813	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-17.8	175.4	-70.5	155.9	-168.2	0	0	113.3	P164	P164-E166 PolarHBondContact O-N 2.97Å
167	F	34.1	Very low	32.8	Very low	166 Å²	166	155.3 Å²	155.3	73%	0.728	76%	0.762	S	S	*	*	S	Bend	trans	-99.7	-3	-178.3	-87.5	-84.5	0	0	0	115.1	P164 R169	P164-F167 PolarHBondContact O-N 3.47Å; F167-R169 PolarHBondContact O-N 3.21Å
168	T	33.7	Very low	33	Very low	92 Å²	92	148.1 Å²	148.1	56%	0.564	76%	0.755	S	S	*	*	S	Bend	trans	-80.8	107.4	169.8	51.2	0	0	0	0	109	R170	T168-R170 PolarHBondContact O-N 3.1Å
169	R	41.8	Very low	32.4	Very low	247 Å²	247	145.8 Å²	145.8	93%	0.932	76%	0.756	S	S	*	*	S	Bend	trans	-48.4	100.2	172.4	-78.2	-178.8	174.1	-177.2	-2.2	110.8	F167	F167-R169 PolarHBondContact O-N 3.21Å
170	R	33.1	Very low	32.7	Very low	248 Å²	248	140.6 Å²	140.6	94%	0.936	73%	0.732	S	S	*	*			trans	172.4	118.3	143.1	-96.5	171.3	-160.4	-128.7	6.6	109.8	T168	T168-R170 PolarHBondContact O-N 3.1Å
171	G	28.7	Very low	33.4	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	72%	0.723	S	S	*	*			trans	117.1	82.5	147.6	0	0	0	0	0	118.7
172	R	32.8	Very low	33.6	Very low	243 Å²	243	137 Å²	137	92%	0.917	72%	0.723	S	S	*	*			trans	49.9	122	140.6	-75.7	-175.4	176.1	-163.6	-0.7	121.8
173	R	37.6	Very low	34.2	Very low	254 Å²	254	139.1 Å²	139.1	96%	0.958	73%	0.726	S	S	*	*			trans	50.7	97.6	140.7	-74.7	-172.1	178.3	-168.2	-0.8	117.7
174	G	28.6	Very low	34.6	Very low	67 Å²	67	139.7 Å²	139.7	69%	0.691	73%	0.729	S	S	*	*			trans	-172.1	81.4	153.7	0	0	0	0	0	107.4	V176	G174-V176 PolarHBondContact O-N 3.32Å
175	A	34.6	Very low	35.1	Very low	111 Å²	111	141.7 Å²	141.7	92%	0.917	73%	0.732	S	S	*	*			trans	-64.6	101.8	168.4	0	0	0	0	0	106.8
176	V	29.6	Very low	35.1	Very low	134 Å²	134	133.6 Å²	133.6	81%	0.812	71%	0.706	S	S	*	*			trans	-86.1	107.6	163.2	-175.6	0	0	0	0	104.2	G174 A178	G174-V176 PolarHBondContact O-N 3.32Å; V176-A178 PolarHBondContact O-N 3.47Å
177	S	31	Very low	35.3	Very low	77 Å²	77	126.9 Å²	126.9	54%	0.538	68%	0.684	S	S	.	*			trans	-53.9	122.8	169.3	132.8	0	0	0	0	107.1	D179	S177-D179 PolarHBondContact O-N 3.44Å; S177-D179 WeakPolarHBondContact OG-CB 3.33Å; S177-D179 PolarHBondContact OG-N 2.92Å; S177-D179 PolarHBondContact OG-OD2 2.86Å
178	A	33.6	Very low	36	Very low	91 Å²	91	121.6 Å²	121.6	75%	0.752	67%	0.671	S	S	*	*			trans	-89.4	56.6	173.3	0	0	0	0	0	108.1	V176 S180	V176-A178 PolarHBondContact O-N 3.47Å; A178-S180 PolarHBondContact O-N 3.24Å
179	D	30.9	Very low	36.6	Very low	141 Å²	141	118.8 Å²	118.8	75%	0.754	65%	0.652	S	S	*	*			trans	-94.5	74.4	178.5	-67.3	-27.5	0	0	0	109.9	S177	S177-D179 PolarHBondContact O-N 3.44Å; S177-D179 WeakPolarHBondContact OG-CB 3.33Å; S177-D179 PolarHBondContact OG-N 2.92Å; S177-D179 PolarHBondContact OG-OD2 2.86Å
180	S	36.1	Very low	36.9	Very low	44 Å²	44	109.6 Å²	109.6	31%	0.308	62%	0.622	S	S	.	*			trans	-167.7	106.5	151	42.1	0	0	0	0	107.7	A178 D182 E183	A178-S180 PolarHBondContact O-N 3.24Å; S180-D182 PolarHBondContact O-N 3.46Å; S180-D182 VanDerWaalsContact O-N 3.09Å; S180-E183 PolarHBondContact O-N 3.28Å; S180-E183 VanDerWaalsContact OG-CG 3.28Å; S180-E183 WeakPolarHBondContact OG-CG 3.16Å
181	A	39.8	Very low	37.9	Very low	70 Å²	70	102.5 Å²	102.5	58%	0.579	60%	0.602	S	S	*	*	H	α-helix	trans	-49.5	-33.3	174	0	0	0	0	0	111.5	E183 L184 E185	A181-E183 PolarHBondContact O-N 3.09Å; A181-L184 PolarHBondContact O-N 3.46Å; A181-E185 WeakPolarHBondContact O-CG 3.36Å; A181-E185 PolarHBondContact O-N 2.98Å
182	D	36.4	Very low	39	Very low	107 Å²	107	100.6 Å²	100.6	57%	0.572	57%	0.573	S	S	*	*	H	α-helix	trans	-58.4	-37.9	175.5	-54.3	-11.4	0	0	0	113.3	S180 N186	S180-D182 PolarHBondContact O-N 3.46Å; S180-D182 VanDerWaalsContact O-N 3.09Å; D182-N186 WeakPolarHBondContact O-CB 3.29Å; D182-N186 PolarHBondContact O-N 3.27Å; D182-N186 PolarHBondContact O-ND2 3.38Å
183	E	37.8	Very low	39.7	Very low	135 Å²	135	89.9 Å²	89.9	63%	0.631	53%	0.534	S	S	*	.	H	α-helix	trans	-71.6	-31.7	179.2	-77.9	-169.6	165.4	0	0	112.6	S180 A181 G187	S180-E183 PolarHBondContact O-N 3.28Å; S180-E183 VanDerWaalsContact OG-CG 3.28Å; S180-E183 WeakPolarHBondContact OG-CG 3.16Å; A181-E183 PolarHBondContact O-N 3.09Å; E183-G187 PolarHBondContact O-N 3.46Å; E183-G187 VanDerWaalsContact O-N 3.14Å
184	L	39.3	Very low	40.3	Very low	143 Å²	143	80.4 Å²	80.4	75%	0.749	50%	0.502	S	S	*	.	H	α-helix	trans	-75.3	-41	176.3	-172.4	67.8	0	0	0	111.2	A181 G187 A188	A181-L184 PolarHBondContact O-N 3.46Å; L184-G187 PolarHBondContact O-N 3.48Å; L184-A188 WeakPolarHBondContact O-CB 3.3Å; L184-A188 PolarHBondContact O-N 2.65Å
185	E	42.1	Very low	41.4	Very low	120 Å²	120	78.2 Å²	78.2	56%	0.561	47%	0.473	S	S	*	.	H	α-helix	trans	-63.7	-44.9	174.3	-73.6	-174.8	177.4	0	0	111.6	A181 G187 A188 L189	A181-E185 WeakPolarHBondContact O-CG 3.36Å; A181-E185 PolarHBondContact O-N 2.98Å; E185-G187 VanDerWaalsContact C-N 3.3Å; E185-G187 PolarHBondContact O-N 2.81Å; E185-A188 PolarHBondContact O-N 2.87Å; E185-A188 VanDerWaalsContact O-N 3.1Å; E185-L189 WeakPolarHBondContact O-CG 3.5Å; E185-L189 PolarHBondContact O-N 3.26Å
186	N	37.4	Very low	42.2	Very low	67 Å²	67	73.4 Å²	73.4	36%	0.358	43%	0.432	S	S	.	.	H	α-helix	trans	-59.7	-38.7	174.5	-77.4	-44.7	0	0	0	112.3	E120 D182 L190	E120-N186 PolarHBondContact OE2-OD1 3.45Å; D182-N186 WeakPolarHBondContact O-CB 3.29Å; D182-N186 PolarHBondContact O-N 3.27Å; D182-N186 PolarHBondContact O-ND2 3.38Å; N186-L190 WeakPolarHBondContact O-CB 3.43Å; N186-L190 PolarHBondContact O-N 2.69Å
187	G	42.9	Very low	43	Very low	34 Å²	34	67.4 Å²	67.4	35%	0.351	40%	0.396	S	S	.	.	H	α-helix	trans	-67.1	-38.8	173.2	0	0	0	0	0	113.4	E183 L184 E185 L190 L191	E183-G187 PolarHBondContact O-N 3.46Å; E183-G187 VanDerWaalsContact O-N 3.14Å; L184-G187 PolarHBondContact O-N 3.48Å; E185-G187 VanDerWaalsContact C-N 3.3Å; E185-G187 PolarHBondContact O-N 2.81Å; G187-L190 PolarHBondContact O-N 2.83Å; G187-L191 WeakPolarHBondContact O-CG 3.39Å; G187-L191 PolarHBondContact O-N 2.84Å
188	A	48.3	Very low	43.9	Very low	55 Å²	55	67.5 Å²	67.5	46%	0.455	39%	0.388	S	S	.	.	H	α-helix	trans	-69	-43.1	178.4	0	0	0	0	0	112.4	L184 E185 L190 L191 Q192	L184-A188 WeakPolarHBondContact O-CB 3.3Å; L184-A188 PolarHBondContact O-N 2.65Å; E185-A188 PolarHBondContact O-N 2.87Å; E185-A188 VanDerWaalsContact O-N 3.1Å; A188-L190 VanDerWaalsContact C-N 3.33Å; A188-L190 PolarHBondContact O-N 3.33Å; A188-L191 PolarHBondContact O-N 3.15Å; A188-Q192 WeakPolarHBondContact O-CB 3.38Å; A188-Q192 PolarHBondContact O-N 3.41Å
189	L	46.3	Very low	44.6	Very low	32 Å²	32	64.3 Å²	64.3	17%	0.168	36%	0.358	C	S	.	.	H	α-helix	trans	-60.5	-42.3	174.2	-71.6	166.9	0	0	0	111.2	E120 E185 L191 Q192 I193	E120-L189 VanDerWaalsContact OE1-CD1 3.29Å; E120-L189 WeakPolarHBondContact OE1-CD1 3.39Å; E185-L189 WeakPolarHBondContact O-CG 3.5Å; E185-L189 PolarHBondContact O-N 3.26Å; L189-L191 PolarHBondContact O-N 3.3Å; L189-Q192 WeakPolarHBondContact O-CB 3.38Å; L189-Q192 PolarHBondContact O-N 3.09Å; L189-I193 WeakPolarHBondContact O-CB 3.32Å; L189-I193 WeakPolarHBondContact O-CD1 2.91Å; L189-I193 WeakPolarHBondContact O-CG1 3.32Å; L189-I193 PolarHBondContact O-N 3.32Å
190	L	47.7	Very low	45.3	Very low	55 Å²	55	57.9 Å²	57.9	29%	0.288	32%	0.324	S	S	.	.	H	α-helix	trans	-68.7	-33.3	179.3	-142.1	152	0	0	0	112.4	F154 N186 G187 A188 L194	F154-L190 HydrophobicContact CE1-CD2 4.35Å; F154-L190 HydrophobicContact CZ-CD2 3.86Å; N186-L190 WeakPolarHBondContact O-CB 3.43Å; N186-L190 PolarHBondContact O-N 2.69Å; G187-L190 PolarHBondContact O-N 2.83Å; A188-L190 VanDerWaalsContact C-N 3.33Å; A188-L190 PolarHBondContact O-N 3.33Å; L190-L194 HydrophobicContact CD2-CD1 4.47Å; L190-L194 WeakPolarHBondContact O-CG 3.35Å; L190-L194 PolarHBondContact O-N 3.2Å; L190-L194 VanDerWaalsContact O-N 3.08Å
191	L	54.2	Low	46.1	Very low	98 Å²	98	56.2 Å²	56.2	51%	0.513	31%	0.313	S	S	.	.	H	α-helix	trans	-67.6	-47.3	168.7	-73.3	173.7	0	0	0	111.3	G187 A188 L189 I193 L194 Q195	G187-L191 WeakPolarHBondContact O-CG 3.39Å; G187-L191 PolarHBondContact O-N 2.84Å; A188-L191 PolarHBondContact O-N 3.15Å; L189-L191 PolarHBondContact O-N 3.3Å; L191-I193 PolarHBondContact O-N 3.4Å; L191-L194 WeakPolarHBondContact O-CB 3.28Å; L191-L194 PolarHBondContact O-N 3.43Å; L191-Q195 VanDerWaalsContact O-CG 3.23Å; L191-Q195 WeakPolarHBondContact O-CG 3.27Å; L191-Q195 PolarHBondContact O-N 3.49Å
192	Q	52.7	Low	46.8	Very low	35 Å²	35	53.8 Å²	53.8	16%	0.164	29%	0.291	C	S	.	.	H	α-helix	trans	-58.4	-37.6	176.9	-166.7	175.5	11.9	0	0	111.8	A188 L189 Q195 L196 A220	A188-Q192 WeakPolarHBondContact O-CB 3.38Å; A188-Q192 PolarHBondContact O-N 3.41Å; L189-Q192 WeakPolarHBondContact O-CB 3.38Å; L189-Q192 PolarHBondContact O-N 3.09Å; Q192-Q195 WeakPolarHBondContact O-CB 3.37Å; Q192-Q195 PolarHBondContact O-N 3.43Å; Q192-L196 HydrophobicContact CG-CD1 4.4Å; Q192-L196 WeakPolarHBondContact O-CB 3.46Å; Q192-L196 WeakPolarHBondContact O-CG 3.48Å; Q192-L196 PolarHBondContact O-N 2.88Å; Q192-A220 HydrophobicContact CG-CB 4.24Å
193	I	47.3	Very low	47.8	Very low	17 Å²	17	48.9 Å²	48.9	9%	0.087	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-46.4	172.5	-75.7	162.9	0	0	0	111.7	L89 L113 L189 L191 Q195 L196 S197	L89-I193 HydrophobicContact CD1-CG2 3.56Å; L89-I193 HydrophobicContact CD2-CD1 4.29Å; L89-I193 HydrophobicContact CD2-CG1 4.32Å; L89-I193 HydrophobicContact CD2-CG2 3.53Å; L89-I193 HydrophobicContact CG-CG2 4.14Å; L113-I193 HydrophobicContact CB-CD1 4.37Å; L113-I193 HydrophobicContact CB-CG1 4.03Å; L113-I193 HydrophobicContact CD1-CG1 3.8Å; L113-I193 HydrophobicContact CD2-CG1 4.21Å; L113-I193 HydrophobicContact CG-CG1 4.25Å; L189-I193 WeakPolarHBondContact O-CB 3.32Å; L189-I193 WeakPolarHBondContact O-CD1 2.91Å; L189-I193 WeakPolarHBondContact O-CG1 3.32Å; L189-I193 PolarHBondContact O-N 3.32Å; L191-I193 PolarHBondContact O-N 3.4Å; I193-Q195 VanDerWaalsContact C-N 3.32Å; I193-L196 PolarHBondContact O-N 3.05Å; I193-S197 PolarHBondContact O-N 3.25Å
194	L	49	Very low	48.6	Very low	56 Å²	56	42.5 Å²	42.5	29%	0.293	24%	0.236	S	C	.	.	H	α-helix	trans	-65.5	-37.1	176.4	-76.5	171.2	0	0	0	111.6	F86 L190 L191 S197 Q198	F86-L194 HydrophobicContact CE1-CD2 4.25Å; L190-L194 HydrophobicContact CD2-CD1 4.47Å; L190-L194 WeakPolarHBondContact O-CG 3.35Å; L190-L194 PolarHBondContact O-N 3.2Å; L190-L194 VanDerWaalsContact O-N 3.08Å; L191-L194 WeakPolarHBondContact O-CB 3.28Å; L191-L194 PolarHBondContact O-N 3.43Å; L194-S197 PolarHBondContact O-OG 3.39Å; L194-Q198 WeakPolarHBondContact O-CG 3.31Å; L194-Q198 PolarHBondContact O-N 2.96Å; L194-Q198 PolarHBondContact O-NE2 3.38Å
195	Q	52.4	Low	49.5	Very low	20 Å²	20	39.3 Å²	39.3	9%	0.093	22%	0.217	C	C	.	.	H	α-helix	trans	-63.6	-47.8	175.3	-68	-179	-39.6	0	0	110.8	E45 L191 Q192 I193 S197 Q198 L199 S215	E45-Q195 WeakPolarHBondContact OE1-CB 3.29Å; E45-Q195 VanDerWaalsContact OE1-CD 3.25Å; E45-Q195 WeakPolarHBondContact OE1-CG 3.4Å; E45-Q195 PolarHBondContact OE1-NE2 2.92Å; L191-Q195 VanDerWaalsContact O-CG 3.23Å; L191-Q195 WeakPolarHBondContact O-CG 3.27Å; L191-Q195 PolarHBondContact O-N 3.49Å; Q192-Q195 WeakPolarHBondContact O-CB 3.37Å; Q192-Q195 PolarHBondContact O-N 3.43Å; I193-Q195 VanDerWaalsContact C-N 3.32Å; Q195-S197 PolarHBondContact O-N 3.1Å; Q195-Q198 WeakPolarHBondContact O-CA 3.41Å; Q195-Q198 WeakPolarHBondContact O-CB 3.49Å; Q195-Q198 PolarHBondContact O-N 3.21Å; Q195-L199 WeakPolarHBondContact O-CD1 3.29Å; Q195-L199 WeakPolarHBondContact O-CG 3.46Å; Q195-L199 PolarHBondContact O-N 3.23Å; Q195-L199 VanDerWaalsContact O-N 3.13Å; Q195-S215 PolarHBondContact NE2-OG 2.91Å
196	L	50.9	Low	50.5	Low	10 Å²	10	34.5 Å²	34.5	5%	0.052	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-40.3	176.9	-80	162.2	0	0	0	113.4	L109 L113 Q192 I193 Q198 L199 S200 Q222	L109-L196 HydrophobicContact CD1-CD2 4.03Å; L113-L196 HydrophobicContact CD1-CD1 3.16Å; Q192-L196 HydrophobicContact CG-CD1 4.4Å; Q192-L196 WeakPolarHBondContact O-CB 3.46Å; Q192-L196 WeakPolarHBondContact O-CG 3.48Å; Q192-L196 PolarHBondContact O-N 2.88Å; I193-L196 PolarHBondContact O-N 3.05Å; L196-Q198 PolarHBondContact O-N 3.47Å; L196-L199 PolarHBondContact O-N 3.33Å; L196-S200 PolarHBondContact O-N 3.47Å; L196-Q222 HydrophobicContact CD2-CB 4.16Å; L196-Q222 HydrophobicContact CD2-CG 3.72Å; L196-Q222 HydrophobicContact CG-CG 4.33Å
197	S	47.9	Very low	51.4	Low	8 Å²	8	32.5 Å²	32.5	6%	0.056	18%	0.183	C	C	.	.	H	α-helix	trans	-64.5	-22.5	173.8	76.8	0	0	0	0	113.4	L82 I193 L194 Q195	L82-S197 WeakPolarHBondContact CD2-O 3.35Å; I193-S197 PolarHBondContact O-N 3.25Å; L194-S197 PolarHBondContact O-OG 3.39Å; Q195-S197 PolarHBondContact O-N 3.1Å
198	Q	49.3	Very low	51.9	Low	80 Å²	80	36.1 Å²	36.1	37%	0.374	19%	0.193	S	C	.	.	H	α-helix	trans	-88.5	-19.4	178.1	-69.5	170.6	44.3	0	0	112.6	L194 Q195 L196	L194-Q198 WeakPolarHBondContact O-CG 3.31Å; L194-Q198 PolarHBondContact O-N 2.96Å; L194-Q198 PolarHBondContact O-NE2 3.38Å; Q195-Q198 WeakPolarHBondContact O-CA 3.41Å; Q195-Q198 WeakPolarHBondContact O-CB 3.49Å; Q195-Q198 PolarHBondContact O-N 3.21Å; L196-Q198 PolarHBondContact O-N 3.47Å
199	L	47.8	Very low	52.1	Low	23 Å²	23	34.5 Å²	34.5	12%	0.12	18%	0.182	C	C	.	.	H	α-helix	trans	-99.1	-13.4	-170.5	-69.6	166	0	0	0	114.8	Q195 L196 S201 I219 Q222 P326	Q195-L199 WeakPolarHBondContact O-CD1 3.29Å; Q195-L199 WeakPolarHBondContact O-CG 3.46Å; Q195-L199 PolarHBondContact O-N 3.23Å; Q195-L199 VanDerWaalsContact O-N 3.13Å; L196-L199 PolarHBondContact O-N 3.33Å; L199-S201 PolarHBondContact O-N 2.91Å; L199-I219 HydrophobicContact CD1-CD1 4.21Å; L199-I219 HydrophobicContact CD1-CG2 4.5Å; L199-Q222 VanDerWaalsContact CD1-NE2 3.31Å; L199-P326 HydrophobicContact CD2-CG 4.12Å
200	S	46.3	Very low	52.2	Low	6 Å²	6	37 Å²	37	4%	0.042	20%	0.202	C	C	.	.			trans	-71.9	3.8	179	72.3	0	0	0	0	115.2	R78 W85 L196	R78-S200 PolarHBondContact NH1-O 3.38Å; W85-S200 VanDerWaalsContact CH2-CB 3.44Å; W85-S200 WeakPolarHBondContact CZ3-OG 3.36Å; L196-S200 PolarHBondContact O-N 3.47Å
201	S	52.9	Low	52.2	Low	9 Å²	9	44.2 Å²	44.2	6%	0.063	23%	0.231	C	C	.	.	S	Bend	trans	-69.1	139.9	178.2	-61.3	0	0	0	0	110.1	L199 R206	L199-S201 PolarHBondContact O-N 2.91Å; S201-R206 WeakPolarHBondContact O-CD 3.49Å; S201-R206 PolarHBondContact O-NE 2.82Å
202	P	55.1	Low	52.3	Low	20 Å²	20	46.6 Å²	46.6	13%	0.13	23%	0.234	C	C	.	.			trans	-58.7	152.7	178.2	28.1	-32.6	0	0	0	110	G204 Q205 R206	P202-G204 PolarHBondContact O-N 3.02Å; P202-G204 VanDerWaalsContact O-N 3.11Å; P202-Q205 HydrophobicContact CG-CB 3.92Å; P202-Q205 HydrophobicContact CG-CG 3.74Å; P202-Q205 PolarHBondContact O-N 3.27Å; P202-R206 PolarHBondContact O-N 2.8Å; P202-R206 VanDerWaalsContact O-N 3.16Å
203	I	57.2	Low	52.3	Low	4 Å²	4	52.9 Å²	52.9	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-48.6	-45.5	-173.6	-57.9	166.8	0	0	0	110.9	F68 Q205 R206 L207 P295 L298 L323 P325	F68-I203 HydrophobicContact CZ-CB 4.23Å; F68-I203 HydrophobicContact CZ-CG2 3.82Å; I203-Q205 PolarHBondContact O-N 3.32Å; I203-R206 PolarHBondContact O-N 2.94Å; I203-L207 HydrophobicContact CG2-CD1 4.07Å; I203-L207 HydrophobicContact CG2-CG 4.5Å; I203-L207 WeakPolarHBondContact O-CG 3.46Å; I203-L207 PolarHBondContact O-N 3.41Å; I203-P295 HydrophobicContact CD1-CB 4.19Å; I203-P295 HydrophobicContact CD1-CG 4.26Å; I203-L298 HydrophobicContact CD1-CD1 4.06Å; I203-L298 HydrophobicContact CD1-CG 4.2Å; I203-L323 HydrophobicContact CG2-CD1 3.94Å; I203-L323 HydrophobicContact CG2-CG 4.03Å; I203-P325 HydrophobicContact CG1-CG 4.26Å
204	G	53.3	Low	53.1	Low	1 Å²	1	54.4 Å²	54.4	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-60.1	-42.9	177.4	0	0	0	0	0	114.7	P202 R206 L207 L208	P202-G204 PolarHBondContact O-N 3.02Å; P202-G204 VanDerWaalsContact O-N 3.11Å; G204-R206 VanDerWaalsContact C-N 3.29Å; G204-R206 PolarHBondContact O-N 3.49Å; G204-L207 PolarHBondContact O-N 3.04Å; G204-L208 WeakPolarHBondContact O-CB 3.38Å; G204-L208 WeakPolarHBondContact O-CD1 3.35Å; G204-L208 VanDerWaalsContact O-CG 3.29Å; G204-L208 WeakPolarHBondContact O-CG 3.34Å; G204-L208 PolarHBondContact O-N 3.07Å
205	Q	59.6	Low	53.6	Low	75 Å²	75	53.3 Å²	53.3	35%	0.35	26%	0.264	S	S	.	.	H	α-helix	trans	-69.4	-26.9	177.3	-74.9	-179.4	13.3	0	0	112.8	P202 I203 G209	P202-Q205 HydrophobicContact CG-CB 3.92Å; P202-Q205 HydrophobicContact CG-CG 3.74Å; P202-Q205 PolarHBondContact O-N 3.27Å; I203-Q205 PolarHBondContact O-N 3.32Å; Q205-G209 WeakPolarHBondContact O-CA 2.99Å; Q205-G209 PolarHBondContact O-N 3.06Å
206	R	61.3	Low	54	Low	19 Å²	19	54.4 Å²	54.4	7%	0.072	27%	0.271	C	S	.	.	H	α-helix	trans	-73.6	-39.9	175	-65.9	-172.1	-69.5	126.2	12.6	111.3	S201 P202 I203 G204 P325 P326	S201-R206 WeakPolarHBondContact O-CD 3.49Å; S201-R206 PolarHBondContact O-NE 2.82Å; P202-R206 PolarHBondContact O-N 2.8Å; P202-R206 VanDerWaalsContact O-N 3.16Å; I203-R206 PolarHBondContact O-N 2.94Å; G204-R206 VanDerWaalsContact C-N 3.29Å; G204-R206 PolarHBondContact O-N 3.49Å; R206-P325 VanDerWaalsContact NH2-CA 3.29Å; R206-P326 VanDerWaalsContact NH1-CD 3.33Å
207	L	57	Low	54.5	Low	26 Å²	26	57.2 Å²	57.2	14%	0.136	29%	0.286	C	S	.	.	H	α-helix	trans	-68.1	-36	174.5	-65	172.3	0	0	0	112.6	Q52 E53 Y56 F68 P70 I203 G204 L323	Q52-L207 HydrophobicContact CB-CD2 4.19Å; E53-L207 HydrophobicContact CG-CD2 4.33Å; Y56-L207 HydrophobicContact CD2-CD1 3.89Å; Y56-L207 HydrophobicContact CE2-CD1 4.42Å; Y56-L207 HydrophobicContact CG-CD1 4.04Å; F68-L207 HydrophobicContact CE1-CD1 4.37Å; P70-L207 HydrophobicContact CB-CD1 4.5Å; I203-L207 HydrophobicContact CG2-CD1 4.07Å; I203-L207 HydrophobicContact CG2-CG 4.5Å; I203-L207 WeakPolarHBondContact O-CG 3.46Å; I203-L207 PolarHBondContact O-N 3.41Å; G204-L207 PolarHBondContact O-N 3.04Å; L207-L323 HydrophobicContact CD1-CD1 4.13Å; L207-L323 HydrophobicContact CD2-CD1 4.38Å
208	L	54.3	Low	55	Low	109 Å²	109	58.2 Å²	58.2	57%	0.571	29%	0.292	S	S	*	.	H	α-helix	trans	-84.6	-18.1	179	-67.6	166.3	0	0	0	113.2	G204 S210	G204-L208 WeakPolarHBondContact O-CB 3.38Å; G204-L208 WeakPolarHBondContact O-CD1 3.35Å; G204-L208 VanDerWaalsContact O-CG 3.29Å; G204-L208 WeakPolarHBondContact O-CG 3.34Å; G204-L208 PolarHBondContact O-N 3.07Å; L208-S210 VanDerWaalsContact C-N 3.31Å; L208-S210 PolarHBondContact O-N 2.98Å
209	G	51.7	Low	55.7	Low	22 Å²	22	54.7 Å²	54.7	23%	0.227	28%	0.276	C	S	.	.			trans	-82.5	47.6	-171.6	0	0	0	0	0	115.8	Q205 K211	Q205-G209 WeakPolarHBondContact O-CA 2.99Å; Q205-G209 PolarHBondContact O-N 3.06Å; G209-K211 PolarHBondContact O-N 2.94Å
210	S	47.8	Very low	56.6	Low	83 Å²	83	55.7 Å²	55.7	58%	0.58	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	2.7	-171.7	-167.2	0	0	0	0	116.3	L208	L208-S210 VanDerWaalsContact C-N 3.31Å; L208-S210 PolarHBondContact O-N 2.98Å
211	K	49.3	Very low	57.8	Low	207 Å²	207	60.3 Å²	60.3	90%	0.9	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	3.1	-173.5	-63.5	-171.4	-177.9	-178.9	0	115.9	G209	G209-K211 PolarHBondContact O-N 2.94Å
212	R	54.6	Low	59	Low	149 Å²	149	60 Å²	60	56%	0.562	31%	0.306	S	S	*	.	S	Bend	trans	-90.8	143.2	179.4	-61.2	178.1	-177.5	171	3.1	109.6	M214	R212-M214 HydrophobicContact CB-CE 3.94Å; R212-M214 VanDerWaalsContact O-CE 3.3Å; R212-M214 WeakPolarHBondContact O-CE 3.28Å; R212-M214 PolarHBondContact O-N 3.04Å
213	K	54.1	Low	60.5	Low	167 Å²	167	60.2 Å²	60.2	73%	0.726	31%	0.306	S	S	*	.			trans	-80.5	112.3	174.4	-69.8	-180	175.2	-172.3	0	108.4	P161	P161-K213 HydrophobicContact CG-CD 3.63Å
214	M	62.8	Low	62	Low	49 Å²	49	60 Å²	60	24%	0.241	31%	0.305	C	S	.	.			trans	-85.2	154.4	177.1	-66.6	84.2	-164.3	0	0	111.3	E45 L46 L49 R212	E45-M214 HydrophobicContact CB-CB 4.15Å; L46-M214 HydrophobicContact CB-CB 4.15Å; L46-M214 HydrophobicContact CD1-CB 4.47Å; L46-M214 HydrophobicContact CD1-SD 4.23Å; L49-M214 HydrophobicContact CD1-CE 3.27Å; L49-M214 HydrophobicContact CD1-CG 4.13Å; L49-M214 HydrophobicContact CD1-SD 3.97Å; R212-M214 HydrophobicContact CB-CE 3.94Å; R212-M214 VanDerWaalsContact O-CE 3.3Å; R212-M214 WeakPolarHBondContact O-CE 3.28Å; R212-M214 PolarHBondContact O-N 3.04Å
215	S	61.3	Low	63.6	Low	32 Å²	32	62.6 Å²	62.6	22%	0.224	32%	0.316	C	S	.	.			trans	-74.5	149.7	175.3	75.9	0	0	0	0	111.5	E45 Q195 N217	E45-S215 WeakPolarHBondContact CG-OG 3.36Å; E45-S215 WeakPolarHBondContact OE2-CB 3.49Å; E45-S215 PolarHBondContact OE2-N 3.01Å; E45-S215 PolarHBondContact OE2-OG 2.7Å; Q195-S215 PolarHBondContact NE2-OG 2.91Å; S215-N217 VanDerWaalsContact C-N 3.28Å
216	L	60.1	Low	65	Low	43 Å²	43	59.1 Å²	59.1	23%	0.225	30%	0.3	C	S	.	.	S	Bend	trans	-95.2	12.1	176.2	-54.6	179.6	0	0	0	112	L46 A435 F438 I439	L46-L216 HydrophobicContact CB-CD2 4.21Å; L46-L216 HydrophobicContact CD2-CD2 3.82Å; L216-A435 HydrophobicContact CD1-CB 4.08Å; L216-A435 HydrophobicContact CD2-CB 3.69Å; L216-F438 HydrophobicContact CB-CD1 3.54Å; L216-F438 HydrophobicContact CB-CE1 3.61Å; L216-F438 HydrophobicContact CD1-CB 3.91Å; L216-F438 HydrophobicContact CD1-CD1 3.55Å; L216-F438 HydrophobicContact CD1-CE1 4.25Å; L216-F438 HydrophobicContact CD1-CG 3.81Å; L216-F438 HydrophobicContact CG-CD1 4.19Å; L216-I439 HydrophobicContact CD2-CD1 4.43Å
217	N	60.9	Low	66.6	Low	69 Å²	69	58.2 Å²	58.2	37%	0.369	30%	0.297	S	S	.	.	S	Bend	trans	-92	141.2	174.8	-69.5	-33.7	0	0	0	109.6	S44 E45 S215 R442	S44-N217 WeakPolarHBondContact CA-O 3.36Å; E45-N217 PolarHBondContact N-O 3.04Å; S215-N217 VanDerWaalsContact C-N 3.28Å; N217-R442 PolarHBondContact OD1-NH1 3.39Å
218	P	59.5	Low	68.2	Low	30 Å²	30	59.2 Å²	59.2	20%	0.195	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-51.5	140	165.4	-22.9	30.8	0	0	0	109.5	L43 A220	L43-P218 WeakPolarHBondContact O-CA 3.34Å; P218-A220 PolarHBondContact O-N 3.05Å
219	I	63.3	Low	70	Confident	6 Å²	6	55.8 Å²	55.8	3%	0.031	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-73.8	125.3	174.3	-51.6	-176.1	0	0	0	106.9	E45 L199 Q222 P326	E45-I219 HydrophobicContact CB-CD1 4.37Å; E45-I219 HydrophobicContact CB-CG1 4.42Å; E45-I219 HydrophobicContact CG-CD1 3.61Å; E45-I219 HydrophobicContact CG-CG1 3.42Å; E45-I219 VanDerWaalsContact CG-CG1 3.42Å; L199-I219 HydrophobicContact CD1-CD1 4.21Å; L199-I219 HydrophobicContact CD1-CG2 4.5Å; I219-Q222 HydrophobicContact CG2-CG 4.16Å; I219-P326 HydrophobicContact CD1-CB 4.31Å; I219-P326 HydrophobicContact CD1-CG 4.21Å
220	A	65.7	Low	72	Confident	44 Å²	44	54.7 Å²	54.7	36%	0.364	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-66.5	136.2	168.2	0	0	0	0	0	108.9	Q192 P218 Q222	Q192-A220 HydrophobicContact CG-CB 4.24Å; P218-A220 PolarHBondContact O-N 3.05Å; A220-Q222 VanDerWaalsContact O-CG 3.31Å; A220-Q222 WeakPolarHBondContact O-CG 3.48Å; A220-Q222 PolarHBondContact O-N 2.71Å
221	Q	72.9	Confident	74.2	Confident	103 Å²	103	50.8 Å²	50.8	48%	0.481	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-50.2	128.8	-174.5	-80.3	178.7	-22.6	0	0	112.1	H41 I223	H41-Q221 VanDerWaalsContact CD2-CG 3.42Å; H41-Q221 WeakPolarHBondContact CD2-CG 3.29Å; H41-Q221 PolarHBondContact CD2-NE2 3.35Å; Q221-I223 HydrophobicContact CB-CD1 4Å; Q221-I223 HydrophobicContact CB-CG1 4.32Å; Q221-I223 HydrophobicContact CG-CD1 4.46Å; Q221-I223 PolarHBondContact O-N 3.31Å
222	Q	78.2	Confident	76.3	Confident	3 Å²	3	45.8 Å²	45.8	1%	0.014	22%	0.224	C	C	.	.			trans	-102.5	64.4	-173.6	-63.3	179.1	-18.6	0	0	110.3	L109 L196 L199 I219 A220 C327 D330 T331	L109-Q222 HydrophobicContact CD1-CB 4.05Å; L196-Q222 HydrophobicContact CD2-CB 4.16Å; L196-Q222 HydrophobicContact CD2-CG 3.72Å; L196-Q222 HydrophobicContact CG-CG 4.33Å; L199-Q222 VanDerWaalsContact CD1-NE2 3.31Å; I219-Q222 HydrophobicContact CG2-CG 4.16Å; A220-Q222 VanDerWaalsContact O-CG 3.31Å; A220-Q222 WeakPolarHBondContact O-CG 3.48Å; A220-Q222 PolarHBondContact O-N 2.71Å; Q222-C327 HydrophobicContact CB-CB 4.27Å; Q222-C327 PolarHBondContact OE1-SG 3.18Å; Q222-D330 PolarHBondContact N-OD2 3.31Å; Q222-D330 VanDerWaalsContact N-OD2 3.09Å; Q222-T331 PolarHBondContact O-OG1 3.2Å
223	I	86	Confident	78.2	Confident	24 Å²	24	39 Å²	39	12%	0.123	20%	0.199	C	C	.	.			trans	-106.2	127.2	-176.7	-58.1	162.5	0	0	0	108.8	Q221 V227 E228 D330 R334	Q221-I223 HydrophobicContact CB-CD1 4Å; Q221-I223 HydrophobicContact CB-CG1 4.32Å; Q221-I223 HydrophobicContact CG-CD1 4.46Å; Q221-I223 PolarHBondContact O-N 3.31Å; I223-V227 HydrophobicContact CG2-CB 4.19Å; I223-V227 HydrophobicContact CG2-CG1 4.28Å; I223-E228 HydrophobicContact CG2-CB 4.17Å; I223-D330 HydrophobicContact CG1-CB 4.27Å; I223-R334 HydrophobicContact CD1-CB 3.83Å; I223-R334 HydrophobicContact CD1-CG 4.17Å; I223-R334 HydrophobicContact CG1-CB 4.26Å; I223-R334 HydrophobicContact CG2-CB 4.23Å; I223-R334 HydrophobicContact CG2-CG 4.03Å
224	P	88.6	Confident	80.1	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.165	C	C	.	.			trans	-61.6	141.2	174.1	-21.9	31.8	0	0	0	112.2	L105 V108 L109 E112 I226 V227 E228 F285 T331	L105-P224 HydrophobicContact CD1-CG 3.34Å; V108-P224 HydrophobicContact CG1-CB 4.09Å; L109-P224 HydrophobicContact CD2-CB 4.4Å; L109-P224 HydrophobicContact CD2-CG 4.03Å; L109-P224 HydrophobicContact CG-CG 4.42Å; E112-P224 WeakPolarHBondContact OE2-CA 3.28Å; P224-I226 HydrophobicContact CB-CG2 3.95Å; P224-I226 PolarHBondContact O-N 3.31Å; P224-V227 HydrophobicContact CB-CG2 4.27Å; P224-V227 HydrophobicContact CG-CG2 4.29Å; P224-V227 PolarHBondContact O-N 3.02Å; P224-E228 PolarHBondContact O-N 3.49Å; P224-F285 HydrophobicContact CB-CZ 4.46Å; P224-F285 HydrophobicContact CG-CZ 4.31Å; P224-T331 VanDerWaalsContact CD-OG1 3.32Å; P224-T331 WeakPolarHBondContact CD-OG1 3.08Å
225	Q	86.1	Confident	81.5	Confident	54 Å²	54	30.4 Å²	30.4	25%	0.252	16%	0.161	S	C	.	.	H	α-helix	trans	-51.9	-40.2	176.7	-105.1	164.3	5.8	0	0	112.9	E112 R116 V227 E228 T229	E112-Q225 VanDerWaalsContact CD-CB 3.45Å; E112-Q225 VanDerWaalsContact CD-CD 3.5Å; E112-Q225 HydrophobicContact CG-CB 4.38Å; E112-Q225 HydrophobicContact CG-CG 4.39Å; E112-Q225 VanDerWaalsContact OE1-CB 3.28Å; E112-Q225 WeakPolarHBondContact OE1-CB 3.5Å; E112-Q225 WeakPolarHBondContact OE1-CG 3.44Å; E112-Q225 PolarHBondContact OE1-N 2.85Å; E112-Q225 PolarHBondContact OE1-NE2 3.48Å; E112-Q225 PolarHBondContact OE1-OE1 3Å; E112-Q225 PolarHBondContact OE2-N 3.46Å; R116-Q225 VanDerWaalsContact NH2-NE2 3.14Å; Q225-V227 VanDerWaalsContact C-N 3.34Å; Q225-V227 PolarHBondContact O-N 3.41Å; Q225-E228 PolarHBondContact O-N 3.13Å; Q225-T229 VanDerWaalsContact O-CB 3.23Å; Q225-T229 WeakPolarHBondContact O-CB 3.5Å; Q225-T229 PolarHBondContact O-N 3.36Å; Q225-T229 PolarHBondContact O-OG1 3.11Å
226	I	90.5	Very high	83	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.015	18%	0.184	C	C	.	.	H	α-helix	trans	-59.2	-45.2	178.2	-177.1	169.5	0	0	0	111.8	F101 P224 C230 F261 F285	F101-I226 HydrophobicContact CE1-CD1 3.8Å; F101-I226 HydrophobicContact CE2-CD1 3.81Å; F101-I226 HydrophobicContact CZ-CD1 3.17Å; P224-I226 HydrophobicContact CB-CG2 3.95Å; P224-I226 PolarHBondContact O-N 3.31Å; I226-C230 VanDerWaalsContact O-CB 3.27Å; I226-C230 WeakPolarHBondContact O-CB 3.37Å; I226-C230 PolarHBondContact O-N 3Å; I226-C230 PolarHBondContact O-SG 2.87Å; I226-F261 HydrophobicContact CB-CD1 3.99Å; I226-F261 HydrophobicContact CB-CE1 3.96Å; I226-F261 HydrophobicContact CB-CZ 4.48Å; I226-F261 HydrophobicContact CD1-CD1 4.42Å; I226-F261 HydrophobicContact CD1-CD2 4.14Å; I226-F261 HydrophobicContact CD1-CE2 4.49Å; I226-F261 HydrophobicContact CD1-CG 4.12Å; I226-F261 HydrophobicContact CG1-CD1 4.19Å; I226-F261 HydrophobicContact CG1-CD2 4.35Å; I226-F261 HydrophobicContact CG1-CE1 4.09Å; I226-F261 HydrophobicContact CG1-CE2 4.27Å; I226-F261 HydrophobicContact CG1-CG 4.33Å; I226-F261 HydrophobicContact CG1-CZ 4.14Å; I226-F285 HydrophobicContact CD1-CB 4.19Å; I226-F285 HydrophobicContact CD1-CD2 3.98Å; I226-F285 HydrophobicContact CD1-CG 4.22Å; I226-F285 HydrophobicContact CG2-CD1 4.42Å; I226-F285 HydrophobicContact CG2-CD2 3.87Å; I226-F285 HydrophobicContact CG2-CE1 4.27Å; I226-F285 HydrophobicContact CG2-CE2 3.7Å; I226-F285 HydrophobicContact CG2-CG 4.23Å; I226-F285 HydrophobicContact CG2-CZ 3.91Å
227	V	93.1	Very high	84.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-66.4	-46.5	179.1	179.1	0	0	0	0	109.7	I223 P224 Q225 T229 C231 L282 F285 F286 T331 R334	I223-V227 HydrophobicContact CG2-CB 4.19Å; I223-V227 HydrophobicContact CG2-CG1 4.28Å; P224-V227 HydrophobicContact CB-CG2 4.27Å; P224-V227 HydrophobicContact CG-CG2 4.29Å; P224-V227 PolarHBondContact O-N 3.02Å; Q225-V227 VanDerWaalsContact C-N 3.34Å; Q225-V227 PolarHBondContact O-N 3.41Å; V227-T229 PolarHBondContact O-N 2.76Å; V227-C231 WeakPolarHBondContact O-CB 3.34Å; V227-C231 PolarHBondContact O-N 3.5Å; V227-C231 PolarHBondContact O-SG 3.33Å; V227-L282 HydrophobicContact CG1-CD1 4.43Å; V227-L282 HydrophobicContact CG2-CD1 4.4Å; V227-F285 HydrophobicContact CG2-CD1 3.87Å; V227-F285 HydrophobicContact CG2-CE1 3.55Å; V227-F285 HydrophobicContact CG2-CZ 4.39Å; V227-F286 HydrophobicContact CG1-CZ 4.17Å; V227-F286 HydrophobicContact CG2-CE1 4.3Å; V227-F286 HydrophobicContact CG2-CZ 3.87Å; V227-T331 HydrophobicContact CG1-CG2 4.21Å; V227-T331 HydrophobicContact CG2-CG2 4.04Å; V227-R334 HydrophobicContact CG1-CG 4.21Å
228	E	91.6	Very high	85.6	Confident	47 Å²	47	34.3 Å²	34.3	22%	0.22	17%	0.17	C	C	.	.	H	α-helix	trans	-61.8	-44.4	-179	-174.7	64.9	-172.6	0	0	112.4	I223 P224 Q225 K232 R334	I223-E228 HydrophobicContact CG2-CB 4.17Å; P224-E228 PolarHBondContact O-N 3.49Å; Q225-E228 PolarHBondContact O-N 3.13Å; E228-K232 HydrophobicContact CG-CD 4.2Å; E228-K232 VanDerWaalsContact O-CB 3.26Å; E228-K232 WeakPolarHBondContact O-CB 3.49Å; E228-K232 VanDerWaalsContact O-CG 3.24Å; E228-K232 WeakPolarHBondContact O-CG 3.37Å; E228-K232 PolarHBondContact O-N 3.25Å; E228-K232 WeakPolarHBondContact OE1-CE 3.18Å; E228-K232 IonicContact OE1-NZ 2.7Å; E228-K232 PolarHBondContact OE1-NZ 2.95Å; E228-R334 IonicContact OE1-NE 3.2Å; E228-R334 WeakPolarHBondContact OE2-CD 3.36Å; E228-R334 IonicContact OE2-CZ 2.84Å; E228-R334 IonicContact OE2-NE 2.67Å; E228-R334 PolarHBondContact OE2-NE 2.87Å
229	T	91.4	Very high	87.1	Confident	36 Å²	36	35.1 Å²	35.1	22%	0.221	17%	0.172	C	C	.	.	H	α-helix	trans	-70.3	-48.9	-177.2	-52.1	0	0	0	0	110.9	Q225 V227 K232 F233 L269	Q225-T229 VanDerWaalsContact O-CB 3.23Å; Q225-T229 WeakPolarHBondContact O-CB 3.5Å; Q225-T229 PolarHBondContact O-N 3.36Å; Q225-T229 PolarHBondContact O-OG1 3.11Å; V227-T229 PolarHBondContact O-N 2.76Å; T229-K232 PolarHBondContact O-N 3.04Å; T229-F233 WeakPolarHBondContact O-CB 3.29Å; T229-F233 PolarHBondContact O-N 3.36Å; T229-L269 HydrophobicContact CG2-CD1 3.9Å; T229-L269 HydrophobicContact CG2-CG 4.07Å
230	C	93.6	Very high	88.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.9	-45.5	177.7	-66.6	0	0	0	0	111.6	I226 K232 F233 I234 V278 L282	I226-C230 VanDerWaalsContact O-CB 3.27Å; I226-C230 WeakPolarHBondContact O-CB 3.37Å; I226-C230 PolarHBondContact O-N 3Å; I226-C230 PolarHBondContact O-SG 2.87Å; C230-K232 PolarHBondContact O-N 3.46Å; C230-F233 PolarHBondContact O-N 2.7Å; C230-I234 WeakPolarHBondContact O-CB 3.29Å; C230-I234 WeakPolarHBondContact O-CD1 3.33Å; C230-I234 VanDerWaalsContact O-CG1 3.26Å; C230-I234 WeakPolarHBondContact O-CG1 3.34Å; C230-I234 PolarHBondContact O-N 3.31Å; C230-V278 HydrophobicContact CB-CG1 3.8Å; C230-L282 HydrophobicContact CB-CB 4.12Å; C230-L282 HydrophobicContact CB-CD1 4.1Å; C230-L282 HydrophobicContact CB-CD2 4.43Å; C230-L282 HydrophobicContact CB-CG 4.45Å
231	C	94.9	Very high	89.4	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-65.3	-39.7	178.5	-70.2	0	0	0	0	112.1	V227 I234 E235 A338	V227-C231 WeakPolarHBondContact O-CB 3.34Å; V227-C231 PolarHBondContact O-N 3.5Å; V227-C231 PolarHBondContact O-SG 3.33Å; C231-I234 PolarHBondContact O-N 3.25Å; C231-E235 WeakPolarHBondContact O-CB 3.04Å; C231-E235 VanDerWaalsContact O-CG 3.25Å; C231-E235 WeakPolarHBondContact O-CG 3.4Å; C231-E235 PolarHBondContact O-N 3.13Å; C231-A338 HydrophobicContact CB-CB 3.92Å
232	K	93.6	Very high	90.2	Very high	101 Å²	101	35.9 Å²	35.9	44%	0.439	18%	0.183	S	C	.	.	H	α-helix	trans	-62	-43	174.8	-83.8	174.6	172.5	152.6	0	112.1	E228 T229 C230 E235 K236	E228-K232 HydrophobicContact CG-CD 4.2Å; E228-K232 VanDerWaalsContact O-CB 3.26Å; E228-K232 WeakPolarHBondContact O-CB 3.49Å; E228-K232 VanDerWaalsContact O-CG 3.24Å; E228-K232 WeakPolarHBondContact O-CG 3.37Å; E228-K232 PolarHBondContact O-N 3.25Å; E228-K232 WeakPolarHBondContact OE1-CE 3.18Å; E228-K232 IonicContact OE1-NZ 2.7Å; E228-K232 PolarHBondContact OE1-NZ 2.95Å; T229-K232 PolarHBondContact O-N 3.04Å; C230-K232 PolarHBondContact O-N 3.46Å; K232-E235 PolarHBondContact O-N 3.35Å; K232-K236 WeakPolarHBondContact O-CG 3.34Å; K232-K236 PolarHBondContact O-N 2.92Å
233	F	93.8	Very high	90.7	Very high	8 Å²	8	36 Å²	36	4%	0.035	19%	0.186	C	C	.	.	H	α-helix	trans	-64.3	-46.8	178.7	-176.2	-97.4	0	0	0	111.4	T229 C230 E235 K236 H237 L269 D270 V273 V275 V278	T229-F233 WeakPolarHBondContact O-CB 3.29Å; T229-F233 PolarHBondContact O-N 3.36Å; C230-F233 PolarHBondContact O-N 2.7Å; F233-E235 VanDerWaalsContact C-N 3.33Å; F233-E235 PolarHBondContact O-N 2.74Å; F233-K236 PolarHBondContact O-N 2.68Å; F233-K236 VanDerWaalsContact O-N 3.1Å; F233-H237 AromaticContact CD2-CD2 3.52Å; F233-H237 AromaticContact CE2-CD2 3.42Å; F233-H237 VanDerWaalsContact CE2-CD2 3.42Å; F233-H237 WeakPolarHBondContact CE2-CD2 3.46Å; F233-H237 AromaticContact CE2-NE2 3.98Å; F233-H237 HydrophobicContact CZ-CB 4.41Å; F233-H237 AromaticContact CZ-CD2 3.92Å; F233-H237 PolarHBondContact O-CD2 3.45Å; F233-H237 PolarHBondContact O-N 3.45Å; F233-L269 HydrophobicContact CB-CB 4.3Å; F233-L269 HydrophobicContact CB-CD1 3.78Å; F233-L269 HydrophobicContact CD1-CD1 4.41Å; F233-L269 HydrophobicContact CD2-CB 3.45Å; F233-L269 VanDerWaalsContact CD2-CB 3.45Å; F233-L269 HydrophobicContact CD2-CD1 4.34Å; F233-L269 HydrophobicContact CE2-CB 3.9Å; F233-L269 HydrophobicContact CG-CB 3.91Å; F233-L269 HydrophobicContact CG-CD1 3.93Å; F233-D270 WeakPolarHBondContact CE2-O 3.35Å; F233-V273 HydrophobicContact CZ-CB 4.11Å; F233-V273 WeakPolarHBondContact CZ-O 3.46Å; F233-V275 HydrophobicContact CE1-CG2 4.01Å; F233-V278 HydrophobicContact CD1-CB 4Å; F233-V278 HydrophobicContact CD1-CG1 3.93Å; F233-V278 HydrophobicContact CD1-CG2 3.79Å; F233-V278 HydrophobicContact CE1-CB 4.33Å; F233-V278 HydrophobicContact CE1-CG2 3.81Å
234	I	93.9	Very high	91	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-62.3	-39.6	177.4	-69.5	165.9	0	0	0	111.6	C230 C231 K236 G238 I244 F245 V278 A279 L282 I342	C230-I234 WeakPolarHBondContact O-CB 3.29Å; C230-I234 WeakPolarHBondContact O-CD1 3.33Å; C230-I234 VanDerWaalsContact O-CG1 3.26Å; C230-I234 WeakPolarHBondContact O-CG1 3.34Å; C230-I234 PolarHBondContact O-N 3.31Å; C231-I234 PolarHBondContact O-N 3.25Å; I234-K236 PolarHBondContact O-N 2.83Å; I234-G238 CarbonylContact O-C 3.6Å; I234-G238 WeakPolarHBondContact O-CA 2.88Å; I234-G238 PolarHBondContact O-N 3.26Å; I234-I244 HydrophobicContact CB-CD1 4.49Å; I234-I244 HydrophobicContact CG1-CD1 4.42Å; I234-I244 HydrophobicContact CG2-CD1 3.5Å; I234-I244 VanDerWaalsContact CG2-CD1 3.5Å; I234-F245 HydrophobicContact CD1-CE1 4.26Å; I234-F245 HydrophobicContact CD1-CZ 3.89Å; I234-V278 HydrophobicContact CD1-CG1 4.41Å; I234-V278 HydrophobicContact CG1-CG1 4.32Å; I234-A279 HydrophobicContact CD1-CB 4.32Å; I234-L282 HydrophobicContact CD1-CD2 4.05Å; I234-I342 HydrophobicContact CG2-CD1 3.65Å; I234-I342 HydrophobicContact CG2-CG1 4.31Å
235	E	93.1	Very high	91.1	Very high	32 Å²	32	35.3 Å²	35.3	15%	0.15	18%	0.182	C	C	.	.	H	α-helix	trans	-66.1	-25.3	176	-77	171.8	-144.2	0	0	113.5	C231 K232 F233 L239 R334 A338 K341	C231-E235 WeakPolarHBondContact O-CB 3.04Å; C231-E235 VanDerWaalsContact O-CG 3.25Å; C231-E235 WeakPolarHBondContact O-CG 3.4Å; C231-E235 PolarHBondContact O-N 3.13Å; K232-E235 PolarHBondContact O-N 3.35Å; F233-E235 VanDerWaalsContact C-N 3.33Å; F233-E235 PolarHBondContact O-N 2.74Å; E235-L239 WeakPolarHBondContact O-CD1 3.1Å; E235-L239 VanDerWaalsContact O-CG 3.31Å; E235-L239 WeakPolarHBondContact O-CG 3.44Å; E235-R334 IonicContact OE1-CZ 3.05Å; E235-R334 IonicContact OE1-NH1 3.2Å; E235-R334 PolarHBondContact OE1-NH1 2.96Å; E235-R334 IonicContact OE1-NH2 3.76Å; E235-R334 PolarHBondContact OE1-NH2 3.27Å; E235-R334 IonicContact OE2-NH2 2.55Å; E235-A338 HydrophobicContact CG-CB 4.41Å; E235-A338 WeakPolarHBondContact OE1-CB 3.33Å; E235-K341 HydrophobicContact CG-CD 3.88Å; E235-K341 IonicContact OE2-NZ 2.77Å; E235-K341 PolarHBondContact OE2-NZ 2.9Å
236	K	91.7	Very high	91.4	Very high	165 Å²	165	36.6 Å²	36.6	72%	0.717	19%	0.193	S	C	*	.	H	α-helix	trans	-88.3	-45	179.1	-73.2	179	177.3	-171.3	0	112.7	K232 F233 I234	K232-K236 WeakPolarHBondContact O-CG 3.34Å; K232-K236 PolarHBondContact O-N 2.92Å; F233-K236 PolarHBondContact O-N 2.68Å; F233-K236 VanDerWaalsContact O-N 3.1Å; I234-K236 PolarHBondContact O-N 2.83Å
237	H	89.6	Confident	91.3	Very high	62 Å²	62	40.2 Å²	40.2	29%	0.287	21%	0.212	S	C	.	.	H	α-helix	trans	-111.4	-19.5	-169.7	-55.1	-75	0	0	0	113.4	F233 S241 D271 V275	F233-H237 AromaticContact CD2-CD2 3.52Å; F233-H237 AromaticContact CE2-CD2 3.42Å; F233-H237 VanDerWaalsContact CE2-CD2 3.42Å; F233-H237 WeakPolarHBondContact CE2-CD2 3.46Å; F233-H237 AromaticContact CE2-NE2 3.98Å; F233-H237 HydrophobicContact CZ-CB 4.41Å; F233-H237 AromaticContact CZ-CD2 3.92Å; F233-H237 PolarHBondContact O-CD2 3.45Å; F233-H237 PolarHBondContact O-N 3.45Å; H237-S241 PolarHBondContact O-OG 3.05Å; H237-D271 IonicContact CE1-OD1 3.91Å; H237-D271 PolarHBondContact CE1-OD1 2.97Å; H237-D271 IonicContact ND1-OD1 3.44Å; H237-D271 IonicContact NE2-OD1 3.86Å; H237-D271 PolarHBondContact NE2-OD1 2.95Å; H237-V275 HydrophobicContact CB-CG2 3.8Å
238	G	86.9	Confident	91	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.251	C	S	.	.	S	Bend	trans	-98.8	-6.2	-169.9	0	0	0	0	0	116.4	I234 S240 S241	I234-G238 CarbonylContact O-C 3.6Å; I234-G238 WeakPolarHBondContact O-CA 2.88Å; I234-G238 PolarHBondContact O-N 3.26Å; G238-S240 VanDerWaalsContact C-N 3.31Å; G238-S240 PolarHBondContact O-N 3.34Å; G238-S241 WeakPolarHBondContact O-CB 3.42Å; G238-S241 PolarHBondContact O-N 2.78Å
239	L	90.1	Very high	91	Very high	46 Å²	46	50.3 Å²	50.3	24%	0.241	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-33	-174.7	-65.1	-178.6	0	0	0	113.5	E235 K341 I342 N345 N360	E235-L239 WeakPolarHBondContact O-CD1 3.1Å; E235-L239 VanDerWaalsContact O-CG 3.31Å; E235-L239 WeakPolarHBondContact O-CG 3.44Å; L239-K341 HydrophobicContact CD2-CB 4.34Å; L239-I342 HydrophobicContact CD2-CG1 4.08Å; L239-N345 HydrophobicContact CB-CB 4.41Å; L239-N360 WeakPolarHBondContact O-CB 3.23Å; L239-N360 PolarHBondContact O-ND2 3.06Å
240	S	87.1	Confident	91.2	Very high	71 Å²	71	50.6 Å²	50.6	50%	0.497	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-2	176.4	54	0	0	0	0	113.5	G238 V242	G238-S240 VanDerWaalsContact C-N 3.31Å; G238-S240 PolarHBondContact O-N 3.34Å; S240-V242 PolarHBondContact O-N 3.43Å
241	S	89.9	Confident	91.1	Very high	26 Å²	26	55.6 Å²	55.6	18%	0.182	29%	0.286	C	S	.	.			trans	-75.4	111.4	-179.4	-66.2	0	0	0	0	110.3	H237 G238 G243 I244 N360	H237-S241 PolarHBondContact O-OG 3.05Å; G238-S241 WeakPolarHBondContact O-CB 3.42Å; G238-S241 PolarHBondContact O-N 2.78Å; S241-G243 PolarHBondContact O-N 3.23Å; S241-I244 PolarHBondContact O-N 3.4Å; S241-N360 WeakPolarHBondContact O-CB 3.41Å
242	V	90.6	Very high	91	Very high	72 Å²	72	65.2 Å²	65.2	44%	0.436	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	134.2	178.7	-177.4	0	0	0	0	110.3	S240 I244 I247 H276 N360 R361	S240-V242 PolarHBondContact O-N 3.43Å; V242-I244 VanDerWaalsContact C-N 3.33Å; V242-I244 PolarHBondContact O-N 3.03Å; V242-I247 WeakPolarHBondContact O-CD1 3.44Å; V242-H276 PolarHBondContact O-CE1 3.24Å; V242-N360 CarbonylContact C-O 3.59Å; V242-N360 WeakPolarHBondContact CA-O 3.39Å; V242-R361 HydrophobicContact CG1-CG 4.18Å
243	G	89.1	Confident	90.9	Very high	7 Å²	7	66.8 Å²	66.8	7%	0.072	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	32.7	172.7	0	0	0	0	0	114.6	S241 F245 T246 I247 N360	S241-G243 PolarHBondContact O-N 3.23Å; G243-F245 PolarHBondContact O-N 3.28Å; G243-T246 WeakPolarHBondContact CA-OG1 3.34Å; G243-T246 PolarHBondContact O-N 3.08Å; G243-T246 PolarHBondContact O-OG1 3.2Å; G243-I247 WeakPolarHBondContact O-CG1 3.39Å; G243-I247 PolarHBondContact O-N 3.32Å; G243-I247 VanDerWaalsContact O-N 3.11Å; G243-N360 PolarHBondContact N-O 3.06Å
244	I	91.7	Very high	90.9	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	134.6	174.1	-164.3	163.8	0	0	0	110.8	I234 S241 V242 T246 V275 A279 I342 M362	I234-I244 HydrophobicContact CB-CD1 4.49Å; I234-I244 HydrophobicContact CG1-CD1 4.42Å; I234-I244 HydrophobicContact CG2-CD1 3.5Å; I234-I244 VanDerWaalsContact CG2-CD1 3.5Å; S241-I244 PolarHBondContact O-N 3.4Å; V242-I244 VanDerWaalsContact C-N 3.33Å; V242-I244 PolarHBondContact O-N 3.03Å; I244-T246 VanDerWaalsContact C-N 3.3Å; I244-T246 PolarHBondContact O-N 2.77Å; I244-V275 HydrophobicContact CD1-CG1 3.51Å; I244-V275 HydrophobicContact CG1-CG1 4.27Å; I244-A279 HydrophobicContact CG1-CB 4.01Å; I244-I342 HydrophobicContact CG2-CD1 4.37Å; I244-I342 HydrophobicContact CG2-CG2 3.64Å; I244-M362 HydrophobicContact CG2-CB 4.45Å; I244-M362 HydrophobicContact CG2-CG 3.99Å
245	F	91.7	Very high	90.8	Very high	8 Å²	8	70 Å²	70	4%	0.035	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	-10	-170.2	-54.4	-79.4	0	0	0	118.4	I234 G243 A279 L282 L339 I342 L367 V370 F371	I234-F245 HydrophobicContact CD1-CE1 4.26Å; I234-F245 HydrophobicContact CD1-CZ 3.89Å; G243-F245 PolarHBondContact O-N 3.28Å; F245-A279 HydrophobicContact CD1-CB 3.63Å; F245-A279 WeakPolarHBondContact CD1-O 2.99Å; F245-A279 HydrophobicContact CE1-CB 3.71Å; F245-A279 WeakPolarHBondContact CE1-O 3.35Å; F245-A279 HydrophobicContact CG-CB 4.18Å; F245-A279 HydrophobicContact CZ-CB 4.34Å; F245-L282 HydrophobicContact CE1-CD2 4.25Å; F245-L282 HydrophobicContact CZ-CD2 4.27Å; F245-L339 HydrophobicContact CE2-CD2 3.88Å; F245-L339 HydrophobicContact CZ-CD2 4.2Å; F245-I342 HydrophobicContact CE2-CD1 3.66Å; F245-I342 HydrophobicContact CZ-CD1 4.44Å; F245-L367 HydrophobicContact CD2-CD2 3.69Å; F245-L367 HydrophobicContact CE2-CD2 4.28Å; F245-V370 HydrophobicContact CB-CG1 4.1Å; F245-F371 AromaticContact CD1-CE2 3.96Å; F245-F371 HydrophobicContact CD1-CE2 3.96Å; F245-F371 AromaticContact CD1-CZ 3.82Å; F245-F371 HydrophobicContact CD1-CZ 3.82Å; F245-F371 HydrophobicContact CD2-CE2 4.1Å; F245-F371 HydrophobicContact CE1-CE2 4.02Å; F245-F371 AromaticContact CE1-CZ 3.59Å; F245-F371 HydrophobicContact CE1-CZ 3.59Å; F245-F371 HydrophobicContact CE2-CE2 4.13Å; F245-F371 HydrophobicContact CE2-CZ 4.4Å; F245-F371 HydrophobicContact CG-CE2 4.02Å; F245-F371 HydrophobicContact CG-CZ 4.35Å; F245-F371 HydrophobicContact CZ-CE2 4.1Å; F245-F371 AromaticContact CZ-CZ 3.9Å; F245-F371 HydrophobicContact CZ-CZ 3.9Å
246	T	90.8	Very high	90.7	Very high	81 Å²	81	74.3 Å²	74.3	50%	0.497	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-24.5	-178.7	58.2	0	0	0	0	114	G243 I244 M362 V370	G243-T246 WeakPolarHBondContact CA-OG1 3.34Å; G243-T246 PolarHBondContact O-N 3.08Å; G243-T246 PolarHBondContact O-OG1 3.2Å; I244-T246 VanDerWaalsContact C-N 3.3Å; I244-T246 PolarHBondContact O-N 2.77Å; T246-M362 HydrophobicContact CG2-CE 3.73Å; T246-M362 HydrophobicContact CG2-SD 4.1Å; T246-V370 HydrophobicContact CG2-CG2 3.7Å
247	I	89.8	Confident	90.6	Very high	79 Å²	79	67.3 Å²	67.3	41%	0.405	33%	0.333	S	S	.	.	S	Bend	trans	-78.1	157.1	178.9	-65.7	-177.5	0	0	0	111.8	V242 G243	V242-I247 WeakPolarHBondContact O-CD1 3.44Å; G243-I247 WeakPolarHBondContact O-CG1 3.39Å; G243-I247 PolarHBondContact O-N 3.32Å; G243-I247 VanDerWaalsContact O-N 3.11Å
248	E	85.8	Confident	90.6	Very high	177 Å²	177	66.9 Å²	66.9	83%	0.827	33%	0.329	S	S	*	.			trans	-57.6	147.3	175.6	-61.7	-176	170.9	0	0	113
249	Y	92.6	Very high	90.7	Very high	82 Å²	82	71.9 Å²	71.9	32%	0.322	35%	0.352	S	S	.	.			trans	-132.9	164.7	-178.6	59	-93	0	0	0	110.1	L251 V254 D277 E280	Y249-L251 HydrophobicContact CE2-CB 4.32Å; Y249-L251 PolarHBondContact O-N 3.36Å; Y249-V254 HydrophobicContact CD2-CG2 3.71Å; Y249-V254 HydrophobicContact CE2-CG2 4.3Å; Y249-V254 HydrophobicContact CG-CG2 4.44Å; Y249-D277 WeakPolarHBondContact CB-OD1 3.32Å; Y249-E280 HydrophobicContact CD1-CB 3.77Å; Y249-E280 HydrophobicContact CD1-CG 3.63Å; Y249-E280 WeakPolarHBondContact CD1-OE2 3.24Å; Y249-E280 HydrophobicContact CD2-CB 4.08Å; Y249-E280 HydrophobicContact CD2-CG 3.81Å; Y249-E280 HydrophobicContact CE1-CB 4.08Å; Y249-E280 HydrophobicContact CE1-CG 3.39Å; Y249-E280 VanDerWaalsContact CE1-OE1 3.31Å; Y249-E280 WeakPolarHBondContact CE1-OE1 3.27Å; Y249-E280 WeakPolarHBondContact CE1-OE2 3.32Å; Y249-E280 HydrophobicContact CE2-CB 4.39Å; Y249-E280 HydrophobicContact CE2-CG 3.6Å; Y249-E280 HydrophobicContact CG-CB 3.75Å; Y249-E280 HydrophobicContact CG-CG 3.81Å; Y249-E280 PolarHBondContact OH-OE1 3.39Å
250	S	94.1	Very high	90.5	Very high	42 Å²	42	72.7 Å²	72.7	29%	0.294	36%	0.356	S	S	.	.			trans	-86.2	104.3	174.7	-172.9	0	0	0	0	111	R252 R253 V254 D277	S250-R252 PolarHBondContact O-N 2.93Å; S250-R253 PolarHBondContact O-N 2.94Å; S250-R253 VanDerWaalsContact O-N 3.1Å; S250-V254 WeakPolarHBondContact O-CG2 3.26Å; S250-V254 PolarHBondContact O-N 2.89Å; S250-D277 PolarHBondContact N-OD1 2.89Å
251	L	91.8	Very high	90.5	Very high	106 Å²	106	70 Å²	70	56%	0.555	34%	0.336	S	S	*	.	H	α-helix	trans	-53.8	-38.8	178.4	-172.6	154.5	0	0	0	112.5	Y249 V254 L255	Y249-L251 HydrophobicContact CE2-CB 4.32Å; Y249-L251 PolarHBondContact O-N 3.36Å; L251-V254 PolarHBondContact O-N 3.41Å; L251-L255 HydrophobicContact CD2-CD1 3.48Å; L251-L255 VanDerWaalsContact CD2-CD1 3.48Å; L251-L255 HydrophobicContact CD2-CG 4Å; L251-L255 WeakPolarHBondContact O-CG 3.33Å; L251-L255 PolarHBondContact O-N 3Å
252	R	93.7	Very high	90.2	Very high	202 Å²	202	70.7 Å²	70.7	76%	0.762	34%	0.337	S	S	*	.	H	α-helix	trans	-60.8	-47.6	178.2	-68.3	-176.2	-176.4	168.3	1.5	111.9	S250 L255 E256	S250-R252 PolarHBondContact O-N 2.93Å; R252-L255 PolarHBondContact O-N 3.33Å; R252-E256 WeakPolarHBondContact O-CG 3.45Å; R252-E256 PolarHBondContact O-N 3.44Å
253	R	92.1	Very high	89.7	Confident	135 Å²	135	73.5 Å²	73.5	51%	0.509	34%	0.344	S	S	.	.	H	α-helix	trans	-67.4	-37.7	179.8	-67.6	179.5	178	153.9	-1.8	112.2	S250 L255 E256 L257 D277	S250-R253 PolarHBondContact O-N 2.94Å; S250-R253 VanDerWaalsContact O-N 3.1Å; R253-L255 VanDerWaalsContact C-N 3.33Å; R253-L255 PolarHBondContact O-N 3.46Å; R253-E256 PolarHBondContact O-N 2.99Å; R253-L257 WeakPolarHBondContact O-CG 3.25Å; R253-L257 PolarHBondContact O-N 3.49Å; R253-D277 WeakPolarHBondContact CD-OD2 3.31Å; R253-D277 IonicContact NH1-OD2 3.14Å
254	V	92.8	Very high	88.7	Confident	2 Å²	2	73.7 Å²	73.7	1%	0.012	35%	0.346	C	S	.	.	H	α-helix	trans	-61.8	-43.3	174.8	177.3	0	0	0	0	110.8	Y249 S250 L251 L257 R258 D277 E280 L281 E284	Y249-V254 HydrophobicContact CD2-CG2 3.71Å; Y249-V254 HydrophobicContact CE2-CG2 4.3Å; Y249-V254 HydrophobicContact CG-CG2 4.44Å; S250-V254 WeakPolarHBondContact O-CG2 3.26Å; S250-V254 PolarHBondContact O-N 2.89Å; L251-V254 PolarHBondContact O-N 3.41Å; V254-L257 PolarHBondContact O-N 3.3Å; V254-R258 VanDerWaalsContact O-CB 3.25Å; V254-R258 WeakPolarHBondContact O-CB 3.14Å; V254-R258 PolarHBondContact O-N 3.19Å; V254-D277 HydrophobicContact CG2-CB 4.08Å; V254-E280 HydrophobicContact CG1-CG 4.45Å; V254-E280 HydrophobicContact CG2-CB 4.11Å; V254-E280 HydrophobicContact CG2-CG 4.36Å; V254-L281 HydrophobicContact CG1-CB 4.4Å; V254-L281 HydrophobicContact CG1-CD1 4.08Å; V254-E284 WeakPolarHBondContact CG1-OE2 3.31Å
255	L	91.4	Very high	87.7	Confident	76 Å²	76	78.1 Å²	78.1	40%	0.398	37%	0.369	S	S	.	.	H	α-helix	trans	-64.1	-40.9	175.2	-71.3	179.6	0	0	0	112.6	L251 R252 R253 R258 E259	L251-L255 HydrophobicContact CD2-CD1 3.48Å; L251-L255 VanDerWaalsContact CD2-CD1 3.48Å; L251-L255 HydrophobicContact CD2-CG 4Å; L251-L255 WeakPolarHBondContact O-CG 3.33Å; L251-L255 PolarHBondContact O-N 3Å; R252-L255 PolarHBondContact O-N 3.33Å; R253-L255 VanDerWaalsContact C-N 3.33Å; R253-L255 PolarHBondContact O-N 3.46Å; L255-R258 WeakPolarHBondContact O-CB 3.48Å; L255-R258 PolarHBondContact O-N 3.18Å; L255-E259 WeakPolarHBondContact O-CG 3.29Å; L255-E259 PolarHBondContact O-N 3.1Å
256	E	90.8	Very high	86.5	Confident	122 Å²	122	82.6 Å²	82.6	57%	0.57	39%	0.393	S	S	*	.	H	α-helix	trans	-60.9	-48.9	174.9	-72.6	167.4	-169.2	0	0	111.3	R252 R253 R258 E259 L260	R252-E256 WeakPolarHBondContact O-CG 3.45Å; R252-E256 PolarHBondContact O-N 3.44Å; R253-E256 PolarHBondContact O-N 2.99Å; E256-R258 VanDerWaalsContact C-N 3.33Å; E256-R258 PolarHBondContact O-N 2.9Å; E256-E259 PolarHBondContact O-N 3.41Å; E256-L260 WeakPolarHBondContact O-CG 3.29Å; E256-L260 PolarHBondContact O-N 2.77Å
257	L	90.5	Very high	85.7	Confident	17 Å²	17	79.7 Å²	79.7	9%	0.089	38%	0.375	C	S	.	.	H	α-helix	trans	-59.9	-43.9	176.2	-71.3	172.8	0	0	0	111.5	R253 V254 E259 L260 F261 L269 V273 V278 L281	R253-L257 WeakPolarHBondContact O-CG 3.25Å; R253-L257 PolarHBondContact O-N 3.49Å; V254-L257 PolarHBondContact O-N 3.3Å; L257-E259 VanDerWaalsContact C-N 3.34Å; L257-E259 PolarHBondContact O-N 3.02Å; L257-L260 WeakPolarHBondContact O-CB 3.44Å; L257-L260 PolarHBondContact O-N 2.89Å; L257-F261 VanDerWaalsContact O-CD2 3.24Å; L257-F261 WeakPolarHBondContact O-CD2 3.42Å; L257-F261 PolarHBondContact O-N 3.32Å; L257-F261 VanDerWaalsContact O-N 3.1Å; L257-L269 HydrophobicContact CD2-CD2 4.07Å; L257-V273 HydrophobicContact CD1-CG1 4.39Å; L257-V278 HydrophobicContact CD1-CG2 4.49Å; L257-L281 HydrophobicContact CB-CD1 4.35Å; L257-L281 HydrophobicContact CB-CD2 3.81Å; L257-L281 HydrophobicContact CD1-CD2 4.33Å
258	R	90.4	Very high	85	Confident	54 Å²	54	81.3 Å²	81.3	20%	0.204	39%	0.388	C	S	.	.	H	α-helix	trans	-55.7	-48.5	175.4	176.7	-172.6	174.1	146.2	10	111.4	F101 V254 L255 E256 L260 F261 D262 L281 E284 E288	F101-R258 HydrophobicContact CD1-CG 4.39Å; F101-R258 HydrophobicContact CD2-CG 3.57Å; F101-R258 HydrophobicContact CE1-CG 4.39Å; F101-R258 HydrophobicContact CE2-CB 4.09Å; F101-R258 HydrophobicContact CE2-CG 3.59Å; F101-R258 HydrophobicContact CG-CG 4Å; F101-R258 HydrophobicContact CZ-CB 4.27Å; F101-R258 HydrophobicContact CZ-CG 4Å; V254-R258 VanDerWaalsContact O-CB 3.25Å; V254-R258 WeakPolarHBondContact O-CB 3.14Å; V254-R258 PolarHBondContact O-N 3.19Å; L255-R258 WeakPolarHBondContact O-CB 3.48Å; L255-R258 PolarHBondContact O-N 3.18Å; E256-R258 VanDerWaalsContact C-N 3.33Å; E256-R258 PolarHBondContact O-N 2.9Å; R258-L260 VanDerWaalsContact C-N 3.32Å; R258-L260 PolarHBondContact O-N 2.94Å; R258-F261 PolarHBondContact O-N 3.33Å; R258-D262 PolarHBondContact O-N 3.48Å; R258-L281 HydrophobicContact CB-CD1 3.97Å; R258-E284 IonicContact CZ-OE1 3.76Å; R258-E284 IonicContact NH1-OE1 2.78Å; R258-E284 PolarHBondContact NH1-OE1 3.46Å; R258-E288 IonicContact CZ-OE1 3.62Å; R258-E288 IonicContact CZ-OE2 3.14Å; R258-E288 VanDerWaalsContact NH1-CD 3.3Å; R258-E288 IonicContact NH1-OE1 3.9Å; R258-E288 PolarHBondContact NH1-OE1 3.1Å; R258-E288 IonicContact NH1-OE2 3.51Å; R258-E288 PolarHBondContact NH1-OE2 2.96Å; R258-E288 VanDerWaalsContact NH1-OE2 3.12Å; R258-E288 IonicContact NH2-OE1 3.6Å; R258-E288 IonicContact NH2-OE2 2.71Å; R258-E288 PolarHBondContact NH2-OE2 2.75Å
259	E	88	Confident	84.9	Confident	105 Å²	105	73.9 Å²	73.9	49%	0.491	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-38.7	178.1	-77.7	-168.8	-165.9	0	0	112.8	L255 E256 L257 F261 D262 K263	L255-E259 WeakPolarHBondContact O-CG 3.29Å; L255-E259 PolarHBondContact O-N 3.1Å; E256-E259 PolarHBondContact O-N 3.41Å; L257-E259 VanDerWaalsContact C-N 3.34Å; L257-E259 PolarHBondContact O-N 3.02Å; E259-F261 VanDerWaalsContact C-N 3.31Å; E259-F261 PolarHBondContact O-N 3.09Å; E259-D262 PolarHBondContact O-N 3.39Å; E259-K263 WeakPolarHBondContact O-CB 3.04Å; E259-K263 WeakPolarHBondContact O-CD 3.42Å; E259-K263 WeakPolarHBondContact O-CG 3.44Å; E259-K263 PolarHBondContact O-N 3.16Å; E259-K263 IonicContact OE2-NZ 2.82Å; E259-K263 PolarHBondContact OE2-NZ 3.34Å
260	L	86.8	Confident	84.3	Confident	63 Å²	63	74.5 Å²	74.5	33%	0.33	36%	0.362	S	S	.	.	H	α-helix	trans	-62.1	-41.6	177.2	-66.8	172.3	0	0	0	111.1	E256 L257 R258 K263 G264 L265 I267	E256-L260 WeakPolarHBondContact O-CG 3.29Å; E256-L260 PolarHBondContact O-N 2.77Å; L257-L260 WeakPolarHBondContact O-CB 3.44Å; L257-L260 PolarHBondContact O-N 2.89Å; R258-L260 VanDerWaalsContact C-N 3.32Å; R258-L260 PolarHBondContact O-N 2.94Å; L260-K263 PolarHBondContact O-N 3.45Å; L260-G264 PolarHBondContact O-N 2.99Å; L260-G264 VanDerWaalsContact O-N 3.15Å; L260-L265 HydrophobicContact CD2-CD1 3.76Å; L260-L265 PolarHBondContact O-N 3.02Å; L260-I267 HydrophobicContact CB-CD1 3.37Å; L260-I267 HydrophobicContact CB-CG1 3.91Å
261	F	86.3	Confident	83.6	Confident	13 Å²	13	78.7 Å²	78.7	6%	0.057	38%	0.382	C	S	.	.	H	α-helix	trans	-69.2	-41.3	177	-82.9	-69.2	0	0	0	111.5	T100 F101 R115 I226 L257 R258 E259 K263 G264 I267 L281	T100-F261 VanDerWaalsContact CG2-O 3.29Å; T100-F261 WeakPolarHBondContact CG2-O 3.41Å; T100-F261 PolarHBondContact OG1-O 3.37Å; F101-F261 HydrophobicContact CE2-CB 3.85Å; R115-F261 PolarHBondContact NH1-O 2.64Å; I226-F261 HydrophobicContact CB-CD1 3.99Å; I226-F261 HydrophobicContact CB-CE1 3.96Å; I226-F261 HydrophobicContact CB-CZ 4.48Å; I226-F261 HydrophobicContact CD1-CD1 4.42Å; I226-F261 HydrophobicContact CD1-CD2 4.14Å; I226-F261 HydrophobicContact CD1-CE2 4.49Å; I226-F261 HydrophobicContact CD1-CG 4.12Å; I226-F261 HydrophobicContact CG1-CD1 4.19Å; I226-F261 HydrophobicContact CG1-CD2 4.35Å; I226-F261 HydrophobicContact CG1-CE1 4.09Å; I226-F261 HydrophobicContact CG1-CE2 4.27Å; I226-F261 HydrophobicContact CG1-CG 4.33Å; I226-F261 HydrophobicContact CG1-CZ 4.14Å; L257-F261 VanDerWaalsContact O-CD2 3.24Å; L257-F261 WeakPolarHBondContact O-CD2 3.42Å; L257-F261 PolarHBondContact O-N 3.32Å; L257-F261 VanDerWaalsContact O-N 3.1Å; R258-F261 PolarHBondContact O-N 3.33Å; E259-F261 VanDerWaalsContact C-N 3.31Å; E259-F261 PolarHBondContact O-N 3.09Å; F261-K263 VanDerWaalsContact C-N 3.32Å; F261-K263 PolarHBondContact O-N 3.19Å; F261-G264 WeakPolarHBondContact O-CA 3.16Å; F261-G264 PolarHBondContact O-N 3.29Å; F261-I267 HydrophobicContact CB-CD1 4.21Å; F261-I267 HydrophobicContact CD1-CD1 3.67Å; F261-I267 HydrophobicContact CD2-CD1 3.38Å; F261-I267 HydrophobicContact CE1-CB 4.46Å; F261-I267 HydrophobicContact CE1-CD1 3.78Å; F261-I267 HydrophobicContact CE2-CD1 3.48Å; F261-I267 VanDerWaalsContact CE2-CD1 3.48Å; F261-I267 HydrophobicContact CG-CD1 3.47Å; F261-I267 VanDerWaalsContact CG-CD1 3.47Å; F261-I267 HydrophobicContact CZ-CB 4.24Å; F261-I267 HydrophobicContact CZ-CD1 3.68Å; F261-L281 HydrophobicContact CD2-CD2 3.79Å; F261-L281 HydrophobicContact CE2-CD2 3.5Å
262	D	84.6	Confident	83	Confident	41 Å²	41	78.9 Å²	78.9	22%	0.219	39%	0.392	C	S	.	.	H	α-helix	trans	-64.2	-36.9	175.8	-88.8	-27.3	0	0	0	111.7	L98 T100 F101 R115 R258 E259 G264	L98-D262 VanDerWaalsContact O-O 3.07Å; T100-D262 PolarHBondContact N-OD1 3.47Å; T100-D262 PolarHBondContact OG1-N 3.35Å; T100-D262 PolarHBondContact OG1-OD1 3.41Å; F101-D262 PolarHBondContact N-OD1 2.85Å; R115-D262 PolarHBondContact NH1-O 2.99Å; R258-D262 PolarHBondContact O-N 3.48Å; E259-D262 PolarHBondContact O-N 3.39Å; D262-G264 PolarHBondContact O-N 3.36Å
263	K	79.7	Confident	82.8	Confident	131 Å²	131	71 Å²	71	57%	0.57	37%	0.366	S	S	*	.	H	α-helix	trans	-69	-15.5	172.1	-71.1	165.1	-167.4	162.2	0	112.2	E259 L260 F261 L265	E259-K263 WeakPolarHBondContact O-CB 3.04Å; E259-K263 WeakPolarHBondContact O-CD 3.42Å; E259-K263 WeakPolarHBondContact O-CG 3.44Å; E259-K263 PolarHBondContact O-N 3.16Å; E259-K263 IonicContact OE2-NZ 2.82Å; E259-K263 PolarHBondContact OE2-NZ 3.34Å; L260-K263 PolarHBondContact O-N 3.45Å; F261-K263 VanDerWaalsContact C-N 3.32Å; F261-K263 PolarHBondContact O-N 3.19Å; K263-L265 HydrophobicContact CB-CD1 4.48Å; K263-L265 HydrophobicContact CB-CG 4.27Å
264	G	68.4	Low	82.7	Confident	11 Å²	11	67.6 Å²	67.6	11%	0.113	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	35.2	177.7	0	0	0	0	0	113.3	R119 L260 F261 D262	R119-G264 PolarHBondContact NH2-O 2.87Å; L260-G264 PolarHBondContact O-N 2.99Å; L260-G264 VanDerWaalsContact O-N 3.15Å; F261-G264 WeakPolarHBondContact O-CA 3.16Å; F261-G264 PolarHBondContact O-N 3.29Å; D262-G264 PolarHBondContact O-N 3.36Å
265	L	68.8	Low	82.7	Confident	93 Å²	93	68 Å²	68	49%	0.487	36%	0.361	S	S	.	.			trans	-78.4	150.2	170.9	-63.3	174.4	0	0	0	109.5	L260 K263 I267	L260-L265 HydrophobicContact CD2-CD1 3.76Å; L260-L265 PolarHBondContact O-N 3.02Å; K263-L265 HydrophobicContact CB-CD1 4.48Å; K263-L265 HydrophobicContact CB-CG 4.27Å; L265-I267 PolarHBondContact O-N 3.44Å
266	D	67.5	Low	82.8	Confident	103 Å²	103	66 Å²	66	55%	0.551	35%	0.349	S	S	*	.			trans	-76.6	110.9	172.4	-134.3	-30.7	0	0	0	106.5	R119	R119-D266 IonicContact NH1-OD2 2.91Å; R119-D266 PolarHBondContact NH1-OD2 3.48Å
267	I	73.1	Confident	83	Confident	20 Å²	20	60.2 Å²	60.2	10%	0.103	32%	0.322	C	S	.	.			trans	-98.7	107.7	-177	-58	167.1	0	0	0	106.5	L260 F261 L265 L269	L260-I267 HydrophobicContact CB-CD1 3.37Å; L260-I267 HydrophobicContact CB-CG1 3.91Å; F261-I267 HydrophobicContact CB-CD1 4.21Å; F261-I267 HydrophobicContact CD1-CD1 3.67Å; F261-I267 HydrophobicContact CD2-CD1 3.38Å; F261-I267 HydrophobicContact CE1-CB 4.46Å; F261-I267 HydrophobicContact CE1-CD1 3.78Å; F261-I267 HydrophobicContact CE2-CD1 3.48Å; F261-I267 VanDerWaalsContact CE2-CD1 3.48Å; F261-I267 HydrophobicContact CG-CD1 3.47Å; F261-I267 VanDerWaalsContact CG-CD1 3.47Å; F261-I267 HydrophobicContact CZ-CB 4.24Å; F261-I267 HydrophobicContact CZ-CD1 3.68Å; L265-I267 PolarHBondContact O-N 3.44Å; I267-L269 HydrophobicContact CG2-CD2 3.69Å; I267-L269 HydrophobicContact CG2-CG 4.21Å
268	V	76.9	Confident	83.2	Confident	113 Å²	113	59.4 Å²	59.4	69%	0.685	32%	0.318	S	S	*	.			trans	-83.9	113.5	163.6	-173.9	0	0	0	0	106	D270	V268-D270 WeakPolarHBondContact CG1-OD1 3.4Å; V268-D270 PolarHBondContact O-N 3.42Å
269	L	82.3	Confident	83.4	Confident	20 Å²	20	56.9 Å²	56.9	11%	0.105	31%	0.308	C	S	.	.			trans	-81.2	106.4	173.3	-63.7	175.4	0	0	0	107.5	T229 F233 L257 I267 V273 V278	T229-L269 HydrophobicContact CG2-CD1 3.9Å; T229-L269 HydrophobicContact CG2-CG 4.07Å; F233-L269 HydrophobicContact CB-CB 4.3Å; F233-L269 HydrophobicContact CB-CD1 3.78Å; F233-L269 HydrophobicContact CD1-CD1 4.41Å; F233-L269 HydrophobicContact CD2-CB 3.45Å; F233-L269 VanDerWaalsContact CD2-CB 3.45Å; F233-L269 HydrophobicContact CD2-CD1 4.34Å; F233-L269 HydrophobicContact CE2-CB 3.9Å; F233-L269 HydrophobicContact CG-CB 3.91Å; F233-L269 HydrophobicContact CG-CD1 3.93Å; L257-L269 HydrophobicContact CD2-CD2 4.07Å; I267-L269 HydrophobicContact CG2-CD2 3.69Å; I267-L269 HydrophobicContact CG2-CG 4.21Å; L269-V273 HydrophobicContact CD2-CG1 4.5Å; L269-V278 HydrophobicContact CD1-CG1 3.89Å; L269-V278 HydrophobicContact CD1-CG2 4.08Å; L269-V278 HydrophobicContact CD2-CG2 4.39Å
270	D	80.5	Confident	83.8	Confident	95 Å²	95	52.1 Å²	52.1	51%	0.508	29%	0.286	S	S	.	.			trans	-84.9	164.1	177	-66	-22.7	0	0	0	111.5	F233 V268 S272 V273	F233-D270 WeakPolarHBondContact CE2-O 3.35Å; V268-D270 WeakPolarHBondContact CG1-OD1 3.4Å; V268-D270 PolarHBondContact O-N 3.42Å; D270-S272 PolarHBondContact O-N 3.43Å; D270-V273 WeakPolarHBondContact O-CB 3.44Å; D270-V273 PolarHBondContact O-N 3.48Å
271	D	78.7	Confident	84.1	Confident	130 Å²	130	49.1 Å²	49.1	70%	0.695	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-17.9	-179.9	-59.8	-2.4	0	0	0	113.8	H237 V273	H237-D271 IonicContact CE1-OD1 3.91Å; H237-D271 PolarHBondContact CE1-OD1 2.97Å; H237-D271 IonicContact ND1-OD1 3.44Å; H237-D271 IonicContact NE2-OD1 3.86Å; H237-D271 PolarHBondContact NE2-OD1 2.95Å; D271-V273 VanDerWaalsContact C-N 3.28Å; D271-V273 PolarHBondContact O-N 2.96Å
272	S	80.6	Confident	84.5	Confident	110 Å²	110	48.6 Å²	48.6	77%	0.769	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-16.6	176	60.5	0	0	0	0	114.1	D270	D270-S272 PolarHBondContact O-N 3.43Å
273	V	87.9	Confident	85	Confident	38 Å²	38	48.3 Å²	48.3	23%	0.23	27%	0.265	C	S	.	.	S	Bend	trans	-80.9	135.4	-177.9	-176.4	0	0	0	0	109.9	F233 L257 L269 D270 D271 V275 V278	F233-V273 HydrophobicContact CZ-CB 4.11Å; F233-V273 WeakPolarHBondContact CZ-O 3.46Å; L257-V273 HydrophobicContact CD1-CG1 4.39Å; L269-V273 HydrophobicContact CD2-CG1 4.5Å; D270-V273 WeakPolarHBondContact O-CB 3.44Å; D270-V273 PolarHBondContact O-N 3.48Å; D271-V273 VanDerWaalsContact C-N 3.28Å; D271-V273 PolarHBondContact O-N 2.96Å; V273-V275 PolarHBondContact O-N 3.24Å; V273-V278 HydrophobicContact CG1-CG2 3.69Å
274	N	91.2	Very high	85.6	Confident	62 Å²	62	42.8 Å²	42.8	33%	0.332	24%	0.241	S	C	.	.			trans	-70.2	128.5	177.9	-173.5	-1.1	0	0	0	111	H276 D277 V278	N274-H276 VanDerWaalsContact C-N 3.27Å; N274-H276 PolarHBondContact O-N 3.32Å; N274-H276 PolarHBondContact OD1-CD2 3.26Å; N274-H276 PolarHBondContact OD1-N 3.1Å; N274-D277 HydrophobicContact CB-CB 4.4Å; N274-D277 WeakPolarHBondContact CB-OD2 3.36Å; N274-D277 PolarHBondContact O-N 2.9Å; N274-D277 VanDerWaalsContact O-N 3.17Å; N274-V278 PolarHBondContact O-N 3.5Å
275	V	93.1	Very high	86.8	Confident	12 Å²	12	42.3 Å²	42.3	7%	0.073	24%	0.236	C	C	.	.	H	α-helix	trans	-58.6	-37.9	178.5	-178.7	0	0	0	0	112.1	F233 H237 I244 V273 D277 V278 A279	F233-V275 HydrophobicContact CE1-CG2 4.01Å; H237-V275 HydrophobicContact CB-CG2 3.8Å; I244-V275 HydrophobicContact CD1-CG1 3.51Å; I244-V275 HydrophobicContact CG1-CG1 4.27Å; V273-V275 PolarHBondContact O-N 3.24Å; V275-D277 VanDerWaalsContact C-N 3.3Å; V275-D277 PolarHBondContact O-N 2.77Å; V275-V278 PolarHBondContact O-N 3.12Å; V275-A279 WeakPolarHBondContact O-CB 3.36Å; V275-A279 PolarHBondContact O-N 3.17Å
276	H	94	Very high	87.9	Confident	33 Å²	33	37.9 Å²	37.9	15%	0.153	21%	0.213	C	C	.	.	H	α-helix	trans	-65.6	-33.9	-179.8	-61.3	-70.7	0	0	0	112.3	V242 N274 A279 E280	V242-H276 PolarHBondContact O-CE1 3.24Å; N274-H276 VanDerWaalsContact C-N 3.27Å; N274-H276 PolarHBondContact O-N 3.32Å; N274-H276 PolarHBondContact OD1-CD2 3.26Å; N274-H276 PolarHBondContact OD1-N 3.1Å; H276-A279 PolarHBondContact O-N 3.33Å; H276-E280 PolarHBondContact O-N 2.84Å
277	D	94.2	Very high	89	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-68.3	-41.6	176.6	-61.3	-20.6	0	0	0	110.4	Y249 S250 R253 V254 N274 V275 E280 L281	Y249-D277 WeakPolarHBondContact CB-OD1 3.32Å; S250-D277 PolarHBondContact N-OD1 2.89Å; R253-D277 WeakPolarHBondContact CD-OD2 3.31Å; R253-D277 IonicContact NH1-OD2 3.14Å; V254-D277 HydrophobicContact CG2-CB 4.08Å; N274-D277 HydrophobicContact CB-CB 4.4Å; N274-D277 WeakPolarHBondContact CB-OD2 3.36Å; N274-D277 PolarHBondContact O-N 2.9Å; N274-D277 VanDerWaalsContact O-N 3.17Å; V275-D277 VanDerWaalsContact C-N 3.3Å; V275-D277 PolarHBondContact O-N 2.77Å; D277-E280 PolarHBondContact O-N 3.39Å; D277-L281 WeakPolarHBondContact O-CB 3.4Å; D277-L281 PolarHBondContact O-N 3.39Å
278	V	94.6	Very high	89.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.5	-38.6	176.9	-179.8	0	0	0	0	111.7	C230 F233 I234 L257 L269 V273 N274 V275 E280 L281 L282	C230-V278 HydrophobicContact CB-CG1 3.8Å; F233-V278 HydrophobicContact CD1-CB 4Å; F233-V278 HydrophobicContact CD1-CG1 3.93Å; F233-V278 HydrophobicContact CD1-CG2 3.79Å; F233-V278 HydrophobicContact CE1-CB 4.33Å; F233-V278 HydrophobicContact CE1-CG2 3.81Å; I234-V278 HydrophobicContact CD1-CG1 4.41Å; I234-V278 HydrophobicContact CG1-CG1 4.32Å; L257-V278 HydrophobicContact CD1-CG2 4.49Å; L269-V278 HydrophobicContact CD1-CG1 3.89Å; L269-V278 HydrophobicContact CD1-CG2 4.08Å; L269-V278 HydrophobicContact CD2-CG2 4.39Å; V273-V278 HydrophobicContact CG1-CG2 3.69Å; N274-V278 PolarHBondContact O-N 3.5Å; V275-V278 PolarHBondContact O-N 3.12Å; V278-E280 VanDerWaalsContact C-N 3.34Å; V278-L281 PolarHBondContact O-N 2.8Å; V278-L282 PolarHBondContact O-N 2.72Å
279	A	94.7	Very high	90.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.6	-42.8	175.1	0	0	0	0	0	111.4	I234 I244 F245 V275 H276 L282 K283	I234-A279 HydrophobicContact CD1-CB 4.32Å; I244-A279 HydrophobicContact CG1-CB 4.01Å; F245-A279 HydrophobicContact CD1-CB 3.63Å; F245-A279 WeakPolarHBondContact CD1-O 2.99Å; F245-A279 HydrophobicContact CE1-CB 3.71Å; F245-A279 WeakPolarHBondContact CE1-O 3.35Å; F245-A279 HydrophobicContact CG-CB 4.18Å; F245-A279 HydrophobicContact CZ-CB 4.34Å; V275-A279 WeakPolarHBondContact O-CB 3.36Å; V275-A279 PolarHBondContact O-N 3.17Å; H276-A279 PolarHBondContact O-N 3.33Å; A279-L282 PolarHBondContact O-N 2.84Å; A279-K283 PolarHBondContact O-N 3.36Å; A279-K283 VanDerWaalsContact O-N 3.14Å
280	E	95.1	Very high	90.3	Very high	5 Å²	5	40.8 Å²	40.8	2%	0.023	21%	0.207	C	C	.	.	H	α-helix	trans	-64.8	-44.6	174.4	-172.6	69	-170.3	0	0	112	Y249 V254 H276 D277 V278 L282 K283 E284	Y249-E280 HydrophobicContact CD1-CB 3.77Å; Y249-E280 HydrophobicContact CD1-CG 3.63Å; Y249-E280 WeakPolarHBondContact CD1-OE2 3.24Å; Y249-E280 HydrophobicContact CD2-CB 4.08Å; Y249-E280 HydrophobicContact CD2-CG 3.81Å; Y249-E280 HydrophobicContact CE1-CB 4.08Å; Y249-E280 HydrophobicContact CE1-CG 3.39Å; Y249-E280 VanDerWaalsContact CE1-OE1 3.31Å; Y249-E280 WeakPolarHBondContact CE1-OE1 3.27Å; Y249-E280 WeakPolarHBondContact CE1-OE2 3.32Å; Y249-E280 HydrophobicContact CE2-CB 4.39Å; Y249-E280 HydrophobicContact CE2-CG 3.6Å; Y249-E280 HydrophobicContact CG-CB 3.75Å; Y249-E280 HydrophobicContact CG-CG 3.81Å; Y249-E280 PolarHBondContact OH-OE1 3.39Å; V254-E280 HydrophobicContact CG1-CG 4.45Å; V254-E280 HydrophobicContact CG2-CB 4.11Å; V254-E280 HydrophobicContact CG2-CG 4.36Å; H276-E280 PolarHBondContact O-N 2.84Å; D277-E280 PolarHBondContact O-N 3.39Å; V278-E280 VanDerWaalsContact C-N 3.34Å; E280-L282 VanDerWaalsContact C-N 3.28Å; E280-L282 PolarHBondContact O-N 3.19Å; E280-K283 CarbonylContact O-C 3.53Å; E280-K283 WeakPolarHBondContact O-CA 3.43Å; E280-K283 WeakPolarHBondContact O-CB 3.29Å; E280-K283 PolarHBondContact O-N 3.45Å; E280-K283 WeakPolarHBondContact OE1-CE 3.5Å; E280-K283 IonicContact OE1-NZ 2.8Å; E280-K283 PolarHBondContact OE1-NZ 2.88Å; E280-K283 VanDerWaalsContact OE1-NZ 3.14Å; E280-K283 WeakPolarHBondContact OE2-CE 3.31Å; E280-K283 IonicContact OE2-NZ 3.12Å; E280-K283 PolarHBondContact OE2-NZ 3.28Å; E280-E284 WeakPolarHBondContact O-CB 3.26Å; E280-E284 PolarHBondContact O-N 3.43Å
281	L	94.8	Very high	90.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57	-43.3	179.2	-174.7	71.2	0	0	0	111.8	F101 V254 L257 R258 F261 D277 V278 K283 E284 F285	F101-L281 HydrophobicContact CE1-CD1 4.15Å; F101-L281 HydrophobicContact CZ-CD1 3.64Å; F101-L281 HydrophobicContact CZ-CG 4.22Å; V254-L281 HydrophobicContact CG1-CB 4.4Å; V254-L281 HydrophobicContact CG1-CD1 4.08Å; L257-L281 HydrophobicContact CB-CD1 4.35Å; L257-L281 HydrophobicContact CB-CD2 3.81Å; L257-L281 HydrophobicContact CD1-CD2 4.33Å; R258-L281 HydrophobicContact CB-CD1 3.97Å; F261-L281 HydrophobicContact CD2-CD2 3.79Å; F261-L281 HydrophobicContact CE2-CD2 3.5Å; D277-L281 WeakPolarHBondContact O-CB 3.4Å; D277-L281 PolarHBondContact O-N 3.39Å; V278-L281 PolarHBondContact O-N 2.8Å; L281-K283 VanDerWaalsContact C-N 3.35Å; L281-E284 PolarHBondContact O-N 3.19Å; L281-F285 PolarHBondContact O-N 3.46Å
282	L	95	Very high	90.7	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-62.7	-41.7	175.6	-176.6	62.5	0	0	0	111.5	V227 C230 I234 F245 V278 A279 E280 F285 F286 L335	V227-L282 HydrophobicContact CG1-CD1 4.43Å; V227-L282 HydrophobicContact CG2-CD1 4.4Å; C230-L282 HydrophobicContact CB-CB 4.12Å; C230-L282 HydrophobicContact CB-CD1 4.1Å; C230-L282 HydrophobicContact CB-CD2 4.43Å; C230-L282 HydrophobicContact CB-CG 4.45Å; I234-L282 HydrophobicContact CD1-CD2 4.05Å; F245-L282 HydrophobicContact CE1-CD2 4.25Å; F245-L282 HydrophobicContact CZ-CD2 4.27Å; V278-L282 PolarHBondContact O-N 2.72Å; A279-L282 PolarHBondContact O-N 2.84Å; E280-L282 VanDerWaalsContact C-N 3.28Å; E280-L282 PolarHBondContact O-N 3.19Å; L282-F285 PolarHBondContact O-N 3.01Å; L282-F286 HydrophobicContact CD1-CD2 4.35Å; L282-F286 HydrophobicContact CD1-CE2 3.56Å; L282-F286 HydrophobicContact CD1-CZ 4.21Å; L282-F286 HydrophobicContact CG-CD2 4.41Å; L282-F286 HydrophobicContact CG-CE2 3.88Å; L282-F286 WeakPolarHBondContact O-CD2 3.19Å; L282-F286 PolarHBondContact O-N 2.67Å; L282-L335 HydrophobicContact CD2-CD1 4.19Å
283	K	93.4	Very high	91.2	Very high	36 Å²	36	27.1 Å²	27.1	16%	0.157	13%	0.126	C	C	.	.	H	α-helix	trans	-64.4	-44	176.3	-171.2	179.6	75.4	-162.6	0	111.6	A279 E280 L281 F285 F286 R287 V370	A279-K283 PolarHBondContact O-N 3.36Å; A279-K283 VanDerWaalsContact O-N 3.14Å; E280-K283 CarbonylContact O-C 3.53Å; E280-K283 WeakPolarHBondContact O-CA 3.43Å; E280-K283 WeakPolarHBondContact O-CB 3.29Å; E280-K283 PolarHBondContact O-N 3.45Å; E280-K283 WeakPolarHBondContact OE1-CE 3.5Å; E280-K283 IonicContact OE1-NZ 2.8Å; E280-K283 PolarHBondContact OE1-NZ 2.88Å; E280-K283 VanDerWaalsContact OE1-NZ 3.14Å; E280-K283 WeakPolarHBondContact OE2-CE 3.31Å; E280-K283 IonicContact OE2-NZ 3.12Å; E280-K283 PolarHBondContact OE2-NZ 3.28Å; L281-K283 VanDerWaalsContact C-N 3.35Å; K283-F285 VanDerWaalsContact C-N 3.35Å; K283-F286 PolarHBondContact O-N 3Å; K283-R287 WeakPolarHBondContact O-CB 3.48Å; K283-R287 PolarHBondContact O-N 3.19Å; K283-V370 HydrophobicContact CD-CG1 3.6Å; K283-V370 HydrophobicContact CG-CG1 4.47Å
284	E	92.2	Very high	91.3	Very high	14 Å²	14	25.3 Å²	25.3	7%	0.065	12%	0.115	C	C	.	.	H	α-helix	trans	-62.9	-41.1	178.7	-171.7	174.5	169.1	0	0	111.4	V254 R258 E280 L281 F286 R287 E288	V254-E284 WeakPolarHBondContact CG1-OE2 3.31Å; R258-E284 IonicContact CZ-OE1 3.76Å; R258-E284 IonicContact NH1-OE1 2.78Å; R258-E284 PolarHBondContact NH1-OE1 3.46Å; E280-E284 WeakPolarHBondContact O-CB 3.26Å; E280-E284 PolarHBondContact O-N 3.43Å; L281-E284 PolarHBondContact O-N 3.19Å; E284-F286 PolarHBondContact O-N 3.45Å; E284-R287 PolarHBondContact O-N 3.1Å; E284-E288 HydrophobicContact CG-CG 4.06Å; E284-E288 WeakPolarHBondContact O-CB 3.34Å; E284-E288 WeakPolarHBondContact O-CG 3.5Å; E284-E288 PolarHBondContact O-N 3.3Å
285	F	93.3	Very high	90.9	Very high	2 Å²	2	23 Å²	23	1%	0.009	10%	0.103	C	C	.	.	H	α-helix	trans	-52.1	-56.4	174.8	175.9	-104.1	0	0	0	111.4	F101 L105 V108 P224 I226 V227 L281 L282 K283 R287 E288 M289	F101-F285 HydrophobicContact CD1-CB 4.36Å; F101-F285 HydrophobicContact CD1-CD2 4.22Å; F101-F285 HydrophobicContact CE1-CB 3.85Å; F101-F285 HydrophobicContact CE1-CD2 4.18Å; L105-F285 HydrophobicContact CD1-CZ 4.28Å; V108-F285 HydrophobicContact CG2-CE2 4.29Å; V108-F285 HydrophobicContact CG2-CZ 4.49Å; P224-F285 HydrophobicContact CB-CZ 4.46Å; P224-F285 HydrophobicContact CG-CZ 4.31Å; I226-F285 HydrophobicContact CD1-CB 4.19Å; I226-F285 HydrophobicContact CD1-CD2 3.98Å; I226-F285 HydrophobicContact CD1-CG 4.22Å; I226-F285 HydrophobicContact CG2-CD1 4.42Å; I226-F285 HydrophobicContact CG2-CD2 3.87Å; I226-F285 HydrophobicContact CG2-CE1 4.27Å; I226-F285 HydrophobicContact CG2-CE2 3.7Å; I226-F285 HydrophobicContact CG2-CG 4.23Å; I226-F285 HydrophobicContact CG2-CZ 3.91Å; V227-F285 HydrophobicContact CG2-CD1 3.87Å; V227-F285 HydrophobicContact CG2-CE1 3.55Å; V227-F285 HydrophobicContact CG2-CZ 4.39Å; L281-F285 PolarHBondContact O-N 3.46Å; L282-F285 PolarHBondContact O-N 3.01Å; K283-F285 VanDerWaalsContact C-N 3.35Å; F285-R287 VanDerWaalsContact C-N 3.35Å; F285-R287 PolarHBondContact O-N 3.02Å; F285-E288 PolarHBondContact O-N 2.95Å; F285-M289 HydrophobicContact CD1-SD 4.45Å; F285-M289 HydrophobicContact CE1-CG 4.45Å; F285-M289 HydrophobicContact CE1-SD 3.82Å; F285-M289 HydrophobicContact CZ-CG 4.46Å; F285-M289 HydrophobicContact CZ-SD 4.02Å; F285-M289 WeakPolarHBondContact O-CG 3.42Å; F285-M289 PolarHBondContact O-N 3.47Å
286	F	93.2	Very high	90.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.7	-37.7	179.4	-65.2	-64.6	0	0	0	112.7	V227 L282 K283 E284 E288 M289 L293 T331 L335 F371 A374 L375 K377	V227-F286 HydrophobicContact CG1-CZ 4.17Å; V227-F286 HydrophobicContact CG2-CE1 4.3Å; V227-F286 HydrophobicContact CG2-CZ 3.87Å; L282-F286 HydrophobicContact CD1-CD2 4.35Å; L282-F286 HydrophobicContact CD1-CE2 3.56Å; L282-F286 HydrophobicContact CD1-CZ 4.21Å; L282-F286 HydrophobicContact CG-CD2 4.41Å; L282-F286 HydrophobicContact CG-CE2 3.88Å; L282-F286 WeakPolarHBondContact O-CD2 3.19Å; L282-F286 PolarHBondContact O-N 2.67Å; K283-F286 PolarHBondContact O-N 3Å; E284-F286 PolarHBondContact O-N 3.45Å; F286-E288 VanDerWaalsContact C-N 3.34Å; F286-E288 PolarHBondContact O-N 3.1Å; F286-M289 HydrophobicContact CD1-CE 3.77Å; F286-M289 HydrophobicContact CD1-SD 4.32Å; F286-L293 HydrophobicContact CD1-CB 4.37Å; F286-L293 HydrophobicContact CD1-CD2 4.16Å; F286-L293 HydrophobicContact CE1-CD2 3.81Å; F286-T331 HydrophobicContact CE1-CG2 4.03Å; F286-T331 HydrophobicContact CZ-CG2 4.36Å; F286-L335 HydrophobicContact CD2-CD2 4.3Å; F286-L335 HydrophobicContact CE1-CD2 4.45Å; F286-L335 HydrophobicContact CE2-CD1 3.84Å; F286-L335 HydrophobicContact CE2-CD2 3.76Å; F286-L335 HydrophobicContact CE2-CG 4.32Å; F286-L335 HydrophobicContact CZ-CB 4.41Å; F286-L335 HydrophobicContact CZ-CD1 4.28Å; F286-L335 HydrophobicContact CZ-CD2 3.85Å; F286-L335 HydrophobicContact CZ-CG 4.41Å; F286-F371 HydrophobicContact CD2-CE1 4.29Å; F286-A374 HydrophobicContact CB-CB 4.41Å; F286-L375 HydrophobicContact CB-CD2 4.32Å; F286-L375 HydrophobicContact CD1-CD2 4.25Å; F286-L375 HydrophobicContact CG-CD2 4.14Å; F286-K377 WeakPolarHBondContact O-CE 3.48Å; F286-K377 PolarHBondContact O-NZ 2.89Å
287	R	90.5	Very high	89.5	Confident	121 Å²	121	27.9 Å²	27.9	46%	0.457	13%	0.13	S	C	.	.	H	α-helix	trans	-65.9	-32.9	178.4	-172.5	179.6	67.5	-161.5	-4.8	112.9	K283 E284 F285 K377	K283-R287 WeakPolarHBondContact O-CB 3.48Å; K283-R287 PolarHBondContact O-N 3.19Å; E284-R287 PolarHBondContact O-N 3.1Å; F285-R287 VanDerWaalsContact C-N 3.35Å; F285-R287 PolarHBondContact O-N 3.02Å; R287-K377 WeakPolarHBondContact O-CE 3.43Å; R287-K377 PolarHBondContact O-NZ 3.1Å
288	E	89.3	Confident	89	Confident	60 Å²	60	27.8 Å²	27.8	28%	0.28	13%	0.13	S	C	.	.	H	α-helix	trans	-92.7	-12.6	-178.3	-69	-164.1	162.8	0	0	114.6	G102 R258 E284 F285 F286 K290	G102-E288 WeakPolarHBondContact CA-O 3.39Å; R258-E288 IonicContact CZ-OE1 3.62Å; R258-E288 IonicContact CZ-OE2 3.14Å; R258-E288 VanDerWaalsContact NH1-CD 3.3Å; R258-E288 IonicContact NH1-OE1 3.9Å; R258-E288 PolarHBondContact NH1-OE1 3.1Å; R258-E288 IonicContact NH1-OE2 3.51Å; R258-E288 PolarHBondContact NH1-OE2 2.96Å; R258-E288 VanDerWaalsContact NH1-OE2 3.12Å; R258-E288 IonicContact NH2-OE1 3.6Å; R258-E288 IonicContact NH2-OE2 2.71Å; R258-E288 PolarHBondContact NH2-OE2 2.75Å; E284-E288 HydrophobicContact CG-CG 4.06Å; E284-E288 WeakPolarHBondContact O-CB 3.34Å; E284-E288 WeakPolarHBondContact O-CG 3.5Å; E284-E288 PolarHBondContact O-N 3.3Å; F285-E288 PolarHBondContact O-N 2.95Å; F286-E288 VanDerWaalsContact C-N 3.34Å; F286-E288 PolarHBondContact O-N 3.1Å; E288-K290 PolarHBondContact O-N 3.16Å
289	M	87.4	Confident	88.5	Confident	6 Å²	6	28.5 Å²	28.5	3%	0.03	13%	0.133	C	C	.	.			trans	-54.2	134.1	176.7	-62.8	-164.2	-54.3	0	0	111.4	L105 F285 F286 D291 L293 K377	L105-M289 HydrophobicContact CB-SD 4.38Å; L105-M289 HydrophobicContact CD1-SD 4.26Å; F285-M289 HydrophobicContact CD1-SD 4.45Å; F285-M289 HydrophobicContact CE1-CG 4.45Å; F285-M289 HydrophobicContact CE1-SD 3.82Å; F285-M289 HydrophobicContact CZ-CG 4.46Å; F285-M289 HydrophobicContact CZ-SD 4.02Å; F285-M289 WeakPolarHBondContact O-CG 3.42Å; F285-M289 PolarHBondContact O-N 3.47Å; F286-M289 HydrophobicContact CD1-CE 3.77Å; F286-M289 HydrophobicContact CD1-SD 4.32Å; M289-D291 VanDerWaalsContact C-N 3.3Å; M289-D291 WeakPolarHBondContact CB-O 3.4Å; M289-D291 PolarHBondContact O-N 3.1Å; M289-L293 HydrophobicContact CE-CB 3.81Å; M289-K377 PolarHBondContact O-NZ 2.77Å
290	K	82.9	Confident	88	Confident	129 Å²	129	29.9 Å²	29.9	56%	0.561	14%	0.14	S	C	*	.	S	Bend	trans	-59.9	-41.7	-178.3	-178.8	177.5	177.4	179.6	0	112.3	I103 R104 E288	I103-K290 PolarHBondContact O-N 2.95Å; R104-K290 HydrophobicContact CG-CB 4.17Å; R104-K290 HydrophobicContact CG-CD 4.03Å; R104-K290 HydrophobicContact CG-CG 4.45Å; E288-K290 PolarHBondContact O-N 3.16Å
291	D	81.4	Confident	87.5	Confident	46 Å²	46	30 Å²	30	25%	0.246	14%	0.141	C	C	.	.	S	Bend	trans	-112.3	128.8	172.1	-56.4	-25.3	0	0	0	106.5	R104 M289	R104-D291 WeakPolarHBondContact CD-OD2 3.47Å; R104-D291 IonicContact CZ-OD2 3.46Å; R104-D291 IonicContact NE-OD1 3.76Å; R104-D291 IonicContact NE-OD2 2.73Å; R104-D291 PolarHBondContact NE-OD2 3.24Å; R104-D291 IonicContact NH2-OD1 3.85Å; R104-D291 IonicContact NH2-OD2 3.57Å; M289-D291 VanDerWaalsContact C-N 3.3Å; M289-D291 WeakPolarHBondContact CB-O 3.4Å; M289-D291 PolarHBondContact O-N 3.1Å
292	P	86.9	Confident	87.3	Confident	3 Å²	3	30 Å²	30	2%	0.019	14%	0.141	C	C	.	.			trans	-64.1	159.4	-179.6	24.9	-32	0	0	0	112.2	L294 D296 K377	P292-L294 VanDerWaalsContact C-N 3.27Å; P292-L294 WeakPolarHBondContact CG-O 3.26Å; P292-L294 PolarHBondContact O-N 2.78Å; P292-D296 WeakPolarHBondContact CD-OD1 3.45Å; P292-D296 WeakPolarHBondContact CG-OD1 3.41Å; P292-K377 HydrophobicContact CB-CB 4.14Å; P292-K377 HydrophobicContact CB-CD 4.12Å; P292-K377 HydrophobicContact CB-CG 4.06Å; P292-K377 HydrophobicContact CG-CB 4.13Å
293	L	89.6	Confident	87	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	-61.6	-37.7	-179.6	-173.7	62	0	0	0	111.9	L105 F286 M289 P295 M324 H328 T331 L332 L335 L375	L105-L293 HydrophobicContact CD2-CD1 4.03Å; F286-L293 HydrophobicContact CD1-CB 4.37Å; F286-L293 HydrophobicContact CD1-CD2 4.16Å; F286-L293 HydrophobicContact CE1-CD2 3.81Å; M289-L293 HydrophobicContact CE-CB 3.81Å; L293-P295 WeakPolarHBondContact O-CD 3.42Å; L293-M324 VanDerWaalsContact O-CE 3.29Å; L293-M324 WeakPolarHBondContact O-CE 3.47Å; L293-H328 HydrophobicContact CD1-CB 4.35Å; L293-H328 PolarHBondContact O-ND1 3.4Å; L293-T331 HydrophobicContact CD1-CG2 3.96Å; L293-L332 HydrophobicContact CD2-CB 4.02Å; L293-L332 HydrophobicContact CD2-CD1 3.84Å; L293-L332 HydrophobicContact CG-CB 4.37Å; L293-L335 HydrophobicContact CD2-CD2 4.26Å; L293-L375 HydrophobicContact CB-CD2 4.08Å; L293-L375 HydrophobicContact CD2-CD2 3.78Å
294	L	89.8	Confident	86.6	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	-91.3	109.4	168.5	-62.6	-179.8	0	0	0	107.4	P292 D296 F302 M324 L332 L375 L376 M406	P292-L294 VanDerWaalsContact C-N 3.27Å; P292-L294 WeakPolarHBondContact CG-O 3.26Å; P292-L294 PolarHBondContact O-N 2.78Å; L294-D296 PolarHBondContact O-N 3.45Å; L294-F302 HydrophobicContact CB-CD2 4.38Å; L294-F302 HydrophobicContact CB-CE2 4.19Å; L294-F302 HydrophobicContact CD2-CE1 4.28Å; L294-F302 HydrophobicContact CD2-CE2 4.14Å; L294-F302 HydrophobicContact CD2-CZ 3.83Å; L294-M324 HydrophobicContact CD2-CE 3.77Å; L294-M324 HydrophobicContact CD2-SD 3.72Å; L294-L332 HydrophobicContact CD2-CD1 4.29Å; L294-L332 HydrophobicContact CD2-CD2 3.94Å; L294-L375 WeakPolarHBondContact CB-O 3.39Å; L294-L375 HydrophobicContact CD1-CB 4.36Å; L294-L375 PolarHBondContact N-O 3.18Å; L294-L376 HydrophobicContact CB-CD2 3.6Å; L294-L376 HydrophobicContact CB-CG 4.18Å; L294-L376 HydrophobicContact CD1-CD1 4.04Å; L294-L376 HydrophobicContact CD1-CD2 3.72Å; L294-L376 HydrophobicContact CD1-CG 3.61Å; L294-L376 HydrophobicContact CG-CD2 4.28Å; L294-L376 HydrophobicContact CG-CG 4.46Å; L294-M406 HydrophobicContact CD1-CE 4.47Å; L294-M406 HydrophobicContact CD1-SD 4.25Å; L294-M406 HydrophobicContact CD2-CE 4.15Å
295	P	84.2	Confident	86.5	Confident	13 Å²	13	29 Å²	29	8%	0.084	14%	0.138	C	C	.	.			trans	-55.1	137	-169	-28.3	34.6	0	0	0	112.9	I203 L293 D297 L298 Y299 M324	I203-P295 HydrophobicContact CD1-CB 4.19Å; I203-P295 HydrophobicContact CD1-CG 4.26Å; L293-P295 WeakPolarHBondContact O-CD 3.42Å; P295-D297 PolarHBondContact O-N 3.3Å; P295-D297 VanDerWaalsContact O-N 3.1Å; P295-L298 PolarHBondContact O-N 3.49Å; P295-Y299 PolarHBondContact O-N 2.88Å; P295-M324 HydrophobicContact CG-CG 4.36Å
296	D	79.4	Confident	86.2	Confident	60 Å²	60	29.8 Å²	29.8	32%	0.321	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-51.1	-36.7	176.8	-79.2	-10.6	0	0	0	112.3	P292 L294 L298 Y299 G379	P292-D296 WeakPolarHBondContact CD-OD1 3.45Å; P292-D296 WeakPolarHBondContact CG-OD1 3.41Å; L294-D296 PolarHBondContact O-N 3.45Å; D296-L298 PolarHBondContact O-N 3.23Å; D296-Y299 WeakPolarHBondContact O-CB 3.24Å; D296-Y299 PolarHBondContact O-N 3.31Å; D296-Y299 VanDerWaalsContact O-N 3.1Å; D296-G379 VanDerWaalsContact OD2-CA 3.26Å; D296-G379 WeakPolarHBondContact OD2-CA 3.24Å
297	D	78.2	Confident	85.8	Confident	87 Å²	87	32 Å²	32	47%	0.465	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-61.4	-26.4	179.7	-59.6	-27.9	0	0	0	113	F68 P295	F68-D297 HydrophobicContact CD2-CB 4.01Å; F68-D297 WeakPolarHBondContact CD2-O 3.49Å; F68-D297 HydrophobicContact CE2-CB 3.73Å; P295-D297 PolarHBondContact O-N 3.3Å; P295-D297 VanDerWaalsContact O-N 3.1Å
298	L	82.3	Confident	85.7	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-103	-0.1	-179.8	-58.6	-179.1	0	0	0	112.4	L65 F68 I203 P295 D296 M300 S301 F302 L323 M324	L65-L298 HydrophobicContact CD2-CD2 4.26Å; F68-L298 HydrophobicContact CD2-CD2 3.97Å; F68-L298 HydrophobicContact CE2-CD2 4.03Å; F68-L298 HydrophobicContact CG-CD2 4.37Å; F68-L298 HydrophobicContact CZ-CD2 4.47Å; I203-L298 HydrophobicContact CD1-CD1 4.06Å; I203-L298 HydrophobicContact CD1-CG 4.2Å; P295-L298 PolarHBondContact O-N 3.49Å; D296-L298 PolarHBondContact O-N 3.23Å; L298-M300 PolarHBondContact O-N 3.46Å; L298-S301 WeakPolarHBondContact O-CB 3.12Å; L298-S301 PolarHBondContact O-N 2.99Å; L298-F302 HydrophobicContact CB-CD2 3.79Å; L298-F302 HydrophobicContact CB-CE2 3.66Å; L298-F302 HydrophobicContact CD1-CE2 4.18Å; L298-F302 VanDerWaalsContact O-CD2 3.26Å; L298-F302 WeakPolarHBondContact O-CD2 3.45Å; L298-F302 PolarHBondContact O-N 3.48Å; L298-L323 HydrophobicContact CD1-CB 4.41Å; L298-L323 HydrophobicContact CD1-CD2 4.31Å; L298-L323 HydrophobicContact CD1-CG 4.38Å; L298-L323 HydrophobicContact CD2-CD2 3.62Å; L298-L323 HydrophobicContact CD2-CG 4.41Å; L298-M324 HydrophobicContact CD1-CG 4.06Å
299	Y	84.9	Confident	85.6	Confident	15 Å²	15	33 Å²	33	6%	0.059	17%	0.167	C	C	.	.	H	α-helix	trans	-51.3	-54.1	-173.7	175.9	-96.6	0	0	0	112.2	P295 D296 S301 F302 L303 L376 K377	P295-Y299 PolarHBondContact O-N 2.88Å; D296-Y299 WeakPolarHBondContact O-CB 3.24Å; D296-Y299 PolarHBondContact O-N 3.31Å; D296-Y299 VanDerWaalsContact O-N 3.1Å; Y299-S301 VanDerWaalsContact C-N 3.32Å; Y299-S301 PolarHBondContact O-N 2.9Å; Y299-F302 PolarHBondContact O-N 3.33Å; Y299-L303 HydrophobicContact CD1-CD1 4.08Å; Y299-L303 HydrophobicContact CE1-CD1 3.41Å; Y299-L303 VanDerWaalsContact CE1-CD1 3.41Å; Y299-L303 HydrophobicContact CE1-CG 4.3Å; Y299-L303 HydrophobicContact CE2-CD1 4.26Å; Y299-L303 WeakPolarHBondContact O-CG 3.26Å; Y299-L303 PolarHBondContact O-N 2.95Å; Y299-L376 HydrophobicContact CD2-CB 4.21Å; Y299-L376 HydrophobicContact CD2-CD2 3.96Å; Y299-L376 HydrophobicContact CE2-CB 4.04Å; Y299-K377 WeakPolarHBondContact CD2-O 3.38Å
300	M	83.3	Confident	85.6	Confident	29 Å²	29	37.3 Å²	37.3	14%	0.143	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-36.8	-179.9	-71.1	-61.2	-86	0	0	112.3	L298 L303 L304 E385	L298-M300 PolarHBondContact O-N 3.46Å; M300-L303 PolarHBondContact O-N 3.42Å; M300-L303 HydrophobicContact SD-CD1 4.48Å; M300-L304 VanDerWaalsContact O-CG 3.29Å; M300-L304 WeakPolarHBondContact O-CG 3.33Å; M300-L304 PolarHBondContact O-N 2.97Å; M300-E385 WeakPolarHBondContact CG-OE2 3.21Å; M300-E385 VanDerWaalsContact SD-OE2 3.35Å
301	S	86.5	Confident	85.8	Confident	8 Å²	8	39.9 Å²	39.9	6%	0.056	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-39.8	176.3	-63.3	0	0	0	0	112.3	F64 L65 L298 Y299 L304 T305	F64-S301 PolarHBondContact O-OG 3.43Å; L65-S301 WeakPolarHBondContact CD2-OG 3.03Å; L298-S301 WeakPolarHBondContact O-CB 3.12Å; L298-S301 PolarHBondContact O-N 2.99Å; Y299-S301 VanDerWaalsContact C-N 3.32Å; Y299-S301 PolarHBondContact O-N 2.9Å; S301-L304 PolarHBondContact O-N 2.79Å; S301-T305 WeakPolarHBondContact O-CG2 3.18Å; S301-T305 PolarHBondContact O-N 3.33Å
302	F	89.2	Confident	86.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.8	-47.6	171.8	-82.5	-69.9	0	0	0	111	L294 L298 Y299 L304 T305 L317 L320 M324 L376 V402	L294-F302 HydrophobicContact CB-CD2 4.38Å; L294-F302 HydrophobicContact CB-CE2 4.19Å; L294-F302 HydrophobicContact CD2-CE1 4.28Å; L294-F302 HydrophobicContact CD2-CE2 4.14Å; L294-F302 HydrophobicContact CD2-CZ 3.83Å; L298-F302 HydrophobicContact CB-CD2 3.79Å; L298-F302 HydrophobicContact CB-CE2 3.66Å; L298-F302 HydrophobicContact CD1-CE2 4.18Å; L298-F302 VanDerWaalsContact O-CD2 3.26Å; L298-F302 WeakPolarHBondContact O-CD2 3.45Å; L298-F302 PolarHBondContact O-N 3.48Å; Y299-F302 PolarHBondContact O-N 3.33Å; F302-L304 VanDerWaalsContact C-N 3.31Å; F302-L304 PolarHBondContact O-N 3.45Å; F302-T305 WeakPolarHBondContact O-CB 3.48Å; F302-T305 PolarHBondContact O-N 2.97Å; F302-T305 PolarHBondContact O-OG1 2.97Å; F302-L317 HydrophobicContact CD1-CD2 3.81Å; F302-L317 HydrophobicContact CE1-CD2 4.12Å; F302-L320 HydrophobicContact CD1-CB 4.39Å; F302-L320 HydrophobicContact CD1-CD1 3.75Å; F302-L320 HydrophobicContact CE1-CB 3.71Å; F302-L320 HydrophobicContact CE1-CD1 3.93Å; F302-L320 HydrophobicContact CE1-CG 4.45Å; F302-L320 HydrophobicContact CE2-CB 4.44Å; F302-L320 HydrophobicContact CG-CD1 4.09Å; F302-L320 HydrophobicContact CZ-CB 3.73Å; F302-L320 HydrophobicContact CZ-CD1 4.44Å; F302-M324 HydrophobicContact CE2-SD 4.48Å; F302-M324 HydrophobicContact CZ-CG 4.48Å; F302-M324 HydrophobicContact CZ-SD 3.87Å; F302-L376 HydrophobicContact CB-CD2 4.11Å; F302-L376 HydrophobicContact CD2-CD2 4.32Å; F302-L376 HydrophobicContact CG-CD2 4.36Å; F302-V402 HydrophobicContact CB-CG1 4.42Å; F302-V402 HydrophobicContact CD1-CG1 4.09Å; F302-V402 WeakPolarHBondContact O-CG2 3.42Å
303	L	88.2	Confident	86.4	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-64.7	-33.7	-179.1	-62.9	-170.9	0	0	0	113.6	Y299 M300 T305 A306 L376 T389 H395 A398	Y299-L303 HydrophobicContact CD1-CD1 4.08Å; Y299-L303 HydrophobicContact CE1-CD1 3.41Å; Y299-L303 VanDerWaalsContact CE1-CD1 3.41Å; Y299-L303 HydrophobicContact CE1-CG 4.3Å; Y299-L303 HydrophobicContact CE2-CD1 4.26Å; Y299-L303 WeakPolarHBondContact O-CG 3.26Å; Y299-L303 PolarHBondContact O-N 2.95Å; M300-L303 PolarHBondContact O-N 3.42Å; M300-L303 HydrophobicContact SD-CD1 4.48Å; L303-T305 PolarHBondContact O-N 3.49Å; L303-A306 WeakPolarHBondContact O-CB 3.49Å; L303-A306 PolarHBondContact O-N 2.94Å; L303-A306 VanDerWaalsContact O-N 3.16Å; L303-L376 HydrophobicContact CD2-CD1 4.36Å; L303-T389 HydrophobicContact CB-CG2 4.28Å; L303-H395 HydrophobicContact CD1-CB 3.86Å; L303-H395 WeakPolarHBondContact CD1-ND1 3.37Å; L303-A398 HydrophobicContact CB-CB 4.26Å; L303-A398 HydrophobicContact CD2-CB 3.86Å
304	L	86.4	Confident	86.4	Confident	30 Å²	30	43.4 Å²	43.4	16%	0.157	23%	0.225	C	C	.	.	H	α-helix	trans	-64.3	-23.6	173.7	-71.4	172.6	0	0	0	112.7	F64 M300 S301 F302 A306 T307	F64-L304 HydrophobicContact CD1-CB 4.47Å; M300-L304 VanDerWaalsContact O-CG 3.29Å; M300-L304 WeakPolarHBondContact O-CG 3.33Å; M300-L304 PolarHBondContact O-N 2.97Å; S301-L304 PolarHBondContact O-N 2.79Å; F302-L304 VanDerWaalsContact C-N 3.31Å; F302-L304 PolarHBondContact O-N 3.45Å; L304-A306 PolarHBondContact O-N 2.95Å; L304-T307 PolarHBondContact O-N 3Å; L304-T307 PolarHBondContact O-OG1 2.97Å
305	T	89	Confident	86.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.5	-27.9	175.3	71.3	0	0	0	0	112.3	S301 F302 L303 T307 L308 Q313 A316 L317 L320	S301-T305 WeakPolarHBondContact O-CG2 3.18Å; S301-T305 PolarHBondContact O-N 3.33Å; F302-T305 WeakPolarHBondContact O-CB 3.48Å; F302-T305 PolarHBondContact O-N 2.97Å; F302-T305 PolarHBondContact O-OG1 2.97Å; L303-T305 PolarHBondContact O-N 3.49Å; T305-T307 PolarHBondContact O-N 2.84Å; T305-T307 VanDerWaalsContact O-N 3.14Å; T305-L308 WeakPolarHBondContact O-CB 3.46Å; T305-L308 PolarHBondContact O-N 3.37Å; T305-L308 VanDerWaalsContact O-N 3.11Å; T305-Q313 WeakPolarHBondContact O-CG 3.35Å; T305-A316 HydrophobicContact CG2-CB 3.81Å; T305-L317 HydrophobicContact CG2-CD2 4.04Å; T305-L317 HydrophobicContact CG2-CG 4.29Å; T305-L317 WeakPolarHBondContact OG1-CD2 3.44Å; T305-L320 HydrophobicContact CG2-CD1 3.62Å
306	A	88.1	Confident	86.8	Confident	17 Å²	17	44.1 Å²	44.1	14%	0.14	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-16.6	179.9	0	0	0	0	0	113.6	L303 L304 A398 N401 V402	L303-A306 WeakPolarHBondContact O-CB 3.49Å; L303-A306 PolarHBondContact O-N 2.94Å; L303-A306 VanDerWaalsContact O-N 3.16Å; L304-A306 PolarHBondContact O-N 2.95Å; A306-A398 HydrophobicContact CB-CB 3.89Å; A306-N401 HydrophobicContact CB-CB 4.14Å; A306-V402 HydrophobicContact CB-CG2 4.2Å
307	T	85	Confident	87.4	Confident	48 Å²	48	41.2 Å²	41.2	29%	0.294	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-3.3	179.4	62.4	0	0	0	0	112.8	L304 T305 L391 I393	L304-T307 PolarHBondContact O-N 3Å; L304-T307 PolarHBondContact O-OG1 2.97Å; T305-T307 PolarHBondContact O-N 2.84Å; T305-T307 VanDerWaalsContact O-N 3.14Å; T307-L391 VanDerWaalsContact CB-CD1 3.47Å; T307-L391 HydrophobicContact CG2-CB 4.24Å; T307-L391 HydrophobicContact CG2-CD1 3.47Å; T307-L391 VanDerWaalsContact CG2-CD1 3.47Å; T307-L391 HydrophobicContact CG2-CG 4.45Å; T307-I393 HydrophobicContact CG2-CD1 3.64Å
308	L	86.7	Confident	88.1	Confident	47 Å²	47	37.8 Å²	37.8	25%	0.246	20%	0.196	C	C	.	.	S	Bend	trans	-87.2	164.1	-177.2	-56.1	176.6	0	0	0	112	F64 T305 D312 Q313 A316	F64-L308 HydrophobicContact CE1-CD1 3.45Å; F64-L308 VanDerWaalsContact CE1-CD1 3.45Å; F64-L308 HydrophobicContact CE1-CD2 3.86Å; F64-L308 HydrophobicContact CE1-CG 4.02Å; F64-L308 HydrophobicContact CE2-CD1 4.39Å; F64-L308 HydrophobicContact CZ-CD1 3.27Å; F64-L308 HydrophobicContact CZ-CD2 3.58Å; F64-L308 HydrophobicContact CZ-CG 3.97Å; T305-L308 WeakPolarHBondContact O-CB 3.46Å; T305-L308 PolarHBondContact O-N 3.37Å; T305-L308 VanDerWaalsContact O-N 3.11Å; L308-D312 HydrophobicContact CB-CB 4.26Å; L308-D312 HydrophobicContact CD1-CB 4.47Å; L308-Q313 HydrophobicContact CB-CB 4.17Å; L308-A316 HydrophobicContact CD1-CB 3.83Å
309	K	88.3	Confident	88.5	Confident	155 Å²	155	37.9 Å²	37.9	67%	0.674	20%	0.197	S	C	*	.			trans	-63.4	150.4	166.4	-66.1	179.7	-178.5	177.1	0	109.6	K311 D312 Q313	K309-K311 VanDerWaalsContact C-N 3.33Å; K309-K311 PolarHBondContact O-N 2.67Å; K309-D312 PolarHBondContact O-N 3.24Å; K309-Q313 WeakPolarHBondContact O-CB 3.43Å; K309-Q313 PolarHBondContact O-N 2.76Å
310	P	86.9	Confident	88.8	Confident	96 Å²	96	37.2 Å²	37.2	62%	0.623	19%	0.194	S	C	*	.	H	α-helix	trans	-56.1	-41.3	-172.3	19.3	-32.8	0	0	0	113.8	Q313 V314	P310-Q313 WeakPolarHBondContact O-CB 3.31Å; P310-Q313 PolarHBondContact O-N 2.94Å; P310-V314 WeakPolarHBondContact O-CG2 3.33Å; P310-V314 PolarHBondContact O-N 2.95Å; P310-V314 VanDerWaalsContact O-N 3.09Å
311	K	87.8	Confident	89.3	Confident	182 Å²	182	35.9 Å²	35.9	79%	0.791	19%	0.187	S	C	*	.	H	α-helix	trans	-64.1	-45.1	177.3	-66	-174.8	176.9	-176.3	0	112.3	K309 Q313 S315	K309-K311 VanDerWaalsContact C-N 3.33Å; K309-K311 PolarHBondContact O-N 2.67Å; K311-Q313 VanDerWaalsContact C-N 3.33Å; K311-S315 PolarHBondContact O-N 3.42Å
312	D	88.6	Confident	89.4	Confident	85 Å²	85	35.8 Å²	35.8	46%	0.455	19%	0.186	S	C	.	.	H	α-helix	trans	-69.9	-36	179.8	-60.5	-33.4	0	0	0	110.8	L308 K309 S315 A316	L308-D312 HydrophobicContact CB-CB 4.26Å; L308-D312 HydrophobicContact CD1-CB 4.47Å; K309-D312 PolarHBondContact O-N 3.24Å; D312-S315 PolarHBondContact O-N 2.78Å; D312-S315 PolarHBondContact O-OG 3.23Å; D312-A316 WeakPolarHBondContact O-CB 3.14Å; D312-A316 PolarHBondContact O-N 3.03Å
313	Q	91.4	Very high	89.4	Confident	16 Å²	16	35.8 Å²	35.8	8%	0.075	19%	0.186	C	C	.	.	H	α-helix	trans	-57.7	-52.8	174.9	-175.8	179.2	27	0	0	111.5	T305 L308 K309 P310 K311 S315 A316 L317	T305-Q313 WeakPolarHBondContact O-CG 3.35Å; L308-Q313 HydrophobicContact CB-CB 4.17Å; K309-Q313 WeakPolarHBondContact O-CB 3.43Å; K309-Q313 PolarHBondContact O-N 2.76Å; P310-Q313 WeakPolarHBondContact O-CB 3.31Å; P310-Q313 PolarHBondContact O-N 2.94Å; K311-Q313 VanDerWaalsContact C-N 3.33Å; Q313-S315 VanDerWaalsContact C-N 3.3Å; Q313-S315 PolarHBondContact O-N 3.09Å; Q313-A316 PolarHBondContact O-N 3.33Å; Q313-L317 HydrophobicContact CG-CD1 3.91Å; Q313-L317 HydrophobicContact CG-CG 4.37Å; Q313-L317 WeakPolarHBondContact O-CB 3.45Å; Q313-L317 VanDerWaalsContact O-CG 3.28Å; Q313-L317 WeakPolarHBondContact O-CG 3.38Å; Q313-L317 PolarHBondContact O-N 3.28Å
314	V	91.3	Very high	89.3	Confident	22 Å²	22	35.8 Å²	35.8	13%	0.133	19%	0.186	C	C	.	.	H	α-helix	trans	-59.8	-43.2	178.3	176.1	0	0	0	0	110.7	P310 A316 L317 Q318 N409 I412 L413	P310-V314 WeakPolarHBondContact O-CG2 3.33Å; P310-V314 PolarHBondContact O-N 2.95Å; P310-V314 VanDerWaalsContact O-N 3.09Å; V314-A316 VanDerWaalsContact C-N 3.34Å; V314-A316 PolarHBondContact O-N 3.48Å; V314-L317 PolarHBondContact O-N 2.76Å; V314-Q318 VanDerWaalsContact O-CB 3.27Å; V314-Q318 WeakPolarHBondContact O-CB 3.36Å; V314-Q318 PolarHBondContact O-N 2.99Å; V314-N409 HydrophobicContact CG1-CB 4.32Å; V314-N409 HydrophobicContact CG2-CB 4.21Å; V314-I412 HydrophobicContact CG1-CG2 4.3Å; V314-L413 HydrophobicContact CG1-CD2 4.36Å
315	S	90.4	Very high	89.1	Confident	28 Å²	28	34.9 Å²	34.9	20%	0.196	18%	0.182	C	C	.	.	H	α-helix	trans	-63.4	-38.5	178.2	82.6	0	0	0	0	113	R62 K311 D312 Q313 L319	R62-S315 PolarHBondContact NH1-OG 3.37Å; K311-S315 PolarHBondContact O-N 3.42Å; D312-S315 PolarHBondContact O-N 2.78Å; D312-S315 PolarHBondContact O-OG 3.23Å; Q313-S315 VanDerWaalsContact C-N 3.3Å; Q313-S315 PolarHBondContact O-N 3.09Å; S315-L319 WeakPolarHBondContact O-CG 3.48Å; S315-L319 PolarHBondContact O-N 3.08Å
316	A	90.9	Very high	88.7	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-71.5	-42.9	178.2	0	0	0	0	0	111.2	F64 T305 L308 D312 Q313 V314 Q318 L319 L320	F64-A316 HydrophobicContact CZ-CB 4.42Å; T305-A316 HydrophobicContact CG2-CB 3.81Å; L308-A316 HydrophobicContact CD1-CB 3.83Å; D312-A316 WeakPolarHBondContact O-CB 3.14Å; D312-A316 PolarHBondContact O-N 3.03Å; Q313-A316 PolarHBondContact O-N 3.33Å; V314-A316 VanDerWaalsContact C-N 3.34Å; V314-A316 PolarHBondContact O-N 3.48Å; A316-Q318 VanDerWaalsContact C-N 3.32Å; A316-Q318 PolarHBondContact O-N 3.4Å; A316-L319 PolarHBondContact O-N 3.4Å; A316-L320 WeakPolarHBondContact O-CG 3.37Å; A316-L320 PolarHBondContact O-N 3.45Å
317	L	92.9	Very high	88.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.8	-42.9	174.7	-72.5	172.9	0	0	0	111.5	F302 T305 Q313 V314 L319 L320 V321 V402 A405 M406 L413	F302-L317 HydrophobicContact CD1-CD2 3.81Å; F302-L317 HydrophobicContact CE1-CD2 4.12Å; T305-L317 HydrophobicContact CG2-CD2 4.04Å; T305-L317 HydrophobicContact CG2-CG 4.29Å; T305-L317 WeakPolarHBondContact OG1-CD2 3.44Å; Q313-L317 HydrophobicContact CG-CD1 3.91Å; Q313-L317 HydrophobicContact CG-CG 4.37Å; Q313-L317 WeakPolarHBondContact O-CB 3.45Å; Q313-L317 VanDerWaalsContact O-CG 3.28Å; Q313-L317 WeakPolarHBondContact O-CG 3.38Å; Q313-L317 PolarHBondContact O-N 3.28Å; V314-L317 PolarHBondContact O-N 2.76Å; L317-L319 PolarHBondContact O-N 3.34Å; L317-L320 PolarHBondContact O-N 3.41Å; L317-V321 WeakPolarHBondContact O-CG2 3.47Å; L317-V321 PolarHBondContact O-N 2.91Å; L317-V402 HydrophobicContact CD2-CG1 3.9Å; L317-A405 HydrophobicContact CD1-CB 3.93Å; L317-M406 HydrophobicContact CD1-CG 4Å; L317-M406 HydrophobicContact CD2-CG 4.27Å; L317-M406 HydrophobicContact CD2-SD 4.3Å; L317-L413 HydrophobicContact CB-CD2 3.66Å
318	Q	93	Very high	88.6	Confident	15 Å²	15	32.3 Å²	32.3	7%	0.07	16%	0.164	C	C	.	.	H	α-helix	trans	-59.3	-46.1	177.3	-174.3	177.5	48.9	0	0	111.7	V314 A316 L320 V321 Y322 I412 L413 Q415	V314-Q318 VanDerWaalsContact O-CB 3.27Å; V314-Q318 WeakPolarHBondContact O-CB 3.36Å; V314-Q318 PolarHBondContact O-N 2.99Å; A316-Q318 VanDerWaalsContact C-N 3.32Å; A316-Q318 PolarHBondContact O-N 3.4Å; Q318-L320 VanDerWaalsContact C-N 3.35Å; Q318-L320 PolarHBondContact O-N 3.28Å; Q318-V321 PolarHBondContact O-N 3.38Å; Q318-Y322 VanDerWaalsContact CD-OH 3.32Å; Q318-Y322 HydrophobicContact CG-CE1 4.13Å; Q318-Y322 HydrophobicContact CG-CE2 3.69Å; Q318-Y322 VanDerWaalsContact CG-CZ 3.4Å; Q318-Y322 WeakPolarHBondContact CG-OH 3.47Å; Q318-Y322 PolarHBondContact NE2-OH 3.39Å; Q318-Y322 VanDerWaalsContact NE2-OH 3.09Å; Q318-Y322 WeakPolarHBondContact O-CD1 3.14Å; Q318-Y322 WeakPolarHBondContact O-CD2 3.35Å; Q318-Y322 VanDerWaalsContact O-CG 3.28Å; Q318-Y322 PolarHBondContact O-N 2.91Å; Q318-Y322 VanDerWaalsContact O-N 3.12Å; Q318-I412 PolarHBondContact NE2-O 3.48Å; Q318-L413 HydrophobicContact CB-CD2 4.03Å; Q318-Q415 PolarHBondContact NE2-O 3.33Å
319	L	90.8	Very high	88.8	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-64.8	-37	175.4	-67.3	173.2	0	0	0	112.5	A55 E58 L59 S315 A316 L317 Y322 L323 I420	A55-L319 HydrophobicContact CB-CB 4.48Å; A55-L319 HydrophobicContact CB-CD2 4.15Å; E58-L319 HydrophobicContact CB-CD1 4.03Å; E58-L319 HydrophobicContact CB-CD2 4.36Å; L59-L319 HydrophobicContact CD1-CB 4.01Å; L59-L319 HydrophobicContact CD2-CB 3.78Å; L59-L319 HydrophobicContact CD2-CD1 4.06Å; L59-L319 HydrophobicContact CG-CB 3.77Å; L59-L319 HydrophobicContact CG-CD1 4.21Å; S315-L319 WeakPolarHBondContact O-CG 3.48Å; S315-L319 PolarHBondContact O-N 3.08Å; A316-L319 PolarHBondContact O-N 3.4Å; L317-L319 PolarHBondContact O-N 3.34Å; L319-Y322 HydrophobicContact CD2-CD2 4.36Å; L319-Y322 PolarHBondContact O-N 2.87Å; L319-L323 PolarHBondContact O-N 3.09Å; L319-I420 HydrophobicContact CD2-CD1 3.74Å
320	L	90.9	Very high	88.9	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.2	-40.6	175.9	-71.2	170.5	0	0	0	111.7	L59 F302 T305 A316 L317 Q318 Y322 L323 M324	L59-L320 HydrophobicContact CD1-CD2 3.83Å; L59-L320 HydrophobicContact CD1-CG 4.32Å; L59-L320 HydrophobicContact CD2-CD2 4.44Å; L59-L320 HydrophobicContact CD2-CG 4.44Å; F302-L320 HydrophobicContact CD1-CB 4.39Å; F302-L320 HydrophobicContact CD1-CD1 3.75Å; F302-L320 HydrophobicContact CE1-CB 3.71Å; F302-L320 HydrophobicContact CE1-CD1 3.93Å; F302-L320 HydrophobicContact CE1-CG 4.45Å; F302-L320 HydrophobicContact CE2-CB 4.44Å; F302-L320 HydrophobicContact CG-CD1 4.09Å; F302-L320 HydrophobicContact CZ-CB 3.73Å; F302-L320 HydrophobicContact CZ-CD1 4.44Å; T305-L320 HydrophobicContact CG2-CD1 3.62Å; A316-L320 WeakPolarHBondContact O-CG 3.37Å; A316-L320 PolarHBondContact O-N 3.45Å; L317-L320 PolarHBondContact O-N 3.41Å; Q318-L320 VanDerWaalsContact C-N 3.35Å; Q318-L320 PolarHBondContact O-N 3.28Å; L320-Y322 VanDerWaalsContact C-N 3.29Å; L320-Y322 PolarHBondContact O-N 2.93Å; L320-L323 WeakPolarHBondContact O-CB 3.35Å; L320-L323 PolarHBondContact O-N 3.02Å; L320-L323 VanDerWaalsContact O-N 3.1Å; L320-M324 WeakPolarHBondContact O-CG 3.44Å; L320-M324 PolarHBondContact O-N 3.36Å
321	V	92.1	Very high	89.1	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.006	9%	0.092	C	C	.	.	H	α-helix	trans	-59.8	-40.3	174	168.8	0	0	0	0	111.1	L317 Q318 L323 M324 L332 M406 F414	L317-V321 WeakPolarHBondContact O-CG2 3.47Å; L317-V321 PolarHBondContact O-N 2.91Å; Q318-V321 PolarHBondContact O-N 3.38Å; V321-L323 PolarHBondContact O-N 3.06Å; V321-M324 WeakPolarHBondContact O-CB 3.39Å; V321-M324 PolarHBondContact O-N 3.09Å; V321-L332 HydrophobicContact CG2-CD2 4.25Å; V321-M406 HydrophobicContact CG2-CE 4.4Å; V321-F414 HydrophobicContact CG1-CD1 3.64Å; V321-F414 HydrophobicContact CG1-CE1 3.45Å; V321-F414 VanDerWaalsContact CG1-CE1 3.45Å; V321-F414 HydrophobicContact CG1-CZ 4.32Å
322	Y	90.2	Very high	89.5	Confident	7 Å²	7	9.8 Å²	9.8	3%	0.027	6%	0.055	C	C	.	.	H	α-helix	trans	-65	-28.2	176.1	-61.6	-17.6	0	0	0	113.7	I40 L51 Q52 A55 Q318 L319 L320 Q415 V416 I420	I40-Y322 HydrophobicContact CG2-CD1 3.88Å; I40-Y322 HydrophobicContact CG2-CE1 3.54Å; L51-Y322 HydrophobicContact CD1-CD2 3.92Å; L51-Y322 HydrophobicContact CD1-CE2 4.27Å; L51-Y322 HydrophobicContact CD1-CG 4.3Å; L51-Y322 HydrophobicContact CD2-CD1 3.88Å; L51-Y322 HydrophobicContact CD2-CD2 4.27Å; L51-Y322 HydrophobicContact CD2-CE1 4.35Å; L51-Y322 HydrophobicContact CD2-CG 3.84Å; L51-Y322 HydrophobicContact CG-CD2 4.1Å; L51-Y322 HydrophobicContact CG-CG 3.96Å; Q52-Y322 VanDerWaalsContact CG-O 3.28Å; Q52-Y322 WeakPolarHBondContact CG-O 3.19Å; Q52-Y322 PolarHBondContact NE2-O 3.3Å; A55-Y322 HydrophobicContact CB-CD2 4.48Å; Q318-Y322 VanDerWaalsContact CD-OH 3.32Å; Q318-Y322 HydrophobicContact CG-CE1 4.13Å; Q318-Y322 HydrophobicContact CG-CE2 3.69Å; Q318-Y322 VanDerWaalsContact CG-CZ 3.4Å; Q318-Y322 WeakPolarHBondContact CG-OH 3.47Å; Q318-Y322 PolarHBondContact NE2-OH 3.39Å; Q318-Y322 VanDerWaalsContact NE2-OH 3.09Å; Q318-Y322 WeakPolarHBondContact O-CD1 3.14Å; Q318-Y322 WeakPolarHBondContact O-CD2 3.35Å; Q318-Y322 VanDerWaalsContact O-CG 3.28Å; Q318-Y322 PolarHBondContact O-N 2.91Å; Q318-Y322 VanDerWaalsContact O-N 3.12Å; L319-Y322 HydrophobicContact CD2-CD2 4.36Å; L319-Y322 PolarHBondContact O-N 2.87Å; L320-Y322 VanDerWaalsContact C-N 3.29Å; L320-Y322 PolarHBondContact O-N 2.93Å; Y322-Q415 PolarHBondContact OH-O 2.79Å; Y322-V416 HydrophobicContact CE1-CG2 4.32Å; Y322-V416 WeakPolarHBondContact OH-CA 3.29Å; Y322-V416 PolarHBondContact OH-N 3.33Å; Y322-I420 HydrophobicContact CE2-CD1 4.1Å
323	L	87.8	Confident	89.7	Confident	0 Å²	0	7 Å²	7	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-78.4	-25.1	178.9	-168.4	60.1	0	0	0	112.7	L59 L65 F68 I203 L207 L298 L319 L320 V321	L59-L323 HydrophobicContact CD1-CD2 4.09Å; L65-L323 HydrophobicContact CD1-CD2 4.17Å; L65-L323 HydrophobicContact CD2-CD2 4.31Å; F68-L323 HydrophobicContact CE1-CD2 4.43Å; I203-L323 HydrophobicContact CG2-CD1 3.94Å; I203-L323 HydrophobicContact CG2-CG 4.03Å; L207-L323 HydrophobicContact CD1-CD1 4.13Å; L207-L323 HydrophobicContact CD2-CD1 4.38Å; L298-L323 HydrophobicContact CD1-CB 4.41Å; L298-L323 HydrophobicContact CD1-CD2 4.31Å; L298-L323 HydrophobicContact CD1-CG 4.38Å; L298-L323 HydrophobicContact CD2-CD2 3.62Å; L298-L323 HydrophobicContact CD2-CG 4.41Å; L319-L323 PolarHBondContact O-N 3.09Å; L320-L323 WeakPolarHBondContact O-CB 3.35Å; L320-L323 PolarHBondContact O-N 3.02Å; L320-L323 VanDerWaalsContact O-N 3.1Å; V321-L323 PolarHBondContact O-N 3.06Å
324	M	86.5	Confident	89.9	Confident	1 Å²	1	7.4 Å²	7.4	1%	0.005	4%	0.04	C	C	.	.	S	Bend	trans	-62.8	154.1	179.7	-69.2	173.3	56	0	0	112.5	Q52 L293 L294 P295 L298 F302 L320 V321 H328 L332	Q52-M324 PolarHBondContact NE2-O 2.92Å; L293-M324 VanDerWaalsContact O-CE 3.29Å; L293-M324 WeakPolarHBondContact O-CE 3.47Å; L294-M324 HydrophobicContact CD2-CE 3.77Å; L294-M324 HydrophobicContact CD2-SD 3.72Å; P295-M324 HydrophobicContact CG-CG 4.36Å; L298-M324 HydrophobicContact CD1-CG 4.06Å; F302-M324 HydrophobicContact CE2-SD 4.48Å; F302-M324 HydrophobicContact CZ-CG 4.48Å; F302-M324 HydrophobicContact CZ-SD 3.87Å; L320-M324 WeakPolarHBondContact O-CG 3.44Å; L320-M324 PolarHBondContact O-N 3.36Å; V321-M324 WeakPolarHBondContact O-CB 3.39Å; V321-M324 PolarHBondContact O-N 3.09Å; M324-H328 HydrophobicContact CE-CB 3.63Å; M324-L332 HydrophobicContact CE-CD2 4.03Å; M324-L332 HydrophobicContact SD-CD2 4.15Å
325	P	82.6	Confident	90.2	Very high	10 Å²	10	6.3 Å²	6.3	7%	0.065	3%	0.033	C	C	.	.			trans	-63	146	172.4	-12.1	24	0	0	0	112.4	I203 R206 C327 H328 S329	I203-P325 HydrophobicContact CG1-CG 4.26Å; R206-P325 VanDerWaalsContact NH2-CA 3.29Å; P325-C327 VanDerWaalsContact C-N 3.31Å; P325-C327 PolarHBondContact O-N 3.1Å; P325-H328 WeakPolarHBondContact O-CB 3.34Å; P325-H328 PolarHBondContact O-N 3.41Å; P325-S329 PolarHBondContact O-N 3.32Å
326	P	81.1	Confident	90.4	Very high	4 Å²	4	5 Å²	5	3%	0.026	2%	0.024	C	C	.	.	H	α-helix	trans	-50.1	-43.5	-179.2	-33.7	38.2	0	0	0	114.8	L199 R206 I219 H328 S329 D330	L199-P326 HydrophobicContact CD2-CG 4.12Å; R206-P326 VanDerWaalsContact NH1-CD 3.33Å; I219-P326 HydrophobicContact CD1-CB 4.31Å; I219-P326 HydrophobicContact CD1-CG 4.21Å; P326-H328 VanDerWaalsContact C-N 3.28Å; P326-H328 PolarHBondContact O-N 3.29Å; P326-S329 WeakPolarHBondContact CA-OG 3.45Å; P326-S329 PolarHBondContact O-N 2.78Å; P326-S329 PolarHBondContact O-OG 3.5Å; P326-D330 WeakPolarHBondContact O-CB 3.31Å; P326-D330 PolarHBondContact O-N 3.38Å; P326-D330 VanDerWaalsContact O-OD1 3.1Å
327	C	82.7	Confident	90.6	Very high	2 Å²	2	9 Å²	9	1%	0.014	4%	0.042	C	C	.	.	H	α-helix	trans	-57.9	-42.4	177.2	-45	0	0	0	0	112.3	L105 L109 Q222 P325 T331	L105-C327 HydrophobicContact CD2-CB 4.21Å; L109-C327 HydrophobicContact CD1-CB 3.75Å; Q222-C327 HydrophobicContact CB-CB 4.27Å; Q222-C327 PolarHBondContact OE1-SG 3.18Å; P325-C327 VanDerWaalsContact C-N 3.31Å; P325-C327 PolarHBondContact O-N 3.1Å; C327-T331 VanDerWaalsContact O-CB 3.26Å; C327-T331 WeakPolarHBondContact O-CB 3.47Å; C327-T331 PolarHBondContact O-N 3.41Å; C327-T331 VanDerWaalsContact O-N 3.1Å; C327-T331 PolarHBondContact O-OG1 3.35Å
328	H	88.6	Confident	90.8	Very high	6 Å²	6	9.2 Å²	9.2	3%	0.028	4%	0.043	C	C	.	.	H	α-helix	trans	-72.5	-42.7	-179.1	-68.4	-101.3	0	0	0	110.9	L105 E106 L293 M324 P325 P326 L332	L105-H328 HydrophobicContact CD2-CB 4.44Å; E106-H328 IonicContact OE1-CD2 3.55Å; E106-H328 IonicContact OE1-CE1 4Å; E106-H328 IonicContact OE1-NE2 2.85Å; E106-H328 PolarHBondContact OE1-NE2 3.05Å; L293-H328 HydrophobicContact CD1-CB 4.35Å; L293-H328 PolarHBondContact O-ND1 3.4Å; M324-H328 HydrophobicContact CE-CB 3.63Å; P325-H328 WeakPolarHBondContact O-CB 3.34Å; P325-H328 PolarHBondContact O-N 3.41Å; P326-H328 VanDerWaalsContact C-N 3.28Å; P326-H328 PolarHBondContact O-N 3.29Å; H328-L332 WeakPolarHBondContact O-CB 3.28Å; H328-L332 PolarHBondContact O-N 3.12Å
329	S	90.4	Very high	90.9	Very high	4 Å²	4	8.6 Å²	8.6	3%	0.028	4%	0.04	C	C	.	.	H	α-helix	trans	-64.1	-43.5	177.4	62.4	0	0	0	0	112.3	P325 P326 L332 E333 F414	P325-S329 PolarHBondContact O-N 3.32Å; P326-S329 WeakPolarHBondContact CA-OG 3.45Å; P326-S329 PolarHBondContact O-N 2.78Å; P326-S329 PolarHBondContact O-OG 3.5Å; S329-L332 PolarHBondContact O-N 2.88Å; S329-E333 PolarHBondContact O-N 3.47Å; S329-F414 WeakPolarHBondContact O-CE1 3.36Å
330	D	89.4	Confident	91.1	Very high	1 Å²	1	10.2 Å²	10.2	1%	0.005	5%	0.048	C	C	.	.	H	α-helix	trans	-68.8	-42.3	-178.1	-62.6	2.5	0	0	0	110.7	H41 R48 Q222 I223 P326 L332 E333 R334	H41-D330 IonicContact CD2-OD1 2.78Å; H41-D330 IonicContact CE1-OD1 3.88Å; H41-D330 VanDerWaalsContact NE2-CG 3.34Å; H41-D330 IonicContact NE2-OD1 3.95Å; H41-D330 PolarHBondContact NE2-OD1 3.49Å; H41-D330 IonicContact NE2-OD2 3.99Å; R48-D330 IonicContact CZ-OD1 2.94Å; R48-D330 IonicContact NH1-OD1 3.57Å; R48-D330 PolarHBondContact NH1-OD1 3.14Å; R48-D330 IonicContact NH1-OD2 2.76Å; R48-D330 IonicContact NH2-OD1 3.98Å; R48-D330 PolarHBondContact NH2-OD1 3.28Å; Q222-D330 PolarHBondContact N-OD2 3.31Å; Q222-D330 VanDerWaalsContact N-OD2 3.09Å; I223-D330 HydrophobicContact CG1-CB 4.27Å; P326-D330 WeakPolarHBondContact O-CB 3.31Å; P326-D330 PolarHBondContact O-N 3.38Å; P326-D330 VanDerWaalsContact O-OD1 3.1Å; D330-L332 VanDerWaalsContact C-N 3.34Å; D330-E333 PolarHBondContact O-N 2.79Å; D330-R334 PolarHBondContact O-N 3.03Å; D330-R334 VanDerWaalsContact O-N 3.09Å
331	T	92.7	Very high	91.2	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-65	-38.6	175.5	-57.8	0	0	0	0	111.6	Q222 P224 V227 F286 L293 C327 R334 L335	Q222-T331 PolarHBondContact O-OG1 3.2Å; P224-T331 VanDerWaalsContact CD-OG1 3.32Å; P224-T331 WeakPolarHBondContact CD-OG1 3.08Å; V227-T331 HydrophobicContact CG1-CG2 4.21Å; V227-T331 HydrophobicContact CG2-CG2 4.04Å; F286-T331 HydrophobicContact CE1-CG2 4.03Å; F286-T331 HydrophobicContact CZ-CG2 4.36Å; L293-T331 HydrophobicContact CD1-CG2 3.96Å; C327-T331 VanDerWaalsContact O-CB 3.26Å; C327-T331 WeakPolarHBondContact O-CB 3.47Å; C327-T331 PolarHBondContact O-N 3.41Å; C327-T331 VanDerWaalsContact O-N 3.1Å; C327-T331 PolarHBondContact O-OG1 3.35Å; T331-R334 PolarHBondContact O-N 2.91Å; T331-L335 PolarHBondContact O-N 3.47Å; T331-L335 VanDerWaalsContact O-N 3.08Å
332	L	94.9	Very high	91.3	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.005	6%	0.062	C	C	.	.	H	α-helix	trans	-65.3	-44.7	175.1	178.6	72	0	0	0	111.8	L293 L294 V321 M324 H328 S329 D330 R334 L335 L336 M406 F414	L293-L332 HydrophobicContact CD2-CB 4.02Å; L293-L332 HydrophobicContact CD2-CD1 3.84Å; L293-L332 HydrophobicContact CG-CB 4.37Å; L294-L332 HydrophobicContact CD2-CD1 4.29Å; L294-L332 HydrophobicContact CD2-CD2 3.94Å; V321-L332 HydrophobicContact CG2-CD2 4.25Å; M324-L332 HydrophobicContact CE-CD2 4.03Å; M324-L332 HydrophobicContact SD-CD2 4.15Å; H328-L332 WeakPolarHBondContact O-CB 3.28Å; H328-L332 PolarHBondContact O-N 3.12Å; S329-L332 PolarHBondContact O-N 2.88Å; D330-L332 VanDerWaalsContact C-N 3.34Å; L332-R334 VanDerWaalsContact C-N 3.29Å; L332-R334 PolarHBondContact O-N 3.34Å; L332-L335 PolarHBondContact O-N 3.35Å; L332-L336 HydrophobicContact CD1-CD1 3.99Å; L332-L336 HydrophobicContact CD1-CG 4.03Å; L332-L336 HydrophobicContact CD2-CD1 4.36Å; L332-L336 HydrophobicContact CG-CD1 3.81Å; L332-L336 HydrophobicContact CG-CG 4.21Å; L332-L336 WeakPolarHBondContact O-CB 3.43Å; L332-L336 VanDerWaalsContact O-CG 3.31Å; L332-L336 WeakPolarHBondContact O-CG 3.35Å; L332-L336 PolarHBondContact O-N 3.34Å; L332-M406 HydrophobicContact CD1-CE 4.04Å; L332-M406 HydrophobicContact CD2-CE 3.48Å; L332-M406 VanDerWaalsContact CD2-CE 3.48Å; L332-M406 HydrophobicContact CG-CE 4.21Å; L332-F414 HydrophobicContact CB-CZ 4.42Å; L332-F414 HydrophobicContact CD2-CE1 4.4Å; L332-F414 HydrophobicContact CD2-CZ 4.03Å; L332-F414 HydrophobicContact CG-CZ 4.04Å
333	E	94.3	Very high	91.5	Very high	28 Å²	28	14 Å²	14	13%	0.131	7%	0.066	C	C	.	.	H	α-helix	trans	-57.1	-46.5	175.6	-176.5	175.9	129.7	0	0	110.4	H41 S329 D330 L335 L336 K337 F414	H41-E333 IonicContact CE1-OE1 2.88Å; H41-E333 IonicContact CE1-OE2 2.7Å; H41-E333 PolarHBondContact CE1-OE2 2.98Å; H41-E333 IonicContact ND1-OE1 3.8Å; H41-E333 IonicContact ND1-OE2 3.34Å; H41-E333 PolarHBondContact ND1-OE2 3.29Å; S329-E333 PolarHBondContact O-N 3.47Å; D330-E333 PolarHBondContact O-N 2.79Å; E333-L335 VanDerWaalsContact C-N 3.33Å; E333-L335 PolarHBondContact O-N 3.42Å; E333-L336 PolarHBondContact O-N 3Å; E333-K337 VanDerWaalsContact O-CB 3.27Å; E333-K337 WeakPolarHBondContact O-CB 3.47Å; E333-K337 PolarHBondContact O-N 2.9Å; E333-F414 VanDerWaalsContact CA-CZ 3.4Å; E333-F414 HydrophobicContact CB-CD1 3.92Å; E333-F414 HydrophobicContact CB-CD2 3.86Å; E333-F414 HydrophobicContact CB-CE1 3.71Å; E333-F414 HydrophobicContact CB-CE2 3.71Å; E333-F414 HydrophobicContact CB-CG 4Å; E333-F414 HydrophobicContact CB-CZ 3.62Å; E333-F414 HydrophobicContact CG-CD1 4.36Å; E333-F414 HydrophobicContact CG-CD2 3.64Å; E333-F414 HydrophobicContact CG-CE2 3.89Å; E333-F414 HydrophobicContact CG-CG 3.93Å; E333-F414 HydrophobicContact CG-CZ 4.32Å; E333-F414 WeakPolarHBondContact OE2-CB 3.5Å; E333-F414 WeakPolarHBondContact OE2-CG 3.26Å
334	R	95	Very high	91.7	Very high	23 Å²	23	20 Å²	20	9%	0.087	9%	0.094	C	C	.	.	H	α-helix	trans	-59.3	-44.7	179.7	-179.4	64.8	-168.5	94.7	-9.4	112.4	I223 V227 E228 E235 D330 T331 L332 A338	I223-R334 HydrophobicContact CD1-CB 3.83Å; I223-R334 HydrophobicContact CD1-CG 4.17Å; I223-R334 HydrophobicContact CG1-CB 4.26Å; I223-R334 HydrophobicContact CG2-CB 4.23Å; I223-R334 HydrophobicContact CG2-CG 4.03Å; V227-R334 HydrophobicContact CG1-CG 4.21Å; E228-R334 IonicContact OE1-NE 3.2Å; E228-R334 WeakPolarHBondContact OE2-CD 3.36Å; E228-R334 IonicContact OE2-CZ 2.84Å; E228-R334 IonicContact OE2-NE 2.67Å; E228-R334 PolarHBondContact OE2-NE 2.87Å; E235-R334 IonicContact OE1-CZ 3.05Å; E235-R334 IonicContact OE1-NH1 3.2Å; E235-R334 PolarHBondContact OE1-NH1 2.96Å; E235-R334 IonicContact OE1-NH2 3.76Å; E235-R334 PolarHBondContact OE1-NH2 3.27Å; E235-R334 IonicContact OE2-NH2 2.55Å; D330-R334 PolarHBondContact O-N 3.03Å; D330-R334 VanDerWaalsContact O-N 3.09Å; T331-R334 PolarHBondContact O-N 2.91Å; L332-R334 VanDerWaalsContact C-N 3.29Å; L332-R334 PolarHBondContact O-N 3.34Å; R334-A338 PolarHBondContact O-N 3.24Å
335	L	96.3	Very high	92	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.3	-51.9	177.9	177.2	64.5	0	0	0	111.1	L282 F286 L293 T331 L332 E333 K337 A338 L339 F371 L375	L282-L335 HydrophobicContact CD2-CD1 4.19Å; F286-L335 HydrophobicContact CD2-CD2 4.3Å; F286-L335 HydrophobicContact CE1-CD2 4.45Å; F286-L335 HydrophobicContact CE2-CD1 3.84Å; F286-L335 HydrophobicContact CE2-CD2 3.76Å; F286-L335 HydrophobicContact CE2-CG 4.32Å; F286-L335 HydrophobicContact CZ-CB 4.41Å; F286-L335 HydrophobicContact CZ-CD1 4.28Å; F286-L335 HydrophobicContact CZ-CD2 3.85Å; F286-L335 HydrophobicContact CZ-CG 4.41Å; L293-L335 HydrophobicContact CD2-CD2 4.26Å; T331-L335 PolarHBondContact O-N 3.47Å; T331-L335 VanDerWaalsContact O-N 3.08Å; L332-L335 PolarHBondContact O-N 3.35Å; E333-L335 VanDerWaalsContact C-N 3.33Å; E333-L335 PolarHBondContact O-N 3.42Å; L335-K337 VanDerWaalsContact C-N 3.28Å; L335-K337 PolarHBondContact O-N 3.02Å; L335-A338 WeakPolarHBondContact O-CB 3.49Å; L335-A338 PolarHBondContact O-N 3.39Å; L335-L339 HydrophobicContact CD1-CD1 4.18Å; L335-L339 HydrophobicContact CD1-CD2 4.49Å; L335-L339 HydrophobicContact CD1-CG 4.15Å; L335-L339 HydrophobicContact CG-CD1 3.99Å; L335-L339 HydrophobicContact CG-CG 4.31Å; L335-L339 WeakPolarHBondContact O-CG 3.14Å; L335-L339 PolarHBondContact O-N 2.9Å; L335-F371 HydrophobicContact CD1-CE1 4.23Å; L335-F371 HydrophobicContact CD1-CZ 4.4Å; L335-F371 HydrophobicContact CD2-CD1 4.42Å; L335-F371 HydrophobicContact CD2-CE1 4.44Å; L335-L375 HydrophobicContact CD2-CD1 4.03Å; L335-L375 HydrophobicContact CD2-CD2 3.75Å; L335-L375 HydrophobicContact CD2-CG 4.48Å
336	L	96.3	Very high	92.4	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-60.9	-38.7	-177.7	-69.8	176.7	0	0	0	111.8	L332 E333 A338 L339 H340 M406 I407 W410 F414	L332-L336 HydrophobicContact CD1-CD1 3.99Å; L332-L336 HydrophobicContact CD1-CG 4.03Å; L332-L336 HydrophobicContact CD2-CD1 4.36Å; L332-L336 HydrophobicContact CG-CD1 3.81Å; L332-L336 HydrophobicContact CG-CG 4.21Å; L332-L336 WeakPolarHBondContact O-CB 3.43Å; L332-L336 VanDerWaalsContact O-CG 3.31Å; L332-L336 WeakPolarHBondContact O-CG 3.35Å; L332-L336 PolarHBondContact O-N 3.34Å; E333-L336 PolarHBondContact O-N 3Å; L336-A338 VanDerWaalsContact C-N 3.35Å; L336-A338 PolarHBondContact O-N 3.1Å; L336-L339 PolarHBondContact O-N 3.05Å; L336-H340 WeakPolarHBondContact O-CB 3.42Å; L336-H340 PolarHBondContact O-N 3.15Å; L336-M406 HydrophobicContact CD1-CB 4.01Å; L336-M406 HydrophobicContact CD1-CE 4.18Å; L336-M406 HydrophobicContact CD2-CB 4.06Å; L336-I407 HydrophobicContact CD2-CG1 3.77Å; L336-W410 HydrophobicContact CB-CB 3.86Å; L336-F414 HydrophobicContact CD1-CE2 3.9Å; L336-F414 HydrophobicContact CD1-CZ 3.98Å
337	K	95.3	Very high	92.7	Very high	84 Å²	84	30.5 Å²	30.5	37%	0.365	15%	0.146	S	C	.	.	H	α-helix	trans	-60.1	-42.8	173.6	-176.3	177.3	-177.9	176.5	0	112.3	E333 L335 K341 W410	E333-K337 VanDerWaalsContact O-CB 3.27Å; E333-K337 WeakPolarHBondContact O-CB 3.47Å; E333-K337 PolarHBondContact O-N 2.9Å; L335-K337 VanDerWaalsContact C-N 3.28Å; L335-K337 PolarHBondContact O-N 3.02Å; K337-K341 WeakPolarHBondContact O-CG 3.44Å; K337-K341 PolarHBondContact O-N 3.07Å; K337-W410 HydrophobicContact CB-CE3 4.11Å; K337-W410 HydrophobicContact CB-CZ3 4.13Å; K337-W410 HydrophobicContact CD-CH2 4.24Å; K337-W410 HydrophobicContact CD-CZ3 4.16Å; K337-W410 HydrophobicContact CG-CE3 4.44Å; K337-W410 HydrophobicContact CG-CH2 4.01Å; K337-W410 HydrophobicContact CG-CZ2 4.42Å; K337-W410 HydrophobicContact CG-CZ3 4.02Å
338	A	95.3	Very high	93	Very high	4 Å²	4	33.3 Å²	33.3	3%	0.033	16%	0.161	C	C	.	.	H	α-helix	trans	-65.8	-45.6	176.3	0	0	0	0	0	111.4	C231 E235 R334 L335 L336 H340 K341 I342	C231-A338 HydrophobicContact CB-CB 3.92Å; E235-A338 HydrophobicContact CG-CB 4.41Å; E235-A338 WeakPolarHBondContact OE1-CB 3.33Å; R334-A338 PolarHBondContact O-N 3.24Å; L335-A338 WeakPolarHBondContact O-CB 3.49Å; L335-A338 PolarHBondContact O-N 3.39Å; L336-A338 VanDerWaalsContact C-N 3.35Å; L336-A338 PolarHBondContact O-N 3.1Å; A338-H340 VanDerWaalsContact C-N 3.33Å; A338-H340 PolarHBondContact O-N 2.96Å; A338-K341 PolarHBondContact O-N 3.21Å; A338-I342 WeakPolarHBondContact O-CG1 2.77Å; A338-I342 PolarHBondContact O-N 2.96Å; A338-I342 VanDerWaalsContact O-N 3.15Å
339	L	95.8	Very high	92.9	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-62.8	-40.5	178.6	-64.3	-180	0	0	0	111.7	F245 L335 L336 I342 T343 L367 F371 I407	F245-L339 HydrophobicContact CE2-CD2 3.88Å; F245-L339 HydrophobicContact CZ-CD2 4.2Å; L335-L339 HydrophobicContact CD1-CD1 4.18Å; L335-L339 HydrophobicContact CD1-CD2 4.49Å; L335-L339 HydrophobicContact CD1-CG 4.15Å; L335-L339 HydrophobicContact CG-CD1 3.99Å; L335-L339 HydrophobicContact CG-CG 4.31Å; L335-L339 WeakPolarHBondContact O-CG 3.14Å; L335-L339 PolarHBondContact O-N 2.9Å; L336-L339 PolarHBondContact O-N 3.05Å; L339-I342 HydrophobicContact CD2-CD1 4.45Å; L339-I342 WeakPolarHBondContact O-CB 3.32Å; L339-I342 PolarHBondContact O-N 2.7Å; L339-T343 WeakPolarHBondContact O-CG2 3.41Å; L339-T343 PolarHBondContact O-N 3.33Å; L339-L367 HydrophobicContact CB-CD1 4.24Å; L339-L367 HydrophobicContact CD2-CD1 4.25Å; L339-L367 HydrophobicContact CD2-CD2 4.41Å; L339-F371 HydrophobicContact CD1-CD2 3.94Å; L339-F371 HydrophobicContact CD1-CE2 4.12Å; L339-F371 HydrophobicContact CD1-CG 4.28Å; L339-F371 HydrophobicContact CD2-CD2 4.07Å; L339-F371 HydrophobicContact CD2-CE2 3.5Å; L339-F371 VanDerWaalsContact CD2-CE2 3.5Å; L339-F371 HydrophobicContact CD2-CZ 4.02Å; L339-F371 HydrophobicContact CG-CE2 4.46Å; L339-I407 HydrophobicContact CB-CD1 4.38Å; L339-I407 HydrophobicContact CB-CG1 4.26Å; L339-I407 HydrophobicContact CB-CG2 4.41Å; L339-I407 HydrophobicContact CD1-CD1 4.01Å; L339-I407 HydrophobicContact CD1-CG1 4.19Å
340	H	95.1	Very high	92.6	Very high	37 Å²	37	42 Å²	42	17%	0.171	21%	0.211	C	C	.	.	H	α-helix	trans	-63.1	-44.5	177.4	-171.4	86.3	0	0	0	112.1	L336 A338 I342 T343 E344 I407 W410	L336-H340 WeakPolarHBondContact O-CB 3.42Å; L336-H340 PolarHBondContact O-N 3.15Å; A338-H340 VanDerWaalsContact C-N 3.33Å; A338-H340 PolarHBondContact O-N 2.96Å; H340-I342 PolarHBondContact O-N 3.06Å; H340-T343 WeakPolarHBondContact CA-OG1 3.14Å; H340-T343 WeakPolarHBondContact O-CA 3.17Å; H340-T343 PolarHBondContact O-N 2.98Å; H340-T343 PolarHBondContact O-OG1 3.31Å; H340-E344 IonicContact CD2-OE1 2.72Å; H340-E344 PolarHBondContact CD2-OE1 3.46Å; H340-E344 IonicContact NE2-OE1 3.45Å; H340-E344 PolarHBondContact NE2-OE1 3.03Å; H340-E344 WeakPolarHBondContact O-CG 3.41Å; H340-E344 PolarHBondContact O-N 3.23Å; H340-I407 PolarHBondContact ND1-O 3.17Å; H340-W410 HydrophobicContact CB-CG 4.15Å; H340-W410 AromaticContact CD2-CD1 3.66Å; H340-W410 AromaticContact CD2-NE1 3.01Å; H340-W410 PolarHBondContact CD2-NE1 2.98Å; H340-W410 AromaticContact CE1-CD1 3.73Å; H340-W410 AromaticContact CE1-NE1 3.62Å; H340-W410 AromaticContact CG-CD1 3.17Å; H340-W410 AromaticContact CG-NE1 3.04Å; H340-W410 AromaticContact ND1-CD1 3.25Å; H340-W410 VanDerWaalsContact ND1-CD1 3.25Å; H340-W410 AromaticContact ND1-NE1 3.46Å; H340-W410 PolarHBondContact ND1-NE1 3.26Å; H340-W410 AromaticContact NE2-CD1 3.92Å; H340-W410 AromaticContact NE2-NE1 3.33Å; H340-W410 PolarHBondContact NE2-NE1 2.83Å
341	K	94	Very high	92.3	Very high	66 Å²	66	43.1 Å²	43.1	29%	0.287	22%	0.222	S	C	.	.	H	α-helix	trans	-58	-35.6	173.6	-73.9	178.7	173.5	-168.2	0	113	E235 L239 K337 A338 N345	E235-K341 HydrophobicContact CG-CD 3.88Å; E235-K341 IonicContact OE2-NZ 2.77Å; E235-K341 PolarHBondContact OE2-NZ 2.9Å; L239-K341 HydrophobicContact CD2-CB 4.34Å; K337-K341 WeakPolarHBondContact O-CG 3.44Å; K337-K341 PolarHBondContact O-N 3.07Å; A338-K341 PolarHBondContact O-N 3.21Å; K341-N345 PolarHBondContact O-ND2 2.99Å
342	I	94.3	Very high	91.8	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-44.3	174	-64.9	167.9	0	0	0	109.5	I234 L239 I244 F245 A338 L339 H340 E344 N345 N360 M362 L367	I234-I342 HydrophobicContact CG2-CD1 3.65Å; I234-I342 HydrophobicContact CG2-CG1 4.31Å; L239-I342 HydrophobicContact CD2-CG1 4.08Å; I244-I342 HydrophobicContact CG2-CD1 4.37Å; I244-I342 HydrophobicContact CG2-CG2 3.64Å; F245-I342 HydrophobicContact CE2-CD1 3.66Å; F245-I342 HydrophobicContact CZ-CD1 4.44Å; A338-I342 WeakPolarHBondContact O-CG1 2.77Å; A338-I342 PolarHBondContact O-N 2.96Å; A338-I342 VanDerWaalsContact O-N 3.15Å; L339-I342 HydrophobicContact CD2-CD1 4.45Å; L339-I342 WeakPolarHBondContact O-CB 3.32Å; L339-I342 PolarHBondContact O-N 2.7Å; H340-I342 PolarHBondContact O-N 3.06Å; I342-E344 VanDerWaalsContact C-N 3.31Å; I342-E344 PolarHBondContact O-N 3.3Å; I342-N345 CarbonylContact O-C 3.56Å; I342-N345 PolarHBondContact O-N 3.43Å; I342-N345 VanDerWaalsContact O-N 3.09Å; I342-N360 WeakPolarHBondContact CG2-ND2 3.13Å; I342-N360 PolarHBondContact O-ND2 2.81Å; I342-M362 HydrophobicContact CG2-CB 4.14Å; I342-L367 HydrophobicContact CB-CD1 4.33Å; I342-L367 HydrophobicContact CG2-CD1 4.11Å
343	T	93.8	Very high	91.3	Very high	20 Å²	20	57 Å²	57	12%	0.123	30%	0.301	C	S	.	.	H	α-helix	trans	-64.7	-32.1	178.2	59.6	0	0	0	0	113.7	L339 H340 N345 C346 L367 I407	L339-T343 WeakPolarHBondContact O-CG2 3.41Å; L339-T343 PolarHBondContact O-N 3.33Å; H340-T343 WeakPolarHBondContact CA-OG1 3.14Å; H340-T343 WeakPolarHBondContact O-CA 3.17Å; H340-T343 PolarHBondContact O-N 2.98Å; H340-T343 PolarHBondContact O-OG1 3.31Å; T343-N345 PolarHBondContact O-N 3.25Å; T343-C346 WeakPolarHBondContact O-CB 3.37Å; T343-C346 PolarHBondContact O-N 2.96Å; T343-C346 PolarHBondContact O-SG 3.26Å; T343-L367 HydrophobicContact CG2-CD1 3.53Å; T343-I407 HydrophobicContact CG2-CG2 4.05Å
344	E	92.6	Very high	90.8	Very high	125 Å²	125	58.3 Å²	58.3	58%	0.584	32%	0.323	S	S	*	.	H	α-helix	trans	-62.7	-27.5	174.4	-71.3	175.1	150.3	0	0	112.2	H340 I342	H340-E344 IonicContact CD2-OE1 2.72Å; H340-E344 PolarHBondContact CD2-OE1 3.46Å; H340-E344 IonicContact NE2-OE1 3.45Å; H340-E344 PolarHBondContact NE2-OE1 3.03Å; H340-E344 WeakPolarHBondContact O-CG 3.41Å; H340-E344 PolarHBondContact O-N 3.23Å; I342-E344 VanDerWaalsContact C-N 3.31Å; I342-E344 PolarHBondContact O-N 3.3Å
345	N	91.4	Very high	90.4	Very high	60 Å²	60	63.9 Å²	63.9	32%	0.321	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	23.2	-179.9	-63.7	-68.2	0	0	0	112.9	L239 K341 I342 T343 G359 N360	L239-N345 HydrophobicContact CB-CB 4.41Å; K341-N345 PolarHBondContact O-ND2 2.99Å; I342-N345 CarbonylContact O-C 3.56Å; I342-N345 PolarHBondContact O-N 3.43Å; I342-N345 VanDerWaalsContact O-N 3.09Å; T343-N345 PolarHBondContact O-N 3.25Å; N345-G359 WeakPolarHBondContact O-CA 3.38Å; N345-N360 PolarHBondContact O-N 3.04Å; N345-N360 PolarHBondContact O-ND2 2.64Å
346	C	90.8	Very high	89.8	Confident	25 Å²	25	69.7 Å²	69.7	17%	0.169	38%	0.381	C	S	.	.			trans	-76.4	-28.1	-176.9	73	0	0	0	0	114.1	T343 N360 R361 M362	T343-C346 WeakPolarHBondContact O-CB 3.37Å; T343-C346 PolarHBondContact O-N 2.96Å; T343-C346 PolarHBondContact O-SG 3.26Å; C346-N360 VanDerWaalsContact CA-OD1 3.26Å; C346-N360 WeakPolarHBondContact CA-OD1 3.45Å; C346-R361 PolarHBondContact O-N 3.48Å; C346-M362 WeakPolarHBondContact CB-O 3.4Å
347	E	89	Confident	89.3	Confident	152 Å²	152	72.4 Å²	72.4	71%	0.71	40%	0.397	S	S	*	.	S	Bend	trans	-90.1	157.5	179.1	-63.8	-175.2	176.2	0	0	111.8	S349 G359	E347-S349 PolarHBondContact O-N 3.38Å; E347-G359 VanDerWaalsContact O-CA 3.27Å; E347-G359 WeakPolarHBondContact O-CA 3.25Å
348	D	88.8	Confident	88.8	Confident	60 Å²	60	71.8 Å²	71.8	32%	0.321	40%	0.402	S	S	.	.			trans	-70.5	130	175.3	-54.7	-35.7	0	0	0	108.8	L356 V357 P358 G359 R361	D348-L356 HydrophobicContact CB-CD1 3.82Å; D348-L356 HydrophobicContact CB-CG 4.34Å; D348-V357 WeakPolarHBondContact CA-O 3.42Å; D348-P358 WeakPolarHBondContact OD1-CA 3.15Å; D348-G359 PolarHBondContact OD1-N 3.41Å; D348-R361 IonicContact OD1-CZ 3.16Å; D348-R361 IonicContact OD1-NE 3.78Å; D348-R361 IonicContact OD1-NH1 3.41Å; D348-R361 PolarHBondContact OD1-NH1 2.93Å; D348-R361 IonicContact OD1-NH2 2.96Å; D348-R361 PolarHBondContact OD1-NH2 3.34Å; D348-R361 IonicContact OD2-CZ 3.3Å; D348-R361 VanDerWaalsContact OD2-CZ 3.3Å; D348-R361 IonicContact OD2-NH1 3.19Å; D348-R361 PolarHBondContact OD2-NH1 2.88Å; D348-R361 IonicContact OD2-NH2 2.7Å; D348-R361 PolarHBondContact OD2-NH2 3.46Å
349	S	85.8	Confident	88.4	Confident	59 Å²	59	71.8 Å²	71.8	41%	0.413	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	154.1	-178	56.7	0	0	0	0	110.6	E347 V357	E347-S349 PolarHBondContact O-N 3.38Å; S349-V357 PolarHBondContact N-O 2.94Å; S349-V357 PolarHBondContact O-N 3.24Å
350	I	84.9	Confident	88.1	Confident	135 Å²	135	71.7 Å²	71.7	69%	0.692	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	116.9	174.3	-57.5	172	0	0	0	106.8
351	G	82.8	Confident	87.9	Confident	23 Å²	23	76.3 Å²	76.3	24%	0.237	42%	0.417	C	S	.	.			trans	-67.2	167.5	176.6	0	0	0	0	0	112.2	D353 G354 Q355	G351-D353 PolarHBondContact O-N 3.35Å; G351-D353 VanDerWaalsContact O-N 3.12Å; G351-G354 PolarHBondContact O-N 3.46Å; G351-Q355 PolarHBondContact N-O 2.72Å
352	V	81.3	Confident	87.9	Confident	153 Å²	153	73.5 Å²	73.5	93%	0.927	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-30	179.7	-172.1	0	0	0	0	111.8	G354	V352-G354 PolarHBondContact O-N 3.19Å
353	D	85.3	Confident	87.9	Confident	139 Å²	139	76.2 Å²	76.2	74%	0.743	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	6.8	179	-51.8	-39.7	0	0	0	113.7	G351 Q355	G351-D353 PolarHBondContact O-N 3.35Å; G351-D353 VanDerWaalsContact O-N 3.12Å; D353-Q355 HydrophobicContact CB-CG 4.4Å; D353-Q355 PolarHBondContact O-N 3.1Å
354	G	83.8	Confident	87.9	Confident	57 Å²	57	76.1 Å²	76.1	59%	0.588	42%	0.422	S	S	*	.	S	Bend	trans	74.1	4	-175.7	0	0	0	0	0	114.5	G351 V352	G351-G354 PolarHBondContact O-N 3.46Å; V352-G354 PolarHBondContact O-N 3.19Å
355	Q	85.6	Confident	88.1	Confident	140 Å²	140	73.3 Å²	73.3	65%	0.654	41%	0.413	S	S	*	.			trans	-83.4	145.7	178.2	-62.7	-174.4	13.6	0	0	111.7	G351 D353 V357	G351-Q355 PolarHBondContact N-O 2.72Å; D353-Q355 HydrophobicContact CB-CG 4.4Å; D353-Q355 PolarHBondContact O-N 3.1Å; Q355-V357 PolarHBondContact O-N 3.24Å
356	L	84.7	Confident	88.2	Confident	122 Å²	122	73.4 Å²	73.4	64%	0.639	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	114.4	175.2	-172.3	71.6	0	0	0	109.8	D348	D348-L356 HydrophobicContact CB-CD1 3.82Å; D348-L356 HydrophobicContact CB-CG 4.34Å
357	V	85	Confident	88.4	Confident	57 Å²	57	72.2 Å²	72.2	35%	0.345	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	114.5	170.5	-178.6	0	0	0	0	107.7	D348 S349 Q355 G359	D348-V357 WeakPolarHBondContact CA-O 3.42Å; S349-V357 PolarHBondContact N-O 2.94Å; S349-V357 PolarHBondContact O-N 3.24Å; Q355-V357 PolarHBondContact O-N 3.24Å; V357-G359 PolarHBondContact O-N 3.41Å
358	P	84.2	Confident	88.7	Confident	72 Å²	72	65 Å²	65	47%	0.468	37%	0.372	S	S	.	.			trans	-64	133.2	178.1	26.8	-33	0	0	0	110	D348	D348-P358 WeakPolarHBondContact OD1-CA 3.15Å
359	G	87.3	Confident	88.9	Confident	3 Å²	3	65.7 Å²	65.7	3%	0.031	38%	0.376	C	S	.	.			trans	-72	162.3	175.6	0	0	0	0	0	111.8	N345 E347 D348 V357 R361	N345-G359 WeakPolarHBondContact O-CA 3.38Å; E347-G359 VanDerWaalsContact O-CA 3.27Å; E347-G359 WeakPolarHBondContact O-CA 3.25Å; D348-G359 PolarHBondContact OD1-N 3.41Å; V357-G359 PolarHBondContact O-N 3.41Å; G359-R361 PolarHBondContact O-N 2.94Å; G359-R361 VanDerWaalsContact O-N 3.16Å
360	N	90.3	Very high	89.3	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	36%	0.364	C	S	.	.			trans	-71.3	-7.5	-179.9	61.3	41.4	0	0	0	114.3	L239 S241 V242 G243 I342 N345 C346 M362	L239-N360 WeakPolarHBondContact O-CB 3.23Å; L239-N360 PolarHBondContact O-ND2 3.06Å; S241-N360 WeakPolarHBondContact O-CB 3.41Å; V242-N360 CarbonylContact C-O 3.59Å; V242-N360 WeakPolarHBondContact CA-O 3.39Å; G243-N360 PolarHBondContact N-O 3.06Å; I342-N360 WeakPolarHBondContact CG2-ND2 3.13Å; I342-N360 PolarHBondContact O-ND2 2.81Å; N345-N360 PolarHBondContact O-N 3.04Å; N345-N360 PolarHBondContact O-ND2 2.64Å; C346-N360 VanDerWaalsContact CA-OD1 3.26Å; C346-N360 WeakPolarHBondContact CA-OD1 3.45Å; N360-M362 PolarHBondContact O-N 3.07Å; N360-M362 VanDerWaalsContact O-N 3.13Å; N360-M362 WeakPolarHBondContact OD1-CB 3.45Å; N360-M362 PolarHBondContact OD1-N 3.47Å
361	R	90.9	Very high	89.7	Confident	134 Å²	134	57.8 Å²	57.8	51%	0.506	33%	0.331	S	S	.	.			trans	59.8	15	-178.2	-52.1	-60.6	-171.4	-174.8	-3.4	115.1	V242 C346 D348 G359 N366	V242-R361 HydrophobicContact CG1-CG 4.18Å; C346-R361 PolarHBondContact O-N 3.48Å; D348-R361 IonicContact OD1-CZ 3.16Å; D348-R361 IonicContact OD1-NE 3.78Å; D348-R361 IonicContact OD1-NH1 3.41Å; D348-R361 PolarHBondContact OD1-NH1 2.93Å; D348-R361 IonicContact OD1-NH2 2.96Å; D348-R361 PolarHBondContact OD1-NH2 3.34Å; D348-R361 IonicContact OD2-CZ 3.3Å; D348-R361 VanDerWaalsContact OD2-CZ 3.3Å; D348-R361 IonicContact OD2-NH1 3.19Å; D348-R361 PolarHBondContact OD2-NH1 2.88Å; D348-R361 IonicContact OD2-NH2 2.7Å; D348-R361 PolarHBondContact OD2-NH2 3.46Å; G359-R361 PolarHBondContact O-N 2.94Å; G359-R361 VanDerWaalsContact O-N 3.16Å; R361-N366 PolarHBondContact O-ND2 3.17Å
362	M	92.8	Very high	90	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.03	32%	0.32	C	S	.	.			trans	-101.6	97.3	-179.2	-69.5	-50.2	-62.4	0	0	111.8	I244 T246 I342 C346 N360 N366 L367	I244-M362 HydrophobicContact CG2-CB 4.45Å; I244-M362 HydrophobicContact CG2-CG 3.99Å; T246-M362 HydrophobicContact CG2-CE 3.73Å; T246-M362 HydrophobicContact CG2-SD 4.1Å; I342-M362 HydrophobicContact CG2-CB 4.14Å; C346-M362 WeakPolarHBondContact CB-O 3.4Å; N360-M362 PolarHBondContact O-N 3.07Å; N360-M362 VanDerWaalsContact O-N 3.13Å; N360-M362 WeakPolarHBondContact OD1-CB 3.45Å; N360-M362 PolarHBondContact OD1-N 3.47Å; M362-N366 HydrophobicContact CE-CB 3.31Å; M362-N366 HydrophobicContact SD-CB 4.11Å; M362-L367 HydrophobicContact CB-CD2 4.17Å; M362-L367 HydrophobicContact CB-CG 4.23Å; M362-L367 HydrophobicContact CE-CD2 3.77Å; M362-L367 HydrophobicContact CE-CG 4.12Å
363	T	94.8	Very high	90.3	Very high	58 Å²	58	53.4 Å²	53.4	36%	0.356	30%	0.3	S	S	.	.			trans	-74.8	163.9	171.8	64.3	0	0	0	0	111.8	T365 N366 L367	T363-T365 PolarHBondContact O-N 2.78Å; T363-N366 PolarHBondContact O-N 3.27Å; T363-N366 VanDerWaalsContact OG1-CG 3.26Å; T363-N366 PolarHBondContact OG1-N 3.18Å; T363-N366 PolarHBondContact OG1-ND2 3.31Å; T363-N366 PolarHBondContact OG1-OD1 2.79Å; T363-L367 PolarHBondContact O-N 3.37Å
364	S	95.1	Very high	90.4	Very high	19 Å²	19	46.9 Å²	46.9	13%	0.133	27%	0.266	C	S	.	.	H	α-helix	trans	-59.1	-34.2	176.6	61.2	0	0	0	0	112.6	A368 D408	S364-A368 WeakPolarHBondContact O-CB 3.27Å; S364-A368 PolarHBondContact O-N 3.33Å; S364-D408 WeakPolarHBondContact CB-OD1 3.15Å; S364-D408 PolarHBondContact OG-OD1 2.85Å
365	T	95.1	Very high	90.7	Very high	65 Å²	65	44.2 Å²	44.2	40%	0.399	24%	0.238	S	C	.	.	H	α-helix	trans	-63.7	-45.6	172.6	-54.2	0	0	0	0	111.8	T363 A368 L369 R404	T363-T365 PolarHBondContact O-N 2.78Å; T365-A368 PolarHBondContact O-N 2.89Å; T365-L369 WeakPolarHBondContact O-CG 3.22Å; T365-L369 PolarHBondContact O-N 3.48Å; T365-R404 VanDerWaalsContact OG1-CD 3.31Å; T365-R404 WeakPolarHBondContact OG1-CD 3.4Å
366	N	94.5	Very high	90.7	Very high	62 Å²	62	37.9 Å²	37.9	33%	0.332	21%	0.209	S	C	.	.	H	α-helix	trans	-65.1	-42.3	-179.5	-66.7	-9	0	0	0	111.2	R361 M362 T363 L369 V370	R361-N366 PolarHBondContact O-ND2 3.17Å; M362-N366 HydrophobicContact CE-CB 3.31Å; M362-N366 HydrophobicContact SD-CB 4.11Å; T363-N366 PolarHBondContact O-N 3.27Å; T363-N366 VanDerWaalsContact OG1-CG 3.26Å; T363-N366 PolarHBondContact OG1-N 3.18Å; T363-N366 PolarHBondContact OG1-ND2 3.31Å; T363-N366 PolarHBondContact OG1-OD1 2.79Å; N366-L369 PolarHBondContact O-N 3.17Å; N366-V370 PolarHBondContact O-N 3.41Å
367	L	95.1	Very high	90.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.9	-39.2	174.1	-67	175.3	0	0	0	111.9	F245 L339 I342 T343 M362 T363 L369 V370 F371 I407	F245-L367 HydrophobicContact CD2-CD2 3.69Å; F245-L367 HydrophobicContact CE2-CD2 4.28Å; L339-L367 HydrophobicContact CB-CD1 4.24Å; L339-L367 HydrophobicContact CD2-CD1 4.25Å; L339-L367 HydrophobicContact CD2-CD2 4.41Å; I342-L367 HydrophobicContact CB-CD1 4.33Å; I342-L367 HydrophobicContact CG2-CD1 4.11Å; T343-L367 HydrophobicContact CG2-CD1 3.53Å; M362-L367 HydrophobicContact CB-CD2 4.17Å; M362-L367 HydrophobicContact CB-CG 4.23Å; M362-L367 HydrophobicContact CE-CD2 3.77Å; M362-L367 HydrophobicContact CE-CG 4.12Å; T363-L367 PolarHBondContact O-N 3.37Å; L367-L369 VanDerWaalsContact C-N 3.31Å; L367-L369 PolarHBondContact O-N 2.92Å; L367-V370 PolarHBondContact O-N 3.32Å; L367-V370 VanDerWaalsContact O-N 3.12Å; L367-F371 WeakPolarHBondContact O-CD2 3.45Å; L367-F371 PolarHBondContact O-N 2.82Å; L367-I407 HydrophobicContact CB-CD1 4.07Å
368	A	94.7	Very high	89.7	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.1	-33	177.5	0	0	0	0	0	113	S364 T365 V370 G372 V400 V403 R404	S364-A368 WeakPolarHBondContact O-CB 3.27Å; S364-A368 PolarHBondContact O-N 3.33Å; T365-A368 PolarHBondContact O-N 2.89Å; A368-V370 VanDerWaalsContact C-N 3.3Å; A368-V370 PolarHBondContact O-N 3.34Å; A368-G372 WeakPolarHBondContact O-CA 3.43Å; A368-G372 PolarHBondContact O-N 3.12Å; A368-V400 HydrophobicContact CB-CG1 3.95Å; A368-V400 WeakPolarHBondContact CB-O 3.05Å; A368-V403 HydrophobicContact CB-CB 4.09Å; A368-V403 HydrophobicContact CB-CG1 3.99Å; A368-R404 HydrophobicContact CB-CB 3.74Å
369	L	93.9	Very high	88.7	Confident	76 Å²	76	32 Å²	32	40%	0.398	17%	0.168	S	C	.	.	H	α-helix	trans	-61.6	-39.8	171.7	-72.4	167.3	0	0	0	111.6	T365 N366 L367 Y396 V400	T365-L369 WeakPolarHBondContact O-CG 3.22Å; T365-L369 PolarHBondContact O-N 3.48Å; N366-L369 PolarHBondContact O-N 3.17Å; L367-L369 VanDerWaalsContact C-N 3.31Å; L367-L369 PolarHBondContact O-N 2.92Å; L369-Y396 HydrophobicContact CD2-CE1 4.38Å; L369-Y396 WeakPolarHBondContact CD2-OH 3.27Å; L369-V400 HydrophobicContact CD2-CG1 3.9Å; L369-V400 HydrophobicContact CD2-CG2 4.02Å; L369-V400 HydrophobicContact CG-CG1 4.13Å
370	V	92.7	Very high	87.1	Confident	28 Å²	28	41.2 Å²	41.2	17%	0.17	21%	0.207	C	C	.	.	H	α-helix	trans	-72.5	-46.7	179.1	178.8	0	0	0	0	111.6	F245 T246 K283 N366 L367 A368	F245-V370 HydrophobicContact CB-CG1 4.1Å; T246-V370 HydrophobicContact CG2-CG2 3.7Å; K283-V370 HydrophobicContact CD-CG1 3.6Å; K283-V370 HydrophobicContact CG-CG1 4.47Å; N366-V370 PolarHBondContact O-N 3.41Å; L367-V370 PolarHBondContact O-N 3.32Å; L367-V370 VanDerWaalsContact O-N 3.12Å; A368-V370 VanDerWaalsContact C-N 3.3Å; A368-V370 PolarHBondContact O-N 3.34Å
371	F	93.8	Very high	85.1	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-87.5	-16.4	-173.3	-79.3	-80.5	0	0	0	114.5	F245 F286 L335 L339 L367 T373 A374 L375 V403	F245-F371 AromaticContact CD1-CE2 3.96Å; F245-F371 HydrophobicContact CD1-CE2 3.96Å; F245-F371 AromaticContact CD1-CZ 3.82Å; F245-F371 HydrophobicContact CD1-CZ 3.82Å; F245-F371 HydrophobicContact CD2-CE2 4.1Å; F245-F371 HydrophobicContact CE1-CE2 4.02Å; F245-F371 AromaticContact CE1-CZ 3.59Å; F245-F371 HydrophobicContact CE1-CZ 3.59Å; F245-F371 HydrophobicContact CE2-CE2 4.13Å; F245-F371 HydrophobicContact CE2-CZ 4.4Å; F245-F371 HydrophobicContact CG-CE2 4.02Å; F245-F371 HydrophobicContact CG-CZ 4.35Å; F245-F371 HydrophobicContact CZ-CE2 4.1Å; F245-F371 AromaticContact CZ-CZ 3.9Å; F245-F371 HydrophobicContact CZ-CZ 3.9Å; F286-F371 HydrophobicContact CD2-CE1 4.29Å; L335-F371 HydrophobicContact CD1-CE1 4.23Å; L335-F371 HydrophobicContact CD1-CZ 4.4Å; L335-F371 HydrophobicContact CD2-CD1 4.42Å; L335-F371 HydrophobicContact CD2-CE1 4.44Å; L339-F371 HydrophobicContact CD1-CD2 3.94Å; L339-F371 HydrophobicContact CD1-CE2 4.12Å; L339-F371 HydrophobicContact CD1-CG 4.28Å; L339-F371 HydrophobicContact CD2-CD2 4.07Å; L339-F371 HydrophobicContact CD2-CE2 3.5Å; L339-F371 VanDerWaalsContact CD2-CE2 3.5Å; L339-F371 HydrophobicContact CD2-CZ 4.02Å; L339-F371 HydrophobicContact CG-CE2 4.46Å; L367-F371 WeakPolarHBondContact O-CD2 3.45Å; L367-F371 PolarHBondContact O-N 2.82Å; F371-T373 VanDerWaalsContact C-N 3.33Å; F371-T373 PolarHBondContact O-N 3.45Å; F371-A374 PolarHBondContact O-N 3.45Å; F371-A374 VanDerWaalsContact O-N 3.1Å; F371-L375 HydrophobicContact CB-CD1 4.03Å; F371-L375 HydrophobicContact CB-CG 4.18Å; F371-L375 HydrophobicContact CD1-CD1 4.49Å; F371-L375 HydrophobicContact CD1-CD2 4.5Å; F371-L375 HydrophobicContact CD1-CG 4.32Å; F371-L375 WeakPolarHBondContact O-CB 3.36Å; F371-L375 WeakPolarHBondContact O-CG 3.33Å; F371-L375 PolarHBondContact O-N 3.18Å; F371-V403 HydrophobicContact CB-CG1 4.17Å
372	G	89.1	Confident	83.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-51.2	-49	-177.4	0	0	0	0	0	113.3	A368 L376	A368-G372 WeakPolarHBondContact O-CA 3.43Å; A368-G372 PolarHBondContact O-N 3.12Å; G372-L376 WeakPolarHBondContact O-CB 3.17Å; G372-L376 PolarHBondContact O-N 2.93Å; G372-L376 VanDerWaalsContact O-N 3.15Å
373	T	87.4	Confident	81.2	Confident	83 Å²	83	48.5 Å²	48.5	51%	0.509	26%	0.258	S	S	.	.	H	α-helix	trans	-82.2	-22.3	-179.9	59	0	0	0	0	113.9	F371 Y396	F371-T373 VanDerWaalsContact C-N 3.33Å; F371-T373 PolarHBondContact O-N 3.45Å; T373-Y396 HydrophobicContact CG2-CD2 3.77Å; T373-Y396 HydrophobicContact CG2-CE2 3.73Å
374	A	88.4	Confident	79.2	Confident	3 Å²	3	55.7 Å²	55.7	3%	0.025	28%	0.284	C	S	.	.	H	α-helix	trans	-76	-38.1	177.3	0	0	0	0	0	111.5	F286 F371 K377	F286-A374 HydrophobicContact CB-CB 4.41Å; F371-A374 PolarHBondContact O-N 3.45Å; F371-A374 VanDerWaalsContact O-N 3.1Å; A374-K377 WeakPolarHBondContact O-CE 3.47Å
375	L	89.8	Confident	77.4	Confident	1 Å²	1	58 Å²	58	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-89.3	-36	-176.3	-61.1	-175.9	0	0	0	113.4	F286 L293 L294 L335 F371 V403	F286-L375 HydrophobicContact CB-CD2 4.32Å; F286-L375 HydrophobicContact CD1-CD2 4.25Å; F286-L375 HydrophobicContact CG-CD2 4.14Å; L293-L375 HydrophobicContact CB-CD2 4.08Å; L293-L375 HydrophobicContact CD2-CD2 3.78Å; L294-L375 WeakPolarHBondContact CB-O 3.39Å; L294-L375 HydrophobicContact CD1-CB 4.36Å; L294-L375 PolarHBondContact N-O 3.18Å; L335-L375 HydrophobicContact CD2-CD1 4.03Å; L335-L375 HydrophobicContact CD2-CD2 3.75Å; L335-L375 HydrophobicContact CD2-CG 4.48Å; F371-L375 HydrophobicContact CB-CD1 4.03Å; F371-L375 HydrophobicContact CB-CG 4.18Å; F371-L375 HydrophobicContact CD1-CD1 4.49Å; F371-L375 HydrophobicContact CD1-CD2 4.5Å; F371-L375 HydrophobicContact CD1-CG 4.32Å; F371-L375 WeakPolarHBondContact O-CB 3.36Å; F371-L375 WeakPolarHBondContact O-CG 3.33Å; F371-L375 PolarHBondContact O-N 3.18Å; L375-V403 HydrophobicContact CD1-CG1 4.31Å; L375-V403 HydrophobicContact CD1-CG2 4.25Å
376	L	84.9	Confident	75.7	Confident	7 Å²	7	58.8 Å²	58.8	4%	0.037	30%	0.301	C	S	.	.	S	Bend	trans	-113.1	107.1	177.1	-74.4	161	0	0	0	109.8	L294 Y299 F302 L303 G372 V402	L294-L376 HydrophobicContact CB-CD2 3.6Å; L294-L376 HydrophobicContact CB-CG 4.18Å; L294-L376 HydrophobicContact CD1-CD1 4.04Å; L294-L376 HydrophobicContact CD1-CD2 3.72Å; L294-L376 HydrophobicContact CD1-CG 3.61Å; L294-L376 HydrophobicContact CG-CD2 4.28Å; L294-L376 HydrophobicContact CG-CG 4.46Å; Y299-L376 HydrophobicContact CD2-CB 4.21Å; Y299-L376 HydrophobicContact CD2-CD2 3.96Å; Y299-L376 HydrophobicContact CE2-CB 4.04Å; F302-L376 HydrophobicContact CB-CD2 4.11Å; F302-L376 HydrophobicContact CD2-CD2 4.32Å; F302-L376 HydrophobicContact CG-CD2 4.36Å; L303-L376 HydrophobicContact CD2-CD1 4.36Å; G372-L376 WeakPolarHBondContact O-CB 3.17Å; G372-L376 PolarHBondContact O-N 2.93Å; G372-L376 VanDerWaalsContact O-N 3.15Å; L376-V402 HydrophobicContact CD1-CB 4.34Å; L376-V402 HydrophobicContact CD1-CG1 4.17Å
377	K	81.1	Confident	74	Confident	45 Å²	45	66.3 Å²	66.3	20%	0.196	32%	0.324	C	S	.	.			trans	-106.2	140.6	175.4	-60.8	176.6	-163.6	167.4	0	109.5	F286 R287 M289 P292 Y299 A374 G379	F286-K377 WeakPolarHBondContact O-CE 3.48Å; F286-K377 PolarHBondContact O-NZ 2.89Å; R287-K377 WeakPolarHBondContact O-CE 3.43Å; R287-K377 PolarHBondContact O-NZ 3.1Å; M289-K377 PolarHBondContact O-NZ 2.77Å; P292-K377 HydrophobicContact CB-CB 4.14Å; P292-K377 HydrophobicContact CB-CD 4.12Å; P292-K377 HydrophobicContact CB-CG 4.06Å; P292-K377 HydrophobicContact CG-CB 4.13Å; Y299-K377 WeakPolarHBondContact CD2-O 3.38Å; A374-K377 WeakPolarHBondContact O-CE 3.47Å; K377-G379 PolarHBondContact O-N 3.02Å; K377-G379 VanDerWaalsContact O-N 3.1Å
378	K	68.1	Low	72.5	Confident	73 Å²	73	71.4 Å²	71.4	32%	0.317	35%	0.347	S	S	.	.			trans	-73.2	102.4	171.1	-171.1	174.1	180	176.2	0	108.2	A382 E385	K378-A382 HydrophobicContact CD-CB 4.44Å; K378-A382 WeakPolarHBondContact CE-O 3.45Å; K378-A382 HydrophobicContact CG-CB 3.62Å; K378-A382 PolarHBondContact NZ-O 3.17Å; K378-E385 PolarHBondContact NZ-O 3.19Å
379	G	62.8	Low	71	Confident	9 Å²	9	71.7 Å²	71.7	9%	0.093	35%	0.349	C	S	.	.			trans	-60	161.1	177.9	0	0	0	0	0	113.5	D296 K377 L381 A382	D296-G379 VanDerWaalsContact OD2-CA 3.26Å; D296-G379 WeakPolarHBondContact OD2-CA 3.24Å; K377-G379 PolarHBondContact O-N 3.02Å; K377-G379 VanDerWaalsContact O-N 3.1Å; G379-L381 PolarHBondContact O-N 3.46Å; G379-L381 VanDerWaalsContact O-N 3.1Å; G379-A382 WeakPolarHBondContact O-CB 3.38Å; G379-A382 PolarHBondContact O-N 2.9Å
380	K	53.8	Low	69.5	Low	196 Å²	196	74.7 Å²	74.7	85%	0.852	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-28.3	-179.3	-65.3	-177.4	-178.1	-178.3	0	113.6
381	L	48.8	Very low	68	Low	164 Å²	164	79.2 Å²	79.2	86%	0.859	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-30.1	176.7	-83.3	147.2	0	0	0	112.9	G379 N383	G379-L381 PolarHBondContact O-N 3.46Å; G379-L381 VanDerWaalsContact O-N 3.1Å; L381-N383 VanDerWaalsContact C-N 3.31Å; L381-N383 PolarHBondContact O-N 3.32Å
382	A	51.3	Low	66.8	Low	12 Å²	12	81.1 Å²	81.1	10%	0.099	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-80.7	-8.3	-179.6	0	0	0	0	0	112.9	K378 G379 K384 E385	K378-A382 HydrophobicContact CD-CB 4.44Å; K378-A382 WeakPolarHBondContact CE-O 3.45Å; K378-A382 HydrophobicContact CG-CB 3.62Å; K378-A382 PolarHBondContact NZ-O 3.17Å; G379-A382 WeakPolarHBondContact O-CB 3.38Å; G379-A382 PolarHBondContact O-N 2.9Å; A382-K384 PolarHBondContact O-N 3.46Å; A382-E385 WeakPolarHBondContact O-CB 3.48Å; A382-E385 PolarHBondContact O-N 3.22Å
383	N	50.6	Low	66.3	Low	118 Å²	118	83.7 Å²	83.7	63%	0.631	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-57.7	-19.3	-179.8	-90.6	-12.4	0	0	0	114.5	L381 E385	L381-N383 VanDerWaalsContact C-N 3.31Å; L381-N383 PolarHBondContact O-N 3.32Å; N383-E385 VanDerWaalsContact C-N 3.35Å
384	K	51.6	Low	66.1	Low	208 Å²	208	83.4 Å²	83.4	90%	0.904	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-83.5	-4.9	174.9	-71	-175.4	176.4	-178.6	0	114.4	A382	A382-K384 PolarHBondContact O-N 3.46Å
385	E	57.7	Low	66	Low	67 Å²	67	83.9 Å²	83.9	31%	0.313	41%	0.411	S	S	.	.	S	Bend	trans	-94.8	146.5	-176	-68.9	168	-175.9	0	0	112.4	M300 K378 A382 N383	M300-E385 WeakPolarHBondContact CG-OE2 3.21Å; M300-E385 VanDerWaalsContact SD-OE2 3.35Å; K378-E385 PolarHBondContact NZ-O 3.19Å; A382-E385 WeakPolarHBondContact O-CB 3.48Å; A382-E385 PolarHBondContact O-N 3.22Å; N383-E385 VanDerWaalsContact C-N 3.35Å
386	S	59.3	Low	65.9	Low	82 Å²	82	89.3 Å²	89.3	57%	0.573	43%	0.432	S	S	*	.			trans	-49.3	148.8	175.6	47.8	0	0	0	0	111.3	K388 H395	S386-K388 PolarHBondContact O-N 3.41Å; S386-K388 PolarHBondContact OG-O 3.38Å; S386-H395 PolarHBondContact O-CD2 2.87Å; S386-H395 VanDerWaalsContact O-CD2 3.31Å; S386-H395 PolarHBondContact O-NE2 3.2Å
387	R	60.3	Low	66.1	Low	220 Å²	220	92 Å²	92	83%	0.83	45%	0.449	S	S	*	.	S	Bend	trans	-64.8	-6.2	175.2	-78	-173.7	-93.1	-176.3	-6.1	114.1	H395	R387-H395 PolarHBondContact O-CD2 2.89Å; R387-H395 PolarHBondContact O-N 3.26Å
388	K	63	Low	66.6	Low	107 Å²	107	89.9 Å²	89.9	47%	0.465	44%	0.44	S	S	.	.	B	Isolated β-bridge	trans	-121.2	148.5	-178.5	-65.1	178.1	174.1	-167.2	0	110.1	S386 G392 I393 D394	S386-K388 PolarHBondContact O-N 3.41Å; S386-K388 PolarHBondContact OG-O 3.38Å; K388-G392 WeakPolarHBondContact CD-O 3.37Å; K388-I393 CarbonylContact C-O 3.53Å; K388-I393 VanDerWaalsContact CA-O 3.26Å; K388-I393 WeakPolarHBondContact CA-O 3.41Å; K388-D394 WeakPolarHBondContact CE-OD1 3.24Å; K388-D394 WeakPolarHBondContact CG-OD1 3.45Å
389	T	62.3	Low	67.7	Low	7 Å²	7	86.6 Å²	86.6	4%	0.043	43%	0.426	C	S	.	.			trans	-63.4	169.6	169	65.2	0	0	0	0	110.3	L303 L391 G392 I393 A398	L303-T389 HydrophobicContact CB-CG2 4.28Å; T389-L391 PolarHBondContact O-N 3.44Å; T389-G392 PolarHBondContact O-N 2.89Å; T389-I393 PolarHBondContact N-O 2.82Å; T389-I393 PolarHBondContact OG1-N 2.55Å; T389-I393 PolarHBondContact OG1-O 3.1Å; T389-A398 HydrophobicContact CG2-CB 4.44Å
390	K	62.4	Low	69.2	Low	139 Å²	139	86.7 Å²	86.7	60%	0.604	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-20.8	175.8	-67.5	178.5	-177.5	168.8	0	113.5	E67	E67-K390 WeakPolarHBondContact OE1-CE 3.43Å; E67-K390 IonicContact OE1-NZ 2.72Å; E67-K390 PolarHBondContact OE1-NZ 3.37Å
391	L	62.1	Low	71	Confident	122 Å²	122	79.9 Å²	79.9	64%	0.639	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	10	179.5	-68.1	168	0	0	0	113.4	T307 T389 I393	T307-L391 VanDerWaalsContact CB-CD1 3.47Å; T307-L391 HydrophobicContact CG2-CB 4.24Å; T307-L391 HydrophobicContact CG2-CD1 3.47Å; T307-L391 VanDerWaalsContact CG2-CD1 3.47Å; T307-L391 HydrophobicContact CG2-CG 4.45Å; T389-L391 PolarHBondContact O-N 3.44Å; L391-I393 VanDerWaalsContact C-N 3.34Å; L391-I393 PolarHBondContact O-N 3.14Å
392	G	68.4	Low	73.2	Confident	40 Å²	40	72 Å²	72	41%	0.412	36%	0.356	S	S	.	.	S	Bend	trans	81.8	4.6	173.8	0	0	0	0	0	115.7	K388 T389	K388-G392 WeakPolarHBondContact CD-O 3.37Å; T389-G392 PolarHBondContact O-N 2.89Å
393	I	77.6	Confident	75.3	Confident	54 Å²	54	71.5 Å²	71.5	28%	0.277	35%	0.352	S	S	.	.			trans	-80.2	135.7	176.9	-56.7	-179.7	0	0	0	109.4	T307 K388 T389 L391 H395 V397 A398	T307-I393 HydrophobicContact CG2-CD1 3.64Å; K388-I393 CarbonylContact C-O 3.53Å; K388-I393 VanDerWaalsContact CA-O 3.26Å; K388-I393 WeakPolarHBondContact CA-O 3.41Å; T389-I393 PolarHBondContact N-O 2.82Å; T389-I393 PolarHBondContact OG1-N 2.55Å; T389-I393 PolarHBondContact OG1-O 3.1Å; L391-I393 VanDerWaalsContact C-N 3.34Å; L391-I393 PolarHBondContact O-N 3.14Å; I393-H395 PolarHBondContact O-N 2.91Å; I393-V397 HydrophobicContact CG2-CB 4.28Å; I393-V397 HydrophobicContact CG2-CG1 4.39Å; I393-A398 HydrophobicContact CG2-CB 4.18Å
394	D	84.7	Confident	77.5	Confident	78 Å²	78	69.3 Å²	69.3	42%	0.417	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-62.5	133.4	174.7	-66.9	-28.2	0	0	0	110.7	K388 Y396 V397 A398	K388-D394 WeakPolarHBondContact CE-OD1 3.24Å; K388-D394 WeakPolarHBondContact CG-OD1 3.45Å; D394-Y396 PolarHBondContact O-N 2.99Å; D394-Y396 VanDerWaalsContact O-N 3.12Å; D394-V397 HydrophobicContact CB-CG2 4.18Å; D394-V397 PolarHBondContact O-N 3.26Å; D394-A398 PolarHBondContact O-N 3.02Å
395	H	85.1	Confident	79.5	Confident	13 Å²	13	59.5 Å²	59.5	6%	0.06	29%	0.293	C	S	.	.	H	α-helix	trans	-56.1	-33.6	-177.8	-70.1	-60.5	0	0	0	113.1	L303 S386 R387 I393 S399	L303-H395 HydrophobicContact CD1-CB 3.86Å; L303-H395 WeakPolarHBondContact CD1-ND1 3.37Å; S386-H395 PolarHBondContact O-CD2 2.87Å; S386-H395 VanDerWaalsContact O-CD2 3.31Å; S386-H395 PolarHBondContact O-NE2 3.2Å; R387-H395 PolarHBondContact O-CD2 2.89Å; R387-H395 PolarHBondContact O-N 3.26Å; I393-H395 PolarHBondContact O-N 2.91Å; H395-S399 WeakPolarHBondContact O-CB 3.18Å; H395-S399 PolarHBondContact O-N 3.42Å
396	Y	87.9	Confident	81.4	Confident	114 Å²	114	56.4 Å²	56.4	45%	0.447	28%	0.278	S	S	.	.	H	α-helix	trans	-61.8	-52.4	174.8	175.2	-102.2	0	0	0	111.7	L369 T373 D394 A398 S399 V400	L369-Y396 HydrophobicContact CD2-CE1 4.38Å; L369-Y396 WeakPolarHBondContact CD2-OH 3.27Å; T373-Y396 HydrophobicContact CG2-CD2 3.77Å; T373-Y396 HydrophobicContact CG2-CE2 3.73Å; D394-Y396 PolarHBondContact O-N 2.99Å; D394-Y396 VanDerWaalsContact O-N 3.12Å; Y396-A398 VanDerWaalsContact C-N 3.29Å; Y396-A398 PolarHBondContact O-N 2.64Å; Y396-S399 WeakPolarHBondContact O-CB 3.31Å; Y396-S399 PolarHBondContact O-N 3.31Å; Y396-S399 PolarHBondContact O-OG 3.35Å; Y396-V400 HydrophobicContact CE1-CG2 4.09Å; Y396-V400 HydrophobicContact CE2-CG2 4.11Å; Y396-V400 WeakPolarHBondContact O-CG2 3.45Å; Y396-V400 PolarHBondContact O-N 3.45Å
397	V	90.2	Very high	83.1	Confident	65 Å²	65	52.5 Å²	52.5	39%	0.394	25%	0.251	S	S	.	.	H	α-helix	trans	-61.3	-41.3	-179.9	178.6	0	0	0	0	110.7	I393 D394 V400 N401	I393-V397 HydrophobicContact CG2-CB 4.28Å; I393-V397 HydrophobicContact CG2-CG1 4.39Å; D394-V397 HydrophobicContact CB-CG2 4.18Å; D394-V397 PolarHBondContact O-N 3.26Å; V397-V400 PolarHBondContact O-N 3.22Å; V397-N401 PolarHBondContact O-N 2.96Å; V397-N401 PolarHBondContact O-ND2 2.63Å
398	A	90.5	Very high	84.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.4	-43.4	174.2	0	0	0	0	0	111.8	L303 A306 T389 I393 D394 Y396 V400 N401 V402	L303-A398 HydrophobicContact CB-CB 4.26Å; L303-A398 HydrophobicContact CD2-CB 3.86Å; A306-A398 HydrophobicContact CB-CB 3.89Å; T389-A398 HydrophobicContact CG2-CB 4.44Å; I393-A398 HydrophobicContact CG2-CB 4.18Å; D394-A398 PolarHBondContact O-N 3.02Å; Y396-A398 VanDerWaalsContact C-N 3.29Å; Y396-A398 PolarHBondContact O-N 2.64Å; A398-V400 PolarHBondContact O-N 3.41Å; A398-N401 PolarHBondContact O-N 3.03Å; A398-V402 VanDerWaalsContact O-CG2 3.3Å; A398-V402 WeakPolarHBondContact O-CG2 3.28Å; A398-V402 PolarHBondContact O-N 3.31Å
399	S	91.5	Very high	86.2	Confident	4 Å²	4	41.8 Å²	41.8	3%	0.028	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-41.6	178.5	74.2	0	0	0	0	112.7	H395 Y396 V402 V403	H395-S399 WeakPolarHBondContact O-CB 3.18Å; H395-S399 PolarHBondContact O-N 3.42Å; Y396-S399 WeakPolarHBondContact O-CB 3.31Å; Y396-S399 PolarHBondContact O-N 3.31Å; Y396-S399 PolarHBondContact O-OG 3.35Å; S399-V402 PolarHBondContact O-N 3.04Å; S399-V403 WeakPolarHBondContact O-CG2 3.42Å; S399-V403 PolarHBondContact O-N 2.71Å
400	V	93.2	Very high	87.7	Confident	10 Å²	10	44 Å²	44	6%	0.061	22%	0.222	C	C	.	.	H	α-helix	trans	-64.3	-44.2	176.8	174.6	0	0	0	0	110.2	A368 L369 Y396 V397 A398 V402 V403 R404	A368-V400 HydrophobicContact CB-CG1 3.95Å; A368-V400 WeakPolarHBondContact CB-O 3.05Å; L369-V400 HydrophobicContact CD2-CG1 3.9Å; L369-V400 HydrophobicContact CD2-CG2 4.02Å; L369-V400 HydrophobicContact CG-CG1 4.13Å; Y396-V400 HydrophobicContact CE1-CG2 4.09Å; Y396-V400 HydrophobicContact CE2-CG2 4.11Å; Y396-V400 WeakPolarHBondContact O-CG2 3.45Å; Y396-V400 PolarHBondContact O-N 3.45Å; V397-V400 PolarHBondContact O-N 3.22Å; A398-V400 PolarHBondContact O-N 3.41Å; V400-V402 VanDerWaalsContact C-N 3.32Å; V400-V402 PolarHBondContact O-N 3.13Å; V400-V403 PolarHBondContact O-N 2.81Å; V400-R404 VanDerWaalsContact O-CB 3.32Å; V400-R404 WeakPolarHBondContact O-CB 3.09Å; V400-R404 PolarHBondContact O-N 3.12Å
401	N	93.5	Very high	89	Confident	53 Å²	53	40.7 Å²	40.7	28%	0.283	21%	0.212	S	C	.	.	H	α-helix	trans	-62.9	-37.1	177.1	-77.8	-25	0	0	0	113	A306 V397 A398 A405	A306-N401 HydrophobicContact CB-CB 4.14Å; V397-N401 PolarHBondContact O-N 2.96Å; V397-N401 PolarHBondContact O-ND2 2.63Å; A398-N401 PolarHBondContact O-N 3.03Å; N401-A405 WeakPolarHBondContact O-CB 3.5Å; N401-A405 PolarHBondContact O-N 3.36Å
402	V	94.1	Very high	90.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.8	-54.4	174.1	169	0	0	0	0	110.3	F302 A306 L317 L376 A398 S399 V400 R404 A405 M406	F302-V402 HydrophobicContact CB-CG1 4.42Å; F302-V402 HydrophobicContact CD1-CG1 4.09Å; F302-V402 WeakPolarHBondContact O-CG2 3.42Å; A306-V402 HydrophobicContact CB-CG2 4.2Å; L317-V402 HydrophobicContact CD2-CG1 3.9Å; L376-V402 HydrophobicContact CD1-CB 4.34Å; L376-V402 HydrophobicContact CD1-CG1 4.17Å; A398-V402 VanDerWaalsContact O-CG2 3.3Å; A398-V402 WeakPolarHBondContact O-CG2 3.28Å; A398-V402 PolarHBondContact O-N 3.31Å; S399-V402 PolarHBondContact O-N 3.04Å; V400-V402 VanDerWaalsContact C-N 3.32Å; V400-V402 PolarHBondContact O-N 3.13Å; V402-R404 VanDerWaalsContact C-N 3.31Å; V402-R404 PolarHBondContact O-N 3.36Å; V402-A405 PolarHBondContact O-N 3.01Å; V402-M406 HydrophobicContact CG1-CG 4.42Å; V402-M406 HydrophobicContact CG1-SD 3.64Å; V402-M406 VanDerWaalsContact O-CG 3.24Å; V402-M406 WeakPolarHBondContact O-CG 3.39Å; V402-M406 PolarHBondContact O-N 3.3Å
403	V	95.6	Very high	91.5	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-62	-40.7	-177.9	174.8	0	0	0	0	111.2	A368 F371 L375 S399 V400 M406 I407	A368-V403 HydrophobicContact CB-CB 4.09Å; A368-V403 HydrophobicContact CB-CG1 3.99Å; F371-V403 HydrophobicContact CB-CG1 4.17Å; L375-V403 HydrophobicContact CD1-CG1 4.31Å; L375-V403 HydrophobicContact CD1-CG2 4.25Å; S399-V403 WeakPolarHBondContact O-CG2 3.42Å; S399-V403 PolarHBondContact O-N 2.71Å; V400-V403 PolarHBondContact O-N 2.81Å; V403-M406 PolarHBondContact O-N 3.43Å; V403-I407 HydrophobicContact CG1-CD1 3.9Å; V403-I407 HydrophobicContact CG1-CG1 4.4Å; V403-I407 WeakPolarHBondContact O-CG1 3.3Å; V403-I407 PolarHBondContact O-N 3.5Å
404	R	95.9	Very high	92.2	Very high	71 Å²	71	33.3 Å²	33.3	27%	0.268	16%	0.163	S	C	.	.	H	α-helix	trans	-57.6	-52.3	174.6	-174.9	-173.2	59.5	72.2	-2.1	111.4	T365 A368 V400 V402 M406 I407 D408	T365-R404 VanDerWaalsContact OG1-CD 3.31Å; T365-R404 WeakPolarHBondContact OG1-CD 3.4Å; A368-R404 HydrophobicContact CB-CB 3.74Å; V400-R404 VanDerWaalsContact O-CB 3.32Å; V400-R404 WeakPolarHBondContact O-CB 3.09Å; V400-R404 PolarHBondContact O-N 3.12Å; V402-R404 VanDerWaalsContact C-N 3.31Å; V402-R404 PolarHBondContact O-N 3.36Å; R404-M406 PolarHBondContact O-N 3.4Å; R404-I407 PolarHBondContact O-N 2.79Å; R404-I407 VanDerWaalsContact O-N 3.13Å; R404-D408 IonicContact NH1-OD2 3.01Å; R404-D408 PolarHBondContact NH1-OD2 3.45Å; R404-D408 VanDerWaalsContact O-CG 3.25Å; R404-D408 PolarHBondContact O-N 3.49Å
405	A	95.2	Very high	92.5	Very high	3 Å²	3	32.7 Å²	32.7	3%	0.025	16%	0.158	C	C	.	.	H	α-helix	trans	-60.3	-31.9	178.4	0	0	0	0	0	112.4	L317 N401 V402 N409	L317-A405 HydrophobicContact CD1-CB 3.93Å; N401-A405 WeakPolarHBondContact O-CB 3.5Å; N401-A405 PolarHBondContact O-N 3.36Å; V402-A405 PolarHBondContact O-N 3.01Å; A405-N409 WeakPolarHBondContact O-CB 3.42Å; A405-N409 PolarHBondContact O-N 3.18Å; A405-N409 PolarHBondContact O-ND2 3.47Å
406	M	96	Very high	92.7	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-72.5	-36.6	175.9	-66.7	173.1	74.3	0	0	113.5	L294 L317 V321 L332 L336 V402 V403 R404 W410 L413	L294-M406 HydrophobicContact CD1-CE 4.47Å; L294-M406 HydrophobicContact CD1-SD 4.25Å; L294-M406 HydrophobicContact CD2-CE 4.15Å; L317-M406 HydrophobicContact CD1-CG 4Å; L317-M406 HydrophobicContact CD2-CG 4.27Å; L317-M406 HydrophobicContact CD2-SD 4.3Å; V321-M406 HydrophobicContact CG2-CE 4.4Å; L332-M406 HydrophobicContact CD1-CE 4.04Å; L332-M406 HydrophobicContact CD2-CE 3.48Å; L332-M406 VanDerWaalsContact CD2-CE 3.48Å; L332-M406 HydrophobicContact CG-CE 4.21Å; L336-M406 HydrophobicContact CD1-CB 4.01Å; L336-M406 HydrophobicContact CD1-CE 4.18Å; L336-M406 HydrophobicContact CD2-CB 4.06Å; V402-M406 HydrophobicContact CG1-CG 4.42Å; V402-M406 HydrophobicContact CG1-SD 3.64Å; V402-M406 VanDerWaalsContact O-CG 3.24Å; V402-M406 WeakPolarHBondContact O-CG 3.39Å; V402-M406 PolarHBondContact O-N 3.3Å; V403-M406 PolarHBondContact O-N 3.43Å; R404-M406 PolarHBondContact O-N 3.4Å; M406-W410 WeakPolarHBondContact O-CA 3.41Å; M406-W410 PolarHBondContact O-N 3.35Å; M406-W410 VanDerWaalsContact O-N 3.16Å; M406-L413 HydrophobicContact CB-CD1 3.92Å; M406-L413 HydrophobicContact CG-CD1 3.88Å
407	I	95.8	Very high	92.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-68.5	-43.8	174.1	-65.3	165.6	0	0	0	110.2	L336 L339 H340 T343 L367 V403 R404 N409	L336-I407 HydrophobicContact CD2-CG1 3.77Å; L339-I407 HydrophobicContact CB-CD1 4.38Å; L339-I407 HydrophobicContact CB-CG1 4.26Å; L339-I407 HydrophobicContact CB-CG2 4.41Å; L339-I407 HydrophobicContact CD1-CD1 4.01Å; L339-I407 HydrophobicContact CD1-CG1 4.19Å; H340-I407 PolarHBondContact ND1-O 3.17Å; T343-I407 HydrophobicContact CG2-CG2 4.05Å; L367-I407 HydrophobicContact CB-CD1 4.07Å; V403-I407 HydrophobicContact CG1-CD1 3.9Å; V403-I407 HydrophobicContact CG1-CG1 4.4Å; V403-I407 WeakPolarHBondContact O-CG1 3.3Å; V403-I407 PolarHBondContact O-N 3.5Å; R404-I407 PolarHBondContact O-N 2.79Å; R404-I407 VanDerWaalsContact O-N 3.13Å; I407-N409 VanDerWaalsContact C-N 3.3Å; I407-N409 PolarHBondContact O-N 3.27Å
408	D	94.6	Very high	92.4	Very high	58 Å²	58	25.7 Å²	25.7	31%	0.31	13%	0.129	S	C	.	.	H	α-helix	trans	-66.2	-30.3	-177.7	-64.9	-22.3	0	0	0	112.4	S364 R404	S364-D408 WeakPolarHBondContact CB-OD1 3.15Å; S364-D408 PolarHBondContact OG-OD1 2.85Å; R404-D408 IonicContact NH1-OD2 3.01Å; R404-D408 PolarHBondContact NH1-OD2 3.45Å; R404-D408 VanDerWaalsContact O-CG 3.25Å; R404-D408 PolarHBondContact O-N 3.49Å
409	N	94.5	Very high	92.2	Very high	43 Å²	43	30.7 Å²	30.7	23%	0.23	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.3	26.4	-173.6	-56.6	-90.9	0	0	0	113.4	V314 A405 I407 D411 I412 L413	V314-N409 HydrophobicContact CG1-CB 4.32Å; V314-N409 HydrophobicContact CG2-CB 4.21Å; A405-N409 WeakPolarHBondContact O-CB 3.42Å; A405-N409 PolarHBondContact O-N 3.18Å; A405-N409 PolarHBondContact O-ND2 3.47Å; I407-N409 VanDerWaalsContact C-N 3.3Å; I407-N409 PolarHBondContact O-N 3.27Å; N409-D411 PolarHBondContact O-N 3.36Å; N409-I412 PolarHBondContact O-N 3.46Å; N409-L413 VanDerWaalsContact O-CG 3.3Å; N409-L413 WeakPolarHBondContact O-CG 3.4Å; N409-L413 PolarHBondContact O-N 3.01Å
410	W	93.3	Very high	92	Very high	53 Å²	53	30.6 Å²	30.6	20%	0.201	15%	0.151	C	C	.	.	H	α-helix	trans	-56.9	-36.6	-173.4	74.8	-81.8	0	0	0	112.5	L336 K337 H340 M406 I412 L413 F414	L336-W410 HydrophobicContact CB-CB 3.86Å; K337-W410 HydrophobicContact CB-CE3 4.11Å; K337-W410 HydrophobicContact CB-CZ3 4.13Å; K337-W410 HydrophobicContact CD-CH2 4.24Å; K337-W410 HydrophobicContact CD-CZ3 4.16Å; K337-W410 HydrophobicContact CG-CE3 4.44Å; K337-W410 HydrophobicContact CG-CH2 4.01Å; K337-W410 HydrophobicContact CG-CZ2 4.42Å; K337-W410 HydrophobicContact CG-CZ3 4.02Å; H340-W410 HydrophobicContact CB-CG 4.15Å; H340-W410 AromaticContact CD2-CD1 3.66Å; H340-W410 AromaticContact CD2-NE1 3.01Å; H340-W410 PolarHBondContact CD2-NE1 2.98Å; H340-W410 AromaticContact CE1-CD1 3.73Å; H340-W410 AromaticContact CE1-NE1 3.62Å; H340-W410 AromaticContact CG-CD1 3.17Å; H340-W410 AromaticContact CG-NE1 3.04Å; H340-W410 AromaticContact ND1-CD1 3.25Å; H340-W410 VanDerWaalsContact ND1-CD1 3.25Å; H340-W410 AromaticContact ND1-NE1 3.46Å; H340-W410 PolarHBondContact ND1-NE1 3.26Å; H340-W410 AromaticContact NE2-CD1 3.92Å; H340-W410 AromaticContact NE2-NE1 3.33Å; H340-W410 PolarHBondContact NE2-NE1 2.83Å; M406-W410 WeakPolarHBondContact O-CA 3.41Å; M406-W410 PolarHBondContact O-N 3.35Å; M406-W410 VanDerWaalsContact O-N 3.16Å; W410-I412 PolarHBondContact O-N 3.15Å; W410-L413 PolarHBondContact O-N 3.18Å; W410-F414 WeakPolarHBondContact O-CD2 3.29Å
411	D	89.9	Confident	91.7	Very high	70 Å²	70	31.1 Å²	31.1	37%	0.374	15%	0.153	S	C	.	.	H	α-helix	trans	-62.8	-39.5	-178.4	64.3	-36.7	0	0	0	112.2	N409 Q415	N409-D411 PolarHBondContact O-N 3.36Å; D411-Q415 VanDerWaalsContact O-CD 3.27Å; D411-Q415 VanDerWaalsContact O-CG 3.22Å; D411-Q415 WeakPolarHBondContact O-CG 3.34Å; D411-Q415 PolarHBondContact O-NE2 3.46Å
412	I	91.4	Very high	91.3	Very high	58 Å²	58	34.1 Å²	34.1	30%	0.297	16%	0.164	S	C	.	.	H	α-helix	trans	-80.5	-35.2	-179.1	-59.5	166.3	0	0	0	111.4	V314 Q318 N409 W410 F414 Q415	V314-I412 HydrophobicContact CG1-CG2 4.3Å; Q318-I412 PolarHBondContact NE2-O 3.48Å; N409-I412 PolarHBondContact O-N 3.46Å; W410-I412 PolarHBondContact O-N 3.15Å; I412-F414 PolarHBondContact O-N 2.65Å; I412-Q415 PolarHBondContact O-N 2.98Å; I412-Q415 VanDerWaalsContact O-N 3.12Å
413	L	91.9	Very high	91	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-29.2	-172.2	-74.2	177.3	0	0	0	114.2	V314 L317 Q318 M406 N409 W410	V314-L413 HydrophobicContact CG1-CD2 4.36Å; L317-L413 HydrophobicContact CB-CD2 3.66Å; Q318-L413 HydrophobicContact CB-CD2 4.03Å; M406-L413 HydrophobicContact CB-CD1 3.92Å; M406-L413 HydrophobicContact CG-CD1 3.88Å; N409-L413 VanDerWaalsContact O-CG 3.3Å; N409-L413 WeakPolarHBondContact O-CG 3.4Å; N409-L413 PolarHBondContact O-N 3.01Å; W410-L413 PolarHBondContact O-N 3.18Å
414	F	91.8	Very high	90.5	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.018	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	10.6	-179	-57	-80	0	0	0	113.4	S39 I40 V321 S329 L332 E333 L336 W410 I412	S39-F414 WeakPolarHBondContact CA-O 3.02Å; I40-F414 HydrophobicContact CD1-CB 4.28Å; I40-F414 HydrophobicContact CD1-CD1 3.68Å; I40-F414 HydrophobicContact CD1-CG 4.46Å; I40-F414 HydrophobicContact CG1-CB 4.14Å; I40-F414 HydrophobicContact CG1-CD1 4.44Å; I40-F414 PolarHBondContact N-O 2.93Å; V321-F414 HydrophobicContact CG1-CD1 3.64Å; V321-F414 HydrophobicContact CG1-CE1 3.45Å; V321-F414 VanDerWaalsContact CG1-CE1 3.45Å; V321-F414 HydrophobicContact CG1-CZ 4.32Å; S329-F414 WeakPolarHBondContact O-CE1 3.36Å; L332-F414 HydrophobicContact CB-CZ 4.42Å; L332-F414 HydrophobicContact CD2-CE1 4.4Å; L332-F414 HydrophobicContact CD2-CZ 4.03Å; L332-F414 HydrophobicContact CG-CZ 4.04Å; E333-F414 VanDerWaalsContact CA-CZ 3.4Å; E333-F414 HydrophobicContact CB-CD1 3.92Å; E333-F414 HydrophobicContact CB-CD2 3.86Å; E333-F414 HydrophobicContact CB-CE1 3.71Å; E333-F414 HydrophobicContact CB-CE2 3.71Å; E333-F414 HydrophobicContact CB-CG 4Å; E333-F414 HydrophobicContact CB-CZ 3.62Å; E333-F414 HydrophobicContact CG-CD1 4.36Å; E333-F414 HydrophobicContact CG-CD2 3.64Å; E333-F414 HydrophobicContact CG-CE2 3.89Å; E333-F414 HydrophobicContact CG-CG 3.93Å; E333-F414 HydrophobicContact CG-CZ 4.32Å; E333-F414 WeakPolarHBondContact OE2-CB 3.5Å; E333-F414 WeakPolarHBondContact OE2-CG 3.26Å; L336-F414 HydrophobicContact CD1-CE2 3.9Å; L336-F414 HydrophobicContact CD1-CZ 3.98Å; W410-F414 WeakPolarHBondContact O-CD2 3.29Å; I412-F414 PolarHBondContact O-N 2.65Å
415	Q	90.8	Very high	90	Very high	64 Å²	64	35.9 Å²	35.9	30%	0.299	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	117	-179.9	-78	-173.5	46.7	0	0	111.4	M37 Q318 Y322 D411 I412 P417	M37-Q415 HydrophobicContact CB-CB 3.98Å; M37-Q415 HydrophobicContact CB-CG 4.45Å; M37-Q415 HydrophobicContact SD-CB 4.12Å; Q318-Q415 PolarHBondContact NE2-O 3.33Å; Y322-Q415 PolarHBondContact OH-O 2.79Å; D411-Q415 VanDerWaalsContact O-CD 3.27Å; D411-Q415 VanDerWaalsContact O-CG 3.22Å; D411-Q415 WeakPolarHBondContact O-CG 3.34Å; D411-Q415 PolarHBondContact O-NE2 3.46Å; I412-Q415 PolarHBondContact O-N 2.98Å; I412-Q415 VanDerWaalsContact O-N 3.12Å; Q415-P417 VanDerWaalsContact O-CD 3.24Å; Q415-P417 WeakPolarHBondContact O-CD 3.28Å
416	V	88.6	Confident	89.5	Confident	2 Å²	2	40 Å²	40	1%	0.012	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	119.2	-178.4	-170.5	0	0	0	0	110.6	V38 I40 L43 L51 Y322 I420 Q421	V38-V416 PolarHBondContact N-O 2.8Å; V38-V416 PolarHBondContact O-N 3.46Å; I40-V416 HydrophobicContact CG2-CG2 3.61Å; L43-V416 HydrophobicContact CD1-CG2 3.99Å; L51-V416 HydrophobicContact CD1-CG1 3.82Å; L51-V416 HydrophobicContact CD1-CG2 4.18Å; L51-V416 HydrophobicContact CD2-CG2 3.81Å; Y322-V416 HydrophobicContact CE1-CG2 4.32Å; Y322-V416 WeakPolarHBondContact OH-CA 3.29Å; Y322-V416 PolarHBondContact OH-N 3.33Å; V416-I420 HydrophobicContact CG1-CB 3.9Å; V416-I420 HydrophobicContact CG1-CG2 3.9Å; V416-Q421 HydrophobicContact CB-CG 4.01Å; V416-Q421 HydrophobicContact CG1-CG 3.61Å; V416-Q421 PolarHBondContact O-NE2 3.02Å
417	P	88.6	Confident	88.8	Confident	12 Å²	12	42.7 Å²	42.7	8%	0.078	21%	0.209	C	C	.	.			trans	-65.6	153.6	175.6	-22.2	34.9	0	0	0	112.3	Q415 H419 I420 Q421	Q415-P417 VanDerWaalsContact O-CD 3.24Å; Q415-P417 WeakPolarHBondContact O-CD 3.28Å; P417-H419 VanDerWaalsContact C-N 3.28Å; P417-H419 WeakPolarHBondContact CB-CE1 3.31Å; P417-H419 WeakPolarHBondContact CB-ND1 3.15Å; P417-H419 PolarHBondContact O-N 3.49Å; P417-I420 HydrophobicContact CG-CD1 4.35Å; P417-I420 PolarHBondContact O-N 3.01Å; P417-I420 VanDerWaalsContact O-N 3.09Å; P417-Q421 WeakPolarHBondContact O-CG 3.49Å; P417-Q421 PolarHBondContact O-N 3.16Å
418	P	84.9	Confident	88.2	Confident	32 Å²	32	42.7 Å²	42.7	21%	0.208	21%	0.209	C	C	.	.	H	α-helix	trans	-64.8	-28.4	-172.6	26	-36.6	0	0	0	114.2	M35 K422	M35-P418 HydrophobicContact CB-CB 3.52Å; M35-P418 HydrophobicContact SD-CB 4.38Å; P418-K422 WeakPolarHBondContact O-CG 3.49Å; P418-K422 PolarHBondContact O-N 3Å; P418-K422 VanDerWaalsContact O-N 3.09Å
419	H	86.1	Confident	87.5	Confident	104 Å²	104	45.1 Å²	45.1	48%	0.481	21%	0.213	S	C	.	.	H	α-helix	trans	-66.8	-41.4	175.3	66.2	-85.6	0	0	0	111.8	P417 E423	P417-H419 VanDerWaalsContact C-N 3.28Å; P417-H419 WeakPolarHBondContact CB-CE1 3.31Å; P417-H419 WeakPolarHBondContact CB-ND1 3.15Å; P417-H419 PolarHBondContact O-N 3.49Å; H419-E423 PolarHBondContact O-N 3.37Å
420	I	87.1	Confident	86.9	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-69.7	-41.3	176.2	-55.6	-171.4	0	0	0	110.1	L51 L319 Y322 V416 P417 K422 E423 V424	L51-I420 HydrophobicContact CD1-CG2 3.45Å; L51-I420 VanDerWaalsContact CD1-CG2 3.45Å; L319-I420 HydrophobicContact CD2-CD1 3.74Å; Y322-I420 HydrophobicContact CE2-CD1 4.1Å; V416-I420 HydrophobicContact CG1-CB 3.9Å; V416-I420 HydrophobicContact CG1-CG2 3.9Å; P417-I420 HydrophobicContact CG-CD1 4.35Å; P417-I420 PolarHBondContact O-N 3.01Å; P417-I420 VanDerWaalsContact O-N 3.09Å; I420-K422 VanDerWaalsContact C-N 3.32Å; I420-K422 PolarHBondContact O-N 3.38Å; I420-E423 PolarHBondContact O-N 3.2Å; I420-V424 HydrophobicContact CG2-CG2 4.19Å; I420-V424 VanDerWaalsContact O-CG2 3.31Å; I420-V424 WeakPolarHBondContact O-CG2 3.46Å; I420-V424 PolarHBondContact O-N 3.36Å
421	Q	87.1	Confident	86.1	Confident	21 Å²	21	51.9 Å²	51.9	10%	0.098	25%	0.25	C	C	.	.	H	α-helix	trans	-56.4	-44.9	176.2	-67	178.6	28.1	0	0	112.2	D36 V38 V416 P417 E423 V424 A425	D36-Q421 PolarHBondContact O-NE2 3.4Å; V38-Q421 VanDerWaalsContact CG2-NE2 3.3Å; V416-Q421 HydrophobicContact CB-CG 4.01Å; V416-Q421 HydrophobicContact CG1-CG 3.61Å; V416-Q421 PolarHBondContact O-NE2 3.02Å; P417-Q421 WeakPolarHBondContact O-CG 3.49Å; P417-Q421 PolarHBondContact O-N 3.16Å; Q421-E423 VanDerWaalsContact C-N 3.28Å; Q421-E423 PolarHBondContact O-N 3.2Å; Q421-V424 PolarHBondContact O-N 3.21Å; Q421-A425 WeakPolarHBondContact O-CB 3.39Å; Q421-A425 PolarHBondContact O-N 3.11Å
422	K	85.1	Confident	85.3	Confident	117 Å²	117	50.1 Å²	50.1	51%	0.509	24%	0.243	S	C	.	.	H	α-helix	trans	-58.9	-42.1	176	-73.5	173.3	-174.3	179.6	0	111.1	M35 P418 I420 A425 K426	M35-K422 WeakPolarHBondContact SD-CE 3.22Å; M35-K422 HydrophobicContact SD-CG 4.36Å; P418-K422 WeakPolarHBondContact O-CG 3.49Å; P418-K422 PolarHBondContact O-N 3Å; P418-K422 VanDerWaalsContact O-N 3.09Å; I420-K422 VanDerWaalsContact C-N 3.32Å; I420-K422 PolarHBondContact O-N 3.38Å; K422-A425 PolarHBondContact O-N 2.97Å; K422-K426 VanDerWaalsContact O-CG 3.31Å; K422-K426 WeakPolarHBondContact O-CG 3.36Å; K422-K426 PolarHBondContact O-N 2.94Å
423	E	86.5	Confident	84.5	Confident	65 Å²	65	50.4 Å²	50.4	30%	0.304	25%	0.249	S	C	.	.	H	α-helix	trans	-72.7	-36	-178.4	-150	63.4	-157	0	0	112.8	H419 I420 Q421 K426 R427	H419-E423 PolarHBondContact O-N 3.37Å; I420-E423 PolarHBondContact O-N 3.2Å; Q421-E423 VanDerWaalsContact C-N 3.28Å; Q421-E423 PolarHBondContact O-N 3.2Å; E423-K426 PolarHBondContact O-N 2.95Å; E423-K426 WeakPolarHBondContact OE2-CD 3.45Å; E423-K426 IonicContact OE2-NZ 3.49Å; E423-K426 PolarHBondContact OE2-NZ 3.17Å; E423-R427 VanDerWaalsContact CG-NH1 3.25Å; E423-R427 PolarHBondContact O-N 2.96Å
424	V	85.9	Confident	83.7	Confident	9 Å²	9	58.2 Å²	58.2	6%	0.055	29%	0.285	C	S	.	.	H	α-helix	trans	-60.6	-50.2	169.4	173.7	0	0	0	0	110	K50 L51 T54 I420 Q421 K426 R427 V428	K50-V424 HydrophobicContact CB-CG1 4.06Å; L51-V424 HydrophobicContact CB-CG2 4.04Å; L51-V424 HydrophobicContact CD1-CG2 3.72Å; T54-V424 HydrophobicContact CG2-CB 4.46Å; T54-V424 HydrophobicContact CG2-CG2 3.67Å; I420-V424 HydrophobicContact CG2-CG2 4.19Å; I420-V424 VanDerWaalsContact O-CG2 3.31Å; I420-V424 WeakPolarHBondContact O-CG2 3.46Å; I420-V424 PolarHBondContact O-N 3.36Å; Q421-V424 PolarHBondContact O-N 3.21Å; V424-K426 VanDerWaalsContact C-N 3.31Å; V424-K426 PolarHBondContact O-N 3.23Å; V424-R427 CarbonylContact O-C 3.56Å; V424-R427 PolarHBondContact O-N 2.86Å; V424-V428 HydrophobicContact CG1-CG2 4.19Å; V424-V428 WeakPolarHBondContact O-CG2 3.38Å; V424-V428 PolarHBondContact O-N 3.39Å
425	A	84.1	Confident	82.7	Confident	35 Å²	35	58.4 Å²	58.4	29%	0.289	29%	0.288	S	S	.	.	H	α-helix	trans	-60.1	-40.1	-179.9	0	0	0	0	0	112.2	Q421 K422 V428 W429 L436	Q421-A425 WeakPolarHBondContact O-CB 3.39Å; Q421-A425 PolarHBondContact O-N 3.11Å; K422-A425 PolarHBondContact O-N 2.97Å; A425-V428 PolarHBondContact O-N 3Å; A425-W429 WeakPolarHBondContact O-CB 3.4Å; A425-W429 PolarHBondContact O-N 3.13Å; A425-L436 HydrophobicContact CB-CD1 4.35Å
426	K	85.4	Confident	82	Confident	90 Å²	90	55.9 Å²	55.9	39%	0.391	28%	0.276	S	S	.	.	H	α-helix	trans	-60.5	-43.6	172.3	-72.6	174.7	-163.9	166.8	0	111.9	K422 E423 V424 W429 K430	K422-K426 VanDerWaalsContact O-CG 3.31Å; K422-K426 WeakPolarHBondContact O-CG 3.36Å; K422-K426 PolarHBondContact O-N 2.94Å; E423-K426 PolarHBondContact O-N 2.95Å; E423-K426 WeakPolarHBondContact OE2-CD 3.45Å; E423-K426 IonicContact OE2-NZ 3.49Å; E423-K426 PolarHBondContact OE2-NZ 3.17Å; V424-K426 VanDerWaalsContact C-N 3.31Å; V424-K426 PolarHBondContact O-N 3.23Å; K426-W429 PolarHBondContact O-N 3.41Å; K426-K430 WeakPolarHBondContact O-CG 3.3Å; K426-K430 PolarHBondContact O-N 3.48Å
427	R	82	Confident	81.1	Confident	57 Å²	57	58.9 Å²	58.9	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-69	-38	177.8	-73.5	-168.2	179.5	82.2	-6.6	112.4	K50 H57 E423 V424 K430 S431	K50-R427 HydrophobicContact CD-CB 4.38Å; H57-R427 PolarHBondContact CD2-NH2 3.32Å; E423-R427 VanDerWaalsContact CG-NH1 3.25Å; E423-R427 PolarHBondContact O-N 2.96Å; V424-R427 CarbonylContact O-C 3.56Å; V424-R427 PolarHBondContact O-N 2.86Å; R427-K430 PolarHBondContact O-N 3.25Å; R427-S431 PolarHBondContact O-N 3.12Å; R427-S431 VanDerWaalsContact O-N 3.13Å
428	V	82	Confident	80.4	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-61.5	-49.7	173.3	174.6	0	0	0	0	109.8	L46 E47 K50 V424 A425 K430 S431 S432 L436 I439	L46-V428 HydrophobicContact CD2-CG1 4.02Å; E47-V428 HydrophobicContact CG-CG2 4.45Å; K50-V428 HydrophobicContact CB-CG2 4.04Å; K50-V428 HydrophobicContact CG-CG2 3.77Å; V424-V428 HydrophobicContact CG1-CG2 4.19Å; V424-V428 WeakPolarHBondContact O-CG2 3.38Å; V424-V428 PolarHBondContact O-N 3.39Å; A425-V428 PolarHBondContact O-N 3Å; V428-K430 VanDerWaalsContact C-N 3.32Å; V428-K430 PolarHBondContact O-N 3.4Å; V428-S431 PolarHBondContact O-N 3.41Å; V428-S431 PolarHBondContact O-OG 3.25Å; V428-S432 PolarHBondContact O-N 2.88Å; V428-L436 HydrophobicContact CB-CD1 4.41Å; V428-L436 HydrophobicContact CG1-CB 4.16Å; V428-L436 HydrophobicContact CG1-CD1 4.09Å; V428-I439 HydrophobicContact CG1-CD1 4.45Å
429	W	80.4	Confident	79.9	Confident	109 Å²	109	61.1 Å²	61.1	41%	0.413	30%	0.298	S	S	.	.	H	α-helix	trans	-52.9	-47.3	176.2	-177	-73	0	0	0	112.2	A425 K426 S431 L436	A425-W429 WeakPolarHBondContact O-CB 3.4Å; A425-W429 PolarHBondContact O-N 3.13Å; K426-W429 PolarHBondContact O-N 3.41Å; W429-S431 VanDerWaalsContact C-N 3.28Å; W429-S431 PolarHBondContact O-N 2.97Å; W429-L436 HydrophobicContact CB-CD2 4.37Å; W429-L436 HydrophobicContact CD2-CD2 4.44Å; W429-L436 HydrophobicContact CE3-CD2 3.44Å; W429-L436 VanDerWaalsContact CE3-CD2 3.44Å; W429-L436 HydrophobicContact CZ3-CD2 4.1Å
430	K	81.1	Confident	79.2	Confident	178 Å²	178	60.3 Å²	60.3	77%	0.774	29%	0.29	S	S	*	.	H	α-helix	trans	-62.1	-34.2	178.7	-74.4	176.5	-179.1	-178.2	0	112.8	K426 R427 V428	K426-K430 WeakPolarHBondContact O-CG 3.3Å; K426-K430 PolarHBondContact O-N 3.48Å; R427-K430 PolarHBondContact O-N 3.25Å; V428-K430 VanDerWaalsContact C-N 3.32Å; V428-K430 PolarHBondContact O-N 3.4Å
431	S	77.4	Confident	78.5	Confident	60 Å²	60	67 Å²	67	42%	0.42	32%	0.315	S	S	.	.	H	α-helix	trans	-82.5	-41.3	-180	77.6	0	0	0	0	113.4	R427 V428 W429	R427-S431 PolarHBondContact O-N 3.12Å; R427-S431 VanDerWaalsContact O-N 3.13Å; V428-S431 PolarHBondContact O-N 3.41Å; V428-S431 PolarHBondContact O-OG 3.25Å; W429-S431 VanDerWaalsContact C-N 3.28Å; W429-S431 PolarHBondContact O-N 2.97Å
432	S	74.1	Confident	77.9	Confident	34 Å²	34	69.1 Å²	69.1	24%	0.238	32%	0.323	C	S	.	.			trans	-161.8	97.6	-171.9	47.3	0	0	0	0	110.7	V428 E434 A435	V428-S432 PolarHBondContact O-N 2.88Å; S432-E434 VanDerWaalsContact C-N 3.32Å; S432-E434 PolarHBondContact O-N 3.4Å; S432-A435 WeakPolarHBondContact O-CB 3.49Å; S432-A435 PolarHBondContact O-N 3.06Å; S432-A435 VanDerWaalsContact OG-CB 3.27Å; S432-A435 WeakPolarHBondContact OG-CB 3.42Å
433	P	74.4	Confident	77.2	Confident	64 Å²	64	64.9 Å²	64.9	42%	0.416	31%	0.306	S	S	.	.	H	α-helix	trans	-65.1	-36.5	179.6	24.6	-32.8	0	0	0	112.1	A435 L436 D437	P433-A435 VanDerWaalsContact C-N 3.26Å; P433-A435 PolarHBondContact O-N 3.38Å; P433-L436 PolarHBondContact O-N 3.34Å; P433-D437 PolarHBondContact O-N 3Å
434	E	73.9	Confident	76.6	Confident	163 Å²	163	64.2 Å²	64.2	76%	0.762	30%	0.304	S	S	*	.	H	α-helix	trans	-61	-34.5	177.8	-61.6	-177.2	173.9	0	0	113	S432 D437 F438	S432-E434 VanDerWaalsContact C-N 3.32Å; S432-E434 PolarHBondContact O-N 3.4Å; E434-D437 PolarHBondContact O-N 3.22Å; E434-F438 PolarHBondContact O-N 2.78Å; E434-F438 VanDerWaalsContact O-N 3.07Å
435	A	71.6	Confident	75.8	Confident	9 Å²	9	72.3 Å²	72.3	7%	0.074	33%	0.333	C	S	.	.	H	α-helix	trans	-67.4	-41.2	178.6	0	0	0	0	0	111.2	L46 L216 S432 P433 D437 F438 I439	L46-A435 HydrophobicContact CD2-CB 3.68Å; L216-A435 HydrophobicContact CD1-CB 4.08Å; L216-A435 HydrophobicContact CD2-CB 3.69Å; S432-A435 WeakPolarHBondContact O-CB 3.49Å; S432-A435 PolarHBondContact O-N 3.06Å; S432-A435 VanDerWaalsContact OG-CB 3.27Å; S432-A435 WeakPolarHBondContact OG-CB 3.42Å; P433-A435 VanDerWaalsContact C-N 3.26Å; P433-A435 PolarHBondContact O-N 3.38Å; A435-D437 PolarHBondContact O-N 2.96Å; A435-F438 WeakPolarHBondContact O-CB 3.34Å; A435-F438 PolarHBondContact O-N 3.32Å; A435-I439 WeakPolarHBondContact O-CD1 3.43Å; A435-I439 VanDerWaalsContact O-CG1 3.24Å; A435-I439 WeakPolarHBondContact O-CG1 3.35Å; A435-I439 PolarHBondContact O-N 3.09Å
436	L	75.3	Confident	75	Confident	10 Å²	10	74.4 Å²	74.4	5%	0.052	34%	0.336	C	S	.	.	H	α-helix	trans	-64.6	-41.9	178	-169.3	73.1	0	0	0	111.4	A425 V428 W429 P433 F438 I439 R440	A425-L436 HydrophobicContact CB-CD1 4.35Å; V428-L436 HydrophobicContact CB-CD1 4.41Å; V428-L436 HydrophobicContact CG1-CB 4.16Å; V428-L436 HydrophobicContact CG1-CD1 4.09Å; W429-L436 HydrophobicContact CB-CD2 4.37Å; W429-L436 HydrophobicContact CD2-CD2 4.44Å; W429-L436 HydrophobicContact CE3-CD2 3.44Å; W429-L436 VanDerWaalsContact CE3-CD2 3.44Å; W429-L436 HydrophobicContact CZ3-CD2 4.1Å; P433-L436 PolarHBondContact O-N 3.34Å; L436-F438 VanDerWaalsContact C-N 3.28Å; L436-F438 PolarHBondContact O-N 2.79Å; L436-I439 PolarHBondContact O-N 3.27Å; L436-R440 WeakPolarHBondContact O-CB 3.32Å; L436-R440 VanDerWaalsContact O-CG 3.32Å; L436-R440 WeakPolarHBondContact O-CG 3.38Å; L436-R440 PolarHBondContact O-N 3.42Å
437	D	71	Confident	74.3	Confident	66 Å²	66	72.6 Å²	72.6	35%	0.353	33%	0.33	S	S	.	.	H	α-helix	trans	-65.8	-33.6	177.3	-72.2	-23.3	0	0	0	112.3	P433 E434 A435 R440 R441	P433-D437 PolarHBondContact O-N 3Å; E434-D437 PolarHBondContact O-N 3.22Å; A435-D437 PolarHBondContact O-N 2.96Å; D437-R440 IonicContact OD1-NH1 3.88Å; D437-R441 WeakPolarHBondContact O-CB 3.36Å; D437-R441 VanDerWaalsContact O-CG 3.27Å; D437-R441 WeakPolarHBondContact O-CG 3.47Å; D437-R441 PolarHBondContact O-N 3.45Å; D437-R441 VanDerWaalsContact O-N 3.09Å; D437-R441 PolarHBondContact O-NE 2.89Å
438	F	72.8	Confident	73.6	Confident	86 Å²	86	75.5 Å²	75.5	38%	0.377	35%	0.346	S	S	.	.	H	α-helix	trans	-66.3	-46.9	172.3	-179.6	-89.9	0	0	0	111.6	L216 E434 A435 L436 R440 R441 R442	L216-F438 HydrophobicContact CB-CD1 3.54Å; L216-F438 HydrophobicContact CB-CE1 3.61Å; L216-F438 HydrophobicContact CD1-CB 3.91Å; L216-F438 HydrophobicContact CD1-CD1 3.55Å; L216-F438 HydrophobicContact CD1-CE1 4.25Å; L216-F438 HydrophobicContact CD1-CG 3.81Å; L216-F438 HydrophobicContact CG-CD1 4.19Å; E434-F438 PolarHBondContact O-N 2.78Å; E434-F438 VanDerWaalsContact O-N 3.07Å; A435-F438 WeakPolarHBondContact O-CB 3.34Å; A435-F438 PolarHBondContact O-N 3.32Å; L436-F438 VanDerWaalsContact C-N 3.28Å; L436-F438 PolarHBondContact O-N 2.79Å; F438-R440 PolarHBondContact O-N 3.41Å; F438-R441 PolarHBondContact O-N 3.04Å; F438-R442 WeakPolarHBondContact O-CB 3.37Å; F438-R442 PolarHBondContact O-N 3.46Å
439	I	73.8	Confident	73	Confident	5 Å²	5	78.2 Å²	78.2	3%	0.026	37%	0.365	C	S	.	.	H	α-helix	trans	-59.8	-45.8	177.7	-68.9	161.2	0	0	0	110.6	E47 L216 V428 A435 L436 R441 R442 N443	E47-I439 HydrophobicContact CG-CD1 3.87Å; E47-I439 VanDerWaalsContact OE1-CG2 3.32Å; E47-I439 WeakPolarHBondContact OE1-CG2 3.43Å; L216-I439 HydrophobicContact CD2-CD1 4.43Å; V428-I439 HydrophobicContact CG1-CD1 4.45Å; A435-I439 WeakPolarHBondContact O-CD1 3.43Å; A435-I439 VanDerWaalsContact O-CG1 3.24Å; A435-I439 WeakPolarHBondContact O-CG1 3.35Å; A435-I439 PolarHBondContact O-N 3.09Å; L436-I439 PolarHBondContact O-N 3.27Å; I439-R441 PolarHBondContact O-N 3.07Å; I439-R442 WeakPolarHBondContact O-CB 3.41Å; I439-R442 PolarHBondContact O-N 3.36Å; I439-N443 PolarHBondContact O-N 3.16Å
440	R	72.2	Confident	72.1	Confident	86 Å²	86	75.4 Å²	75.4	33%	0.325	37%	0.365	S	S	.	.	H	α-helix	trans	-57.8	-49	175.8	-75.4	172.8	174.9	179.7	-5	111.7	L436 D437 F438 R442 N443 L444	L436-R440 WeakPolarHBondContact O-CB 3.32Å; L436-R440 VanDerWaalsContact O-CG 3.32Å; L436-R440 WeakPolarHBondContact O-CG 3.38Å; L436-R440 PolarHBondContact O-N 3.42Å; D437-R440 IonicContact OD1-NH1 3.88Å; F438-R440 PolarHBondContact O-N 3.41Å; R440-R442 VanDerWaalsContact C-N 3.32Å; R440-R442 PolarHBondContact O-N 3.14Å; R440-N443 PolarHBondContact O-N 3.11Å; R440-L444 WeakPolarHBondContact O-CB 3.34Å; R440-L444 WeakPolarHBondContact O-CG 3.4Å; R440-L444 PolarHBondContact O-N 3.01Å
441	R	73	Confident	71.5	Confident	142 Å²	142	75.4 Å²	75.4	54%	0.536	36%	0.36	S	S	.	.	H	α-helix	trans	-62.3	-39.1	177.6	-77.5	179.4	-79.2	-175.4	-6.1	112.3	D437 F438 I439 R445	D437-R441 WeakPolarHBondContact O-CB 3.36Å; D437-R441 VanDerWaalsContact O-CG 3.27Å; D437-R441 WeakPolarHBondContact O-CG 3.47Å; D437-R441 PolarHBondContact O-N 3.45Å; D437-R441 VanDerWaalsContact O-N 3.09Å; D437-R441 PolarHBondContact O-NE 2.89Å; F438-R441 PolarHBondContact O-N 3.04Å; I439-R441 PolarHBondContact O-N 3.07Å; R441-R445 WeakPolarHBondContact O-CG 3.34Å; R441-R445 PolarHBondContact O-N 2.84Å; R441-R445 VanDerWaalsContact O-N 3.1Å
442	R	73.8	Confident	71.1	Confident	66 Å²	66	77.4 Å²	77.4	25%	0.249	37%	0.365	C	S	.	.	H	α-helix	trans	-62.4	-48.8	175.6	-178.1	-163.7	-179.2	102.5	16.3	111.4	N217 F438 I439 R440 L444 R445 K446	N217-R442 PolarHBondContact OD1-NH1 3.39Å; F438-R442 WeakPolarHBondContact O-CB 3.37Å; F438-R442 PolarHBondContact O-N 3.46Å; I439-R442 WeakPolarHBondContact O-CB 3.41Å; I439-R442 PolarHBondContact O-N 3.36Å; R440-R442 VanDerWaalsContact C-N 3.32Å; R440-R442 PolarHBondContact O-N 3.14Å; R442-L444 VanDerWaalsContact C-N 3.32Å; R442-L444 PolarHBondContact O-N 3.38Å; R442-R445 PolarHBondContact O-N 3.02Å; R442-K446 PolarHBondContact O-N 3.35Å
443	N	70.9	Confident	70.9	Confident	29 Å²	29	82 Å²	82	16%	0.155	38%	0.381	C	S	.	.	H	α-helix	trans	-65.8	-37.6	-178.6	-70.4	-18.3	0	0	0	111.4	I439 R440 R445 K446 I447	I439-N443 PolarHBondContact O-N 3.16Å; R440-N443 PolarHBondContact O-N 3.11Å; N443-R445 PolarHBondContact O-N 3.04Å; N443-K446 PolarHBondContact O-N 3.46Å; N443-I447 VanDerWaalsContact O-CG1 3.29Å; N443-I447 WeakPolarHBondContact O-CG1 3.42Å; N443-I447 PolarHBondContact O-N 3.33Å
444	L	72.8	Confident	70.5	Confident	51 Å²	51	84.5 Å²	84.5	27%	0.267	39%	0.388	S	S	.	.	H	α-helix	trans	-57.3	-46.5	171	-79.1	169.6	0	0	0	112.5	V20 V22 R440 R442 K446 I447 Q448	V20-L444 HydrophobicContact CG1-CD2 4.35Å; V22-L444 HydrophobicContact CG1-CD2 4.33Å; V22-L444 HydrophobicContact CG1-CG 4.16Å; V22-L444 HydrophobicContact CG2-CD1 4.42Å; V22-L444 HydrophobicContact CG2-CD2 3.7Å; V22-L444 HydrophobicContact CG2-CG 4.25Å; R440-L444 WeakPolarHBondContact O-CB 3.34Å; R440-L444 WeakPolarHBondContact O-CG 3.4Å; R440-L444 PolarHBondContact O-N 3.01Å; R442-L444 VanDerWaalsContact C-N 3.32Å; R442-L444 PolarHBondContact O-N 3.38Å; L444-K446 VanDerWaalsContact C-N 3.34Å; L444-K446 PolarHBondContact O-N 3.43Å; L444-I447 PolarHBondContact O-N 3.43Å; L444-Q448 WeakPolarHBondContact O-CG 3.26Å; L444-Q448 PolarHBondContact O-N 2.87Å
445	R	68.9	Low	70.3	Confident	178 Å²	178	82.4 Å²	82.4	67%	0.672	38%	0.378	S	S	*	.	H	α-helix	trans	-62.1	-41	176.9	-71.6	175.2	-174.7	-177.9	0.5	112.2	R441 R442 N443 Q448 S449	R441-R445 WeakPolarHBondContact O-CG 3.34Å; R441-R445 PolarHBondContact O-N 2.84Å; R441-R445 VanDerWaalsContact O-N 3.1Å; R442-R445 PolarHBondContact O-N 3.02Å; N443-R445 PolarHBondContact O-N 3.04Å; R445-Q448 PolarHBondContact O-N 3.12Å; R445-S449 PolarHBondContact O-N 3.07Å; R445-S449 PolarHBondContact O-OG 3.3Å; R445-S449 VanDerWaalsContact O-OG 3.11Å
446	K	68.9	Low	70.1	Confident	80 Å²	80	87.3 Å²	87.3	35%	0.348	40%	0.4	S	S	.	.	H	α-helix	trans	-60.6	-46.1	176.1	-72.4	-177.2	178.2	178.9	0	111.7	R442 N443 L444 Q448 S449 A450	R442-K446 PolarHBondContact O-N 3.35Å; N443-K446 PolarHBondContact O-N 3.46Å; L444-K446 VanDerWaalsContact C-N 3.34Å; L444-K446 PolarHBondContact O-N 3.43Å; K446-Q448 VanDerWaalsContact C-N 3.33Å; K446-Q448 PolarHBondContact O-N 2.85Å; K446-S449 WeakPolarHBondContact CA-OG 3.44Å; K446-S449 PolarHBondContact O-N 2.79Å; K446-S449 PolarHBondContact O-OG 3.03Å; K446-A450 WeakPolarHBondContact O-CB 3.46Å; K446-A450 PolarHBondContact O-N 2.92Å
447	I	69.3	Low	69.6	Low	51 Å²	51	91.3 Å²	91.3	26%	0.262	42%	0.421	S	S	.	.	H	α-helix	trans	-62.4	-43.7	178.4	-65.9	162.7	0	0	0	110.3	N443 L444 A450 R451	N443-I447 VanDerWaalsContact O-CG1 3.29Å; N443-I447 WeakPolarHBondContact O-CG1 3.42Å; N443-I447 PolarHBondContact O-N 3.33Å; L444-I447 PolarHBondContact O-N 3.43Å; I447-A450 PolarHBondContact O-N 3.29Å; I447-R451 WeakPolarHBondContact O-CB 3.36Å; I447-R451 PolarHBondContact O-N 3.09Å
448	Q	67.4	Low	69.7	Low	119 Å²	119	90.9 Å²	90.9	56%	0.556	43%	0.427	S	S	*	.	H	α-helix	trans	-62	-45.2	176	-73	173.8	-18.8	0	0	111.8	L444 R445 K446 A450 R451 I452	L444-Q448 WeakPolarHBondContact O-CG 3.26Å; L444-Q448 PolarHBondContact O-N 2.87Å; R445-Q448 PolarHBondContact O-N 3.12Å; K446-Q448 VanDerWaalsContact C-N 3.33Å; K446-Q448 PolarHBondContact O-N 2.85Å; Q448-A450 PolarHBondContact O-N 2.95Å; Q448-R451 PolarHBondContact O-N 3.37Å; Q448-I452 VanDerWaalsContact O-CG1 3.29Å; Q448-I452 WeakPolarHBondContact O-CG1 3.47Å; Q448-I452 PolarHBondContact O-N 3.03Å
449	S	69.3	Low	69.4	Low	57 Å²	57	93 Å²	93	40%	0.399	44%	0.441	S	S	.	.	H	α-helix	trans	-65.5	-37	177	56.6	0	0	0	0	113.1	R445 K446 I452 K453	R445-S449 PolarHBondContact O-N 3.07Å; R445-S449 PolarHBondContact O-OG 3.3Å; R445-S449 VanDerWaalsContact O-OG 3.11Å; K446-S449 WeakPolarHBondContact CA-OG 3.44Å; K446-S449 PolarHBondContact O-N 2.79Å; K446-S449 PolarHBondContact O-OG 3.03Å; S449-I452 PolarHBondContact O-N 3.05Å; S449-K453 WeakPolarHBondContact O-CG 3.22Å; S449-K453 PolarHBondContact O-N 3.24Å
450	A	62.8	Low	68.7	Low	49 Å²	49	99 Å²	99	41%	0.405	47%	0.473	S	S	.	.	H	α-helix	trans	-67.2	-40.1	176.4	0	0	0	0	0	111.1	K446 I447 Q448 K453 M454	K446-A450 WeakPolarHBondContact O-CB 3.46Å; K446-A450 PolarHBondContact O-N 2.92Å; I447-A450 PolarHBondContact O-N 3.29Å; Q448-A450 PolarHBondContact O-N 2.95Å; A450-K453 PolarHBondContact O-N 3.45Å; A450-M454 WeakPolarHBondContact O-CG 3.46Å; A450-M454 PolarHBondContact O-N 3.43Å
451	R	67.7	Low	67.8	Low	178 Å²	178	99.3 Å²	99.3	67%	0.672	49%	0.488	S	S	*	.	H	α-helix	trans	-62.1	-44.7	175.3	-176.4	177.3	177.2	170.9	0.6	112.2	I447 Q448 K453 M454 E455	I447-R451 WeakPolarHBondContact O-CB 3.36Å; I447-R451 PolarHBondContact O-N 3.09Å; Q448-R451 PolarHBondContact O-N 3.37Å; R451-K453 VanDerWaalsContact C-N 3.34Å; R451-M454 PolarHBondContact O-N 2.85Å; R451-E455 WeakPolarHBondContact O-CB 3.49Å; R451-E455 PolarHBondContact O-N 2.87Å
452	I	69.6	Low	66.5	Low	103 Å²	103	98.3 Å²	98.3	53%	0.528	49%	0.494	S	S	.	.	H	α-helix	trans	-62.3	-43.7	176.9	-66.9	163	0	0	0	110.3	Q448 S449 M454 E455 E456	Q448-I452 VanDerWaalsContact O-CG1 3.29Å; Q448-I452 WeakPolarHBondContact O-CG1 3.47Å; Q448-I452 PolarHBondContact O-N 3.03Å; S449-I452 PolarHBondContact O-N 3.05Å; I452-M454 PolarHBondContact O-N 3.38Å; I452-E455 WeakPolarHBondContact O-CB 2.98Å; I452-E455 PolarHBondContact O-N 3.13Å; I452-E456 WeakPolarHBondContact O-CB 3.26Å; I452-E456 PolarHBondContact O-N 3.41Å
453	K	69.6	Low	65.1	Low	131 Å²	131	100 Å²	100	57%	0.57	51%	0.513	S	S	*	.	H	α-helix	trans	-62	-41.2	175.5	-75	-177.9	175.2	-161	0	113	S449 A450 R451 E455 E456 D457	S449-K453 WeakPolarHBondContact O-CG 3.22Å; S449-K453 PolarHBondContact O-N 3.24Å; A450-K453 PolarHBondContact O-N 3.45Å; R451-K453 VanDerWaalsContact C-N 3.34Å; K453-E455 VanDerWaalsContact C-N 3.3Å; K453-E455 PolarHBondContact O-N 2.79Å; K453-E456 PolarHBondContact O-N 3.47Å; K453-D457 WeakPolarHBondContact O-CB 3.38Å; K453-D457 PolarHBondContact O-N 2.87Å
454	M	65.9	Low	63.9	Low	115 Å²	115	104.6 Å²	104.6	57%	0.567	54%	0.542	S	S	*	.	H	α-helix	trans	-65.9	-34.5	175.9	-71.2	-176.6	80.8	0	0	112.4	A450 R451 I452 A458	A450-M454 WeakPolarHBondContact O-CG 3.46Å; A450-M454 PolarHBondContact O-N 3.43Å; R451-M454 PolarHBondContact O-N 2.85Å; I452-M454 PolarHBondContact O-N 3.38Å; M454-A458 WeakPolarHBondContact O-CB 3.47Å; M454-A458 PolarHBondContact O-N 3.05Å
455	E	70.4	Confident	62.8	Low	119 Å²	119	110 Å²	110	56%	0.556	57%	0.566	S	S	*	*	H	α-helix	trans	-68.7	-41.3	174.4	-169.1	170.4	177.5	0	0	110.7	R451 I452 K453 A458 L459	R451-E455 WeakPolarHBondContact O-CB 3.49Å; R451-E455 PolarHBondContact O-N 2.87Å; I452-E455 WeakPolarHBondContact O-CB 2.98Å; I452-E455 PolarHBondContact O-N 3.13Å; K453-E455 VanDerWaalsContact C-N 3.3Å; K453-E455 PolarHBondContact O-N 2.79Å; E455-A458 PolarHBondContact O-N 3.1Å; E455-L459 WeakPolarHBondContact O-CG 3.16Å; E455-L459 PolarHBondContact O-N 2.68Å
456	E	66.3	Low	61.6	Low	112 Å²	112	105.8 Å²	105.8	52%	0.523	56%	0.557	S	S	.	*	H	α-helix	trans	-66.2	-46.5	174.9	-169	175.1	-176.5	0	0	112.5	I452 K453 A458 L459 L460	I452-E456 WeakPolarHBondContact O-CB 3.26Å; I452-E456 PolarHBondContact O-N 3.41Å; K453-E456 PolarHBondContact O-N 3.47Å; E456-A458 VanDerWaalsContact C-N 3.32Å; E456-A458 PolarHBondContact O-N 3.26Å; E456-L459 PolarHBondContact O-N 3.01Å; E456-L460 HydrophobicContact CG-CD1 4.38Å; E456-L460 VanDerWaalsContact O-CG 3.31Å; E456-L460 WeakPolarHBondContact O-CG 3.01Å; E456-L460 PolarHBondContact O-N 3.05Å
457	D	66.3	Low	60.8	Low	94 Å²	94	105.4 Å²	105.4	50%	0.503	56%	0.564	S	S	.	*	H	α-helix	trans	-64.6	-36.4	176.6	-69.1	-24.7	0	0	0	111.2	K453 L460 S461	K453-D457 WeakPolarHBondContact O-CB 3.38Å; K453-D457 PolarHBondContact O-N 2.87Å; D457-L460 PolarHBondContact O-N 3.19Å; D457-S461 WeakPolarHBondContact O-CB 3.33Å; D457-S461 PolarHBondContact O-N 2.85Å; D457-S461 PolarHBondContact O-OG 3.16Å
458	A	72.2	Confident	59.9	Low	57 Å²	57	106.4 Å²	106.4	47%	0.471	58%	0.58	S	S	.	*	H	α-helix	trans	-66.7	-39.5	174.7	0	0	0	0	0	112.1	M454 E455 E456 L460 S461	M454-A458 WeakPolarHBondContact O-CB 3.47Å; M454-A458 PolarHBondContact O-N 3.05Å; E455-A458 PolarHBondContact O-N 3.1Å; E456-A458 VanDerWaalsContact C-N 3.32Å; E456-A458 PolarHBondContact O-N 3.26Å; A458-L460 VanDerWaalsContact C-N 3.26Å; A458-L460 PolarHBondContact O-N 3.4Å; A458-S461 PolarHBondContact O-N 3.25Å
459	L	65.9	Low	59.2	Low	130 Å²	130	106.7 Å²	106.7	68%	0.681	58%	0.581	S	S	*	*	H	α-helix	trans	-68.7	-24.7	174.6	-68.6	169.3	0	0	0	112.8	E455 E456	E455-L459 WeakPolarHBondContact O-CG 3.16Å; E455-L459 PolarHBondContact O-N 2.68Å; E456-L459 PolarHBondContact O-N 3.01Å
460	L	60.3	Low	58.2	Low	132 Å²	132	106.3 Å²	106.3	69%	0.691	58%	0.582	S	S	*	*	H	α-helix	trans	-87.7	-11	175.4	-69.2	170.5	0	0	0	113.5	E456 D457 A458	E456-L460 HydrophobicContact CG-CD1 4.38Å; E456-L460 VanDerWaalsContact O-CG 3.31Å; E456-L460 WeakPolarHBondContact O-CG 3.01Å; E456-L460 PolarHBondContact O-N 3.05Å; D457-L460 PolarHBondContact O-N 3.19Å; A458-L460 VanDerWaalsContact C-N 3.26Å; A458-L460 PolarHBondContact O-N 3.4Å
461	S	51.7	Low	57.4	Low	92 Å²	92	110 Å²	110	64%	0.643	59%	0.591	S	S	*	*	S	Bend	trans	-95.2	-5.3	-177.8	-58.2	0	0	0	0	113.9	D457 A458	D457-S461 WeakPolarHBondContact O-CB 3.33Å; D457-S461 PolarHBondContact O-N 2.85Å; D457-S461 PolarHBondContact O-OG 3.16Å; A458-S461 PolarHBondContact O-N 3.25Å
462	D	46	Very low	56.9	Low	122 Å²	122	104.5 Å²	104.5	65%	0.652	58%	0.583	S	S	*	*	S	Bend	trans	-69	124.6	171.1	-85.7	-16.5	0	0	0	109.2	V464	D462-V464 PolarHBondContact O-N 3.22Å; D462-V464 VanDerWaalsContact O-N 3.17Å
463	P	45	Very low	56.1	Low	101 Å²	101	102.5 Å²	102.5	66%	0.656	58%	0.582	S	S	*	*			trans	-68.4	119	173.5	29.3	-29.4	0	0	0	107.1	E465	P463-E465 PolarHBondContact O-N 3.31Å
464	V	46.2	Very low	55.1	Low	126 Å²	126	102.3 Å²	102.3	76%	0.764	59%	0.586	S	S	*	*			trans	-70	71.7	163.1	-176.7	0	0	0	0	107.6	D462	D462-V464 PolarHBondContact O-N 3.22Å; D462-V464 VanDerWaalsContact O-N 3.17Å
465	E	50	Low	54.2	Low	164 Å²	164	103.3 Å²	103.3	77%	0.766	59%	0.593	S	S	*	*			trans	-81.3	133.4	149.6	-73.7	-175.9	166	0	0	106.6	P463	P463-E465 PolarHBondContact O-N 3.31Å
466	N	43.8	Very low	53.1	Low	90 Å²	90	101.8 Å²	101.8	48%	0.481	60%	0.6	S	S	.	*			trans	94.4	38.2	171.4	-59.4	-0.9	0	0	0	119.3	E469 A470	N466-E469 HydrophobicContact CB-CB 4.27Å; N466-E469 VanDerWaalsContact CG-OE2 3.23Å; N466-E469 PolarHBondContact ND2-OE2 3.47Å; N466-E469 PolarHBondContact OD1-OE2 3.29Å; N466-E469 VanDerWaalsContact OD1-OE2 3.07Å; N466-A470 VanDerWaalsContact O-CB 3.28Å; N466-A470 WeakPolarHBondContact O-CB 3.38Å
467	S	50.6	Low	52.3	Low	71 Å²	71	104.8 Å²	104.8	50%	0.497	61%	0.614	S	S	.	*	S	Bend	trans	-84	-26.2	146.5	72.4	0	0	0	0	112.5	Q471	S467-Q471 WeakPolarHBondContact O-CB 3.39Å; S467-Q471 WeakPolarHBondContact O-CG 3.43Å; S467-Q471 PolarHBondContact O-N 3.12Å
468	A	50.9	Low	51.2	Low	73 Å²	73	104.3 Å²	104.3	60%	0.603	62%	0.618	S	S	*	*	H	α-helix	trans	-79.5	-42.1	178.1	0	0	0	0	0	113.1	Q471 A472	A468-Q471 PolarHBondContact O-N 3.33Å; A468-A472 WeakPolarHBondContact O-CB 3.27Å; A468-A472 PolarHBondContact O-N 2.82Å
469	E	52.8	Low	49.4	Very low	125 Å²	125	110.7 Å²	110.7	58%	0.584	64%	0.638	S	S	*	*	H	α-helix	trans	-71.9	-35	176.4	-73.3	-170.1	156.9	0	0	112.7	N466 Q471 A472 A473	N466-E469 HydrophobicContact CB-CB 4.27Å; N466-E469 VanDerWaalsContact CG-OE2 3.23Å; N466-E469 PolarHBondContact ND2-OE2 3.47Å; N466-E469 PolarHBondContact OD1-OE2 3.29Å; N466-E469 VanDerWaalsContact OD1-OE2 3.07Å; E469-Q471 VanDerWaalsContact C-N 3.34Å; E469-Q471 PolarHBondContact O-N 3.31Å; E469-A472 PolarHBondContact O-N 2.92Å; E469-A473 PolarHBondContact O-N 2.78Å
470	A	49.1	Very low	47.9	Very low	49 Å²	49	110.2 Å²	110.2	41%	0.405	64%	0.643	S	S	.	*	H	α-helix	trans	-67.2	-35.1	175	0	0	0	0	0	112.1	N466 I474	N466-A470 VanDerWaalsContact O-CB 3.28Å; N466-A470 WeakPolarHBondContact O-CB 3.38Å; A470-I474 WeakPolarHBondContact O-CD1 3.43Å; A470-I474 VanDerWaalsContact O-CG1 3.29Å; A470-I474 WeakPolarHBondContact O-CG1 3.31Å; A470-I474 PolarHBondContact O-N 3.46Å
471	Q	46	Very low	46.4	Very low	127 Å²	127	113.9 Å²	113.9	59%	0.593	65%	0.654	S	S	*	*	H	α-helix	trans	-74.6	-33.7	174.8	-73.6	176.8	6.1	0	0	112.4	S467 A468 E469 I474 L475	S467-Q471 WeakPolarHBondContact O-CB 3.39Å; S467-Q471 WeakPolarHBondContact O-CG 3.43Å; S467-Q471 PolarHBondContact O-N 3.12Å; A468-Q471 PolarHBondContact O-N 3.33Å; E469-Q471 VanDerWaalsContact C-N 3.34Å; E469-Q471 PolarHBondContact O-N 3.31Å; Q471-I474 PolarHBondContact O-N 2.97Å; Q471-L475 PolarHBondContact O-N 2.7Å; Q471-L475 VanDerWaalsContact O-N 3.12Å
472	A	56.1	Low	45.4	Very low	61 Å²	61	117.2 Å²	117.2	50%	0.504	66%	0.664	S	S	.	*	H	α-helix	trans	-66.2	-36.7	174.1	0	0	0	0	0	112.6	A468 E469 I474 A476	A468-A472 WeakPolarHBondContact O-CB 3.27Å; A468-A472 PolarHBondContact O-N 2.82Å; E469-A472 PolarHBondContact O-N 2.92Å; A472-I474 VanDerWaalsContact C-N 3.34Å; A472-I474 PolarHBondContact O-N 3.19Å; A472-A476 PolarHBondContact O-N 2.96Å
473	A	53.1	Low	44.8	Very low	61 Å²	61	120.3 Å²	120.3	50%	0.504	68%	0.675	S	S	.	*	H	α-helix	trans	-69.2	-29.1	175.9	0	0	0	0	0	113.4	E469	E469-A473 PolarHBondContact O-N 2.78Å
474	I	48.9	Very low	44	Very low	128 Å²	128	118.9 Å²	118.9	66%	0.656	68%	0.679	S	S	*	*	H	α-helix	trans	-80.8	-32.4	178.3	-65.1	165.1	0	0	0	111.3	A470 Q471 A472 A476	A470-I474 WeakPolarHBondContact O-CD1 3.43Å; A470-I474 VanDerWaalsContact O-CG1 3.29Å; A470-I474 WeakPolarHBondContact O-CG1 3.31Å; A470-I474 PolarHBondContact O-N 3.46Å; Q471-I474 PolarHBondContact O-N 2.97Å; A472-I474 VanDerWaalsContact C-N 3.34Å; A472-I474 PolarHBondContact O-N 3.19Å; I474-A476 VanDerWaalsContact C-N 3.35Å
475	L	46.4	Very low	43.9	Very low	136 Å²	136	119 Å²	119	71%	0.712	68%	0.681	S	S	*	*	H	α-helix	trans	-73.8	-21.9	176.9	-83.2	160.9	0	0	0	113.9	Q471 Q477	Q471-L475 PolarHBondContact O-N 2.7Å; Q471-L475 VanDerWaalsContact O-N 3.12Å; L475-Q477 VanDerWaalsContact C-N 3.3Å; L475-Q477 PolarHBondContact O-N 3.41Å
476	A	47.1	Very low	42.8	Very low	86 Å²	86	116.4 Å²	116.4	71%	0.711	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-8.4	178.7	0	0	0	0	0	114.5	A472 I474	A472-A476 PolarHBondContact O-N 2.96Å; I474-A476 VanDerWaalsContact C-N 3.35Å
477	Q	49.4	Very low	42.2	Very low	176 Å²	176	121.2 Å²	121.2	82%	0.822	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	16.7	-176.4	-65.8	-169.3	13.1	0	0	114.8	L475	L475-Q477 VanDerWaalsContact C-N 3.3Å; L475-Q477 PolarHBondContact O-N 3.41Å
478	S	42.8	Very low	41.1	Very low	83 Å²	83	126.4 Å²	126.4	58%	0.58	72%	0.718	S	S	*	*			trans	-134.8	87.7	177.5	53.5	0	0	0	0	113.4
479	Q	34.8	Very low	41.1	Very low	192 Å²	192	128.3 Å²	128.3	90%	0.897	72%	0.724	S	S	*	*			trans	-139.9	150.8	144.9	-85.9	-143.5	-12.5	0	0	110.4
480	P	35.4	Very low	39.9	Very low	120 Å²	120	127.2 Å²	127.2	78%	0.779	74%	0.736	S	S	*	*			trans	-99.5	164.2	-141.2	18	-0.6	0	0	0	114.8
481	F	28.3	Very low	39.1	Very low	208 Å²	208	131.5 Å²	131.5	91%	0.912	76%	0.757	S	S	*	*			trans	-41.8	142.6	169.8	-88.4	-105.6	0	0	0	115.1
482	D	30.7	Very low	39.4	Very low	163 Å²	163	130.9 Å²	130.9	87%	0.872	76%	0.764	S	S	*	*			trans	-126.2	137.7	152	-156.1	5.6	0	0	0	108.6
483	E	33.5	Very low	38.1	Very low	187 Å²	187	132.3 Å²	132.3	87%	0.874	78%	0.776	S	S	*	*			trans	-88.9	149.3	-169	-74.6	-177.9	146.4	0	0	113.2
484	G	27.5	Very low	36.8	Very low	71 Å²	71	134.2 Å²	134.2	73%	0.732	79%	0.785	S	S	*	*			trans	138.4	150.4	146.4	0	0	0	0	0	117.2
485	P	45	Very low	35.9	Very low	127 Å²	127	133.9 Å²	133.9	83%	0.825	79%	0.79	S	S	*	*				-124.6	163.2	-127.2	39.1	-26.4	0	0	0	115
486	S	27.7	Very low	35	Very low	110 Å²	110	132.3 Å²	132.3	77%	0.769	80%	0.796	S	S	*	*			trans	162.3	139.5	134.7	54.5	0	0	0	0	115
487	E	30	Very low	34	Very low	191 Å²	191	131.9 Å²	131.9	89%	0.893	80%	0.8	S	S	*	*			trans	84	118.5	147	-73.3	177	175.6	0	0	122.5
488	E	27.7	Very low	33.1	Very low	181 Å²	181	129.1 Å²	129.1	85%	0.846	80%	0.801	S	S	*	*			trans	-60.5	-175.5	157.2	-91.3	-171.4	161.8	0	0	113.3
489	P	50.9	Low	33.6	Very low	112 Å²	112	130.2 Å²	130.2	73%	0.727	81%	0.806	S	S	*	*			cis	-135.6	174.3	-38.1	34.9	-17.6	0	0	0	112.1
490	A	28	Very low	33.5	Very low	103 Å²	103	127.3 Å²	127.3	85%	0.851	80%	0.796	S	S	*	*			trans	171.6	134.3	137	0	0	0	0	0	113.8
491	V	31.8	Very low	33.4	Very low	138 Å²	138	129.2 Å²	129.2	84%	0.836	79%	0.792	S	S	*	*			trans	-98.4	-177	163.7	-131.5	0	0	0	0	107.7
492	P	52.8	Low	33.6	Very low	114 Å²	114	126.8 Å²	126.8	74%	0.74	78%	0.784	S	S	*	*			cis	-142	-166.2	-16.1	32.4	-8.1	0	0	0	115.1
493	A	27.4	Very low	33.7	Very low	91 Å²	91	127.2 Å²	127.2	75%	0.752	78%	0.78	S	S	*	*			trans	84.1	146.7	148.1	0	0	0	0	0	117.3
494	S	26.7	Very low	33.5	Very low	101 Å²	101	121.9 Å²	121.9	71%	0.706	78%	0.776	S	S	*	*			cis	178.4	163.1	-10.5	54.9	0	0	0	0	107.1
495	T	29.2	Very low	33.7	Very low	122 Å²	122	123.2 Å²	123.2	75%	0.748	78%	0.78	S	S	*	*			trans	90.4	104.4	144.1	-40.6	0	0	0	0	120.4
496	A	28.7	Very low	33.1	Very low	102 Å²	102	122.4 Å²	122.4	84%	0.843	78%	0.784	S	S	*	*				52.8	140.9	126.1	0	0	0	0	0	123
497	G	26.3	Very low	33.2	Very low	78 Å²	78	121 Å²	121	80%	0.804	79%	0.787	S	S	*	*			trans	146.3	91.3	146.3	0	0	0	0	0	115.6
498	S	30.1	Very low	33.3	Very low	118 Å²	118	120 Å²	120	83%	0.825	79%	0.788	S	S	*	*			trans	-93.8	-178.4	147	-45.7	0	0	0	0	107.9
499	P	53.6	Low	34.9	Very low	106 Å²	106	116.5 Å²	116.5	69%	0.688	78%	0.781	S	S	*	*			cis	-131	-174.8	-26.2	20.6	5	0	0	0	110.9
500	D	32.2	Very low	34.7	Very low	131 Å²	131	116.4 Å²	116.4	70%	0.701	78%	0.78	S	S	*	*				156.7	145.5	120.8	-87.6	-9.2	0	0	0	116.7
501	K	34.1	Very low	34.8	Very low	159 Å²	159	119 Å²	119	69%	0.691	78%	0.78	S	S	*	*			trans	88.1	112.3	145.7	-79.9	172.6	-176	-161.7	0	120.3
502	E	33.1	Very low	34.9	Very low	157 Å²	157	116.5 Å²	116.5	73%	0.734	77%	0.773	S	S	*	*				85.1	146.1	86.5	-87.1	-176.6	174.6	0	0	111
503	E	32.4	Very low	33.9	Very low	172 Å²	172	118.8 Å²	118.8	80%	0.804	78%	0.779	S	S	*	*			cis	-179.2	147.6	-10.7	-174.5	-179.4	-164.5	0	0	106.1
504	G	29	Very low	34.3	Very low	75 Å²	75	125.1 Å²	125.1	77%	0.773	78%	0.784	S	S	*	*			trans	72.7	158.2	152.9	0	0	0	0	0	119.7
505	A	31.9	Very low	35.2	Very low	99 Å²	99	126.2 Å²	126.2	82%	0.818	79%	0.788	S	S	*	*			cis	-170.8	149	-13.3	0	0	0	0	0	108.3
506	A	32	Very low	35.7	Very low	110 Å²	110	127.4 Å²	127.4	91%	0.909	79%	0.789	S	S	*	*			trans	48.5	134.8	148.3	0	0	0	0	0	123.9
507	G	29.1	Very low	36.3	Very low	81 Å²	81	128.9 Å²	128.9	84%	0.835	79%	0.79	S	S	*	*			trans	161.9	114.5	152.8	0	0	0	0	0	114.8
508	N	32.2	Very low	36.5	Very low	170 Å²	170	136.8 Å²	136.8	91%	0.909	80%	0.796	S	S	*	*			trans	-97.9	178.7	179.9	-118.6	-3	0	0	0	111.7
509	P	60.9	Low	36.9	Very low	107 Å²	107	136.8 Å²	136.8	70%	0.695	79%	0.79	S	S	*	*			trans	-96.5	-174	-138.3	44	-41.7	0	0	0	115.2
510	P	48.3	Very low	36.4	Very low	111 Å²	111	137.7 Å²	137.7	72%	0.721	80%	0.796	S	S	*	*				-160.1	172.5	89.9	39.3	-17.1	0	0	0	118.6
511	N	30.2	Very low	36.5	Very low	158 Å²	158	140.5 Å²	140.5	85%	0.845	81%	0.805	S	S	*	*			trans	40.1	131.6	146	-66.7	-20.4	0	0	0	123.5
512	A	32.3	Very low	36.3	Very low	84 Å²	84	136.4 Å²	136.4	69%	0.694	81%	0.808	S	S	*	*				152.4	142.3	104	0	0	0	0	0	115
513	D	31.6	Very low	36.3	Very low	162 Å²	162	139.1 Å²	139.1	87%	0.866	82%	0.818	S	S	*	*			trans	87.5	116.6	143.3	-61.4	-23.5	0	0	0	125.3
514	R	35.5	Very low	36.5	Very low	225 Å²	225	141 Å²	141	85%	0.849	82%	0.823	S	S	*	*			trans	-53.5	174	159.5	-94	177.8	178.5	178.8	0.6	113.6
515	P	47.5	Very low	36.5	Very low	124 Å²	124	141.3 Å²	141.3	81%	0.805	83%	0.827	S	S	*	*			cis	-153.6	176.1	42.2	37.7	-12.7	0	0	0	120.3
516	L	39.6	Very low	36.8	Very low	147 Å²	147	145.6 Å²	145.6	77%	0.77	83%	0.827	S	S	*	*			trans	-69.9	175.5	168.7	-66.2	158.6	0	0	0	113.4
517	P	40.8	Very low	36.7	Very low	132 Å²	132	150.9 Å²	150.9	86%	0.857	83%	0.829	S	S	*	*			trans	-125.1	162.6	134.8	31.2	-17.4	0	0	0	116
518	R	29.8	Very low	37	Very low	244 Å²	244	150.8 Å²	150.8	92%	0.921	82%	0.821	S	S	*	*			trans	-82.1	160.5	-160	-75.5	164.5	168.5	177.8	-1.8	117.6
519	V	37.7	Very low	37.1	Very low	118 Å²	118	148.5 Å²	148.5	72%	0.715	81%	0.813	S	S	*	*			trans	-46.8	166.2	155.4	-156.7	0	0	0	0	115.5	Q521	V519-Q521 HydrophobicContact CG1-CG 4.35Å
520	P	43.3	Very low	35.8	Very low	125 Å²	125	154 Å²	154	81%	0.812	82%	0.82	S	S	*	*				-143.9	131.3	96	34	-16.6	0	0	0	113.9
521	Q	34.2	Very low	35.5	Very low	191 Å²	191	157.2 Å²	157.2	89%	0.893	82%	0.823	S	S	*	*				64.6	122.3	77.4	-88.8	-154.3	10.7	0	0	120.2	V519	V519-Q521 HydrophobicContact CG1-CG 4.35Å
522	G	29.8	Very low	35.6	Very low	72 Å²	72	158 Å²	158	74%	0.742	82%	0.819	S	S	*	*			trans	159.4	138.3	148.2	0	0	0	0	0	111.6
523	K	33.5	Very low	37	Very low	215 Å²	215	163 Å²	163	94%	0.935	85%	0.845	S	S	*	*			cis	-161.2	160.6	-2.2	-106.3	178.7	-179.5	174	0	108.4
524	K	36.2	Very low	37.3	Very low	210 Å²	210	163.1 Å²	163.1	91%	0.913	84%	0.844	S	S	*	*			trans	-72.5	158.5	-173.5	-66.5	166.4	170.7	169.6	0	115.2
525	G	30.3	Very low	37.4	Very low	83 Å²	83	159.8 Å²	159.8	86%	0.856	84%	0.844	S	S	*	*			trans	-151.6	107.3	152.1	0	0	0	0	0	111.4
526	K	38.6	Very low	36.8	Very low	189 Å²	189	161.8 Å²	161.8	82%	0.822	85%	0.846	S	S	*	*			trans	-89.6	146.1	165.8	-73.5	176.4	171.9	-177.4	0	107.9
527	F	29.7	Very low	36.7	Very low	220 Å²	220	162.7 Å²	162.7	97%	0.965	85%	0.85	S	S	*	*			trans	-156.7	144.4	138.6	-100.4	-73.6	0	0	0	111
528	A	35.1	Very low	36.4	Very low	79 Å²	79	164.6 Å²	164.6	65%	0.653	85%	0.85	S	S	*	*			trans	-112.1	174.8	-176.2	0	0	0	0	0	111.1
529	T	34.8	Very low	36.9	Very low	122 Å²	122	159.3 Å²	159.3	75%	0.748	85%	0.845	S	S	*	*			trans	92.7	122.9	148.3	35.6	0	0	0	0	122.9
530	R	32.6	Very low	36.8	Very low	224 Å²	224	162.3 Å²	162.3	85%	0.845	86%	0.855	S	S	*	*				103.2	120.7	125.3	-82.6	177.8	-170	-175.6	3.4	121.9
531	F	42.3	Very low	36.3	Very low	178 Å²	178	165.2 Å²	165.2	78%	0.781	86%	0.858	S	S	*	*				38.5	121.9	126.3	-86.2	-96.8	0	0	0	122
532	F	31.6	Very low	36.5	Very low	173 Å²	173	163 Å²	163	76%	0.759	86%	0.855	S	S	*	*			trans	43.9	149.5	132.1	-79.9	-79.7	0	0	0	121.3
533	P	63.3	Low	37.1	Very low	191 Å²	191	171.3 Å²	171.3	100%	1.24	87%	0.865	S	S	*	*				-118.9	0	78	7.1	14	0	0	0	115.1

Retrieved 533 of 533 residues in 231.3 ms (Link to these results)

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