A0A093GXY4_STRCA Loading...

Rac GTPase-activating protein 1

AlphaFold DB , UniProt , Accession A0A093GXY4, Species STRCA (Struthio camelus australis), Gene n/a, Length 631 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53	Low	64.1	Low	210 Å²	210	128.5 Å²	128.5	100%	1.034	66%	0.659	S	S	*	*				0	-42.2	0	-125.9	-179.5	-79.9	0	0	111.1	T3 A4 M5	M1-T3 PolarHBondContact O-N 3.4Å; M1-A4 PolarHBondContact O-N 3.11Å; M1-M5 PolarHBondContact O-N 3.1Å
2	E	52.4	Low	65.4	Low	162 Å²	162	127.8 Å²	127.8	76%	0.757	65%	0.648	S	S	*	*	H	α-helix	trans	-62.9	-37	178.7	-70.2	172.6	147	0	0	114.9	A4 M5 L6	E2-A4 PolarHBondContact O-N 3.12Å; E2-M5 PolarHBondContact O-N 3.12Å; E2-L6 PolarHBondContact O-N 2.87Å
3	T	55.6	Low	66.7	Low	117 Å²	117	122.4 Å²	122.4	72%	0.718	62%	0.622	S	S	*	*	H	α-helix	trans	-67.6	-32.7	178	39.5	0	0	0	0	113.7	M1 N7	M1-T3 PolarHBondContact O-N 3.4Å; T3-N7 PolarHBondContact O-N 3.34Å
4	A	55.4	Low	67.5	Low	57 Å²	57	121.6 Å²	121.6	47%	0.471	61%	0.614	S	S	.	*	H	α-helix	trans	-73.4	-35.4	175	0	0	0	0	0	111.7	M1 E2 N7 L8	M1-A4 PolarHBondContact O-N 3.11Å; E2-A4 PolarHBondContact O-N 3.12Å; A4-N7 PolarHBondContact O-N 3.08Å; A4-L8 PolarHBondContact O-N 2.88Å; A4-L8 VanDerWaalsContact O-N 3.16Å
5	M	57.2	Low	68.3	Low	146 Å²	146	120.9 Å²	120.9	72%	0.719	61%	0.612	S	S	*	*	H	α-helix	trans	-70.2	-37.5	175.7	-83.4	-153.8	150.3	0	0	113.2	M1 E2 N7 L8 R9	M1-M5 PolarHBondContact O-N 3.1Å; E2-M5 PolarHBondContact O-N 3.12Å; M5-N7 VanDerWaalsContact C-N 3.32Å; M5-N7 PolarHBondContact O-N 3.14Å; M5-L8 PolarHBondContact O-N 3.13Å; M5-R9 WeakPolarHBondContact O-CB 3.47Å; M5-R9 PolarHBondContact O-N 3.22Å
6	L	61.3	Low	68.9	Low	116 Å²	116	118.6 Å²	118.6	61%	0.607	60%	0.6	S	S	*	*	H	α-helix	trans	-62.7	-39.1	173.2	-103.9	83.8	0	0	0	112.1	E2 R9 N10	E2-L6 PolarHBondContact O-N 2.87Å; L6-R9 PolarHBondContact O-N 3.46Å; L6-N10 VanDerWaalsContact O-CG 3.29Å; L6-N10 PolarHBondContact O-N 2.85Å; L6-N10 PolarHBondContact O-ND2 2.92Å
7	N	68.9	Low	69.1	Low	107 Å²	107	121.9 Å²	121.9	57%	0.572	60%	0.603	S	S	*	*	H	α-helix	trans	-68.2	-40.8	179.3	-110.1	-10.8	0	0	0	112.6	T3 A4 M5 N10 L11	T3-N7 PolarHBondContact O-N 3.34Å; A4-N7 PolarHBondContact O-N 3.08Å; M5-N7 VanDerWaalsContact C-N 3.32Å; M5-N7 PolarHBondContact O-N 3.14Å; N7-N10 PolarHBondContact O-N 2.83Å; N7-L11 WeakPolarHBondContact O-CB 3.36Å; N7-L11 PolarHBondContact O-N 2.81Å
8	L	72.3	Confident	69.2	Low	124 Å²	124	121.5 Å²	121.5	65%	0.649	60%	0.6	S	S	*	*	H	α-helix	trans	-66.5	-37.1	175.5	-96.1	144.5	0	0	0	112.4	A4 M5 L11 F12	A4-L8 PolarHBondContact O-N 2.88Å; A4-L8 VanDerWaalsContact O-N 3.16Å; M5-L8 PolarHBondContact O-N 3.13Å; L8-L11 PolarHBondContact O-N 2.86Å; L8-F12 WeakPolarHBondContact O-CB 3.39Å; L8-F12 PolarHBondContact O-N 2.74Å
9	R	75.9	Confident	69.2	Low	172 Å²	172	117.3 Å²	117.3	65%	0.649	59%	0.586	S	S	*	*	H	α-helix	trans	-64.5	-44.8	174.8	-166.1	76.5	-176.7	-142	1.8	111.6	M5 L6 F12 D13	M5-R9 WeakPolarHBondContact O-CB 3.47Å; M5-R9 PolarHBondContact O-N 3.22Å; L6-R9 PolarHBondContact O-N 3.46Å; R9-F12 PolarHBondContact O-N 2.9Å; R9-D13 WeakPolarHBondContact O-CB 3.44Å; R9-D13 PolarHBondContact O-N 3.31Å
10	N	75.2	Confident	69	Low	92 Å²	92	117.1 Å²	117.1	49%	0.492	58%	0.583	S	S	.	*	H	α-helix	trans	-64.6	-40.4	177.5	-72.9	-20.2	0	0	0	112.4	L6 N7 D13 Q14	L6-N10 VanDerWaalsContact O-CG 3.29Å; L6-N10 PolarHBondContact O-N 2.85Å; L6-N10 PolarHBondContact O-ND2 2.92Å; N7-N10 PolarHBondContact O-N 2.83Å; N10-D13 PolarHBondContact O-N 3.16Å; N10-Q14 VanDerWaalsContact O-CB 3.28Å; N10-Q14 WeakPolarHBondContact O-CB 3.42Å; N10-Q14 PolarHBondContact O-N 2.99Å
11	L	77.6	Confident	68.7	Low	110 Å²	110	116.2 Å²	116.2	58%	0.576	58%	0.584	S	S	*	*	H	α-helix	trans	-64.2	-41.2	174.6	-94.1	150.9	0	0	0	112	N7 L8 Q14 L15	N7-L11 WeakPolarHBondContact O-CB 3.36Å; N7-L11 PolarHBondContact O-N 2.81Å; L8-L11 PolarHBondContact O-N 2.86Å; L11-Q14 PolarHBondContact O-N 3.26Å; L11-L15 VanDerWaalsContact O-CB 3.32Å; L11-L15 WeakPolarHBondContact O-CB 3.49Å; L11-L15 PolarHBondContact O-N 3.01Å
12	F	80.8	Confident	69.1	Low	120 Å²	120	113.2 Å²	113.2	53%	0.526	57%	0.572	S	S	.	*	H	α-helix	trans	-65.4	-45.5	175.9	-177.8	-97.9	0	0	0	111.9	L8 R9 Q14 L15 M16	L8-F12 WeakPolarHBondContact O-CB 3.39Å; L8-F12 PolarHBondContact O-N 2.74Å; R9-F12 PolarHBondContact O-N 2.9Å; F12-Q14 VanDerWaalsContact C-N 3.29Å; F12-Q14 PolarHBondContact O-N 3.18Å; F12-L15 PolarHBondContact O-N 2.85Å; F12-M16 HydrophobicContact CD1-CG 4.11Å; F12-M16 HydrophobicContact CE1-CG 3.72Å; F12-M16 HydrophobicContact CE1-SD 4.47Å; F12-M16 HydrophobicContact CE2-CG 4.36Å; F12-M16 HydrophobicContact CZ-CG 3.85Å; F12-M16 HydrophobicContact CZ-SD 4.05Å; F12-M16 WeakPolarHBondContact O-CB 3.5Å; F12-M16 WeakPolarHBondContact O-CG 3.19Å; F12-M16 PolarHBondContact O-N 2.89Å
13	D	81.2	Confident	69.5	Low	58 Å²	58	109.9 Å²	109.9	31%	0.31	57%	0.566	S	S	.	*	H	α-helix	trans	-65.1	-34.2	177.7	-71.2	-16.1	0	0	0	111.6	R9 N10 R17	R9-D13 WeakPolarHBondContact O-CB 3.44Å; R9-D13 PolarHBondContact O-N 3.31Å; N10-D13 PolarHBondContact O-N 3.16Å; D13-R17 VanDerWaalsContact O-CG 3.32Å; D13-R17 WeakPolarHBondContact O-CG 3.24Å; D13-R17 PolarHBondContact O-N 3.42Å
14	Q	78.1	Confident	69.8	Low	111 Å²	111	111.7 Å²	111.7	52%	0.519	57%	0.567	S	S	.	*	H	α-helix	trans	-69.4	-39	174.3	-172.6	166.8	-0.6	0	0	112	N10 L11 F12 R17 Q18	N10-Q14 VanDerWaalsContact O-CB 3.28Å; N10-Q14 WeakPolarHBondContact O-CB 3.42Å; N10-Q14 PolarHBondContact O-N 2.99Å; L11-Q14 PolarHBondContact O-N 3.26Å; F12-Q14 VanDerWaalsContact C-N 3.29Å; F12-Q14 PolarHBondContact O-N 3.18Å; Q14-R17 PolarHBondContact O-N 3.24Å; Q14-Q18 WeakPolarHBondContact O-CB 3.31Å; Q14-Q18 WeakPolarHBondContact O-CG 3.2Å; Q14-Q18 PolarHBondContact O-N 3.31Å
15	L	80.1	Confident	70.1	Confident	112 Å²	112	111 Å²	111	59%	0.586	57%	0.565	S	S	*	*	H	α-helix	trans	-69.3	-37.6	176.9	-158.8	147.2	0	0	0	111.3	L11 F12 Q18 A19	L11-L15 VanDerWaalsContact O-CB 3.32Å; L11-L15 WeakPolarHBondContact O-CB 3.49Å; L11-L15 PolarHBondContact O-N 3.01Å; F12-L15 PolarHBondContact O-N 2.85Å; L15-Q18 PolarHBondContact O-N 2.84Å; L15-A19 VanDerWaalsContact O-CB 3.29Å; L15-A19 WeakPolarHBondContact O-CB 3.42Å; L15-A19 PolarHBondContact O-N 3.45Å
16	M	77.6	Confident	70.6	Confident	84 Å²	84	109.3 Å²	109.3	41%	0.414	56%	0.559	S	S	.	*	H	α-helix	trans	-65.7	-41.9	173.7	-72.9	-61.3	-63.4	0	0	112.4	F12 Q18 A19 E20	F12-M16 HydrophobicContact CD1-CG 4.11Å; F12-M16 HydrophobicContact CE1-CG 3.72Å; F12-M16 HydrophobicContact CE1-SD 4.47Å; F12-M16 HydrophobicContact CE2-CG 4.36Å; F12-M16 HydrophobicContact CZ-CG 3.85Å; F12-M16 HydrophobicContact CZ-SD 4.05Å; F12-M16 WeakPolarHBondContact O-CB 3.5Å; F12-M16 WeakPolarHBondContact O-CG 3.19Å; F12-M16 PolarHBondContact O-N 2.89Å; M16-Q18 PolarHBondContact O-N 3.3Å; M16-A19 PolarHBondContact O-N 2.9Å; M16-E20 PolarHBondContact O-N 3.49Å
17	R	72.9	Confident	71.4	Confident	174 Å²	174	110.7 Å²	110.7	66%	0.657	56%	0.562	S	S	*	*	H	α-helix	trans	-64	-39.4	173.7	-72.6	179.6	-149.3	-169.8	5.3	112.5	D13 Q14 E20 V21	D13-R17 VanDerWaalsContact O-CG 3.32Å; D13-R17 WeakPolarHBondContact O-CG 3.24Å; D13-R17 PolarHBondContact O-N 3.42Å; Q14-R17 PolarHBondContact O-N 3.24Å; R17-E20 PolarHBondContact O-N 3.33Å; R17-V21 WeakPolarHBondContact O-CG2 3.04Å; R17-V21 PolarHBondContact O-N 3.23Å; R17-V21 VanDerWaalsContact O-N 3.14Å
18	Q	70.1	Confident	71.8	Confident	115 Å²	115	113.9 Å²	113.9	54%	0.537	57%	0.567	S	S	.	*	H	α-helix	trans	-69.1	-36.1	176.1	-74.1	180	-18	0	0	111.8	Q14 L15 M16 L22	Q14-Q18 WeakPolarHBondContact O-CB 3.31Å; Q14-Q18 WeakPolarHBondContact O-CG 3.2Å; Q14-Q18 PolarHBondContact O-N 3.31Å; L15-Q18 PolarHBondContact O-N 2.84Å; M16-Q18 PolarHBondContact O-N 3.3Å; Q18-L22 VanDerWaalsContact O-CG 3.28Å; Q18-L22 WeakPolarHBondContact O-CG 3.33Å; Q18-L22 PolarHBondContact O-N 3.12Å; Q18-L22 VanDerWaalsContact O-N 3.11Å
19	A	69.6	Low	72.1	Confident	42 Å²	42	114.1 Å²	114.1	35%	0.347	57%	0.565	S	S	.	*	H	α-helix	trans	-67.8	-37.9	173.2	0	0	0	0	0	112.2	L15 M16 L22 S23	L15-A19 VanDerWaalsContact O-CB 3.29Å; L15-A19 WeakPolarHBondContact O-CB 3.42Å; L15-A19 PolarHBondContact O-N 3.45Å; M16-A19 PolarHBondContact O-N 2.9Å; A19-L22 CarbonylContact O-C 3.57Å; A19-L22 PolarHBondContact O-N 3.39Å; A19-S23 VanDerWaalsContact O-CB 3.25Å; A19-S23 WeakPolarHBondContact O-CB 3.31Å; A19-S23 PolarHBondContact O-N 3.07Å; A19-S23 PolarHBondContact O-OG 2.93Å
20	E	64.1	Low	72.4	Confident	112 Å²	112	113.1 Å²	113.1	52%	0.523	57%	0.566	S	S	.	*	H	α-helix	trans	-60.3	-47.6	173.8	-84.5	175.6	164.5	0	0	111.4	M16 R17 L22 S23 E24	M16-E20 PolarHBondContact O-N 3.49Å; R17-E20 PolarHBondContact O-N 3.33Å; E20-L22 VanDerWaalsContact C-N 3.29Å; E20-L22 PolarHBondContact O-N 3.1Å; E20-S23 VanDerWaalsContact CA-OG 3.31Å; E20-S23 WeakPolarHBondContact CA-OG 3.26Å; E20-S23 CarbonylContact O-C 3.6Å; E20-S23 PolarHBondContact O-N 3.23Å; E20-S23 PolarHBondContact O-OG 3.06Å; E20-E24 WeakPolarHBondContact O-CG 3.49Å; E20-E24 PolarHBondContact O-N 3.32Å
21	V	64	Low	72.8	Confident	100 Å²	100	112.1 Å²	112.1	61%	0.606	56%	0.559	S	S	*	*	H	α-helix	trans	-62	-35.5	176.1	172.8	0	0	0	0	112.4	R17	R17-V21 WeakPolarHBondContact O-CG2 3.04Å; R17-V21 PolarHBondContact O-N 3.23Å; R17-V21 VanDerWaalsContact O-N 3.14Å
22	L	61.2	Low	73.1	Confident	147 Å²	147	110.5 Å²	110.5	77%	0.77	55%	0.549	S	S	*	.	H	α-helix	trans	-75.2	-28	174.9	-70.3	168.5	0	0	0	112.3	Q18 A19 E20	Q18-L22 VanDerWaalsContact O-CG 3.28Å; Q18-L22 WeakPolarHBondContact O-CG 3.33Å; Q18-L22 PolarHBondContact O-N 3.12Å; Q18-L22 VanDerWaalsContact O-N 3.11Å; A19-L22 CarbonylContact O-C 3.57Å; A19-L22 PolarHBondContact O-N 3.39Å; E20-L22 VanDerWaalsContact C-N 3.29Å; E20-L22 PolarHBondContact O-N 3.1Å
23	S	60.6	Low	73.5	Confident	92 Å²	92	108.8 Å²	108.8	64%	0.643	55%	0.545	S	S	*	.	H	α-helix	trans	-82.9	-26	179.3	74.3	0	0	0	0	113.8	A19 E20 G25	A19-S23 VanDerWaalsContact O-CB 3.25Å; A19-S23 WeakPolarHBondContact O-CB 3.31Å; A19-S23 PolarHBondContact O-N 3.07Å; A19-S23 PolarHBondContact O-OG 2.93Å; E20-S23 VanDerWaalsContact CA-OG 3.31Å; E20-S23 WeakPolarHBondContact CA-OG 3.26Å; E20-S23 CarbonylContact O-C 3.6Å; E20-S23 PolarHBondContact O-N 3.23Å; E20-S23 PolarHBondContact O-OG 3.06Å; S23-G25 PolarHBondContact O-N 3.09Å
24	E	61.1	Low	73.9	Confident	155 Å²	155	108.4 Å²	108.4	72%	0.724	55%	0.55	S	S	*	.	S	Bend	trans	-73.6	-9.8	179.8	-81.9	-173.5	165.8	0	0	113.9	E20	E20-E24 WeakPolarHBondContact O-CG 3.49Å; E20-E24 PolarHBondContact O-N 3.32Å
25	G	62.2	Low	74.5	Confident	42 Å²	42	108.7 Å²	108.7	43%	0.433	55%	0.549	S	S	.	.			trans	48.6	100.1	166.6	0	0	0	0	0	115.1	S23 E27	S23-G25 PolarHBondContact O-N 3.09Å; G25-E27 PolarHBondContact O-N 2.78Å
26	N	68.7	Low	75.1	Confident	111 Å²	111	106.2 Å²	106.2	59%	0.594	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	15.9	176.6	-65.2	-29.2	0	0	0	114.8	Y28 Q29 F30	N26-Y28 VanDerWaalsContact C-N 3.3Å; N26-Y28 PolarHBondContact O-N 3.3Å; N26-Q29 WeakPolarHBondContact O-CB 3.36Å; N26-Q29 PolarHBondContact O-N 3.45Å; N26-Q29 VanDerWaalsContact O-N 3.08Å; N26-F30 PolarHBondContact O-N 2.8Å
27	E	77.4	Confident	75.8	Confident	144 Å²	144	108.7 Å²	108.7	67%	0.673	55%	0.545	S	S	*	.	H	α-helix	trans	-56.9	-41.3	-177.3	-172	172.9	-170.8	0	0	111.8	G25 Q29 F30 I31	G25-E27 PolarHBondContact O-N 2.78Å; E27-Q29 VanDerWaalsContact C-N 3.33Å; E27-Q29 PolarHBondContact O-N 3.4Å; E27-F30 PolarHBondContact O-N 3.21Å; E27-I31 HydrophobicContact CG-CD1 3.92Å; E27-I31 HydrophobicContact CG-CG1 4.48Å; E27-I31 WeakPolarHBondContact O-CB 3.48Å; E27-I31 VanDerWaalsContact O-CG1 3.26Å; E27-I31 WeakPolarHBondContact O-CG1 3.44Å; E27-I31 PolarHBondContact O-N 3.36Å
28	Y	77.3	Confident	76.8	Confident	175 Å²	175	105.1 Å²	105.1	69%	0.686	54%	0.536	S	S	*	.	H	α-helix	trans	-60.9	-41.3	176.2	-179.2	-99.3	0	0	0	112.5	N26 I31 Q32	N26-Y28 VanDerWaalsContact C-N 3.3Å; N26-Y28 PolarHBondContact O-N 3.3Å; Y28-I31 PolarHBondContact O-N 2.66Å; Y28-Q32 WeakPolarHBondContact O-CB 3.25Å; Y28-Q32 PolarHBondContact O-N 2.97Å
29	Q	78.4	Confident	78	Confident	128 Å²	128	104.1 Å²	104.1	60%	0.598	53%	0.532	S	S	*	.	H	α-helix	trans	-68.4	-38.1	178.5	-61.8	179	0.3	0	0	111.3	N26 E27 Q32 L33	N26-Q29 WeakPolarHBondContact O-CB 3.36Å; N26-Q29 PolarHBondContact O-N 3.45Å; N26-Q29 VanDerWaalsContact O-N 3.08Å; E27-Q29 VanDerWaalsContact C-N 3.33Å; E27-Q29 PolarHBondContact O-N 3.4Å; Q29-Q32 PolarHBondContact O-N 2.79Å; Q29-L33 WeakPolarHBondContact O-CB 3.46Å; Q29-L33 PolarHBondContact O-N 3.37Å
30	F	83.3	Confident	79.2	Confident	151 Å²	151	108.5 Å²	108.5	66%	0.662	54%	0.543	S	S	*	.	H	α-helix	trans	-67.6	-41.5	175.9	-167.9	-96	0	0	0	112.1	N26 E27 Q32 L33 A34	N26-F30 PolarHBondContact O-N 2.8Å; E27-F30 PolarHBondContact O-N 3.21Å; F30-Q32 VanDerWaalsContact C-N 3.32Å; F30-Q32 PolarHBondContact O-N 2.88Å; F30-L33 PolarHBondContact O-N 2.87Å; F30-A34 WeakPolarHBondContact O-CB 3.38Å; F30-A34 PolarHBondContact O-N 3.43Å
31	I	82.9	Confident	80.7	Confident	71 Å²	71	112.2 Å²	112.2	36%	0.364	55%	0.552	S	S	.	*	H	α-helix	trans	-61.2	-42.9	173.5	-70	167.3	0	0	0	110.4	E27 Y28 A34 K35	E27-I31 HydrophobicContact CG-CD1 3.92Å; E27-I31 HydrophobicContact CG-CG1 4.48Å; E27-I31 WeakPolarHBondContact O-CB 3.48Å; E27-I31 VanDerWaalsContact O-CG1 3.26Å; E27-I31 WeakPolarHBondContact O-CG1 3.44Å; E27-I31 PolarHBondContact O-N 3.36Å; Y28-I31 PolarHBondContact O-N 2.66Å; I31-A34 PolarHBondContact O-N 2.92Å; I31-K35 HydrophobicContact CG2-CD 4.21Å; I31-K35 WeakPolarHBondContact O-CG 3.48Å; I31-K35 PolarHBondContact O-N 3.06Å
32	Q	83.7	Confident	82.2	Confident	76 Å²	76	114.7 Å²	114.7	36%	0.355	55%	0.551	S	S	.	*	H	α-helix	trans	-64.2	-41.5	177.4	-170.9	61.8	25.1	0	0	111.7	Y28 Q29 F30 K35 N36	Y28-Q32 WeakPolarHBondContact O-CB 3.25Å; Y28-Q32 PolarHBondContact O-N 2.97Å; Q29-Q32 PolarHBondContact O-N 2.79Å; F30-Q32 VanDerWaalsContact C-N 3.32Å; F30-Q32 PolarHBondContact O-N 2.88Å; Q32-K35 PolarHBondContact O-N 3.15Å; Q32-N36 PolarHBondContact NE2-OD1 2.92Å; Q32-N36 PolarHBondContact O-N 3.33Å; Q32-N36 PolarHBondContact O-ND2 2.81Å; Q32-N36 PolarHBondContact O-OD1 3.12Å
33	L	88.3	Confident	83.8	Confident	84 Å²	84	112.8 Å²	112.8	44%	0.44	54%	0.536	S	S	.	.	H	α-helix	trans	-61.7	-45	175	-178.2	65.4	0	0	0	111.7	Q29 F30 K35 N36 F37	Q29-L33 WeakPolarHBondContact O-CB 3.46Å; Q29-L33 PolarHBondContact O-N 3.37Å; F30-L33 PolarHBondContact O-N 2.87Å; L33-K35 PolarHBondContact O-N 3.43Å; L33-N36 PolarHBondContact O-N 2.94Å; L33-F37 HydrophobicContact CD1-CD2 4.02Å; L33-F37 HydrophobicContact CD1-CE2 3.53Å; L33-F37 HydrophobicContact CD1-CZ 4.27Å; L33-F37 HydrophobicContact CD2-CE2 4.01Å; L33-F37 HydrophobicContact CG-CD2 3.83Å; L33-F37 HydrophobicContact CG-CE2 3.53Å; L33-F37 WeakPolarHBondContact O-CD2 2.96Å; L33-F37 PolarHBondContact O-N 3.01Å
34	A	89.8	Confident	85.5	Confident	50 Å²	50	117.1 Å²	117.1	41%	0.413	54%	0.538	S	S	.	.	H	α-helix	trans	-61.9	-43.1	177.3	0	0	0	0	0	112.2	F30 I31 N36 F37 E38	F30-A34 WeakPolarHBondContact O-CB 3.38Å; F30-A34 PolarHBondContact O-N 3.43Å; I31-A34 PolarHBondContact O-N 2.92Å; A34-N36 VanDerWaalsContact C-N 3.34Å; A34-N36 PolarHBondContact O-N 3.41Å; A34-F37 PolarHBondContact O-N 3.21Å; A34-E38 PolarHBondContact O-N 3.12Å
35	K	90.3	Very high	87.2	Confident	118 Å²	118	115.7 Å²	115.7	51%	0.513	53%	0.532	S	S	.	.	H	α-helix	trans	-60.2	-43.5	174.1	-74.6	174.9	179.8	175.6	0	111.9	I31 Q32 L33 E38 E39	I31-K35 HydrophobicContact CG2-CD 4.21Å; I31-K35 WeakPolarHBondContact O-CG 3.48Å; I31-K35 PolarHBondContact O-N 3.06Å; Q32-K35 PolarHBondContact O-N 3.15Å; L33-K35 PolarHBondContact O-N 3.43Å; K35-E38 PolarHBondContact O-N 2.76Å; K35-E39 PolarHBondContact O-N 3.35Å
36	N	92.8	Very high	88.8	Confident	59 Å²	59	120.2 Å²	120.2	32%	0.316	54%	0.539	S	S	.	.	H	α-helix	trans	-62.8	-44.8	177.2	-68.9	-11	0	0	0	111.2	Q32 L33 A34 E38 E39 F40	Q32-N36 PolarHBondContact NE2-OD1 2.92Å; Q32-N36 PolarHBondContact O-N 3.33Å; Q32-N36 PolarHBondContact O-ND2 2.81Å; Q32-N36 PolarHBondContact O-OD1 3.12Å; L33-N36 PolarHBondContact O-N 2.94Å; A34-N36 VanDerWaalsContact C-N 3.34Å; A34-N36 PolarHBondContact O-N 3.41Å; N36-E38 VanDerWaalsContact C-N 3.31Å; N36-E38 PolarHBondContact O-N 3.04Å; N36-E39 PolarHBondContact O-N 3Å; N36-F40 HydrophobicContact CB-CE2 4.38Å; N36-F40 WeakPolarHBondContact O-CD2 3.4Å; N36-F40 PolarHBondContact O-N 3.17Å
37	F	94	Very high	90	Very high	136 Å²	136	118.5 Å²	118.5	60%	0.596	53%	0.533	S	S	*	.	H	α-helix	trans	-60.1	-40.2	175.9	-83.7	-62.7	0	0	0	112.6	L33 A34 F40 R41	L33-F37 HydrophobicContact CD1-CD2 4.02Å; L33-F37 HydrophobicContact CD1-CE2 3.53Å; L33-F37 HydrophobicContact CD1-CZ 4.27Å; L33-F37 HydrophobicContact CD2-CE2 4.01Å; L33-F37 HydrophobicContact CG-CD2 3.83Å; L33-F37 HydrophobicContact CG-CE2 3.53Å; L33-F37 WeakPolarHBondContact O-CD2 2.96Å; L33-F37 PolarHBondContact O-N 3.01Å; A34-F37 PolarHBondContact O-N 3.21Å; F37-F40 PolarHBondContact O-N 3.25Å; F37-R41 WeakPolarHBondContact O-CB 3.17Å; F37-R41 PolarHBondContact O-N 2.76Å
38	E	93.8	Very high	90.9	Very high	100 Å²	100	117.3 Å²	117.3	47%	0.467	53%	0.528	S	S	.	.	H	α-helix	trans	-66.1	-39.6	176.5	-160.3	-175.5	151.2	0	0	111.8	A34 K35 N36 R41 R42	A34-E38 PolarHBondContact O-N 3.12Å; K35-E38 PolarHBondContact O-N 2.76Å; N36-E38 VanDerWaalsContact C-N 3.31Å; N36-E38 PolarHBondContact O-N 3.04Å; E38-R41 PolarHBondContact O-N 3.34Å; E38-R42 WeakPolarHBondContact O-CG 3.24Å; E38-R42 PolarHBondContact O-N 2.86Å; E38-R42 IonicContact OE1-CZ 2.73Å; E38-R42 IonicContact OE1-NE 3.73Å; E38-R42 IonicContact OE1-NH2 3.55Å; E38-R42 PolarHBondContact OE1-NH2 3.13Å
39	E	94.1	Very high	91.8	Very high	94 Å²	94	114.4 Å²	114.4	44%	0.439	52%	0.52	S	S	.	.	H	α-helix	trans	-63.3	-44.6	174.4	-164.1	-171.3	154.1	0	0	111.8	K35 N36 R41 R42 K43	K35-E39 PolarHBondContact O-N 3.35Å; N36-E39 PolarHBondContact O-N 3Å; E39-R41 VanDerWaalsContact C-N 3.34Å; E39-R41 PolarHBondContact O-N 3.27Å; E39-R42 PolarHBondContact O-N 3.23Å; E39-K43 WeakPolarHBondContact O-CG 3.45Å; E39-K43 PolarHBondContact O-N 2.91Å; E39-K43 WeakPolarHBondContact OE1-CE 3.44Å; E39-K43 IonicContact OE1-NZ 2.62Å; E39-K43 PolarHBondContact OE1-NZ 2.97Å
40	F	95.1	Very high	92.7	Very high	133 Å²	133	112 Å²	112	58%	0.583	51%	0.509	S	S	*	.	H	α-helix	trans	-61.8	-41.8	175.2	-77.1	-62.6	0	0	0	112	N36 F37 R42 K43 W44	N36-F40 HydrophobicContact CB-CE2 4.38Å; N36-F40 WeakPolarHBondContact O-CD2 3.4Å; N36-F40 PolarHBondContact O-N 3.17Å; F37-F40 PolarHBondContact O-N 3.25Å; F40-R42 VanDerWaalsContact C-N 3.35Å; F40-R42 PolarHBondContact O-N 3.24Å; F40-K43 PolarHBondContact O-N 3.24Å; F40-W44 WeakPolarHBondContact O-CB 3.47Å; F40-W44 PolarHBondContact O-N 3.17Å
41	R	96.4	Very high	93.3	Very high	190 Å²	190	109.1 Å²	109.1	72%	0.717	50%	0.5	S	S	*	.	H	α-helix	trans	-60.4	-43.3	175.5	-175.3	-177.3	176.9	-174.1	0.4	111.7	F37 E38 E39 W44 Q45	F37-R41 WeakPolarHBondContact O-CB 3.17Å; F37-R41 PolarHBondContact O-N 2.76Å; E38-R41 PolarHBondContact O-N 3.34Å; E39-R41 VanDerWaalsContact C-N 3.34Å; E39-R41 PolarHBondContact O-N 3.27Å; R41-W44 PolarHBondContact O-N 3.3Å; R41-Q45 WeakPolarHBondContact O-CB 3.13Å; R41-Q45 PolarHBondContact O-N 2.88Å
42	R	95.5	Very high	94	Very high	153 Å²	153	107.8 Å²	107.8	58%	0.577	50%	0.499	S	S	*	.	H	α-helix	trans	-64.5	-42.2	176.3	-70.8	-177.1	-147.9	164.8	5.3	111.9	E38 E39 F40 Q45 K46	E38-R42 WeakPolarHBondContact O-CG 3.24Å; E38-R42 PolarHBondContact O-N 2.86Å; E38-R42 IonicContact OE1-CZ 2.73Å; E38-R42 IonicContact OE1-NE 3.73Å; E38-R42 IonicContact OE1-NH2 3.55Å; E38-R42 PolarHBondContact OE1-NH2 3.13Å; E39-R42 PolarHBondContact O-N 3.23Å; F40-R42 VanDerWaalsContact C-N 3.35Å; F40-R42 PolarHBondContact O-N 3.24Å; R42-Q45 PolarHBondContact O-N 3.48Å; R42-K46 WeakPolarHBondContact O-CB 3.22Å; R42-K46 PolarHBondContact O-N 3.03Å
43	K	95.3	Very high	94.6	Very high	107 Å²	107	110 Å²	110	47%	0.465	51%	0.508	S	S	.	.	H	α-helix	trans	-60.6	-46.2	175.1	-73.7	176.2	-175.9	166.8	0	110.9	E39 F40 Q45 K46 T47	E39-K43 WeakPolarHBondContact O-CG 3.45Å; E39-K43 PolarHBondContact O-N 2.91Å; E39-K43 WeakPolarHBondContact OE1-CE 3.44Å; E39-K43 IonicContact OE1-NZ 2.62Å; E39-K43 PolarHBondContact OE1-NZ 2.97Å; F40-K43 PolarHBondContact O-N 3.24Å; K43-Q45 PolarHBondContact O-N 3.29Å; K43-K46 WeakPolarHBondContact O-CB 3.45Å; K43-K46 PolarHBondContact O-N 3.37Å; K43-T47 WeakPolarHBondContact O-CG2 3.25Å; K43-T47 PolarHBondContact O-N 3.01Å; K43-T47 PolarHBondContact O-OG1 3.37Å
44	W	96.1	Very high	94.9	Very high	182 Å²	182	113.8 Å²	113.8	69%	0.689	52%	0.517	S	S	*	.	H	α-helix	trans	-57.8	-48.9	176.5	-175.7	-87.8	0	0	0	112.1	F40 R41 K46 T47 E48	F40-W44 WeakPolarHBondContact O-CB 3.47Å; F40-W44 PolarHBondContact O-N 3.17Å; R41-W44 PolarHBondContact O-N 3.3Å; W44-K46 VanDerWaalsContact C-N 3.29Å; W44-K46 PolarHBondContact O-N 3.44Å; W44-T47 WeakPolarHBondContact CA-OG1 3.43Å; W44-T47 PolarHBondContact O-N 3.46Å; W44-T47 PolarHBondContact O-OG1 3.31Å; W44-E48 WeakPolarHBondContact O-CB 3.35Å; W44-E48 PolarHBondContact O-N 3.31Å
45	Q	96.7	Very high	95.3	Very high	126 Å²	126	117.3 Å²	117.3	59%	0.589	52%	0.524	S	S	*	.	H	α-helix	trans	-62.3	-37.9	178.9	-169.6	177.6	10.7	0	0	112	R41 R42 K43 E48 H49	R41-Q45 WeakPolarHBondContact O-CB 3.13Å; R41-Q45 PolarHBondContact O-N 2.88Å; R42-Q45 PolarHBondContact O-N 3.48Å; K43-Q45 PolarHBondContact O-N 3.29Å; Q45-E48 PolarHBondContact O-N 3.37Å; Q45-H49 WeakPolarHBondContact O-CB 3.4Å; Q45-H49 PolarHBondContact O-N 3.41Å
46	K	95.4	Very high	95.6	Very high	136 Å²	136	116.5 Å²	116.5	59%	0.591	53%	0.525	S	S	*	.	H	α-helix	trans	-64.1	-45.8	174.5	-172.3	-179.1	176.1	-172.1	0	111.3	R42 K43 W44 E48 H49 E50	R42-K46 WeakPolarHBondContact O-CB 3.22Å; R42-K46 PolarHBondContact O-N 3.03Å; K43-K46 WeakPolarHBondContact O-CB 3.45Å; K43-K46 PolarHBondContact O-N 3.37Å; W44-K46 VanDerWaalsContact C-N 3.29Å; W44-K46 PolarHBondContact O-N 3.44Å; K46-E48 VanDerWaalsContact C-N 3.33Å; K46-E48 PolarHBondContact O-N 3.04Å; K46-H49 PolarHBondContact O-N 3.47Å; K46-E50 VanDerWaalsContact CE-OE1 3.23Å; K46-E50 WeakPolarHBondContact CE-OE1 3.4Å; K46-E50 WeakPolarHBondContact O-CG 3.45Å; K46-E50 PolarHBondContact O-N 3.48Å
47	T	92.7	Very high	95.8	Very high	75 Å²	75	118.4 Å²	118.4	46%	0.46	54%	0.535	S	S	.	.	H	α-helix	trans	-64.7	-37.1	177.9	50.2	0	0	0	0	112.4	K43 W44 H49 E50 L51	K43-T47 WeakPolarHBondContact O-CG2 3.25Å; K43-T47 PolarHBondContact O-N 3.01Å; K43-T47 PolarHBondContact O-OG1 3.37Å; W44-T47 WeakPolarHBondContact CA-OG1 3.43Å; W44-T47 PolarHBondContact O-N 3.46Å; W44-T47 PolarHBondContact O-OG1 3.31Å; T47-H49 VanDerWaalsContact C-N 3.34Å; T47-E50 PolarHBondContact O-N 3.28Å; T47-L51 VanDerWaalsContact O-CB 3.31Å; T47-L51 WeakPolarHBondContact O-CB 3.44Å; T47-L51 PolarHBondContact O-N 2.87Å
48	E	97.4	Very high	95.9	Very high	119 Å²	119	116.4 Å²	116.4	56%	0.556	53%	0.53	S	S	*	.	H	α-helix	trans	-64.7	-40.7	176	-170.6	176.6	-172.3	0	0	111.4	W44 Q45 K46 L51 A52	W44-E48 WeakPolarHBondContact O-CB 3.35Å; W44-E48 PolarHBondContact O-N 3.31Å; Q45-E48 PolarHBondContact O-N 3.37Å; K46-E48 VanDerWaalsContact C-N 3.33Å; K46-E48 PolarHBondContact O-N 3.04Å; E48-L51 PolarHBondContact O-N 3.46Å; E48-A52 PolarHBondContact O-N 3.46Å
49	H	96.9	Very high	96.1	Very high	114 Å²	114	116.6 Å²	116.6	53%	0.528	53%	0.532	S	S	.	.	H	α-helix	trans	-68.8	-37.3	176	-164.5	72.3	0	0	0	112.7	Q45 K46 T47 A52 K53	Q45-H49 WeakPolarHBondContact O-CB 3.4Å; Q45-H49 PolarHBondContact O-N 3.41Å; K46-H49 PolarHBondContact O-N 3.47Å; T47-H49 VanDerWaalsContact C-N 3.34Å; H49-A52 PolarHBondContact O-N 3Å; H49-K53 VanDerWaalsContact CD2-CE 3.45Å; H49-K53 WeakPolarHBondContact CD2-CE 3.31Å; H49-K53 VanDerWaalsContact NE2-CE 3.26Å; H49-K53 WeakPolarHBondContact NE2-CE 3.34Å; H49-K53 WeakPolarHBondContact O-CG 3.37Å; H49-K53 PolarHBondContact O-N 2.85Å; H49-K53 VanDerWaalsContact O-N 3.12Å
50	E	96.9	Very high	96.2	Very high	77 Å²	77	118 Å²	118	36%	0.36	54%	0.537	S	S	.	.	H	α-helix	trans	-65	-42.4	172.2	-74.1	174.1	-176.5	0	0	111.4	K46 T47 A52 K53 Y54	K46-E50 VanDerWaalsContact CE-OE1 3.23Å; K46-E50 WeakPolarHBondContact CE-OE1 3.4Å; K46-E50 WeakPolarHBondContact O-CG 3.45Å; K46-E50 PolarHBondContact O-N 3.48Å; T47-E50 PolarHBondContact O-N 3.28Å; E50-A52 VanDerWaalsContact C-N 3.35Å; E50-A52 PolarHBondContact O-N 2.65Å; E50-K53 WeakPolarHBondContact O-CB 3.46Å; E50-K53 PolarHBondContact O-N 3.39Å; E50-Y54 HydrophobicContact CB-CE2 4.34Å; E50-Y54 WeakPolarHBondContact O-CD2 3.19Å; E50-Y54 PolarHBondContact O-N 2.96Å
51	L	95.6	Very high	96.1	Very high	91 Å²	91	114.8 Å²	114.8	48%	0.476	53%	0.528	S	S	.	.	H	α-helix	trans	-61.5	-42.6	176.2	-167.1	162.7	0	0	0	111.4	T47 E48 K53 Y54 K55	T47-L51 VanDerWaalsContact O-CB 3.31Å; T47-L51 WeakPolarHBondContact O-CB 3.44Å; T47-L51 PolarHBondContact O-N 2.87Å; E48-L51 PolarHBondContact O-N 3.46Å; L51-K53 PolarHBondContact O-N 3.5Å; L51-Y54 PolarHBondContact O-N 3Å; L51-K55 HydrophobicContact CD2-CD 3.63Å; L51-K55 HydrophobicContact CD2-CG 4.05Å; L51-K55 PolarHBondContact O-N 2.91Å
52	A	97.4	Very high	96.1	Very high	43 Å²	43	110.2 Å²	110.2	36%	0.355	52%	0.515	S	S	.	.	H	α-helix	trans	-59.2	-45.8	173.8	0	0	0	0	0	111.9	E48 H49 E50 Y54 K55 D56	E48-A52 PolarHBondContact O-N 3.46Å; H49-A52 PolarHBondContact O-N 3Å; E50-A52 VanDerWaalsContact C-N 3.35Å; E50-A52 PolarHBondContact O-N 2.65Å; A52-Y54 VanDerWaalsContact C-N 3.33Å; A52-Y54 PolarHBondContact O-N 3.24Å; A52-K55 WeakPolarHBondContact O-CB 3.43Å; A52-K55 PolarHBondContact O-N 2.96Å; A52-D56 PolarHBondContact O-N 3.22Å
53	K	97	Very high	96.2	Very high	123 Å²	123	107 Å²	107	54%	0.535	51%	0.512	S	S	.	.	H	α-helix	trans	-59.9	-41.7	175.8	-72.7	175.3	-179.8	174.6	0	112.7	H49 E50 L51 D56 L57	H49-K53 VanDerWaalsContact CD2-CE 3.45Å; H49-K53 WeakPolarHBondContact CD2-CE 3.31Å; H49-K53 VanDerWaalsContact NE2-CE 3.26Å; H49-K53 WeakPolarHBondContact NE2-CE 3.34Å; H49-K53 WeakPolarHBondContact O-CG 3.37Å; H49-K53 PolarHBondContact O-N 2.85Å; H49-K53 VanDerWaalsContact O-N 3.12Å; E50-K53 WeakPolarHBondContact O-CB 3.46Å; E50-K53 PolarHBondContact O-N 3.39Å; L51-K53 PolarHBondContact O-N 3.5Å; K53-D56 PolarHBondContact O-N 3.16Å; K53-L57 WeakPolarHBondContact O-CB 3.41Å; K53-L57 PolarHBondContact O-N 3.46Å
54	Y	94.1	Very high	96.2	Very high	163 Å²	163	106.7 Å²	106.7	64%	0.639	51%	0.512	S	S	*	.	H	α-helix	trans	-68.1	-35.7	177.6	-72	-57.6	0	0	0	112.5	E50 L51 A52 L57 L58	E50-Y54 HydrophobicContact CB-CE2 4.34Å; E50-Y54 WeakPolarHBondContact O-CD2 3.19Å; E50-Y54 PolarHBondContact O-N 2.96Å; L51-Y54 PolarHBondContact O-N 3Å; A52-Y54 VanDerWaalsContact C-N 3.33Å; A52-Y54 PolarHBondContact O-N 3.24Å; Y54-L57 PolarHBondContact O-N 3.07Å; Y54-L58 WeakPolarHBondContact O-CB 3.18Å; Y54-L58 PolarHBondContact O-N 3.45Å
55	K	97.3	Very high	96.2	Very high	125 Å²	125	106 Å²	106	54%	0.543	51%	0.509	S	S	.	.	H	α-helix	trans	-62.6	-44.2	172.7	-78.9	177.9	170.5	171	0	112.1	L51 A52 L57 L58 M59	L51-K55 HydrophobicContact CD2-CD 3.63Å; L51-K55 HydrophobicContact CD2-CG 4.05Å; L51-K55 PolarHBondContact O-N 2.91Å; A52-K55 WeakPolarHBondContact O-CB 3.43Å; A52-K55 PolarHBondContact O-N 2.96Å; K55-L57 VanDerWaalsContact C-N 3.35Å; K55-L58 PolarHBondContact O-N 3.23Å; K55-M59 WeakPolarHBondContact O-CG 3.37Å; K55-M59 PolarHBondContact O-N 3.43Å
56	D	97.3	Very high	96.2	Very high	101 Å²	101	103 Å²	103	54%	0.54	50%	0.502	S	S	.	.	H	α-helix	trans	-64.6	-41.3	177.7	-70.1	-17.6	0	0	0	111.7	A52 K53 M59 K60	A52-D56 PolarHBondContact O-N 3.22Å; K53-D56 PolarHBondContact O-N 3.16Å; D56-M59 PolarHBondContact O-N 3.06Å; D56-M59 WeakPolarHBondContact OD1-CE 3.43Å; D56-K60 WeakPolarHBondContact O-CB 3.5Å; D56-K60 PolarHBondContact O-N 2.95Å
57	L	97	Very high	96.2	Very high	99 Å²	99	98.9 Å²	98.9	52%	0.518	49%	0.494	S	S	.	.	H	α-helix	trans	-63.6	-43.1	175.7	-174.1	62.2	0	0	0	111.4	K53 Y54 K55 K60 T61	K53-L57 WeakPolarHBondContact O-CB 3.41Å; K53-L57 PolarHBondContact O-N 3.46Å; Y54-L57 PolarHBondContact O-N 3.07Å; K55-L57 VanDerWaalsContact C-N 3.35Å; L57-K60 PolarHBondContact O-N 3.01Å; L57-T61 WeakPolarHBondContact O-CG2 3.31Å; L57-T61 PolarHBondContact O-N 3.15Å; L57-T61 PolarHBondContact O-OG1 3.39Å
58	L	95.5	Very high	96.3	Very high	94 Å²	94	100.4 Å²	100.4	49%	0.492	50%	0.499	S	S	.	.	H	α-helix	trans	-58.9	-52.4	176.7	-178.3	66	0	0	0	110.7	Y54 K55 K60 T61 E62	Y54-L58 WeakPolarHBondContact O-CB 3.18Å; Y54-L58 PolarHBondContact O-N 3.45Å; K55-L58 PolarHBondContact O-N 3.23Å; L58-K60 VanDerWaalsContact C-N 3.28Å; L58-K60 PolarHBondContact O-N 3.41Å; L58-T61 WeakPolarHBondContact CA-OG1 3.46Å; L58-T61 PolarHBondContact O-N 3.49Å; L58-T61 VanDerWaalsContact O-N 3.13Å; L58-T61 PolarHBondContact O-OG1 2.95Å; L58-E62 HydrophobicContact CD1-CG 4.43Å; L58-E62 HydrophobicContact CG-CG 4.49Å; L58-E62 WeakPolarHBondContact O-CG 3.47Å; L58-E62 PolarHBondContact O-N 3.22Å
59	M	97.7	Very high	96.1	Very high	104 Å²	104	98.4 Å²	98.4	51%	0.512	49%	0.492	S	S	.	.	H	α-helix	trans	-56.3	-43.6	177.1	-73.7	-169.5	-67.5	0	0	111.7	K55 D56 T61 E62 T63	K55-M59 WeakPolarHBondContact O-CG 3.37Å; K55-M59 PolarHBondContact O-N 3.43Å; D56-M59 PolarHBondContact O-N 3.06Å; D56-M59 WeakPolarHBondContact OD1-CE 3.43Å; M59-T61 PolarHBondContact O-N 3.2Å; M59-E62 PolarHBondContact O-N 2.89Å; M59-T63 WeakPolarHBondContact O-CG2 3.11Å; M59-T63 PolarHBondContact O-N 3.33Å; M59-T63 PolarHBondContact O-OG1 2.74Å
60	K	97.3	Very high	96.1	Very high	124 Å²	124	97.7 Å²	97.7	54%	0.539	50%	0.495	S	S	.	.	H	α-helix	trans	-60.7	-48.5	177.3	-172.4	-180	176.6	-173.6	0	111.4	D56 L57 L58 E62 T63 E64	D56-K60 WeakPolarHBondContact O-CB 3.5Å; D56-K60 PolarHBondContact O-N 2.95Å; L57-K60 PolarHBondContact O-N 3.01Å; L58-K60 VanDerWaalsContact C-N 3.28Å; L58-K60 PolarHBondContact O-N 3.41Å; K60-E62 VanDerWaalsContact C-N 3.33Å; K60-E62 PolarHBondContact O-N 2.96Å; K60-T63 PolarHBondContact O-N 3.06Å; K60-T63 PolarHBondContact O-OG1 3.32Å; K60-E64 VanDerWaalsContact CE-OE1 3.26Å; K60-E64 WeakPolarHBondContact CE-OE1 3.34Å; K60-E64 WeakPolarHBondContact O-CG 3.49Å; K60-E64 PolarHBondContact O-N 2.88Å
61	T	92.5	Very high	96.1	Very high	65 Å²	65	100.8 Å²	100.8	40%	0.399	51%	0.507	S	S	.	.	H	α-helix	trans	-63.8	-36.5	178.5	56.2	0	0	0	0	112.8	L57 L58 M59 E64 R65	L57-T61 WeakPolarHBondContact O-CG2 3.31Å; L57-T61 PolarHBondContact O-N 3.15Å; L57-T61 PolarHBondContact O-OG1 3.39Å; L58-T61 WeakPolarHBondContact CA-OG1 3.46Å; L58-T61 PolarHBondContact O-N 3.49Å; L58-T61 VanDerWaalsContact O-N 3.13Å; L58-T61 PolarHBondContact O-OG1 2.95Å; M59-T61 PolarHBondContact O-N 3.2Å; T61-E64 PolarHBondContact O-N 2.74Å; T61-R65 WeakPolarHBondContact O-CB 3.48Å; T61-R65 PolarHBondContact O-N 3.29Å
62	E	96.8	Very high	96	Very high	94 Å²	94	99.9 Å²	99.9	44%	0.439	50%	0.502	S	S	.	.	H	α-helix	trans	-65	-41.3	175.8	-74.2	176.1	166.5	0	0	111.8	L58 M59 K60 R65 S66	L58-E62 HydrophobicContact CD1-CG 4.43Å; L58-E62 HydrophobicContact CG-CG 4.49Å; L58-E62 WeakPolarHBondContact O-CG 3.47Å; L58-E62 PolarHBondContact O-N 3.22Å; M59-E62 PolarHBondContact O-N 2.89Å; K60-E62 VanDerWaalsContact C-N 3.33Å; K60-E62 PolarHBondContact O-N 2.96Å; E62-R65 PolarHBondContact O-N 3.45Å; E62-S66 PolarHBondContact O-N 2.84Å
63	T	97.2	Very high	96	Very high	84 Å²	84	104.3 Å²	104.3	52%	0.515	51%	0.514	S	S	.	.	H	α-helix	trans	-64.6	-42.2	175.2	62.5	0	0	0	0	111.8	M59 K60 S66 A67	M59-T63 WeakPolarHBondContact O-CG2 3.11Å; M59-T63 PolarHBondContact O-N 3.33Å; M59-T63 PolarHBondContact O-OG1 2.74Å; K60-T63 PolarHBondContact O-N 3.06Å; K60-T63 PolarHBondContact O-OG1 3.32Å; T63-S66 PolarHBondContact O-N 3.04Å; T63-S66 PolarHBondContact O-OG 3.42Å; T63-A67 PolarHBondContact O-N 3.5Å
64	E	96.1	Very high	96	Very high	101 Å²	101	104.4 Å²	104.4	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-63.6	-42.7	176.3	-72.1	176.4	-173.2	0	0	111.6	K60 T61 S66 A67 L68	K60-E64 VanDerWaalsContact CE-OE1 3.26Å; K60-E64 WeakPolarHBondContact CE-OE1 3.34Å; K60-E64 WeakPolarHBondContact O-CG 3.49Å; K60-E64 PolarHBondContact O-N 2.88Å; T61-E64 PolarHBondContact O-N 2.74Å; E64-S66 PolarHBondContact O-N 2.81Å; E64-A67 PolarHBondContact O-N 3.49Å; E64-L68 WeakPolarHBondContact O-CG 3.34Å; E64-L68 PolarHBondContact O-N 2.83Å
65	R	95.1	Very high	95.9	Very high	167 Å²	167	99 Å²	99	63%	0.63	50%	0.504	S	S	*	.	H	α-helix	trans	-57.7	-48.7	173.9	-173	-173.5	70.7	160.6	1.6	111.2	T61 E62 A67 L68 D69	T61-R65 WeakPolarHBondContact O-CB 3.48Å; T61-R65 PolarHBondContact O-N 3.29Å; E62-R65 PolarHBondContact O-N 3.45Å; R65-A67 VanDerWaalsContact C-N 3.28Å; R65-A67 PolarHBondContact O-N 3.08Å; R65-L68 PolarHBondContact O-N 3.04Å; R65-L68 VanDerWaalsContact O-N 3.13Å; R65-D69 PolarHBondContact O-N 3.34Å
66	S	96.2	Very high	95.8	Very high	64 Å²	64	100.6 Å²	100.6	45%	0.448	51%	0.507	S	S	.	.	H	α-helix	trans	-60.9	-37.1	179.4	76.5	0	0	0	0	112.5	E62 T63 E64 D69 V70	E62-S66 PolarHBondContact O-N 2.84Å; T63-S66 PolarHBondContact O-N 3.04Å; T63-S66 PolarHBondContact O-OG 3.42Å; E64-S66 PolarHBondContact O-N 2.81Å; S66-D69 PolarHBondContact O-N 3.28Å; S66-V70 WeakPolarHBondContact O-CG2 3.46Å; S66-V70 PolarHBondContact O-N 3.33Å
67	A	96.4	Very high	95.7	Very high	50 Å²	50	100.5 Å²	100.5	41%	0.413	51%	0.507	S	S	.	.	H	α-helix	trans	-68.5	-38	176.6	0	0	0	0	0	112.1	T63 E64 R65 V70 K71	T63-A67 PolarHBondContact O-N 3.5Å; E64-A67 PolarHBondContact O-N 3.49Å; R65-A67 VanDerWaalsContact C-N 3.28Å; R65-A67 PolarHBondContact O-N 3.08Å; A67-V70 PolarHBondContact O-N 3.27Å; A67-K71 WeakPolarHBondContact O-CG 3.13Å; A67-K71 PolarHBondContact O-N 2.73Å
68	L	93.9	Very high	95.6	Very high	107 Å²	107	101.5 Å²	101.5	56%	0.56	51%	0.509	S	S	*	.	H	α-helix	trans	-67.6	-39.2	175	-70.7	175	0	0	0	112	E64 R65 V70 K71 L72	E64-L68 WeakPolarHBondContact O-CG 3.34Å; E64-L68 PolarHBondContact O-N 2.83Å; R65-L68 PolarHBondContact O-N 3.04Å; R65-L68 VanDerWaalsContact O-N 3.13Å; L68-V70 VanDerWaalsContact C-N 3.3Å; L68-V70 PolarHBondContact O-N 2.82Å; L68-K71 HydrophobicContact CD2-CD 4.42Å; L68-K71 WeakPolarHBondContact O-CB 3.14Å; L68-K71 PolarHBondContact O-N 2.83Å; L68-K71 VanDerWaalsContact O-N 3.15Å; L68-L72 WeakPolarHBondContact O-CB 2.96Å; L68-L72 PolarHBondContact O-N 3.45Å
69	D	94	Very high	95.5	Very high	76 Å²	76	101 Å²	101	41%	0.406	51%	0.509	S	S	.	.	H	α-helix	trans	-60.6	-40	175.9	-77.4	-25.8	0	0	0	112.1	R65 S66 L72 K73	R65-D69 PolarHBondContact O-N 3.34Å; S66-D69 PolarHBondContact O-N 3.28Å; D69-L72 PolarHBondContact O-N 3.16Å; D69-K73 WeakPolarHBondContact O-CB 3.3Å; D69-K73 WeakPolarHBondContact O-CG 3.09Å; D69-K73 PolarHBondContact O-N 3.36Å
70	V	97.6	Very high	95.3	Very high	99 Å²	99	100 Å²	100	60%	0.6	51%	0.506	S	S	*	.	H	α-helix	trans	-63.5	-44.9	174.5	174.4	0	0	0	0	111.1	S66 A67 L68 L72 K73 H74	S66-V70 WeakPolarHBondContact O-CG2 3.46Å; S66-V70 PolarHBondContact O-N 3.33Å; A67-V70 PolarHBondContact O-N 3.27Å; L68-V70 VanDerWaalsContact C-N 3.3Å; L68-V70 PolarHBondContact O-N 2.82Å; V70-L72 VanDerWaalsContact C-N 3.31Å; V70-L72 PolarHBondContact O-N 3.11Å; V70-K73 PolarHBondContact O-N 3.14Å; V70-H74 PolarHBondContact O-N 2.88Å
71	K	96.3	Very high	95.3	Very high	142 Å²	142	97.3 Å²	97.3	62%	0.617	50%	0.5	S	S	*	.	H	α-helix	trans	-62	-40.7	177.1	-71.8	176.6	-177.7	176.4	0	111.8	A67 L68 H74 A75	A67-K71 WeakPolarHBondContact O-CG 3.13Å; A67-K71 PolarHBondContact O-N 2.73Å; L68-K71 HydrophobicContact CD2-CD 4.42Å; L68-K71 WeakPolarHBondContact O-CB 3.14Å; L68-K71 PolarHBondContact O-N 2.83Å; L68-K71 VanDerWaalsContact O-N 3.15Å; K71-H74 WeakPolarHBondContact O-CB 3.2Å; K71-H74 PolarHBondContact O-N 3.46Å; K71-A75 WeakPolarHBondContact O-CB 3.12Å; K71-A75 PolarHBondContact O-N 3.47Å
72	L	93.8	Very high	95.3	Very high	72 Å²	72	98.9 Å²	98.9	38%	0.377	50%	0.503	S	S	.	.	H	α-helix	trans	-67.3	-41.5	178.5	178.2	158.3	0	0	0	111.3	L68 D69 V70 H74 A75 R76	L68-L72 WeakPolarHBondContact O-CB 2.96Å; L68-L72 PolarHBondContact O-N 3.45Å; D69-L72 PolarHBondContact O-N 3.16Å; V70-L72 VanDerWaalsContact C-N 3.31Å; V70-L72 PolarHBondContact O-N 3.11Å; L72-H74 VanDerWaalsContact C-N 3.33Å; L72-H74 PolarHBondContact O-N 3.47Å; L72-A75 PolarHBondContact O-N 3.22Å; L72-R76 HydrophobicContact CD2-CG 4.34Å; L72-R76 VanDerWaalsContact CD2-NE 3.34Å; L72-R76 WeakPolarHBondContact O-CG 3.34Å; L72-R76 PolarHBondContact O-N 3.49Å
73	K	96.3	Very high	95.1	Very high	136 Å²	136	98 Å²	98	59%	0.591	50%	0.501	S	S	*	.	H	α-helix	trans	-59.5	-42.5	170.9	-75.6	177.1	-178.7	178	0	111.7	D69 V70 R76 N77	D69-K73 WeakPolarHBondContact O-CB 3.3Å; D69-K73 WeakPolarHBondContact O-CG 3.09Å; D69-K73 PolarHBondContact O-N 3.36Å; V70-K73 PolarHBondContact O-N 3.14Å; K73-R76 PolarHBondContact O-N 3.39Å; K73-N77 PolarHBondContact O-N 3.26Å
74	H	97	Very high	95	Very high	126 Å²	126	100.9 Å²	100.9	58%	0.583	51%	0.506	S	S	*	.	H	α-helix	trans	-63.3	-45.3	176.8	-173.2	73.7	0	0	0	112.3	V70 K71 L72 N77 Q78	V70-H74 PolarHBondContact O-N 2.88Å; K71-H74 WeakPolarHBondContact O-CB 3.2Å; K71-H74 PolarHBondContact O-N 3.46Å; L72-H74 VanDerWaalsContact C-N 3.33Å; L72-H74 PolarHBondContact O-N 3.47Å; H74-N77 PolarHBondContact O-N 3.23Å; H74-Q78 PolarHBondContact O-N 3.12Å
75	A	93.3	Very high	94.9	Very high	48 Å²	48	103.6 Å²	103.6	40%	0.397	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-43.8	177.4	0	0	0	0	0	112.1	K71 L72 N77 Q78 V79	K71-A75 WeakPolarHBondContact O-CB 3.12Å; K71-A75 PolarHBondContact O-N 3.47Å; L72-A75 PolarHBondContact O-N 3.22Å; A75-N77 PolarHBondContact O-N 3.29Å; A75-Q78 WeakPolarHBondContact O-CB 3.34Å; A75-Q78 PolarHBondContact O-N 2.85Å; A75-V79 WeakPolarHBondContact O-CG2 3.4Å; A75-V79 PolarHBondContact O-N 3.04Å
76	R	94.3	Very high	94.8	Very high	160 Å²	160	102.2 Å²	102.2	60%	0.604	51%	0.506	S	S	*	.	H	α-helix	trans	-58.1	-47.8	174.6	-74.8	179.3	177.9	164.7	-0.9	111.6	L72 K73 Q78 V79 D80	L72-R76 HydrophobicContact CD2-CG 4.34Å; L72-R76 VanDerWaalsContact CD2-NE 3.34Å; L72-R76 WeakPolarHBondContact O-CG 3.34Å; L72-R76 PolarHBondContact O-N 3.49Å; K73-R76 PolarHBondContact O-N 3.39Å; R76-Q78 VanDerWaalsContact C-N 3.28Å; R76-Q78 PolarHBondContact O-N 3.48Å; R76-V79 PolarHBondContact O-N 2.85Å; R76-D80 PolarHBondContact O-N 3.1Å
77	N	96.6	Very high	94.7	Very high	99 Å²	99	104.2 Å²	104.2	53%	0.529	51%	0.509	S	S	.	.	H	α-helix	trans	-60.3	-37.8	177	-74.8	-11.6	0	0	0	112.3	K73 H74 A75 D80 V81	K73-N77 PolarHBondContact O-N 3.26Å; H74-N77 PolarHBondContact O-N 3.23Å; A75-N77 PolarHBondContact O-N 3.29Å; N77-D80 PolarHBondContact O-N 3.02Å; N77-V81 VanDerWaalsContact O-CG2 3.31Å; N77-V81 WeakPolarHBondContact O-CG2 3.45Å; N77-V81 PolarHBondContact O-N 3.36Å
78	Q	94.3	Very high	94.7	Very high	120 Å²	120	108.7 Å²	108.7	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-65.5	-42.8	177.7	-169.9	174.2	41.2	0	0	111.7	H74 A75 R76 V81 E82	H74-Q78 PolarHBondContact O-N 3.12Å; A75-Q78 WeakPolarHBondContact O-CB 3.34Å; A75-Q78 PolarHBondContact O-N 2.85Å; R76-Q78 VanDerWaalsContact C-N 3.28Å; R76-Q78 PolarHBondContact O-N 3.48Å; Q78-V81 PolarHBondContact O-N 3.42Å; Q78-E82 PolarHBondContact O-N 3.45Å
79	V	92.2	Very high	94.6	Very high	83 Å²	83	106.1 Å²	106.1	50%	0.503	51%	0.513	S	S	.	.	H	α-helix	trans	-61.9	-44.3	175.1	173	0	0	0	0	110.8	A75 R76 V81 E82 I83	A75-V79 WeakPolarHBondContact O-CG2 3.4Å; A75-V79 PolarHBondContact O-N 3.04Å; R76-V79 PolarHBondContact O-N 2.85Å; V79-V81 VanDerWaalsContact C-N 3.3Å; V79-V81 PolarHBondContact O-N 2.95Å; V79-E82 PolarHBondContact O-N 2.98Å; V79-E82 VanDerWaalsContact O-N 3.16Å; V79-I83 HydrophobicContact CG1-CD1 3.73Å; V79-I83 HydrophobicContact CG1-CG1 4.25Å; V79-I83 VanDerWaalsContact O-CG1 3.31Å; V79-I83 WeakPolarHBondContact O-CG1 3.27Å; V79-I83 PolarHBondContact O-N 3.39Å
80	D	93.8	Very high	94.5	Very high	82 Å²	82	106.4 Å²	106.4	44%	0.439	51%	0.512	S	S	.	.	H	α-helix	trans	-61.3	-38.4	177.5	-75.8	-17.7	0	0	0	112.7	R76 N77 K84	R76-D80 PolarHBondContact O-N 3.1Å; N77-D80 PolarHBondContact O-N 3.02Å; D80-K84 WeakPolarHBondContact O-CB 3.35Å; D80-K84 WeakPolarHBondContact O-CG 3.41Å; D80-K84 PolarHBondContact O-N 2.98Å
81	V	96.9	Very high	94.3	Very high	68 Å²	68	104.7 Å²	104.7	41%	0.412	50%	0.502	S	S	.	.	H	α-helix	trans	-63.9	-44.1	175.1	169.6	0	0	0	0	110.7	N77 Q78 V79 K84 R85	N77-V81 VanDerWaalsContact O-CG2 3.31Å; N77-V81 WeakPolarHBondContact O-CG2 3.45Å; N77-V81 PolarHBondContact O-N 3.36Å; Q78-V81 PolarHBondContact O-N 3.42Å; V79-V81 VanDerWaalsContact C-N 3.3Å; V79-V81 PolarHBondContact O-N 2.95Å; V81-K84 PolarHBondContact O-N 3.28Å; V81-R85 WeakPolarHBondContact O-CG 3.48Å; V81-R85 PolarHBondContact O-N 2.95Å
82	E	93.4	Very high	94.1	Very high	98 Å²	98	101 Å²	101	46%	0.458	49%	0.489	S	S	.	.	H	α-helix	trans	-67.7	-38.9	177.8	-72.7	-55.1	134.4	0	0	112.5	Q78 V79 K84 R85 R86	Q78-E82 PolarHBondContact O-N 3.45Å; V79-E82 PolarHBondContact O-N 2.98Å; V79-E82 VanDerWaalsContact O-N 3.16Å; E82-K84 VanDerWaalsContact C-N 3.34Å; E82-K84 PolarHBondContact O-N 3.31Å; E82-R85 PolarHBondContact O-N 2.93Å; E82-R85 IonicContact OE1-CZ 3.59Å; E82-R85 IonicContact OE1-NE 2.96Å; E82-R85 IonicContact OE1-NH1 2.72Å; E82-R85 PolarHBondContact OE1-NH1 2.95Å; E82-R86 WeakPolarHBondContact O-CB 3.43Å; E82-R86 PolarHBondContact O-N 2.95Å
83	I	92.1	Very high	93.9	Very high	77 Å²	77	101.4 Å²	101.4	40%	0.395	50%	0.497	S	S	.	.	H	α-helix	trans	-59	-47.3	173.3	-70.5	169.6	0	0	0	110.2	V79 R85 R86 Q87	V79-I83 HydrophobicContact CG1-CD1 3.73Å; V79-I83 HydrophobicContact CG1-CG1 4.25Å; V79-I83 VanDerWaalsContact O-CG1 3.31Å; V79-I83 WeakPolarHBondContact O-CG1 3.27Å; V79-I83 PolarHBondContact O-N 3.39Å; I83-R85 PolarHBondContact O-N 3.2Å; I83-R86 PolarHBondContact O-N 3.49Å; I83-Q87 HydrophobicContact CG2-CG 4.47Å; I83-Q87 WeakPolarHBondContact O-CG 3.41Å; I83-Q87 PolarHBondContact O-N 3.38Å
84	K	95.2	Very high	93.7	Very high	144 Å²	144	99.3 Å²	99.3	63%	0.626	49%	0.489	S	S	*	.	H	α-helix	trans	-63.9	-40.2	178.1	-74.2	174.1	-177.7	173	0	112.4	D80 V81 E82 Q87 K88	D80-K84 WeakPolarHBondContact O-CB 3.35Å; D80-K84 WeakPolarHBondContact O-CG 3.41Å; D80-K84 PolarHBondContact O-N 2.98Å; V81-K84 PolarHBondContact O-N 3.28Å; E82-K84 VanDerWaalsContact C-N 3.34Å; E82-K84 PolarHBondContact O-N 3.31Å; K84-Q87 PolarHBondContact O-N 3.45Å; K84-K88 PolarHBondContact O-N 3.37Å
85	R	95.1	Very high	93.5	Very high	157 Å²	157	98.6 Å²	98.6	59%	0.592	49%	0.485	S	S	*	.	H	α-helix	trans	-62.1	-45.1	175.2	-77.1	174.9	-179.6	174.5	-2.3	111.3	V81 E82 I83 K88 A89	V81-R85 WeakPolarHBondContact O-CG 3.48Å; V81-R85 PolarHBondContact O-N 2.95Å; E82-R85 PolarHBondContact O-N 2.93Å; E82-R85 IonicContact OE1-CZ 3.59Å; E82-R85 IonicContact OE1-NE 2.96Å; E82-R85 IonicContact OE1-NH1 2.72Å; E82-R85 PolarHBondContact OE1-NH1 2.95Å; I83-R85 PolarHBondContact O-N 3.2Å; R85-K88 PolarHBondContact O-N 3.49Å; R85-A89 PolarHBondContact O-N 3.45Å
86	R	92.8	Very high	93.4	Very high	138 Å²	138	101 Å²	101	52%	0.521	49%	0.49	S	S	.	.	H	α-helix	trans	-61.1	-49.2	176.7	179	179.1	169.5	150.8	-0	111.7	E82 I83 K88 A89 E90	E82-R86 WeakPolarHBondContact O-CB 3.43Å; E82-R86 PolarHBondContact O-N 2.95Å; I83-R86 PolarHBondContact O-N 3.49Å; R86-K88 VanDerWaalsContact C-N 3.29Å; R86-K88 PolarHBondContact O-N 3Å; R86-A89 WeakPolarHBondContact O-CB 3.41Å; R86-A89 PolarHBondContact O-N 3.34Å; R86-A89 VanDerWaalsContact O-N 3.12Å; R86-E90 HydrophobicContact CG-CG 4.37Å; R86-E90 IonicContact CZ-OE1 2.74Å; R86-E90 VanDerWaalsContact CZ-OE1 3.3Å; R86-E90 IonicContact NE-OE1 3.82Å; R86-E90 PolarHBondContact NE-OE1 2.94Å; R86-E90 IonicContact NH2-OE1 2.82Å; R86-E90 PolarHBondContact NH2-OE1 3.5Å; R86-E90 WeakPolarHBondContact O-CG 3.45Å; R86-E90 PolarHBondContact O-N 3.06Å
87	Q	93.8	Very high	93	Very high	107 Å²	107	99.3 Å²	99.3	50%	0.5	49%	0.489	S	S	.	.	H	α-helix	trans	-57.9	-42.8	177.8	-75.1	174.6	-7.3	0	0	111.6	I83 K84 A89 E90 T91	I83-Q87 HydrophobicContact CG2-CG 4.47Å; I83-Q87 WeakPolarHBondContact O-CG 3.41Å; I83-Q87 PolarHBondContact O-N 3.38Å; K84-Q87 PolarHBondContact O-N 3.45Å; Q87-A89 PolarHBondContact O-N 3.41Å; Q87-E90 PolarHBondContact O-N 3.2Å; Q87-T91 WeakPolarHBondContact O-CG2 3.49Å; Q87-T91 PolarHBondContact O-N 2.95Å; Q87-T91 PolarHBondContact O-OG1 3.07Å
88	K	95.6	Very high	92.6	Very high	143 Å²	143	101.8 Å²	101.8	62%	0.622	49%	0.491	S	S	*	.	H	α-helix	trans	-59.3	-48.4	175.1	-172.6	178.6	178.7	-177.3	0	111.4	K84 R85 R86 E90 T91 D92	K84-K88 PolarHBondContact O-N 3.37Å; R85-K88 PolarHBondContact O-N 3.49Å; R86-K88 VanDerWaalsContact C-N 3.29Å; R86-K88 PolarHBondContact O-N 3Å; K88-E90 VanDerWaalsContact C-N 3.33Å; K88-E90 PolarHBondContact O-N 3.12Å; K88-T91 PolarHBondContact O-N 3.44Å; K88-T91 PolarHBondContact O-OG1 3.16Å; K88-D92 PolarHBondContact O-N 3.35Å
89	A	92	Very high	92.2	Very high	54 Å²	54	101.4 Å²	101.4	45%	0.446	49%	0.489	S	S	.	.	H	α-helix	trans	-61.7	-39.7	178.1	0	0	0	0	0	112.6	R85 R86 Q87 D92 C93	R85-A89 PolarHBondContact O-N 3.45Å; R86-A89 WeakPolarHBondContact O-CB 3.41Å; R86-A89 PolarHBondContact O-N 3.34Å; R86-A89 VanDerWaalsContact O-N 3.12Å; Q87-A89 PolarHBondContact O-N 3.41Å; A89-D92 PolarHBondContact O-N 3.18Å; A89-C93 PolarHBondContact O-N 2.82Å; A89-C93 PolarHBondContact O-SG 2.82Å
90	E	91.9	Very high	91.8	Very high	81 Å²	81	101.1 Å²	101.1	38%	0.379	48%	0.484	S	S	.	.	H	α-helix	trans	-62.7	-45.5	175.3	-73.8	173	168.4	0	0	111.1	R86 Q87 K88 D92 C93 E94	R86-E90 HydrophobicContact CG-CG 4.37Å; R86-E90 IonicContact CZ-OE1 2.74Å; R86-E90 VanDerWaalsContact CZ-OE1 3.3Å; R86-E90 IonicContact NE-OE1 3.82Å; R86-E90 PolarHBondContact NE-OE1 2.94Å; R86-E90 IonicContact NH2-OE1 2.82Å; R86-E90 PolarHBondContact NH2-OE1 3.5Å; R86-E90 WeakPolarHBondContact O-CG 3.45Å; R86-E90 PolarHBondContact O-N 3.06Å; Q87-E90 PolarHBondContact O-N 3.2Å; K88-E90 VanDerWaalsContact C-N 3.33Å; K88-E90 PolarHBondContact O-N 3.12Å; E90-D92 VanDerWaalsContact C-N 3.3Å; E90-D92 PolarHBondContact O-N 2.89Å; E90-C93 WeakPolarHBondContact O-CB 3.25Å; E90-C93 PolarHBondContact O-N 2.93Å; E90-E94 PolarHBondContact O-N 3.35Å
91	T	93.8	Very high	91.1	Very high	64 Å²	64	101.1 Å²	101.1	39%	0.393	48%	0.482	S	S	.	.	H	α-helix	trans	-64.1	-33.4	177	62.8	0	0	0	0	113.3	Q87 K88 K95	Q87-T91 WeakPolarHBondContact O-CG2 3.49Å; Q87-T91 PolarHBondContact O-N 2.95Å; Q87-T91 PolarHBondContact O-OG1 3.07Å; K88-T91 PolarHBondContact O-N 3.44Å; K88-T91 PolarHBondContact O-OG1 3.16Å; T91-K95 WeakPolarHBondContact O-CG 3.46Å; T91-K95 PolarHBondContact O-N 3.41Å
92	D	92.5	Very high	90.4	Very high	64 Å²	64	102.6 Å²	102.6	34%	0.342	49%	0.486	S	S	.	.	H	α-helix	trans	-74.3	-36.9	176.6	-71	-22.8	0	0	0	111.2	K88 A89 E90 K95 L96	K88-D92 PolarHBondContact O-N 3.35Å; A89-D92 PolarHBondContact O-N 3.18Å; E90-D92 VanDerWaalsContact C-N 3.3Å; E90-D92 PolarHBondContact O-N 2.89Å; D92-K95 PolarHBondContact O-N 2.73Å; D92-K95 IonicContact OD1-NZ 2.91Å; D92-K95 PolarHBondContact OD1-NZ 2.76Å; D92-L96 WeakPolarHBondContact O-CG 3.15Å; D92-L96 PolarHBondContact O-N 3.2Å; D92-L96 VanDerWaalsContact O-N 3.1Å
93	C	89.8	Confident	89.8	Confident	80 Å²	80	102.3 Å²	102.3	54%	0.541	49%	0.487	S	S	.	.	H	α-helix	trans	-60	-45.9	170.6	-69.7	0	0	0	0	111.6	A89 E90 K95 L96 E97	A89-C93 PolarHBondContact O-N 2.82Å; A89-C93 PolarHBondContact O-SG 2.82Å; E90-C93 WeakPolarHBondContact O-CB 3.25Å; E90-C93 PolarHBondContact O-N 2.93Å; C93-K95 VanDerWaalsContact C-N 3.3Å; C93-K95 PolarHBondContact O-N 2.97Å; C93-L96 PolarHBondContact O-N 3.34Å; C93-E97 WeakPolarHBondContact O-CB 3.18Å; C93-E97 PolarHBondContact O-N 3.49Å
94	E	91.8	Very high	88.8	Confident	93 Å²	93	102.1 Å²	102.1	44%	0.435	48%	0.481	S	S	.	.	H	α-helix	trans	-60	-38.4	176.7	-74.5	-177	-167.5	0	0	112.7	E90 E97 R98	E90-E94 PolarHBondContact O-N 3.35Å; E94-E97 PolarHBondContact O-N 3.31Å; E94-R98 WeakPolarHBondContact O-CG 3.34Å; E94-R98 PolarHBondContact O-N 2.99Å; E94-R98 IonicContact OE2-CZ 3.63Å; E94-R98 IonicContact OE2-NH2 3.36Å; E94-R98 PolarHBondContact OE2-NH2 2.89Å
95	K	93.4	Very high	87.8	Confident	111 Å²	111	100 Å²	100	48%	0.483	47%	0.474	S	S	.	.	H	α-helix	trans	-63.9	-45.4	176.6	-72	170.1	-160.6	156.3	0	111.3	T91 D92 C93 E97 R98 Q99	T91-K95 WeakPolarHBondContact O-CG 3.46Å; T91-K95 PolarHBondContact O-N 3.41Å; D92-K95 PolarHBondContact O-N 2.73Å; D92-K95 IonicContact OD1-NZ 2.91Å; D92-K95 PolarHBondContact OD1-NZ 2.76Å; C93-K95 VanDerWaalsContact C-N 3.3Å; C93-K95 PolarHBondContact O-N 2.97Å; K95-E97 VanDerWaalsContact C-N 3.34Å; K95-R98 PolarHBondContact O-N 3.3Å; K95-Q99 WeakPolarHBondContact O-CG 3.25Å; K95-Q99 PolarHBondContact O-N 2.9Å
96	L	90.1	Very high	86.6	Confident	99 Å²	99	99.3 Å²	99.3	52%	0.518	48%	0.481	S	S	.	.	H	α-helix	trans	-64.3	-40.8	177.6	-69.3	172.7	0	0	0	111.2	D92 C93 R98 Q99 I100	D92-L96 WeakPolarHBondContact O-CG 3.15Å; D92-L96 PolarHBondContact O-N 3.2Å; D92-L96 VanDerWaalsContact O-N 3.1Å; C93-L96 PolarHBondContact O-N 3.34Å; L96-R98 PolarHBondContact O-N 3.16Å; L96-Q99 WeakPolarHBondContact O-CB 3.48Å; L96-Q99 PolarHBondContact O-N 3.37Å; L96-Q99 VanDerWaalsContact O-N 3.17Å; L96-I100 WeakPolarHBondContact O-CG1 3.33Å; L96-I100 PolarHBondContact O-N 3.14Å
97	E	86.2	Confident	85.3	Confident	124 Å²	124	95.7 Å²	95.7	58%	0.579	47%	0.472	S	S	*	.	H	α-helix	trans	-63.5	-41.5	176.8	-168.6	166.2	-158.7	0	0	111.7	C93 E94 K95 Q99 I100 Q101	C93-E97 WeakPolarHBondContact O-CB 3.18Å; C93-E97 PolarHBondContact O-N 3.49Å; E94-E97 PolarHBondContact O-N 3.31Å; K95-E97 VanDerWaalsContact C-N 3.34Å; E97-Q99 PolarHBondContact O-N 3.21Å; E97-I100 PolarHBondContact O-N 3.48Å; E97-Q101 WeakPolarHBondContact O-CB 3.29Å; E97-Q101 PolarHBondContact O-N 3.08Å
98	R	87.9	Confident	83.8	Confident	151 Å²	151	96.5 Å²	96.5	57%	0.57	48%	0.477	S	S	*	.	H	α-helix	trans	-62.4	-39.1	171.6	-72	177.9	-165.2	129.6	13.8	112.5	E94 K95 L96 Q101 L102	E94-R98 WeakPolarHBondContact O-CG 3.34Å; E94-R98 PolarHBondContact O-N 2.99Å; E94-R98 IonicContact OE2-CZ 3.63Å; E94-R98 IonicContact OE2-NH2 3.36Å; E94-R98 PolarHBondContact OE2-NH2 2.89Å; K95-R98 PolarHBondContact O-N 3.3Å; L96-R98 PolarHBondContact O-N 3.16Å; R98-Q101 PolarHBondContact O-N 3.17Å; R98-L102 WeakPolarHBondContact O-CG 3.44Å; R98-L102 PolarHBondContact O-N 3.35Å
99	Q	86.4	Confident	82	Confident	111 Å²	111	94.2 Å²	94.2	52%	0.519	48%	0.478	S	S	.	.	H	α-helix	trans	-63.9	-44.5	175.6	-75.2	178.8	-18.4	0	0	111.7	K95 L96 E97 Q101 L102 I103	K95-Q99 WeakPolarHBondContact O-CG 3.25Å; K95-Q99 PolarHBondContact O-N 2.9Å; L96-Q99 WeakPolarHBondContact O-CB 3.48Å; L96-Q99 PolarHBondContact O-N 3.37Å; L96-Q99 VanDerWaalsContact O-N 3.17Å; E97-Q99 PolarHBondContact O-N 3.21Å; Q99-Q101 VanDerWaalsContact C-N 3.27Å; Q99-Q101 PolarHBondContact O-N 3.17Å; Q99-L102 PolarHBondContact O-N 2.67Å; Q99-I103 VanDerWaalsContact O-CG1 3.29Å; Q99-I103 WeakPolarHBondContact O-CG1 3.45Å; Q99-I103 PolarHBondContact O-N 2.82Å
100	I	83.1	Confident	80.3	Confident	77 Å²	77	97.4 Å²	97.4	40%	0.395	49%	0.487	S	S	.	.	H	α-helix	trans	-60.3	-41.5	174.8	-67.9	167.2	0	0	0	110.2	L96 E97 I103 R104	L96-I100 WeakPolarHBondContact O-CG1 3.33Å; L96-I100 PolarHBondContact O-N 3.14Å; E97-I100 PolarHBondContact O-N 3.48Å; I100-I103 PolarHBondContact O-N 3.43Å; I100-R104 WeakPolarHBondContact O-CG 3.21Å; I100-R104 PolarHBondContact O-N 3.41Å
101	Q	80.5	Confident	78.5	Confident	83 Å²	83	97.2 Å²	97.2	39%	0.388	50%	0.5	S	S	.	.	H	α-helix	trans	-64.4	-41.9	178.1	-168.2	60.5	24.8	0	0	112.6	E97 R98 Q99 R104 E105	E97-Q101 WeakPolarHBondContact O-CB 3.29Å; E97-Q101 PolarHBondContact O-N 3.08Å; R98-Q101 PolarHBondContact O-N 3.17Å; Q99-Q101 VanDerWaalsContact C-N 3.27Å; Q99-Q101 PolarHBondContact O-N 3.17Å; Q101-R104 WeakPolarHBondContact O-CB 3.3Å; Q101-R104 PolarHBondContact O-N 3.41Å; Q101-E105 WeakPolarHBondContact O-CG 3.42Å; Q101-E105 PolarHBondContact O-N 3.38Å
102	L	81.6	Confident	76.6	Confident	98 Å²	98	100.1 Å²	100.1	51%	0.513	52%	0.523	S	S	.	.	H	α-helix	trans	-64.6	-38.8	174.4	-71.6	170.5	0	0	0	112.3	R98 Q99 R104 E105 L106	R98-L102 WeakPolarHBondContact O-CG 3.44Å; R98-L102 PolarHBondContact O-N 3.35Å; Q99-L102 PolarHBondContact O-N 2.67Å; L102-R104 VanDerWaalsContact C-N 3.33Å; L102-E105 PolarHBondContact O-N 3.49Å; L102-L106 WeakPolarHBondContact O-CB 3.28Å; L102-L106 PolarHBondContact O-N 2.82Å
103	I	79.8	Confident	74.8	Confident	93 Å²	93	101.3 Å²	101.3	48%	0.477	55%	0.55	S	S	.	*	H	α-helix	trans	-62.8	-42.8	174.1	-68.1	164.8	0	0	0	110	Q99 I100 L106 L107	Q99-I103 VanDerWaalsContact O-CG1 3.29Å; Q99-I103 WeakPolarHBondContact O-CG1 3.45Å; Q99-I103 PolarHBondContact O-N 2.82Å; I100-I103 PolarHBondContact O-N 3.43Å; I103-L106 PolarHBondContact O-N 2.81Å; I103-L107 HydrophobicContact CG2-CD1 3.75Å; I103-L107 HydrophobicContact CG2-CG 4.35Å; I103-L107 WeakPolarHBondContact O-CB 3.25Å; I103-L107 VanDerWaalsContact O-CG 3.22Å; I103-L107 WeakPolarHBondContact O-CG 3.37Å; I103-L107 PolarHBondContact O-N 3.28Å
104	R	71.6	Confident	73	Confident	72 Å²	72	102.9 Å²	102.9	27%	0.272	56%	0.562	S	S	.	*	H	α-helix	trans	-59.1	-46.5	173.5	-72.6	169.2	172.8	159.9	-2.4	111.4	I100 Q101 L102 L107 M108 L128	I100-R104 WeakPolarHBondContact O-CG 3.21Å; I100-R104 PolarHBondContact O-N 3.41Å; Q101-R104 WeakPolarHBondContact O-CB 3.3Å; Q101-R104 PolarHBondContact O-N 3.41Å; L102-R104 VanDerWaalsContact C-N 3.33Å; R104-L107 PolarHBondContact O-N 2.94Å; R104-M108 VanDerWaalsContact O-CB 3.29Å; R104-M108 WeakPolarHBondContact O-CB 3.32Å; R104-M108 WeakPolarHBondContact O-CG 3.38Å; R104-M108 PolarHBondContact O-N 3.47Å; R104-L128 VanDerWaalsContact CZ-O 3.25Å; R104-L128 PolarHBondContact NE-O 3.49Å; R104-L128 PolarHBondContact NH2-O 3.19Å
105	E	74	Confident	71.3	Confident	99 Å²	99	104.6 Å²	104.6	46%	0.463	57%	0.573	S	S	.	*	H	α-helix	trans	-63.3	-42.6	178.4	-73.6	172.1	-168.3	0	0	112.3	Q101 L102 L107 M108 C109	Q101-E105 WeakPolarHBondContact O-CG 3.42Å; Q101-E105 PolarHBondContact O-N 3.38Å; L102-E105 PolarHBondContact O-N 3.49Å; E105-L107 VanDerWaalsContact C-N 3.33Å; E105-L107 PolarHBondContact O-N 2.99Å; E105-M108 PolarHBondContact O-N 3.38Å; E105-C109 WeakPolarHBondContact O-CB 3.37Å; E105-C109 PolarHBondContact O-N 3.36Å; E105-C109 PolarHBondContact O-SG 3.48Å; E105-C109 VanDerWaalsContact O-SG 3.33Å
106	L	70.6	Confident	69.6	Low	143 Å²	143	108.7 Å²	108.7	75%	0.749	59%	0.594	S	S	*	*	H	α-helix	trans	-63.4	-36.6	175.3	-83	157.1	0	0	0	113	L102 I103 M108	L102-L106 WeakPolarHBondContact O-CB 3.28Å; L102-L106 PolarHBondContact O-N 2.82Å; I103-L106 PolarHBondContact O-N 2.81Å; L106-M108 VanDerWaalsContact C-N 3.32Å
107	L	65.1	Low	68.2	Low	62 Å²	62	105.9 Å²	105.9	33%	0.325	58%	0.579	S	S	.	*	H	α-helix	trans	-74.4	-21.3	175.7	-71.2	169.1	0	0	0	113	I103 R104 E105 L117 L125 L128	I103-L107 HydrophobicContact CG2-CD1 3.75Å; I103-L107 HydrophobicContact CG2-CG 4.35Å; I103-L107 WeakPolarHBondContact O-CB 3.25Å; I103-L107 VanDerWaalsContact O-CG 3.22Å; I103-L107 WeakPolarHBondContact O-CG 3.37Å; I103-L107 PolarHBondContact O-N 3.28Å; R104-L107 PolarHBondContact O-N 2.94Å; E105-L107 VanDerWaalsContact C-N 3.33Å; E105-L107 PolarHBondContact O-N 2.99Å; L107-L117 HydrophobicContact CD2-CD1 3.71Å; L107-L125 HydrophobicContact CD2-CD1 4.25Å; L107-L128 HydrophobicContact CD1-CD1 4.09Å
108	M	62.2	Low	67.1	Low	125 Å²	125	102.6 Å²	102.6	62%	0.616	57%	0.57	S	S	*	*	H	α-helix	trans	-105.1	-13.8	-174.4	-65.1	-66.2	-66.3	0	0	114	R104 E105 L106 D110	R104-M108 VanDerWaalsContact O-CB 3.29Å; R104-M108 WeakPolarHBondContact O-CB 3.32Å; R104-M108 WeakPolarHBondContact O-CG 3.38Å; R104-M108 PolarHBondContact O-N 3.47Å; E105-M108 PolarHBondContact O-N 3.38Å; L106-M108 VanDerWaalsContact C-N 3.32Å; M108-D110 PolarHBondContact O-N 2.95Å
109	C	58.3	Low	65.9	Low	95 Å²	95	103.5 Å²	103.5	64%	0.642	58%	0.581	S	S	*	*			trans	-77.8	81.6	174.1	-78.9	0	0	0	0	111.4	E105 A111	E105-C109 WeakPolarHBondContact O-CB 3.37Å; E105-C109 PolarHBondContact O-N 3.36Å; E105-C109 PolarHBondContact O-SG 3.48Å; E105-C109 VanDerWaalsContact O-SG 3.33Å; C109-A111 PolarHBondContact O-N 3.46Å
110	D	55.2	Low	64.8	Low	120 Å²	120	106 Å²	106	64%	0.642	59%	0.592	S	S	*	*			trans	-72	69.5	162.5	-81.5	-28.4	0	0	0	109.9	M108 K122	M108-D110 PolarHBondContact O-N 2.95Å; D110-K122 IonicContact OD2-NZ 3.39Å; D110-K122 PolarHBondContact OD2-NZ 3.38Å
111	A	53.8	Low	63.7	Low	78 Å²	78	106.9 Å²	106.9	65%	0.645	60%	0.595	S	S	*	*			trans	-156.6	107.6	167.5	0	0	0	0	0	109.8	C109	C109-A111 PolarHBondContact O-N 3.46Å
112	S	54.2	Low	62.8	Low	125 Å²	125	107.4 Å²	107.4	87%	0.874	60%	0.596	S	S	*	*	S	Bend	trans	94.3	57.3	176.5	-27.8	0	0	0	0	116.7
113	G	54.8	Low	62	Low	89 Å²	89	107 Å²	107	92%	0.918	60%	0.601	S	S	*	*	S	Bend		76.6	33.7	123.8	0	0	0	0	0	121.7
114	S	52.9	Low	61.2	Low	112 Å²	112	105.7 Å²	105.7	78%	0.783	60%	0.604	S	S	*	*	S	Bend	trans	-139.4	-15.7	168.5	-175.5	0	0	0	0	117.6
115	I	56.8	Low	60.8	Low	130 Å²	130	105.1 Å²	105.1	67%	0.667	61%	0.606	S	S	*	*			trans	-140.3	89.1	-179.4	-47.8	176.9	0	0	0	109.5	L117	I115-L117 HydrophobicContact CG2-CD2 3.93Å; I115-L117 HydrophobicContact CG2-CG 3.95Å; I115-L117 PolarHBondContact O-N 2.86Å
116	Q	56.5	Low	60.2	Low	196 Å²	196	102.9 Å²	102.9	92%	0.916	61%	0.605	S	S	*	*			trans	-80.3	98.5	165.2	-78.3	-177.4	-18.4	0	0	108.3
117	L	59.8	Low	59.8	Low	41 Å²	41	103 Å²	103	22%	0.215	60%	0.599	C	S	.	*			trans	-74.8	130.6	169.7	-66	170.6	0	0	0	109.1	L107 I115 Q121 K122 L125	L107-L117 HydrophobicContact CD2-CD1 3.71Å; I115-L117 HydrophobicContact CG2-CD2 3.93Å; I115-L117 HydrophobicContact CG2-CG 3.95Å; I115-L117 PolarHBondContact O-N 2.86Å; L117-Q121 HydrophobicContact CB-CB 4.27Å; L117-Q121 HydrophobicContact CD2-CB 4.32Å; L117-K122 HydrophobicContact CB-CG 3.9Å; L117-K122 VanDerWaalsContact O-CE 3.27Å; L117-K122 WeakPolarHBondContact O-CE 3.45Å; L117-L125 HydrophobicContact CD1-CD1 3.98Å
118	S	63.7	Low	59.4	Low	55 Å²	55	102.1 Å²	102.1	39%	0.385	60%	0.595	S	S	.	*			trans	-64.1	158.3	174.3	59.5	0	0	0	0	111.8	E120 Q121 K122	S118-E120 PolarHBondContact O-N 3.39Å; S118-Q121 WeakPolarHBondContact O-CB 3.32Å; S118-Q121 PolarHBondContact O-N 3.24Å; S118-Q121 VanDerWaalsContact OG-CD 3.26Å; S118-Q121 VanDerWaalsContact OG-CG 3.27Å; S118-Q121 WeakPolarHBondContact OG-CG 3.28Å; S118-Q121 PolarHBondContact OG-OE1 3.39Å; S118-K122 PolarHBondContact O-N 3.05Å
119	E	64.1	Low	59	Low	170 Å²	170	101.3 Å²	101.3	79%	0.794	59%	0.593	S	S	*	*	H	α-helix	trans	-52.4	-38.6	178.7	-155.4	95	-152.2	0	0	112.3	K122 S123	E119-K122 PolarHBondContact O-N 3.45Å; E119-S123 WeakPolarHBondContact O-CB 3.48Å; E119-S123 PolarHBondContact O-N 3.17Å
120	E	61.5	Low	58.8	Low	163 Å²	163	106.2 Å²	106.2	76%	0.762	60%	0.598	S	S	*	*	H	α-helix	trans	-68.6	-37	176.2	-76.5	178.4	152.5	0	0	112.8	S118 S123 A124	S118-E120 PolarHBondContact O-N 3.39Å; E120-S123 PolarHBondContact O-N 3.27Å; E120-A124 WeakPolarHBondContact O-CB 3.47Å; E120-A124 PolarHBondContact O-N 3.25Å
121	Q	60.6	Low	58.3	Low	96 Å²	96	105 Å²	105	45%	0.449	60%	0.597	S	S	.	*	H	α-helix	trans	-72.6	-36.6	176.1	-71.7	168.8	-32.8	0	0	111.9	L117 S118 S123 A124 L125	L117-Q121 HydrophobicContact CB-CB 4.27Å; L117-Q121 HydrophobicContact CD2-CB 4.32Å; S118-Q121 WeakPolarHBondContact O-CB 3.32Å; S118-Q121 PolarHBondContact O-N 3.24Å; S118-Q121 VanDerWaalsContact OG-CD 3.26Å; S118-Q121 VanDerWaalsContact OG-CG 3.27Å; S118-Q121 WeakPolarHBondContact OG-CG 3.28Å; S118-Q121 PolarHBondContact OG-OE1 3.39Å; Q121-S123 VanDerWaalsContact C-N 3.35Å; Q121-A124 PolarHBondContact O-N 3.08Å; Q121-L125 WeakPolarHBondContact O-CB 3.45Å; Q121-L125 WeakPolarHBondContact O-CG 3.31Å; Q121-L125 PolarHBondContact O-N 3.12Å; Q121-L125 VanDerWaalsContact O-N 3.07Å
122	K	61.4	Low	57.9	Low	94 Å²	94	110.8 Å²	110.8	41%	0.409	61%	0.61	S	S	.	*	H	α-helix	trans	-64.5	-39.9	172.3	-69.2	-176.1	175.8	-171.1	0	111	D110 L117 S118 E119 L125 A126	D110-K122 IonicContact OD2-NZ 3.39Å; D110-K122 PolarHBondContact OD2-NZ 3.38Å; L117-K122 HydrophobicContact CB-CG 3.9Å; L117-K122 VanDerWaalsContact O-CE 3.27Å; L117-K122 WeakPolarHBondContact O-CE 3.45Å; S118-K122 PolarHBondContact O-N 3.05Å; E119-K122 PolarHBondContact O-N 3.45Å; K122-L125 PolarHBondContact O-N 2.86Å; K122-A126 PolarHBondContact O-N 2.83Å
123	S	64.4	Low	57.2	Low	88 Å²	88	109.9 Å²	109.9	62%	0.615	60%	0.6	S	S	*	*	H	α-helix	trans	-65.2	-44	173.4	-177.5	0	0	0	0	112.6	E119 E120 Q121 L125 A126	E119-S123 WeakPolarHBondContact O-CB 3.48Å; E119-S123 PolarHBondContact O-N 3.17Å; E120-S123 PolarHBondContact O-N 3.27Å; Q121-S123 VanDerWaalsContact C-N 3.35Å; S123-L125 VanDerWaalsContact C-N 3.25Å; S123-L125 PolarHBondContact O-N 2.92Å; S123-A126 WeakPolarHBondContact O-CB 3.24Å; S123-A126 PolarHBondContact O-N 2.99Å; S123-A126 VanDerWaalsContact O-N 3.12Å
124	A	64.6	Low	56.7	Low	67 Å²	67	110.7 Å²	110.7	55%	0.554	59%	0.591	S	S	*	*	H	α-helix	trans	-64.5	-27.5	176.8	0	0	0	0	0	113.3	E120 Q121 F127	E120-A124 WeakPolarHBondContact O-CB 3.47Å; E120-A124 PolarHBondContact O-N 3.25Å; Q121-A124 PolarHBondContact O-N 3.08Å; A124-F127 WeakPolarHBondContact O-CD1 3.39Å; A124-F127 VanDerWaalsContact O-CE1 3.25Å; A124-F127 WeakPolarHBondContact O-CE1 3.3Å
125	L	61.7	Low	55.9	Low	59 Å²	59	111.6 Å²	111.6	31%	0.309	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.5	-1.2	176.6	-67.1	169.6	0	0	0	113.5	L107 L117 Q121 K122 S123 F127 L128	L107-L125 HydrophobicContact CD2-CD1 4.25Å; L117-L125 HydrophobicContact CD1-CD1 3.98Å; Q121-L125 WeakPolarHBondContact O-CB 3.45Å; Q121-L125 WeakPolarHBondContact O-CG 3.31Å; Q121-L125 PolarHBondContact O-N 3.12Å; Q121-L125 VanDerWaalsContact O-N 3.07Å; K122-L125 PolarHBondContact O-N 2.86Å; S123-L125 VanDerWaalsContact C-N 3.25Å; S123-L125 PolarHBondContact O-N 2.92Å; L125-F127 HydrophobicContact CD2-CE1 4.38Å; L125-F127 PolarHBondContact O-N 3.46Å; L125-F127 VanDerWaalsContact O-N 3.12Å; L125-L128 HydrophobicContact CB-CD1 4.47Å; L125-L128 HydrophobicContact CD2-CD1 3.98Å; L125-L128 WeakPolarHBondContact O-CB 3.47Å; L125-L128 PolarHBondContact O-N 3.17Å
126	A	61.2	Low	54.9	Low	53 Å²	53	109.1 Å²	109.1	44%	0.438	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-62.2	-20.6	-178.7	0	0	0	0	0	113.8	K122 S123 L128 N129	K122-A126 PolarHBondContact O-N 2.83Å; S123-A126 WeakPolarHBondContact O-CB 3.24Å; S123-A126 PolarHBondContact O-N 2.99Å; S123-A126 VanDerWaalsContact O-N 3.12Å; A126-L128 PolarHBondContact O-N 2.89Å; A126-N129 WeakPolarHBondContact O-CA 3.42Å; A126-N129 WeakPolarHBondContact O-CB 3.37Å; A126-N129 PolarHBondContact O-N 3.18Å
127	F	63.1	Low	53.9	Low	144 Å²	144	102.9 Å²	102.9	63%	0.632	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-62.6	-27.1	173	73.3	-90.4	0	0	0	112.8	A124 L125 N129	A124-F127 WeakPolarHBondContact O-CD1 3.39Å; A124-F127 VanDerWaalsContact O-CE1 3.25Å; A124-F127 WeakPolarHBondContact O-CE1 3.3Å; L125-F127 HydrophobicContact CD2-CE1 4.38Å; L125-F127 PolarHBondContact O-N 3.46Å; L125-F127 VanDerWaalsContact O-N 3.12Å; F127-N129 PolarHBondContact O-N 3.47Å
128	L	57.3	Low	53.1	Low	44 Å²	44	107.2 Å²	107.2	23%	0.23	62%	0.621	C	S	.	*	G	3₁₀ helix	trans	-70.6	-22.9	174.4	-66.8	169.9	0	0	0	111.9	R104 L107 L125 A126	R104-L128 VanDerWaalsContact CZ-O 3.25Å; R104-L128 PolarHBondContact NE-O 3.49Å; R104-L128 PolarHBondContact NH2-O 3.19Å; L107-L128 HydrophobicContact CD1-CD1 4.09Å; L125-L128 HydrophobicContact CB-CD1 4.47Å; L125-L128 HydrophobicContact CD2-CD1 3.98Å; L125-L128 WeakPolarHBondContact O-CB 3.47Å; L125-L128 PolarHBondContact O-N 3.17Å; A126-L128 PolarHBondContact O-N 2.89Å
129	N	52.3	Low	52.1	Low	108 Å²	108	108 Å²	108	58%	0.578	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-91.2	0.8	-176.3	-142.7	11	0	0	0	113	A126 F127 P131	A126-N129 WeakPolarHBondContact O-CA 3.42Å; A126-N129 WeakPolarHBondContact O-CB 3.37Å; A126-N129 PolarHBondContact O-N 3.18Å; F127-N129 PolarHBondContact O-N 3.47Å; N129-P131 WeakPolarHBondContact O-CD 3.34Å
130	R	54.4	Low	51.1	Low	199 Å²	199	107.5 Å²	107.5	75%	0.751	64%	0.64	S	S	*	*			trans	-72.7	114.6	170.9	-144.6	178.5	-165.1	-158.8	3.3	107.3	Q132	R130-Q132 PolarHBondContact O-N 2.94Å
131	P	44.3	Very low	50	Low	95 Å²	95	110 Å²	110	62%	0.617	65%	0.648	S	S	*	*			trans	-55.9	136.1	162	24.1	-27.4	0	0	0	105.4	N129 V133	N129-P131 WeakPolarHBondContact O-CD 3.34Å; P131-V133 HydrophobicContact CG-CG2 4.19Å; P131-V133 PolarHBondContact O-N 3.06Å
132	Q	46.4	Very low	48.8	Very low	198 Å²	198	115.8 Å²	115.8	93%	0.925	67%	0.666	S	S	*	*			trans	-63.9	81.3	166.1	-80.8	-130.6	-38.8	0	0	107	R130 S134	R130-Q132 PolarHBondContact O-N 2.94Å; Q132-S134 VanDerWaalsContact C-N 3.33Å; Q132-S134 PolarHBondContact O-N 3.26Å
133	V	39.9	Very low	47.7	Very low	107 Å²	107	119 Å²	119	65%	0.648	69%	0.687	S	S	*	*			trans	-60.8	108.6	157.4	179.4	0	0	0	0	103.3	P131 V135	P131-V133 HydrophobicContact CG-CG2 4.19Å; P131-V133 PolarHBondContact O-N 3.06Å; V133-V135 PolarHBondContact O-N 3.38Å
134	S	43.1	Very low	46.4	Very low	105 Å²	105	118.7 Å²	118.7	73%	0.734	68%	0.684	S	S	*	*			trans	-30.5	104.5	159.7	46.3	0	0	0	0	109.8	Q132 G136	Q132-S134 VanDerWaalsContact C-N 3.33Å; Q132-S134 PolarHBondContact O-N 3.26Å; S134-G136 VanDerWaalsContact C-N 3.28Å; S134-G136 PolarHBondContact O-N 3.25Å
135	V	36.3	Very low	45.2	Very low	131 Å²	131	121.8 Å²	121.8	79%	0.794	70%	0.696	S	S	*	*			trans	-68	97.4	165.1	175.7	0	0	0	0	105.6	V133 G137	V133-V135 PolarHBondContact O-N 3.38Å; V135-G137 PolarHBondContact O-N 2.79Å
136	G	37.4	Very low	44.3	Very low	79 Å²	79	125.7 Å²	125.7	81%	0.814	72%	0.716	S	S	*	*			trans	-61.7	117.8	156.5	0	0	0	0	0	108	S134	S134-G136 VanDerWaalsContact C-N 3.28Å; S134-G136 PolarHBondContact O-N 3.25Å
137	G	33.7	Very low	43.1	Very low	65 Å²	65	129.6 Å²	129.6	67%	0.67	73%	0.73	S	S	*	*	S	Bend	trans	154.5	68.3	179.1	0	0	0	0	0	112.7	V135	V135-G137 PolarHBondContact O-N 2.79Å
138	S	43.9	Very low	42	Very low	132 Å²	132	130.5 Å²	130.5	92%	0.923	74%	0.736	S	S	*	*	S	Bend	trans	45.2	106.1	163.4	-85.3	0	0	0	0	119.1
139	G	42.1	Very low	41.4	Very low	71 Å²	71	134 Å²	134	73%	0.732	76%	0.764	S	S	*	*	S	Bend	trans	137.5	84	155.6	0	0	0	0	0	114
140	N	44.1	Very low	40.7	Very low	159 Å²	159	131.8 Å²	131.8	85%	0.85	77%	0.767	S	S	*	*			trans	56.7	94.3	157.5	-64.6	-17.7	0	0	0	117.7
141	K	38.9	Very low	40.3	Very low	215 Å²	215	127.7 Å²	127.7	94%	0.935	77%	0.769	S	S	*	*			trans	-171.1	141.5	132.6	-101.1	157.1	-169.9	-173.9	0	112.2
142	R	33.8	Very low	40	Very low	219 Å²	219	130.1 Å²	130.1	83%	0.826	78%	0.775	S	S	*	*			trans	79.9	91.2	179	-79.1	-173.8	167.8	-165.9	-1.3	117.4	S144	R142-S144 PolarHBondContact O-N 2.8Å; R142-S144 VanDerWaalsContact O-N 3.12Å
143	L	38.7	Very low	39.6	Very low	162 Å²	162	129.4 Å²	129.4	85%	0.848	78%	0.777	S	S	*	*			trans	-71.5	81	138.5	-78.6	159.5	0	0	0	107.2
144	S	36.6	Very low	39.7	Very low	80 Å²	80	129.2 Å²	129.2	56%	0.559	78%	0.78	S	S	*	*			trans	-78.4	119.7	158.5	44.8	0	0	0	0	107.3	R142 I146	R142-S144 PolarHBondContact O-N 2.8Å; R142-S144 VanDerWaalsContact O-N 3.12Å; S144-I146 PolarHBondContact O-N 3.41Å
145	T	39.9	Very low	39.4	Very low	132 Å²	132	131 Å²	131	81%	0.81	78%	0.781	S	S	*	*			trans	-20.8	117.6	153	43.1	0	0	0	0	112.4	D147	T145-D147 PolarHBondContact O-N 2.96Å
146	I	42.5	Very low	39.6	Very low	141 Å²	141	133.2 Å²	133.2	72%	0.723	79%	0.787	S	S	*	*			trans	-67.2	111.9	161.2	-65.4	169.6	0	0	0	105.7	S144 E148	S144-I146 PolarHBondContact O-N 3.41Å; I146-E148 VanDerWaalsContact C-N 3.33Å; I146-E148 HydrophobicContact CG2-CB 4.11Å; I146-E148 HydrophobicContact CG2-CG 3.65Å; I146-E148 PolarHBondContact O-N 2.89Å
147	D	36.6	Very low	39.7	Very low	135 Å²	135	133.5 Å²	133.5	72%	0.722	78%	0.776	S	S	*	*			trans	-78.3	90.1	160.3	-178.7	24.8	0	0	0	106.9	T145 S149	T145-D147 PolarHBondContact O-N 2.96Å; D147-S149 PolarHBondContact OD1-OG 3.41Å; D147-S149 VanDerWaalsContact OD1-OG 3.07Å
148	E	40.8	Very low	40	Very low	163 Å²	163	138.7 Å²	138.7	76%	0.762	78%	0.781	S	S	*	*			trans	-105.1	89.2	157.2	-85.4	177.5	-168.4	0	0	106.4	I146 G150	I146-E148 VanDerWaalsContact C-N 3.33Å; I146-E148 HydrophobicContact CG2-CB 4.11Å; I146-E148 HydrophobicContact CG2-CG 3.65Å; I146-E148 PolarHBondContact O-N 2.89Å; E148-G150 PolarHBondContact O-N 3.26Å
149	S	43.6	Very low	39.6	Very low	117 Å²	117	138.2 Å²	138.2	82%	0.818	77%	0.768	S	S	*	*			trans	-67.1	83.8	159.9	-70	0	0	0	0	108.3	D147	D147-S149 PolarHBondContact OD1-OG 3.41Å; D147-S149 VanDerWaalsContact OD1-OG 3.07Å
150	G	38.6	Very low	39.6	Very low	63 Å²	63	143 Å²	143	65%	0.649	77%	0.769	S	S	*	*	S	Bend	trans	-157.7	27	-177.7	0	0	0	0	0	113.9	E148	E148-G150 PolarHBondContact O-N 3.26Å
151	S	44.3	Very low	39.5	Very low	112 Å²	112	140.7 Å²	140.7	78%	0.783	76%	0.761	S	S	*	*	S	Bend	trans	67.9	139.1	167.7	-156.4	0	0	0	0	117
152	I	40	Very low	39.4	Very low	147 Å²	147	137.3 Å²	137.3	75%	0.754	75%	0.753	S	S	*	*			trans	106.4	20.6	168.7	-52.2	161.2	0	0	0	117.6
153	L	37.1	Very low	39.8	Very low	183 Å²	183	136.1 Å²	136.1	96%	0.958	76%	0.756	S	S	*	*			trans	-126	43.3	160.9	-67.6	175.4	0	0	0	113.3
154	S	42.5	Very low	39.8	Very low	102 Å²	102	132.3 Å²	132.3	71%	0.713	74%	0.744	S	S	*	*			trans	-76.8	139.5	143.5	-50.4	0	0	0	0	107
155	D	36.5	Very low	39.8	Very low	143 Å²	143	136.7 Å²	136.7	77%	0.765	76%	0.76	S	S	*	*			trans	101.1	52.3	173.7	-49.5	-18.6	0	0	0	116.8	S157	D155-S157 PolarHBondContact O-N 3.28Å
156	I	40.5	Very low	39.7	Very low	177 Å²	177	137.4 Å²	137.4	91%	0.908	76%	0.759	S	S	*	*				-83.5	72.4	126.9	-62	174.8	0	0	0	105.9	F158	I156-F158 PolarHBondContact O-N 2.95Å
157	S	39.1	Very low	39.3	Very low	85 Å²	85	142 Å²	142	59%	0.594	77%	0.767	S	S	*	*			trans	-65.3	119.1	166.7	169.8	0	0	0	0	107	D155 D159	D155-S157 PolarHBondContact O-N 3.28Å; S157-D159 PolarHBondContact O-N 3.48Å
158	F	40	Very low	39	Very low	175 Å²	175	143.3 Å²	143.3	77%	0.768	77%	0.774	S	S	*	*			trans	-64.4	89.4	166	-147.2	-91.9	0	0	0	106.6	I156 K160	I156-F158 PolarHBondContact O-N 2.95Å; F158-K160 VanDerWaalsContact C-N 3.26Å; F158-K160 HydrophobicContact CD1-CG 4.14Å; F158-K160 HydrophobicContact CE1-CG 4.4Å; F158-K160 PolarHBondContact O-N 3.48Å
159	D	35	Very low	38.4	Very low	121 Å²	121	140.5 Å²	140.5	65%	0.647	77%	0.772	S	S	*	*			trans	-71	87.1	176.7	-169.7	13.2	0	0	0	109.3	S157 T161	S157-D159 PolarHBondContact O-N 3.48Å; D159-T161 VanDerWaalsContact C-N 3.3Å; D159-T161 VanDerWaalsContact CG-OG1 3.27Å; D159-T161 WeakPolarHBondContact OD1-CB 3.28Å; D159-T161 VanDerWaalsContact OD1-CG2 3.22Å; D159-T161 WeakPolarHBondContact OD1-CG2 3.45Å; D159-T161 PolarHBondContact OD1-N 3.45Å; D159-T161 PolarHBondContact OD1-OG1 2.89Å; D159-T161 PolarHBondContact OD2-OG1 3.42Å
160	K	43.3	Very low	37.7	Very low	172 Å²	172	140 Å²	140	75%	0.748	77%	0.769	S	S	*	*			trans	-87.6	75.8	153	-80.2	-175.5	177.2	-174.9	0	107.3	F158 D162	F158-K160 VanDerWaalsContact C-N 3.26Å; F158-K160 HydrophobicContact CD1-CG 4.14Å; F158-K160 HydrophobicContact CE1-CG 4.4Å; F158-K160 PolarHBondContact O-N 3.48Å; K160-D162 PolarHBondContact O-N 2.93Å
161	T	41.6	Very low	37.5	Very low	111 Å²	111	143.1 Å²	143.1	68%	0.681	78%	0.775	S	S	*	*			trans	-81.3	83.5	152	31.7	0	0	0	0	106.6	D159 E163	D159-T161 VanDerWaalsContact C-N 3.3Å; D159-T161 VanDerWaalsContact CG-OG1 3.27Å; D159-T161 WeakPolarHBondContact OD1-CB 3.28Å; D159-T161 VanDerWaalsContact OD1-CG2 3.22Å; D159-T161 WeakPolarHBondContact OD1-CG2 3.45Å; D159-T161 PolarHBondContact OD1-N 3.45Å; D159-T161 PolarHBondContact OD1-OG1 2.89Å; D159-T161 PolarHBondContact OD2-OG1 3.42Å; T161-E163 PolarHBondContact O-N 3.42Å
162	D	36.3	Very low	36.9	Very low	144 Å²	144	143.6 Å²	143.6	77%	0.77	77%	0.773	S	S	*	*			trans	-65.6	116.2	159.3	-163.7	16.9	0	0	0	106.9	K160 S164	K160-D162 PolarHBondContact O-N 2.93Å; D162-S164 PolarHBondContact O-N 2.97Å
163	E	42.9	Very low	36.4	Very low	193 Å²	193	146.1 Å²	146.1	90%	0.902	78%	0.778	S	S	*	*			trans	-66.2	95.8	163.9	-75.3	-174.3	140.4	0	0	108.1	T161	T161-E163 PolarHBondContact O-N 3.42Å
164	S	38.2	Very low	36.1	Very low	83 Å²	83	141.8 Å²	141.8	58%	0.58	77%	0.769	S	S	*	*			trans	-164	87.9	155.9	-169.5	0	0	0	0	110.8	D162 D166	D162-S164 PolarHBondContact O-N 2.97Å; S164-D166 VanDerWaalsContact C-N 3.32Å; S164-D166 PolarHBondContact O-N 2.98Å
165	L	36.6	Very low	35.4	Very low	172 Å²	172	144 Å²	144	90%	0.901	78%	0.778	S	S	*	*			trans	-80.3	87.9	154.5	-74.3	175.9	0	0	0	107.7
166	D	37.3	Very low	35.1	Very low	147 Å²	147	147.9 Å²	147.9	79%	0.786	78%	0.782	S	S	*	*			trans	-119.7	121.8	155.2	-93.7	-25.3	0	0	0	108.5	S164	S164-D166 VanDerWaalsContact C-N 3.32Å; S164-D166 PolarHBondContact O-N 2.98Å
167	W	33.9	Very low	34.5	Very low	237 Å²	237	146.7 Å²	146.7	90%	0.898	78%	0.776	S	S	*	*			trans	-63.3	124.3	174.5	-83.9	83.4	0	0	0	109.9
168	D	30.6	Very low	34	Very low	163 Å²	163	151.7 Å²	151.7	87%	0.872	79%	0.787	S	S	*	*				-164.9	141.6	124.8	-107.6	-25.5	0	0	0	114.5
169	S	29.6	Very low	33.5	Very low	103 Å²	103	153.1 Å²	153.1	72%	0.72	79%	0.793	S	S	*	*			trans	-84.1	131.7	-179.1	176.6	0	0	0	0	110.8
170	S	28.9	Very low	33.1	Very low	107 Å²	107	157.4 Å²	157.4	75%	0.748	80%	0.8	S	S	*	*			trans	154.4	152.3	131.3	56.6	0	0	0	0	113.8
171	V	33.2	Very low	32.3	Very low	129 Å²	129	154.6 Å²	154.6	78%	0.782	79%	0.79	S	S	*	*			trans	98.8	79.8	162.2	-160.5	0	0	0	0	118.5
172	V	31.4	Very low	31.5	Very low	121 Å²	121	156.5 Å²	156.5	73%	0.733	79%	0.789	S	S	*	*			trans	3.6	127.7	132.6	-144.1	0	0	0	0	119.2
173	K	29.9	Very low	31.2	Very low	200 Å²	200	159.5 Å²	159.5	87%	0.87	79%	0.789	S	S	*	*				165.5	140.8	102.4	-93.4	-175.4	-179.9	167.3	0	114.3
174	A	30.5	Very low	30.5	Very low	92 Å²	92	161 Å²	161	76%	0.76	79%	0.787	S	S	*	*			trans	-81.6	150.3	174.5	0	0	0	0	0	113.1
175	V	29.1	Very low	30.2	Very low	148 Å²	148	162.2 Å²	162.2	90%	0.897	80%	0.795	S	S	*	*			trans	-151.1	127	144.7	177.2	0	0	0	0	109.9
176	R	29	Very low	29.9	Very low	225 Å²	225	159.1 Å²	159.1	85%	0.849	79%	0.788	S	S	*	*			trans	-90.6	161.3	165.5	-67.7	176.6	157.9	168.2	-5.2	110.4
177	L	27.7	Very low	29.6	Very low	152 Å²	152	163.7 Å²	163.7	80%	0.796	79%	0.794	S	S	*	*			trans	113.6	128.5	141.1	-71.7	164.1	0	0	0	119.5
178	K	29.2	Very low	29.5	Very low	190 Å²	190	160.3 Å²	160.3	83%	0.826	79%	0.788	S	S	*	*			trans	104.6	102.6	133.5	-85.3	173.2	178.9	-178.2	0	120.8
179	K	28.9	Very low	29.4	Very low	205 Å²	205	162.9 Å²	162.9	89%	0.891	79%	0.792	S	S	*	*			trans	-18.7	129.2	132.5	-175	179.1	-172.5	175.9	0	117
180	R	26.5	Very low	29.6	Very low	212 Å²	212	164.6 Å²	164.6	80%	0.8	79%	0.792	S	S	*	*				-174.5	133.1	127.1	-138.9	-172.3	156.3	152.4	-6.7	115.8
181	E	26.8	Very low	29.6	Very low	112 Å²	112	168.7 Å²	168.7	52%	0.523	80%	0.799	S	S	.	*			trans	33.7	128.5	142.1	-73	-172.6	123.7	0	0	127.6
182	K	25.7	Very low	29.5	Very low	151 Å²	151	166.1 Å²	166.1	66%	0.657	80%	0.799	S	S	*	*				57.2	125.4	119.6	-70.1	178.9	-175.7	148.1	0	123.6
183	R	29.1	Very low	30	Very low	207 Å²	207	166.4 Å²	166.4	78%	0.781	80%	0.803	S	S	*	*			trans	68.2	148	133.6	-64.8	-179.6	178.4	-171.4	-1.4	115.4
184	R	29.5	Very low	30.9	Very low	225 Å²	225	163.1 Å²	163.1	85%	0.849	80%	0.802	S	S	*	*			cis	-177.2	145.5	33.2	-140.9	176.8	-167.6	-178.1	2.4	109.2
185	S	29.9	Very low	30.9	Very low	109 Å²	109	162.1 Å²	162.1	76%	0.762	80%	0.801	S	S	*	*			trans	168.3	122.9	137.5	65.7	0	0	0	0	107.1
186	S	30.6	Very low	31.5	Very low	106 Å²	106	160.8 Å²	160.8	74%	0.741	80%	0.795	S	S	*	*			cis	71.4	102.7	48.6	80.5	0	0	0	0	114.9
187	R	32.2	Very low	31.7	Very low	243 Å²	243	158.2 Å²	158.2	92%	0.917	80%	0.797	S	S	*	*				-177.1	145.8	117.9	-101.9	175.2	168.7	-165.5	-4.1	113
188	Q	30.9	Very low	31.7	Very low	167 Å²	167	159.4 Å²	159.4	78%	0.78	80%	0.796	S	S	*	*			trans	-78.1	160.9	-172	-69.5	131.1	-50.1	0	0	114.6
189	F	29.4	Very low	31.7	Very low	217 Å²	217	158.8 Å²	158.8	95%	0.952	79%	0.793	S	S	*	*			trans	-156	153.4	134.6	-108.2	-79.1	0	0	0	111.2
190	I	32.5	Very low	31.5	Very low	139 Å²	139	154.4 Å²	154.4	71%	0.713	78%	0.784	S	S	*	*			trans	-111.4	144.3	-155.5	-77.6	167.4	0	0	0	112.9
191	E	30.4	Very low	31.6	Very low	193 Å²	193	155.5 Å²	155.5	90%	0.902	79%	0.788	S	S	*	*			trans	36.3	142.1	152	-69.6	-178.4	142.3	0	0	126.6
192	G	30.8	Very low	31.6	Very low	75 Å²	75	154.2 Å²	154.2	77%	0.773	79%	0.791	S	S	*	*			trans	160.4	115.2	147.1	0	0	0	0	0	116
193	P	40.8	Very low	31.8	Very low	126 Å²	126	155.1 Å²	155.1	82%	0.818	80%	0.801	S	S	*	*			trans	-110.6	-163.5	-179.2	43.7	-33.1	0	0	0	112
194	P	48.5	Very low	31.7	Very low	132 Å²	132	148.7 Å²	148.7	86%	0.857	80%	0.8	S	S	*	*			cis	-133.4	-178.2	-12.6	37.1	-17.4	0	0	0	114.5
195	G	30.6	Very low	31.8	Very low	71 Å²	71	143.5 Å²	143.5	73%	0.732	80%	0.798	S	S	*	*			trans	145.4	154.9	147	0	0	0	0	0	119.3
196	P	43.3	Very low	32	Very low	120 Å²	120	144.8 Å²	144.8	78%	0.779	80%	0.801	S	S	*	*			trans	-120.8	168.3	-142.1	39.6	-25.9	0	0	0	115.6
197	L	31.5	Very low	32.1	Very low	170 Å²	170	145.9 Å²	145.9	89%	0.89	80%	0.803	S	S	*	*			trans	179.3	105.5	152.5	-93	144.1	0	0	0	108.7
198	K	28.4	Very low	32.3	Very low	178 Å²	178	140.2 Å²	140.2	77%	0.774	79%	0.791	S	S	*	*				63	118.1	82.5	-80.7	-173.4	-178.6	172.5	0	118
199	K	28.5	Very low	32.7	Very low	177 Å²	177	140.2 Å²	140.2	77%	0.77	79%	0.791	S	S	*	*			trans	76.2	144	141.5	-69.2	-177.9	178.6	-175.9	0	116.7
200	T	25.3	Very low	32.8	Very low	113 Å²	113	133.4 Å²	133.4	69%	0.693	78%	0.782	S	S	*	*			cis	-172.4	156.8	27.1	-4.1	0	0	0	0	110.7
201	R	27.9	Very low	32.9	Very low	235 Å²	235	134 Å²	134	89%	0.887	79%	0.787	S	S	*	*			trans	35.7	149.1	135.4	-78.5	178.9	171.8	-177.1	-4.2	120
202	S	28.5	Very low	33.2	Very low	84 Å²	84	134 Å²	134	59%	0.587	79%	0.787	S	S	*	*			cis	168.7	157.3	1.8	51.5	0	0	0	0	107.6
203	I	29.1	Very low	33.5	Very low	170 Å²	170	135.8 Å²	135.8	87%	0.872	79%	0.788	S	S	*	*			trans	70.6	136.9	151.4	-60.5	153.3	0	0	0	116.1
204	G	26.4	Very low	33.8	Very low	73 Å²	73	135.7 Å²	135.7	75%	0.753	78%	0.779	S	S	*	*			cis	-174.7	167.3	7.6	0	0	0	0	0	112
205	S	33.3	Very low	34	Very low	115 Å²	115	133.6 Å²	133.6	80%	0.804	76%	0.764	S	S	*	*			trans	-119.7	142.1	175	58.5	0	0	0	0	109.7
206	T	32.8	Very low	34.5	Very low	136 Å²	136	133.1 Å²	133.1	83%	0.834	75%	0.752	S	S	*	*			trans	-147.4	136	163.8	54.2	0	0	0	0	105.8
207	V	33.8	Very low	34.8	Very low	129 Å²	129	134.4 Å²	134.4	78%	0.782	75%	0.746	S	S	*	*				-164.4	122	52.3	167.6	0	0	0	0	106.8
208	D	34.7	Very low	35.7	Very low	124 Å²	124	130.5 Å²	130.5	66%	0.663	73%	0.729	S	S	*	*				72.4	135	99.6	-141.5	24.8	0	0	0	114.3
209	Q	40.5	Very low	37.2	Very low	167 Å²	167	126.4 Å²	126.4	78%	0.78	72%	0.719	S	S	*	*			cis	-175.2	150.8	45.7	-161.1	165.5	71.4	0	0	112.7
210	G	31.3	Very low	38	Very low	74 Å²	74	123.4 Å²	123.4	76%	0.763	71%	0.711	S	S	*	*			trans	159.7	100.6	164.1	0	0	0	0	0	115.5
211	N	35.5	Very low	39.6	Very low	152 Å²	152	122.1 Å²	122.1	81%	0.813	70%	0.703	S	S	*	*			trans	-82	142.8	-165.7	-62.5	-36.6	0	0	0	117.3
212	E	36	Very low	41.5	Very low	192 Å²	192	115.7 Å²	115.7	90%	0.897	69%	0.69	S	S	*	*			trans	-135.3	118.2	143.8	-72.1	-171.9	169.8	0	0	108.1
213	S	37.6	Very low	43	Very low	113 Å²	113	114.8 Å²	114.8	79%	0.79	68%	0.682	S	S	*	*			trans	-99.1	104.3	-174.5	63.3	0	0	0	0	112.1
214	I	46.7	Very low	44.6	Very low	125 Å²	125	112.5 Å²	112.5	64%	0.641	68%	0.681	S	S	*	*			trans	-88.3	123.4	163.9	-61.1	168.7	0	0	0	107.4	I235	I214-I235 HydrophobicContact CG2-CG2 4.15Å
215	V	52	Low	46.4	Very low	88 Å²	88	116.4 Å²	116.4	53%	0.533	69%	0.685	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.7	110.3	175.3	-177.1	0	0	0	0	108.9	K217	V215-K217 HydrophobicContact CG1-CG 4.39Å
216	A	42.6	Very low	47.5	Very low	60 Å²	60	114.5 Å²	114.5	50%	0.496	68%	0.684	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.8	125.2	168.4	0	0	0	0	0	108.8	I235	A216-I235 HydrophobicContact CB-CG1 4.11Å
217	K	48.4	Very low	48.9	Very low	147 Å²	147	109.7 Å²	109.7	64%	0.639	66%	0.66	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.4	120.8	173.3	-79	-175.8	177.3	-180	0	109.2	V215 S233 T234	V215-K217 HydrophobicContact CG1-CG 4.39Å; K217-S233 WeakPolarHBondContact O-CA 2.96Å; K217-T234 PolarHBondContact N-O 3.38Å; K217-T234 PolarHBondContact O-N 2.96Å; K217-T234 PolarHBondContact O-OG1 3.32Å
218	T	49.8	Very low	49.8	Very low	89 Å²	89	109.2 Å²	109.2	55%	0.546	66%	0.66	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.6	119.8	171.8	-54.4	0	0	0	0	108.7	I232 S233	T218-I232 WeakPolarHBondContact CA-O 3.42Å; T218-S233 WeakPolarHBondContact OG1-CB 3.43Å; T218-S233 PolarHBondContact OG1-OG 2.9Å
219	T	59.6	Low	50.9	Low	92 Å²	92	108.2 Å²	108.2	56%	0.564	65%	0.654	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.1	127.5	180	-9.4	0	0	0	0	108.2	I232	T219-I232 PolarHBondContact N-O 3.36Å; T219-I232 PolarHBondContact O-N 3.47Å
220	L	45.6	Very low	51.4	Low	114 Å²	114	106.4 Å²	106.4	60%	0.597	65%	0.645	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109	121	177.4	-69	168.4	0	0	0	108.3	I229 A231	L220-I229 HydrophobicContact CD2-CG2 4.35Å; L220-A231 HydrophobicContact CD2-CB 3.23Å
221	T	60.3	Low	52.2	Low	86 Å²	86	106 Å²	106	53%	0.528	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.2	113.7	174.3	31.2	0	0	0	0	109.1	E230	T221-E230 PolarHBondContact N-O 3.49Å; T221-E230 PolarHBondContact O-N 3.39Å; T221-E230 PolarHBondContact OG1-O 3.02Å
222	V	67.3	Low	53.2	Low	99 Å²	99	103.6 Å²	103.6	60%	0.6	62%	0.62	S	S	*	*			trans	-107	109.9	176.3	-176.3	0	0	0	0	107.8	I229	V222-I229 HydrophobicContact CB-CG1 4.41Å; V222-I229 HydrophobicContact CG1-CD1 4.26Å; V222-I229 HydrophobicContact CG1-CG1 4.11Å; V222-I229 HydrophobicContact CG2-CB 4.47Å; V222-I229 HydrophobicContact CG2-CD1 3.92Å; V222-I229 HydrophobicContact CG2-CG1 3.94Å; V222-I229 HydrophobicContact CG2-CG2 3.78Å
223	P	60.8	Low	53.5	Low	66 Å²	66	97.7 Å²	97.7	43%	0.429	60%	0.601	S	S	.	*			trans	-71.2	140.3	174	-13.7	28.7	0	0	0	110.7	D225	P223-D225 PolarHBondContact O-N 2.96Å; P223-D225 VanDerWaalsContact O-N 3.13Å
224	S	62.8	Low	54	Low	121 Å²	121	96.3 Å²	96.3	85%	0.846	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-9.5	-178.5	43	0	0	0	0	114.9
225	D	62.2	Low	54.2	Low	155 Å²	155	96.1 Å²	96.1	83%	0.829	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	19	-174.1	-58	-18.3	0	0	0	113.4	P223 G227	P223-D225 PolarHBondContact O-N 2.96Å; P223-D225 VanDerWaalsContact O-N 3.13Å; D225-G227 PolarHBondContact O-N 2.98Å
226	G	57.4	Low	53.6	Low	76 Å²	76	99.1 Å²	99.1	78%	0.784	60%	0.595	S	S	*	*	S	Bend	trans	76.7	15.5	171.7	0	0	0	0	0	115.9
227	G	63.1	Low	53.6	Low	34 Å²	34	102 Å²	102	35%	0.351	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-76.3	167.9	172.8	0	0	0	0	0	114.1	D225	D225-G227 PolarHBondContact O-N 2.98Å
228	P	52.4	Low	53.1	Low	119 Å²	119	101.1 Å²	101.1	77%	0.773	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-63.5	141.1	-176.7	25.5	-32.5	0	0	0	112.4
229	I	56.1	Low	52.3	Low	103 Å²	103	102 Å²	102	53%	0.528	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-82.1	122.2	-176.2	-58.1	172.7	0	0	0	109.6	L220 V222	L220-I229 HydrophobicContact CD2-CG2 4.35Å; V222-I229 HydrophobicContact CB-CG1 4.41Å; V222-I229 HydrophobicContact CG1-CD1 4.26Å; V222-I229 HydrophobicContact CG1-CG1 4.11Å; V222-I229 HydrophobicContact CG2-CB 4.47Å; V222-I229 HydrophobicContact CG2-CD1 3.92Å; V222-I229 HydrophobicContact CG2-CG1 3.94Å; V222-I229 HydrophobicContact CG2-CG2 3.78Å
230	E	51.2	Low	50.8	Low	130 Å²	130	108.6 Å²	108.6	61%	0.607	64%	0.636	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-95.6	135	175.1	-71.4	-170.5	166.5	0	0	111.5	T221	T221-E230 PolarHBondContact N-O 3.49Å; T221-E230 PolarHBondContact O-N 3.39Å; T221-E230 PolarHBondContact OG1-O 3.02Å
231	A	48.9	Very low	50.2	Low	64 Å²	64	107.8 Å²	107.8	53%	0.529	64%	0.641	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.5	117.8	-178.7	0	0	0	0	0	110.1	L220	L220-A231 HydrophobicContact CD2-CB 3.23Å
232	I	56.6	Low	48.7	Very low	102 Å²	102	111.5 Å²	111.5	52%	0.523	66%	0.656	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.5	122.4	178.3	-57.6	175.2	0	0	0	109.3	T218 T219	T218-I232 WeakPolarHBondContact CA-O 3.42Å; T219-I232 PolarHBondContact N-O 3.36Å; T219-I232 PolarHBondContact O-N 3.47Å
233	S	42.9	Very low	46.8	Very low	69 Å²	69	118.4 Å²	118.4	48%	0.483	67%	0.671	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.2	130.1	176	-161	0	0	0	0	111.2	K217 T218	K217-S233 WeakPolarHBondContact O-CA 2.96Å; T218-S233 WeakPolarHBondContact OG1-CB 3.43Å; T218-S233 PolarHBondContact OG1-OG 2.9Å
234	T	48.4	Very low	45.2	Very low	83 Å²	83	120.1 Å²	120.1	51%	0.509	69%	0.685	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.8	129.8	174.8	44.4	0	0	0	0	110.4	K217	K217-T234 PolarHBondContact N-O 3.38Å; K217-T234 PolarHBondContact O-N 2.96Å; K217-T234 PolarHBondContact O-OG1 3.32Å
235	I	48.8	Very low	43.6	Very low	122 Å²	122	123.7 Å²	123.7	63%	0.626	69%	0.688	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.1	120.5	179.2	-54.9	172.8	0	0	0	107.3	I214 A216	I214-I235 HydrophobicContact CG2-CG2 4.15Å; A216-I235 HydrophobicContact CB-CG1 4.11Å
236	Q	40.9	Very low	42	Very low	151 Å²	151	127.5 Å²	127.5	71%	0.706	69%	0.691	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-119.8	132.3	173.5	-82	-176.9	-18.1	0	0	110.2
237	T	42.6	Very low	40.6	Very low	119 Å²	119	133.7 Å²	133.7	73%	0.73	70%	0.696	S	S	*	*			trans	-101.1	127.7	167.6	49.8	0	0	0	0	108.9
238	V	37.7	Very low	38.9	Very low	129 Å²	129	138.9 Å²	138.9	78%	0.782	72%	0.722	S	S	*	*			trans	-105.3	114.2	177.7	-175.6	0	0	0	0	108.6
239	P	33.2	Very low	37.7	Very low	109 Å²	109	137 Å²	137	71%	0.708	72%	0.724	S	S	*	*			trans	-77.3	132.1	172.6	28.4	-29.4	0	0	0	110.4	S241	P239-S241 PolarHBondContact O-N 2.74Å
240	Y	27.8	Very low	36.3	Very low	229 Å²	229	138.6 Å²	138.6	90%	0.898	74%	0.739	S	S	*	*			trans	-83.2	106.8	170.5	-174.9	-98.1	0	0	0	109.7
241	S	33	Very low	35.2	Very low	98 Å²	98	140.8 Å²	140.8	69%	0.685	75%	0.753	S	S	*	*			trans	-130.3	121.7	161.6	39.6	0	0	0	0	111.2	P239	P239-S241 PolarHBondContact O-N 2.74Å
242	L	29.3	Very low	34.3	Very low	163 Å²	163	146.5 Å²	146.5	85%	0.853	77%	0.769	S	S	*	*			trans	39.6	114.3	147.8	-61.3	169.6	0	0	0	118.2
243	R	27.5	Very low	33.4	Very low	244 Å²	244	145.9 Å²	145.9	92%	0.921	77%	0.772	S	S	*	*			trans	-138.6	115.2	155.4	-144.4	-178.2	-151.6	-161	9.2	111.9
244	S	26.5	Very low	32.6	Very low	103 Å²	103	154.4 Å²	154.4	72%	0.72	79%	0.793	S	S	*	*				-172.8	82.1	123.2	-179.6	0	0	0	0	110.7
245	Q	28.2	Very low	31.4	Very low	195 Å²	195	157.4 Å²	157.4	91%	0.911	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-95	126.2	143.1	-86.9	-170.7	-3.1	0	0	107.3
246	R	28.9	Very low	30.4	Very low	235 Å²	235	156.7 Å²	156.7	89%	0.887	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-82.4	137.3	169.4	-80	-177.1	-177.8	176.6	0	109.1
247	K	28.3	Very low	29.5	Very low	206 Å²	206	158.3 Å²	158.3	90%	0.896	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-59.7	137.1	172.6	-69.7	173.9	170.9	-177.4	0	111.5
248	T	26.7	Very low	28.7	Very low	143 Å²	143	157.4 Å²	157.4	88%	0.877	82%	0.819	S	S	*	*			trans	-113.3	131.1	149.6	38.1	0	0	0	0	107.8
249	G	27.4	Very low	28.2	Very low	79 Å²	79	157.1 Å²	157.1	81%	0.814	82%	0.822	S	S	*	*			trans	-89.7	146.7	175.2	0	0	0	0	0	111.1
250	T	28	Very low	27.9	Very low	138 Å²	138	160.6 Å²	160.6	85%	0.847	83%	0.834	S	S	*	*			trans	-77.2	129.6	177.9	-46.9	0	0	0	0	111.2
251	L	27.8	Very low	27.9	Very low	175 Å²	175	153.7 Å²	153.7	92%	0.916	83%	0.832	S	S	*	*			trans	-139.4	149.6	151.7	-85.4	173.7	0	0	0	109.1
252	Q	30	Very low	27.5	Very low	184 Å²	184	154.2 Å²	154.2	86%	0.86	84%	0.836	S	S	*	*			trans	-72.8	171.8	-160.1	-100.1	-117.6	-43.9	0	0	116.7
253	P	36.5	Very low	27.3	Very low	89 Å²	89	157 Å²	157	58%	0.578	84%	0.835	S	S	*	*			trans	-99.2	152.4	-163.4	37.6	-29.5	0	0	0	113.2
254	W	26.1	Very low	27.2	Very low	248 Å²	248	153.3 Å²	153.3	94%	0.939	83%	0.828	S	S	*	*			trans	-149.2	120.9	157.6	-92	-3.9	0	0	0	112.8
255	N	24.2	Very low	27.1	Very low	146 Å²	146	156.4 Å²	156.4	78%	0.781	84%	0.836	S	S	*	*			trans	8.1	138.4	146.7	-56.1	-13.3	0	0	0	122.9
256	S	26.8	Very low	26.9	Very low	107 Å²	107	155.8 Å²	155.8	75%	0.748	83%	0.833	S	S	*	*			trans	27.2	124.3	135.5	-46.4	0	0	0	0	120.7
257	E	23.7	Very low	26.6	Very low	186 Å²	186	149.5 Å²	149.5	87%	0.869	83%	0.825	S	S	*	*				177.2	155	98.6	-95.3	-174.1	167.2	0	0	112.9
258	S	26.2	Very low	26.4	Very low	100 Å²	100	149.1 Å²	149.1	70%	0.699	82%	0.823	S	S	*	*			trans	-35.5	150	175	50	0	0	0	0	118.9
259	S	26.4	Very low	26.3	Very low	123 Å²	123	148 Å²	148	86%	0.86	82%	0.821	S	S	*	*				179.3	151.9	108.3	37.2	0	0	0	0	113.9
260	L	27.6	Very low	26.1	Very low	182 Å²	182	153.3 Å²	153.3	95%	0.953	83%	0.825	S	S	*	*			trans	-65.8	148.9	-171	-67.6	138.7	0	0	0	114.5
261	G	26.3	Very low	26	Very low	83 Å²	83	152.5 Å²	152.5	86%	0.856	83%	0.825	S	S	*	*			trans	-157.7	101.1	162.9	0	0	0	0	0	110.2
262	S	25.4	Very low	25.9	Very low	109 Å²	109	151.7 Å²	151.7	76%	0.762	82%	0.821	S	S	*	*			trans	-89.2	160.1	-175	-167.8	0	0	0	0	112.2
263	R	25.6	Very low	25.6	Very low	222 Å²	222	145.9 Å²	145.9	84%	0.838	81%	0.81	S	S	*	*			trans	84.5	137.9	164.5	-53.9	179.5	-179.8	-179.3	-1.4	114.5
264	Q	24.6	Very low	25.2	Very low	167 Å²	167	146.4 Å²	146.4	78%	0.78	82%	0.816	S	S	*	*			cis	-160.5	143.4	27.9	-143.3	163.6	-6.9	0	0	110.8
265	L	25.3	Very low	25.3	Very low	168 Å²	168	139.7 Å²	139.7	88%	0.88	81%	0.807	S	S	*	*			trans	-80.4	127.5	168.8	-168	92.5	0	0	0	108.1
266	E	23.3	Very low	25.7	Very low	181 Å²	181	138.4 Å²	138.4	85%	0.846	81%	0.805	S	S	*	*			trans	-138.2	143.3	160	-81.6	-169.9	155.8	0	0	111
267	S	22.6	Very low	26.1	Very low	103 Å²	103	138.7 Å²	138.7	72%	0.72	80%	0.804	S	S	*	*			trans	-114.7	158.5	-162.4	55.4	0	0	0	0	112.7
268	K	23.7	Very low	26.6	Very low	199 Å²	199	138.7 Å²	138.7	87%	0.865	80%	0.804	S	S	*	*			trans	84.9	121.4	161	-69.1	-176.5	170.3	-176.6	0	118
269	S	24.2	Very low	26.8	Very low	118 Å²	118	141.3 Å²	141.3	83%	0.825	81%	0.81	S	S	*	*				-170	137.4	86.2	56.1	0	0	0	0	112
270	E	24.8	Very low	27.1	Very low	191 Å²	191	142.8 Å²	142.8	89%	0.893	81%	0.808	S	S	*	*			trans	-60.9	146.1	172.8	-63.2	161.2	146.2	0	0	112.3
271	S	25.1	Very low	27.6	Very low	121 Å²	121	138.2 Å²	138.2	85%	0.846	80%	0.797	S	S	*	*			trans	-145.6	96.1	140.3	69	0	0	0	0	108
272	D	25.2	Very low	28.7	Very low	159 Å²	159	138.5 Å²	138.5	85%	0.85	80%	0.8	S	S	*	*			trans	-61.2	143.5	169	-151.1	-5.8	0	0	0	110
273	G	24.5	Very low	30.5	Very low	61 Å²	61	136.6 Å²	136.6	63%	0.629	78%	0.784	S	S	*	*			trans	-158.3	45.6	-172.3	0	0	0	0	0	111	S275	G273-S275 PolarHBondContact O-N 3.48Å; G273-S275 VanDerWaalsContact O-N 3.08Å
274	S	28.4	Very low	32.8	Very low	100 Å²	100	131.4 Å²	131.4	70%	0.699	76%	0.764	S	S	*	*			trans	-49.5	111.1	163.5	177.4	0	0	0	0	109.5
275	S	27.8	Very low	35.6	Very low	107 Å²	107	128.5 Å²	128.5	75%	0.748	75%	0.753	S	S	*	*			trans	-112.3	89.7	167	-52.3	0	0	0	0	107	G273	G273-S275 PolarHBondContact O-N 3.48Å; G273-S275 VanDerWaalsContact O-N 3.08Å
276	T	31.9	Very low	38.3	Very low	120 Å²	120	121.5 Å²	121.5	74%	0.736	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-53.7	127.9	161.4	23.9	0	0	0	0	109.4
277	P	36.5	Very low	41.3	Very low	112 Å²	112	117.3 Å²	117.3	73%	0.727	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-84.9	116.2	167	8.3	8.4	0	0	0	108.8
278	Q	32.8	Very low	44.6	Very low	187 Å²	187	114.1 Å²	114.1	87%	0.874	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-66.1	146.2	165	-76.7	177.2	-36.2	0	0	111.1
279	N	30.6	Very low	47.7	Very low	155 Å²	155	107.5 Å²	107.5	83%	0.829	65%	0.646	S	S	*	*			trans	-36.2	128.1	177.8	-91.2	-30.9	0	0	0	116.3
280	N	33.1	Very low	50.9	Low	153 Å²	153	105.6 Å²	105.6	82%	0.818	63%	0.633	S	S	*	*	S	Bend	trans	-148.7	110.7	135.3	-103.7	-13.9	0	0	0	108.6
281	A	38.7	Very low	53.9	Low	86 Å²	86	102.1 Å²	102.1	71%	0.711	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	36.4	80.1	165.5	0	0	0	0	0	116.7	V283	A281-V283 WeakPolarHBondContact O-CB 3.43Å; A281-V283 WeakPolarHBondContact O-CG2 3.15Å; A281-V283 PolarHBondContact O-N 2.95Å
282	G	48.4	Very low	56.9	Low	90 Å²	90	100.9 Å²	100.9	93%	0.928	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.6	3.1	150.9	0	0	0	0	0	121
283	V	63.6	Low	59.7	Low	69 Å²	69	93.6 Å²	93.6	42%	0.418	56%	0.563	S	S	.	*			trans	-110.2	122.3	-168.3	176.4	0	0	0	0	109	A281 L285 L332 P333	A281-V283 WeakPolarHBondContact O-CB 3.43Å; A281-V283 WeakPolarHBondContact O-CG2 3.15Å; A281-V283 PolarHBondContact O-N 2.95Å; V283-L285 PolarHBondContact O-N 3Å; V283-L332 HydrophobicContact CG1-CB 3.76Å; V283-P333 HydrophobicContact CG1-CB 3.67Å; V283-P333 HydrophobicContact CG1-CG 4.44Å
284	R	74.2	Confident	62.5	Low	113 Å²	113	97.1 Å²	97.1	43%	0.426	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-58.1	121.4	-178.8	-175	170.5	174.6	149	3.1	111.1	D317 P333 C334	R284-D317 IonicContact CZ-OD2 3.31Å; R284-D317 IonicContact NE-OD2 2.73Å; R284-D317 IonicContact NH2-OD1 2.72Å; R284-D317 IonicContact NH2-OD2 3.61Å; R284-D317 PolarHBondContact NH2-OD2 3.48Å; R284-P333 HydrophobicContact CB-CB 4.32Å; R284-P333 CarbonylContact O-C 3.49Å; R284-P333 WeakPolarHBondContact O-CA 3.39Å; R284-C334 VanDerWaalsContact CD-O 3.24Å; R284-C334 WeakPolarHBondContact CD-O 3.3Å; R284-C334 HydrophobicContact CG-CB 4.26Å; R284-C334 PolarHBondContact O-N 2.86Å
285	L	82.7	Confident	64.9	Low	105 Å²	105	100.2 Å²	100.2	55%	0.55	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-84.5	160.8	177.9	-61.7	176.4	0	0	0	111.7	V283 L332 C334	V283-L285 PolarHBondContact O-N 3Å; L285-L332 HydrophobicContact CD2-CD1 3.94Å; L285-L332 HydrophobicContact CD2-CD2 3.86Å; L285-C334 WeakPolarHBondContact O-CB 3.24Å
286	H	82.9	Confident	67.4	Low	21 Å²	21	98 Å²	98	10%	0.097	55%	0.55	C	S	.	*	P	Polyproline II helix	trans	-82.8	130.2	177	-67.8	-87.7	0	0	0	111.7	F288 C315 C318 P331 C334	H286-F288 HydrophobicContact CB-CD2 3.92Å; H286-F288 HydrophobicContact CB-CE1 4.13Å; H286-F288 HydrophobicContact CB-CE2 3.32Å; H286-F288 HydrophobicContact CB-CZ 3.43Å; H286-F288 VanDerWaalsContact CB-CZ 3.43Å; H286-F288 AromaticContact CG-CZ 3.79Å; H286-C315 HydrophobicContact CB-CB 4.34Å; H286-C318 PolarHBondContact CE1-SG 3.15Å; H286-C318 PolarHBondContact ND1-SG 3.02Å; H286-P331 PolarHBondContact NE2-O 3.21Å; H286-C334 HydrophobicContact CB-CB 4.32Å; H286-C334 WeakPolarHBondContact ND1-CB 3.15Å; H286-C334 PolarHBondContact ND1-SG 3.36Å; H286-C334 VanDerWaalsContact ND1-SG 3.4Å
287	E	86.8	Confident	69.8	Low	93 Å²	93	95.1 Å²	95.1	44%	0.435	53%	0.528	S	S	.	.			trans	-91.1	101.7	168.9	-172.4	-172.5	147.2	0	0	109.9	C315 R316	E287-C315 CarbonylContact O-C 3.58Å; E287-C315 VanDerWaalsContact O-CA 3.24Å; E287-C315 WeakPolarHBondContact O-CA 3.27Å; E287-R316 PolarHBondContact O-N 3.41Å; E287-R316 WeakPolarHBondContact OE1-CD 3.48Å; E287-R316 IonicContact OE1-NH1 3.1Å; E287-R316 PolarHBondContact OE1-NH1 2.97Å; E287-R316 VanDerWaalsContact OE1-NH1 3.1Å
288	F	90.3	Very high	72	Confident	36 Å²	36	92.6 Å²	92.6	16%	0.158	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	134.4	-175.4	-70.7	-71.8	0	0	0	113.6	H286 L313 C315 V320 T322 R327 C330	H286-F288 HydrophobicContact CB-CD2 3.92Å; H286-F288 HydrophobicContact CB-CE1 4.13Å; H286-F288 HydrophobicContact CB-CE2 3.32Å; H286-F288 HydrophobicContact CB-CZ 3.43Å; H286-F288 VanDerWaalsContact CB-CZ 3.43Å; H286-F288 AromaticContact CG-CZ 3.79Å; F288-L313 HydrophobicContact CB-CB 4.13Å; F288-L313 HydrophobicContact CB-CD1 4.46Å; F288-L313 HydrophobicContact CB-CD2 4.48Å; F288-L313 HydrophobicContact CD1-CB 3.75Å; F288-L313 HydrophobicContact CE1-CB 4.46Å; F288-L313 HydrophobicContact CG-CB 4.09Å; F288-L313 HydrophobicContact CG-CD1 4.41Å; F288-C315 HydrophobicContact CD1-CB 4.09Å; F288-C315 HydrophobicContact CE1-CB 3.99Å; F288-V320 HydrophobicContact CE1-CG1 3.79Å; F288-V320 HydrophobicContact CZ-CG1 4.22Å; F288-T322 HydrophobicContact CE1-CG2 3.73Å; F288-T322 HydrophobicContact CZ-CG2 4.09Å; F288-R327 HydrophobicContact CD2-CG 3.81Å; F288-R327 HydrophobicContact CE2-CG 3.67Å; F288-C330 HydrophobicContact CZ-CB 4.3Å
289	V	89.9	Confident	74.5	Confident	61 Å²	61	83.7 Å²	83.7	37%	0.37	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.7	168.6	-176.9	0	0	0	0	109.1	K314 R316	V289-K314 PolarHBondContact N-O 3.41Å; V289-K314 PolarHBondContact O-N 3.3Å; V289-R316 HydrophobicContact CG2-CB 4.45Å
290	S	90.9	Very high	76.9	Confident	78 Å²	78	77.2 Å²	77.2	55%	0.545	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	132.1	176.3	52.9	0	0	0	0	111.1	S312	S290-S312 WeakPolarHBondContact CA-O 3.47Å
291	K	88.3	Confident	79.2	Confident	117 Å²	117	71.3 Å²	71.3	51%	0.509	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	143.9	177.1	-68.8	-171.5	177.4	-178.5	0	110.8	S312	K291-S312 PolarHBondContact N-O 3Å; K291-S312 PolarHBondContact O-N 3.35Å; K291-S312 PolarHBondContact O-OG 2.88Å
292	T	88.1	Confident	81.1	Confident	95 Å²	95	69.4 Å²	69.4	58%	0.583	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	129.4	170.1	49.9	0	0	0	0	109.9	I294	T292-I294 PolarHBondContact O-N 3.35Å; T292-I294 VanDerWaalsContact O-N 3.13Å
293	V	84	Confident	82.4	Confident	6 Å²	6	66 Å²	66	4%	0.036	35%	0.353	C	S	.	.			trans	-74.2	104.7	-176.7	177.8	0	0	0	0	110.6	K295 I306 F308 G309 K310 S312	V293-K295 WeakPolarHBondContact CG1-O 3.21Å; V293-I306 HydrophobicContact CB-CG2 4.37Å; V293-I306 HydrophobicContact CG2-CB 4.03Å; V293-I306 HydrophobicContact CG2-CG2 3.62Å; V293-F308 WeakPolarHBondContact O-CA 3.35Å; V293-G309 PolarHBondContact O-N 2.81Å; V293-K310 WeakPolarHBondContact CB-O 3.43Å; V293-K310 WeakPolarHBondContact CG2-O 3.47Å; V293-K310 PolarHBondContact N-O 3.21Å; V293-S312 VanDerWaalsContact CG2-OG 3.31Å; V293-S312 WeakPolarHBondContact CG2-OG 3.26Å
294	I	83.1	Confident	83.4	Confident	136 Å²	136	69.7 Å²	69.7	70%	0.697	36%	0.364	S	S	*	.	S	Bend	trans	-86.3	-31.4	175.2	-55.5	172.7	0	0	0	111.1	T292 F308	T292-I294 PolarHBondContact O-N 3.35Å; T292-I294 VanDerWaalsContact O-N 3.13Å; I294-F308 HydrophobicContact CG2-CE2 4.33Å; I294-F308 WeakPolarHBondContact O-CD2 3.29Å; I294-F308 WeakPolarHBondContact O-CE2 3.41Å
295	K	79.4	Confident	83.9	Confident	165 Å²	165	72.4 Å²	72.4	72%	0.717	37%	0.374	S	S	*	.	S	Bend	trans	-121.6	131.5	174.6	-178	174.8	179.8	172.7	0	108.4	V293 E297	V293-K295 WeakPolarHBondContact CG1-O 3.21Å; K295-E297 PolarHBondContact O-N 3.4Å
296	P	79.3	Confident	84.1	Confident	60 Å²	60	67.4 Å²	67.4	39%	0.39	35%	0.348	S	S	.	.			trans	-57	113.2	-177.1	-24.5	32.9	0	0	0	111.9
297	E	82.5	Confident	84.3	Confident	59 Å²	59	74 Å²	74	28%	0.276	38%	0.376	S	S	.	.			trans	-106.6	160.3	173.3	-70.1	-174.9	162.3	0	0	109.3	K295 I306 K314 V321	K295-E297 PolarHBondContact O-N 3.4Å; E297-I306 PolarHBondContact O-N 2.96Å; E297-K314 IonicContact OE1-NZ 3.99Å; E297-V321 HydrophobicContact CB-CG1 4.18Å; E297-V321 WeakPolarHBondContact OE2-CG1 3.4Å; E297-V321 VanDerWaalsContact OE2-CG2 3.26Å; E297-V321 WeakPolarHBondContact OE2-CG2 3.43Å
298	S	82.8	Confident	84.3	Confident	60 Å²	60	76.9 Å²	76.9	42%	0.42	39%	0.388	S	S	.	.	B	Isolated β-bridge	trans	-103.8	130.9	178.5	-61.8	0	0	0	0	110	V300	S298-V300 PolarHBondContact O-N 2.98Å
299	C	85.7	Confident	84	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	41%	0.406	C	S	.	.			trans	-64.7	127.3	171.3	175	0	0	0	0	109.4	P301 C302 G303 K304 I306 V321 H323	C299-P301 VanDerWaalsContact SG-CD 3.58Å; C299-C302 VanDerWaalsContact CB-SG 3.54Å; C299-C302 PolarHBondContact SG-SG 2.83Å; C299-G303 WeakPolarHBondContact O-CA 3.19Å; C299-G303 PolarHBondContact O-N 3.41Å; C299-K304 PolarHBondContact N-O 2.9Å; C299-I306 HydrophobicContact CB-CD1 4.2Å; C299-I306 HydrophobicContact CB-CG1 4.16Å; C299-V321 CarbonylContact C-O 3.58Å; C299-V321 WeakPolarHBondContact CA-O 3.27Å; C299-H323 VanDerWaalsContact CB-CE1 3.44Å; C299-H323 WeakPolarHBondContact CB-CE1 3.31Å; C299-H323 WeakPolarHBondContact CB-ND1 3.4Å; C299-H323 PolarHBondContact SG-N 2.86Å; C299-H323 PolarHBondContact SG-ND1 3.41Å; C299-H323 VanDerWaalsContact SG-ND1 3.37Å
300	V	80.9	Confident	83.9	Confident	19 Å²	19	81.1 Å²	81.1	12%	0.115	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-53.8	-178.8	172.5	0	0	0	0	111.4	S298 C302 G303 V320 V321 L407	S298-V300 PolarHBondContact O-N 2.98Å; V300-C302 PolarHBondContact O-N 2.99Å; V300-G303 PolarHBondContact O-N 2.76Å; V300-V320 HydrophobicContact CB-CG2 3.62Å; V300-V320 HydrophobicContact CG1-CG2 3.9Å; V300-V320 HydrophobicContact CG2-CG2 3.59Å; V300-V321 PolarHBondContact N-O 2.95Å; V300-L407 HydrophobicContact CG1-CD1 4.18Å; V300-L407 WeakPolarHBondContact O-CD1 3.45Å; V300-L407 VanDerWaalsContact O-CD2 3.3Å; V300-L407 WeakPolarHBondContact O-CD2 3.5Å
301	P	80.9	Confident	83.7	Confident	29 Å²	29	81.6 Å²	81.6	19%	0.188	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-40	-178.2	-28.6	32	0	0	0	116.1	C299 T322 C326 R329 C330	C299-P301 VanDerWaalsContact SG-CD 3.58Å; P301-T322 HydrophobicContact CG-CG2 4.28Å; P301-C326 HydrophobicContact CB-CB 3.96Å; P301-C326 HydrophobicContact CG-CB 4.01Å; P301-R329 HydrophobicContact CB-CB 3.82Å; P301-R329 HydrophobicContact CG-CB 4.43Å; P301-C330 HydrophobicContact CG-CB 4.48Å; P301-C330 VanDerWaalsContact CG-SG 3.52Å
302	C	79.4	Confident	83.9	Confident	46 Å²	46	76.1 Å²	76.1	31%	0.311	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-6.8	-175.3	73.6	0	0	0	0	113.9	C299 V300 K304 H323	C299-C302 VanDerWaalsContact CB-SG 3.54Å; C299-C302 PolarHBondContact SG-SG 2.83Å; V300-C302 PolarHBondContact O-N 2.99Å; C302-K304 PolarHBondContact O-N 3.4Å; C302-H323 VanDerWaalsContact SG-CE1 3.55Å; C302-H323 PolarHBondContact SG-ND1 3.14Å
303	G	75.7	Confident	84	Confident	17 Å²	17	72.7 Å²	72.7	18%	0.175	37%	0.366	C	S	.	.			trans	63.9	4.7	-179.6	0	0	0	0	0	115.8	C299 V300 K410	C299-G303 WeakPolarHBondContact O-CA 3.19Å; C299-G303 PolarHBondContact O-N 3.41Å; V300-G303 PolarHBondContact O-N 2.76Å; G303-K410 PolarHBondContact O-NZ 3.42Å
304	K	83.6	Confident	84.2	Confident	147 Å²	147	74.8 Å²	74.8	64%	0.639	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-85.5	148.1	179.2	-62.7	178.8	-177.7	177.4	0	110.8	C299 C302	C299-K304 PolarHBondContact N-O 2.9Å; C302-K304 PolarHBondContact O-N 3.4Å
305	R	84.8	Confident	84.3	Confident	170 Å²	170	68.4 Å²	68.4	64%	0.642	34%	0.342	S	S	*	.	B	Isolated β-bridge	trans	-75.6	131.3	176.8	-66.6	-178.5	78.8	-164.8	8.7	111
306	I	87.6	Confident	84.4	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.005	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-81.7	120.6	171.9	-41.5	-173.4	0	0	0	107.5	V293 E297 C299 K310 S312 V321	V293-I306 HydrophobicContact CB-CG2 4.37Å; V293-I306 HydrophobicContact CG2-CB 4.03Å; V293-I306 HydrophobicContact CG2-CG2 3.62Å; E297-I306 PolarHBondContact O-N 2.96Å; C299-I306 HydrophobicContact CB-CD1 4.2Å; C299-I306 HydrophobicContact CB-CG1 4.16Å; I306-K310 HydrophobicContact CG2-CB 4.03Å; I306-S312 VanDerWaalsContact CD1-CB 3.46Å; I306-V321 HydrophobicContact CD1-CG1 3.8Å
307	K	85.9	Confident	84.2	Confident	160 Å²	160	67.6 Å²	67.6	70%	0.696	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-70.2	155.9	-176	-65.6	-176.7	-180	-178.9	0	111.2	G309 K310	K307-G309 PolarHBondContact O-N 3.27Å; K307-K310 HydrophobicContact CB-CG 4.15Å; K307-K310 WeakPolarHBondContact O-CB 3.49Å; K307-K310 PolarHBondContact O-N 3.48Å
308	F	87.9	Confident	83.9	Confident	152 Å²	152	65.6 Å²	65.6	67%	0.667	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	136.7	172.7	178.3	-95.9	0	0	0	111.3	V293 I294 K310	V293-F308 WeakPolarHBondContact O-CA 3.35Å; I294-F308 HydrophobicContact CG2-CE2 4.33Å; I294-F308 WeakPolarHBondContact O-CD2 3.29Å; I294-F308 WeakPolarHBondContact O-CE2 3.41Å; F308-K310 PolarHBondContact O-N 2.98Å
309	G	82.8	Confident	83.7	Confident	52 Å²	52	67.3 Å²	67.3	54%	0.536	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	-1.5	178.9	0	0	0	0	0	115.3	V293 K307	V293-G309 PolarHBondContact O-N 2.81Å; K307-G309 PolarHBondContact O-N 3.27Å
310	K	88.4	Confident	83.5	Confident	134 Å²	134	68 Å²	68	58%	0.583	32%	0.324	S	S	*	.			trans	-85.7	154.5	172.9	-67.4	-66.5	-175.6	-179.8	0	111.3	V293 I306 K307 F308	V293-K310 WeakPolarHBondContact CB-O 3.43Å; V293-K310 WeakPolarHBondContact CG2-O 3.47Å; V293-K310 PolarHBondContact N-O 3.21Å; I306-K310 HydrophobicContact CG2-CB 4.03Å; K307-K310 HydrophobicContact CB-CG 4.15Å; K307-K310 WeakPolarHBondContact O-CB 3.49Å; K307-K310 PolarHBondContact O-N 3.48Å; F308-K310 PolarHBondContact O-N 2.98Å
311	L	87.7	Confident	83.8	Confident	88 Å²	88	67.1 Å²	67.1	46%	0.461	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	132.4	177.2	-165.4	70.7	0	0	0	110.1	P324	L311-P324 HydrophobicContact CB-CG 4.36Å; L311-P324 HydrophobicContact CD2-CG 3.98Å; L311-P324 HydrophobicContact CG-CG 4.3Å
312	S	91.3	Very high	84.2	Confident	3 Å²	3	65.8 Å²	65.8	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	151.8	166.6	66.7	0	0	0	0	110.6	S290 K291 V293 I306	S290-S312 WeakPolarHBondContact CA-O 3.47Å; K291-S312 PolarHBondContact N-O 3Å; K291-S312 PolarHBondContact O-N 3.35Å; K291-S312 PolarHBondContact O-OG 2.88Å; V293-S312 VanDerWaalsContact CG2-OG 3.31Å; V293-S312 WeakPolarHBondContact CG2-OG 3.26Å; I306-S312 VanDerWaalsContact CD1-CB 3.46Å
313	L	90.6	Very high	84.7	Confident	22 Å²	22	64.8 Å²	64.8	12%	0.115	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	129.9	167.8	-62.6	-178.4	0	0	0	108.2	F288 V321 T322 R327	F288-L313 HydrophobicContact CB-CB 4.13Å; F288-L313 HydrophobicContact CB-CD1 4.46Å; F288-L313 HydrophobicContact CB-CD2 4.48Å; F288-L313 HydrophobicContact CD1-CB 3.75Å; F288-L313 HydrophobicContact CE1-CB 4.46Å; F288-L313 HydrophobicContact CG-CB 4.09Å; F288-L313 HydrophobicContact CG-CD1 4.41Å; L313-V321 CarbonylContact O-C 3.58Å; L313-V321 WeakPolarHBondContact O-CA 3.3Å; L313-T322 PolarHBondContact N-O 2.91Å; L313-T322 PolarHBondContact O-N 3.25Å; L313-R327 HydrophobicContact CD1-CB 3.96Å; L313-R327 HydrophobicContact CD1-CG 4.15Å
314	K	87.3	Confident	85.3	Confident	50 Å²	50	66.5 Å²	66.5	22%	0.217	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122.5	175.8	-171.5	165.4	-167.8	156.5	0	109.8	V289 E297 V320 V321	V289-K314 PolarHBondContact N-O 3.41Å; V289-K314 PolarHBondContact O-N 3.3Å; E297-K314 IonicContact OE1-NZ 3.99Å; K314-V320 CarbonylContact C-O 3.59Å; K314-V320 VanDerWaalsContact CA-O 3.31Å; K314-V320 WeakPolarHBondContact CA-O 3.31Å; K314-V321 HydrophobicContact CD-CG2 4.11Å; K314-V321 HydrophobicContact CG-CG2 4.07Å
315	C	86	Confident	85.6	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.014	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	136.6	176.6	-177.6	0	0	0	0	110.3	H286 E287 F288 D317 C318 R319 V320	H286-C315 HydrophobicContact CB-CB 4.34Å; E287-C315 CarbonylContact O-C 3.58Å; E287-C315 VanDerWaalsContact O-CA 3.24Å; E287-C315 WeakPolarHBondContact O-CA 3.27Å; F288-C315 HydrophobicContact CD1-CB 4.09Å; F288-C315 HydrophobicContact CE1-CB 3.99Å; C315-D317 VanDerWaalsContact C-N 3.32Å; C315-C318 WeakPolarHBondContact CB-SG 3.38Å; C315-R319 WeakPolarHBondContact O-CA 3.46Å; C315-R319 PolarHBondContact O-N 3.5Å; C315-V320 HydrophobicContact CB-CG1 3.72Å; C315-V320 PolarHBondContact N-O 3Å
316	R	81.5	Confident	85.6	Confident	169 Å²	169	58.3 Å²	58.3	64%	0.638	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-36.5	178.5	-172.7	178.6	176.5	-174.9	-3.6	111.8	E287 V289	E287-R316 PolarHBondContact O-N 3.41Å; E287-R316 WeakPolarHBondContact OE1-CD 3.48Å; E287-R316 IonicContact OE1-NH1 3.1Å; E287-R316 PolarHBondContact OE1-NH1 2.97Å; E287-R316 VanDerWaalsContact OE1-NH1 3.1Å; V289-R316 HydrophobicContact CG2-CB 4.45Å
317	D	76.1	Confident	85.5	Confident	40 Å²	40	64.3 Å²	64.3	21%	0.214	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-61.7	-172.9	-65.8	-15.2	0	0	0	112.4	R284 C315 P336 T337	R284-D317 IonicContact CZ-OD2 3.31Å; R284-D317 IonicContact NE-OD2 2.73Å; R284-D317 IonicContact NH2-OD1 2.72Å; R284-D317 IonicContact NH2-OD2 3.61Å; R284-D317 PolarHBondContact NH2-OD2 3.48Å; C315-D317 VanDerWaalsContact C-N 3.32Å; D317-P336 HydrophobicContact CB-CB 4.41Å; D317-P336 HydrophobicContact CB-CG 4.3Å; D317-P336 WeakPolarHBondContact O-CA 3.43Å; D317-T337 PolarHBondContact O-N 3.31Å
318	C	75.4	Confident	85.2	Confident	16 Å²	16	64.4 Å²	64.4	11%	0.108	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-0.8	-175.1	74.6	0	0	0	0	113.6	H286 C315 V320 I335 T337	H286-C318 PolarHBondContact CE1-SG 3.15Å; H286-C318 PolarHBondContact ND1-SG 3.02Å; C315-C318 WeakPolarHBondContact CB-SG 3.38Å; C318-V320 PolarHBondContact O-N 3.12Å; C318-V320 VanDerWaalsContact SG-CB 3.5Å; C318-V320 WeakPolarHBondContact SG-CG1 3.48Å; C318-V320 PolarHBondContact SG-N 2.66Å; C318-I335 WeakPolarHBondContact CA-O 3.3Å; C318-I335 WeakPolarHBondContact CB-O 3.2Å; C318-T337 VanDerWaalsContact C-OG1 3.27Å; C318-T337 WeakPolarHBondContact CA-OG1 3.47Å; C318-T337 PolarHBondContact O-OG1 3.07Å
319	R	79.3	Confident	84.8	Confident	97 Å²	97	66.1 Å²	66.1	37%	0.366	31%	0.308	S	S	.	.			trans	57.3	10.3	-179.1	-59.7	179.5	172	-179.2	-3.5	115.6	C315	C315-R319 WeakPolarHBondContact O-CA 3.46Å; C315-R319 PolarHBondContact O-N 3.5Å
320	V	81.4	Confident	84.5	Confident	15 Å²	15	64.2 Å²	64.2	9%	0.091	29%	0.286	C	S	.	.			trans	-58.1	137.7	177.2	80.7	0	0	0	0	110	F288 V300 K314 C315 C318 T322	F288-V320 HydrophobicContact CE1-CG1 3.79Å; F288-V320 HydrophobicContact CZ-CG1 4.22Å; V300-V320 HydrophobicContact CB-CG2 3.62Å; V300-V320 HydrophobicContact CG1-CG2 3.9Å; V300-V320 HydrophobicContact CG2-CG2 3.59Å; K314-V320 CarbonylContact C-O 3.59Å; K314-V320 VanDerWaalsContact CA-O 3.31Å; K314-V320 WeakPolarHBondContact CA-O 3.31Å; C315-V320 HydrophobicContact CB-CG1 3.72Å; C315-V320 PolarHBondContact N-O 3Å; C318-V320 PolarHBondContact O-N 3.12Å; C318-V320 VanDerWaalsContact SG-CB 3.5Å; C318-V320 WeakPolarHBondContact SG-CG1 3.48Å; C318-V320 PolarHBondContact SG-N 2.66Å; V320-T322 HydrophobicContact CG1-CG2 4.08Å; V320-T322 HydrophobicContact CG2-CG2 4.39Å
321	V	86.7	Confident	83.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	132.4	-177.3	-177.4	0	0	0	0	109.3	E297 C299 V300 I306 L313 K314	E297-V321 HydrophobicContact CB-CG1 4.18Å; E297-V321 WeakPolarHBondContact OE2-CG1 3.4Å; E297-V321 VanDerWaalsContact OE2-CG2 3.26Å; E297-V321 WeakPolarHBondContact OE2-CG2 3.43Å; C299-V321 CarbonylContact C-O 3.58Å; C299-V321 WeakPolarHBondContact CA-O 3.27Å; V300-V321 PolarHBondContact N-O 2.95Å; I306-V321 HydrophobicContact CD1-CG1 3.8Å; L313-V321 CarbonylContact O-C 3.58Å; L313-V321 WeakPolarHBondContact O-CA 3.3Å; K314-V321 HydrophobicContact CD-CG2 4.11Å; K314-V321 HydrophobicContact CG-CG2 4.07Å
322	T	89.3	Confident	82.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	154.9	-169.9	88.2	0	0	0	0	110	F288 P301 L313 V320 C330	F288-T322 HydrophobicContact CE1-CG2 3.73Å; F288-T322 HydrophobicContact CZ-CG2 4.09Å; P301-T322 HydrophobicContact CG-CG2 4.28Å; L313-T322 PolarHBondContact N-O 2.91Å; L313-T322 PolarHBondContact O-N 3.25Å; V320-T322 HydrophobicContact CG1-CG2 4.08Å; V320-T322 HydrophobicContact CG2-CG2 4.39Å; T322-C330 WeakPolarHBondContact CG2-SG 3.48Å
323	H	90	Very high	81.9	Confident	26 Å²	26	61.1 Å²	61.1	12%	0.12	28%	0.28	C	S	.	.			trans	-72.1	153.7	164.1	-63.4	107.7	0	0	0	109.8	C299 C302 E325 C326 R327	C299-H323 VanDerWaalsContact CB-CE1 3.44Å; C299-H323 WeakPolarHBondContact CB-CE1 3.31Å; C299-H323 WeakPolarHBondContact CB-ND1 3.4Å; C299-H323 PolarHBondContact SG-N 2.86Å; C299-H323 PolarHBondContact SG-ND1 3.41Å; C299-H323 VanDerWaalsContact SG-ND1 3.37Å; C302-H323 VanDerWaalsContact SG-CE1 3.55Å; C302-H323 PolarHBondContact SG-ND1 3.14Å; H323-E325 VanDerWaalsContact CB-CD 3.47Å; H323-E325 HydrophobicContact CB-CG 4.08Å; H323-E325 WeakPolarHBondContact CB-OE1 3.33Å; H323-E325 IonicContact CD2-OE1 3.6Å; H323-E325 IonicContact CG-OE1 2.74Å; H323-E325 PolarHBondContact O-N 3.17Å; H323-C326 HydrophobicContact CB-CB 4.1Å; H323-C326 WeakPolarHBondContact O-CA 3.3Å; H323-C326 PolarHBondContact O-N 2.9Å; H323-R327 PolarHBondContact O-N 3.26Å
324	P	88.6	Confident	81.3	Confident	52 Å²	52	60.1 Å²	60.1	34%	0.338	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-50.3	-43.9	172.1	-26.1	35.2	0	0	0	113	L311 C326 R327	L311-P324 HydrophobicContact CB-CG 4.36Å; L311-P324 HydrophobicContact CD2-CG 3.98Å; L311-P324 HydrophobicContact CG-CG 4.3Å; P324-C326 PolarHBondContact O-N 3.04Å; P324-R327 PolarHBondContact O-N 3.3Å
325	E	89.1	Confident	80.5	Confident	139 Å²	139	58.7 Å²	58.7	65%	0.65	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-71.6	-13	177.4	63.5	-89.2	-170.2	0	0	114.8	H323	H323-E325 VanDerWaalsContact CB-CD 3.47Å; H323-E325 HydrophobicContact CB-CG 4.08Å; H323-E325 WeakPolarHBondContact CB-OE1 3.33Å; H323-E325 IonicContact CD2-OE1 3.6Å; H323-E325 IonicContact CG-OE1 2.74Å; H323-E325 PolarHBondContact O-N 3.17Å
326	C	85.5	Confident	79.7	Confident	7 Å²	7	60.4 Å²	60.4	5%	0.047	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-99.9	2.5	-178.7	-68.8	0	0	0	0	113	P301 H323 P324 E328 R329	P301-C326 HydrophobicContact CB-CB 3.96Å; P301-C326 HydrophobicContact CG-CB 4.01Å; H323-C326 HydrophobicContact CB-CB 4.1Å; H323-C326 WeakPolarHBondContact O-CA 3.3Å; H323-C326 PolarHBondContact O-N 2.9Å; P324-C326 PolarHBondContact O-N 3.04Å; C326-E328 PolarHBondContact O-N 2.79Å; C326-R329 PolarHBondContact O-N 3.47Å
327	R	85.3	Confident	78.8	Confident	126 Å²	126	54.7 Å²	54.7	48%	0.475	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-49.6	-51.8	-176.6	-177	-176.8	176.5	166.5	0.3	112.8	F288 L313 H323 P324 R329 C330	F288-R327 HydrophobicContact CD2-CG 3.81Å; F288-R327 HydrophobicContact CE2-CG 3.67Å; L313-R327 HydrophobicContact CD1-CB 3.96Å; L313-R327 HydrophobicContact CD1-CG 4.15Å; H323-R327 PolarHBondContact O-N 3.26Å; P324-R327 PolarHBondContact O-N 3.3Å; R327-R329 PolarHBondContact O-N 3.29Å; R327-C330 PolarHBondContact O-N 3.13Å; R327-C330 PolarHBondContact O-SG 3.24Å
328	E	80.2	Confident	78	Confident	162 Å²	162	56.3 Å²	56.3	76%	0.757	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-74.3	-8.8	-175.6	-56	-50.2	131.1	0	0	113.9	C326	C326-E328 PolarHBondContact O-N 2.79Å
329	R	78.6	Confident	76.8	Confident	189 Å²	189	61.3 Å²	61.3	71%	0.713	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-98.6	11	179.7	-59.4	-177.5	-168.5	-178	2.7	112.7	P301 C326 R327	P301-R329 HydrophobicContact CB-CB 3.82Å; P301-R329 HydrophobicContact CG-CB 4.43Å; C326-R329 PolarHBondContact O-N 3.47Å; R327-R329 PolarHBondContact O-N 3.29Å
330	C	76.8	Confident	75.4	Confident	11 Å²	11	59.5 Å²	59.5	7%	0.074	32%	0.315	C	S	.	.	S	Bend	trans	-74	142.5	-179.5	-64.2	0	0	0	0	110.9	F288 P301 T322 R327 L332	F288-C330 HydrophobicContact CZ-CB 4.3Å; P301-C330 HydrophobicContact CG-CB 4.48Å; P301-C330 VanDerWaalsContact CG-SG 3.52Å; T322-C330 WeakPolarHBondContact CG2-SG 3.48Å; R327-C330 PolarHBondContact O-N 3.13Å; R327-C330 PolarHBondContact O-SG 3.24Å; C330-L332 PolarHBondContact O-N 3.24Å; C330-L332 VanDerWaalsContact O-N 3.15Å
331	P	70.2	Confident	73.8	Confident	49 Å²	49	64.9 Å²	64.9	32%	0.318	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-61.2	122.4	175.7	25.4	-32	0	0	0	108.8	H286	H286-P331 PolarHBondContact NE2-O 3.21Å
332	L	69.9	Low	72.3	Confident	76 Å²	76	69.7 Å²	69.7	40%	0.398	38%	0.379	S	S	.	.	S	Bend	trans	-99	150	169.9	-69.4	174.4	0	0	0	108.9	V283 L285 C330 N370	V283-L332 HydrophobicContact CG1-CB 3.76Å; L285-L332 HydrophobicContact CD2-CD1 3.94Å; L285-L332 HydrophobicContact CD2-CD2 3.86Å; C330-L332 PolarHBondContact O-N 3.24Å; C330-L332 VanDerWaalsContact O-N 3.15Å; L332-N370 PolarHBondContact O-ND2 3.31Å
333	P	72.9	Confident	70.8	Confident	35 Å²	35	71.9 Å²	71.9	23%	0.227	39%	0.392	C	S	.	.	S	Bend	cis	-72.8	159.8	-3.7	26.2	-30.3	0	0	0	114.1	V283 R284 I335 V366 N370	V283-P333 HydrophobicContact CG1-CB 3.67Å; V283-P333 HydrophobicContact CG1-CG 4.44Å; R284-P333 HydrophobicContact CB-CB 4.32Å; R284-P333 CarbonylContact O-C 3.49Å; R284-P333 WeakPolarHBondContact O-CA 3.39Å; P333-I335 HydrophobicContact CG-CG1 4.38Å; P333-I335 PolarHBondContact O-N 3.05Å; P333-V366 HydrophobicContact CG-CG1 4Å; P333-N370 WeakPolarHBondContact CD-ND2 3.49Å
334	C	76.6	Confident	69.3	Low	2 Å²	2	79.3 Å²	79.3	1%	0.014	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-73	116.7	166.7	176.8	0	0	0	0	110.3	R284 L285 H286	R284-C334 VanDerWaalsContact CD-O 3.24Å; R284-C334 WeakPolarHBondContact CD-O 3.3Å; R284-C334 HydrophobicContact CG-CB 4.26Å; R284-C334 PolarHBondContact O-N 2.86Å; L285-C334 WeakPolarHBondContact O-CB 3.24Å; H286-C334 HydrophobicContact CB-CB 4.32Å; H286-C334 WeakPolarHBondContact ND1-CB 3.15Å; H286-C334 PolarHBondContact ND1-SG 3.36Å; H286-C334 VanDerWaalsContact ND1-SG 3.4Å
335	I	71.5	Confident	67.9	Low	19 Å²	19	81 Å²	81	10%	0.097	43%	0.425	C	S	.	.			trans	-110.9	115.4	-178.7	-52.9	168.6	0	0	0	108.9	C318 P333 T337 V366	C318-I335 WeakPolarHBondContact CA-O 3.3Å; C318-I335 WeakPolarHBondContact CB-O 3.2Å; P333-I335 HydrophobicContact CG-CG1 4.38Å; P333-I335 PolarHBondContact O-N 3.05Å; I335-T337 PolarHBondContact O-N 2.95Å; I335-V366 HydrophobicContact CD1-CB 3.42Å; I335-V366 VanDerWaalsContact CD1-CB 3.42Å; I335-V366 HydrophobicContact CD1-CG1 3.56Å; I335-V366 HydrophobicContact CD1-CG2 3.78Å
336	P	68.4	Low	66.3	Low	38 Å²	38	76.4 Å²	76.4	25%	0.247	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-53.8	129	179.1	-24.7	33.1	0	0	0	111.6	D317	D317-P336 HydrophobicContact CB-CB 4.41Å; D317-P336 HydrophobicContact CB-CG 4.3Å; D317-P336 WeakPolarHBondContact O-CA 3.43Å
337	T	63.5	Low	65.1	Low	49 Å²	49	81.7 Å²	81.7	30%	0.301	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-80.6	124.7	178.1	-48.1	0	0	0	0	109.2	D317 C318 I335 T339	D317-T337 PolarHBondContact O-N 3.31Å; C318-T337 VanDerWaalsContact C-OG1 3.27Å; C318-T337 WeakPolarHBondContact CA-OG1 3.47Å; C318-T337 PolarHBondContact O-OG1 3.07Å; I335-T337 PolarHBondContact O-N 2.95Å; T337-T339 PolarHBondContact O-N 3.36Å
338	L	59.6	Low	64.2	Low	74 Å²	74	75.8 Å²	75.8	39%	0.387	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-51.5	124.2	175.8	-74.3	165.6	0	0	0	111.1	G340 D352 V354	L338-G340 PolarHBondContact O-N 3.49Å; L338-D352 WeakPolarHBondContact CD1-O 3.21Å; L338-V354 WeakPolarHBondContact CD2-O 3.34Å
339	T	49	Very low	64.4	Low	122 Å²	122	70.6 Å²	70.6	75%	0.748	40%	0.396	S	S	*	.			trans	-81.2	37.8	179.7	35.9	0	0	0	0	112.7	T337	T337-T339 PolarHBondContact O-N 3.36Å
340	G	51.1	Low	64.8	Low	59 Å²	59	61.9 Å²	61.9	61%	0.608	36%	0.364	S	S	*	.	S	Bend	trans	-109.7	163.5	-176	0	0	0	0	0	114.7	L338	L338-G340 PolarHBondContact O-N 3.49Å
341	T	47.5	Very low	65.2	Low	128 Å²	128	66.3 Å²	66.3	79%	0.785	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-57.5	142.2	166.5	40.7	0	0	0	0	110.6	V343	T341-V343 PolarHBondContact O-N 3.07Å; T341-V343 VanDerWaalsContact O-N 3.1Å
342	P	55.5	Low	65.9	Low	100 Å²	100	67.5 Å²	67.5	65%	0.649	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-59.2	118.7	-177.5	24	-32.5	0	0	0	110.2
343	V	58	Low	66.6	Low	47 Å²	47	65.5 Å²	65.5	29%	0.285	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-65.7	133.3	172.7	-176.9	0	0	0	0	107.7	T341 D352 F353	T341-V343 PolarHBondContact O-N 3.07Å; T341-V343 VanDerWaalsContact O-N 3.1Å; V343-D352 HydrophobicContact CG2-CB 4.02Å; V343-F353 HydrophobicContact CB-CE1 4.09Å; V343-F353 HydrophobicContact CB-CZ 4.17Å; V343-F353 HydrophobicContact CG1-CE1 4.29Å; V343-F353 HydrophobicContact CG1-CZ 3.85Å
344	R	57.7	Low	67.3	Low	181 Å²	181	64 Å²	64	68%	0.683	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-63.1	139.9	177.9	-74.1	178.9	172.6	-171	2.5	110	G346 E347	R344-G346 PolarHBondContact O-N 3.4Å; R344-G346 VanDerWaalsContact O-N 3.16Å; R344-E347 HydrophobicContact CB-CB 4.31Å; R344-E347 HydrophobicContact CB-CG 4.45Å; R344-E347 WeakPolarHBondContact CB-OE2 3.3Å; R344-E347 WeakPolarHBondContact CD-OE2 3.5Å; R344-E347 PolarHBondContact O-N 3.43Å
345	I	58.2	Low	67.5	Low	89 Å²	89	64.6 Å²	64.6	46%	0.456	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	118.1	178.6	-52.8	-176.4	0	0	0	108.3	E397 L400	I345-E397 HydrophobicContact CD1-CB 4.33Å; I345-E397 HydrophobicContact CD1-CG 4.16Å; I345-L400 HydrophobicContact CB-CD1 4.06Å; I345-L400 HydrophobicContact CD1-CD1 4.3Å; I345-L400 HydrophobicContact CG1-CB 4.18Å; I345-L400 HydrophobicContact CG1-CD1 3.67Å; I345-L400 HydrophobicContact CG2-CD1 3.83Å
346	G	56.2	Low	67.7	Low	42 Å²	42	69.8 Å²	69.8	43%	0.433	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.1	3.4	177.5	0	0	0	0	0	116.5	R344	R344-G346 PolarHBondContact O-N 3.4Å; R344-G346 VanDerWaalsContact O-N 3.16Å
347	E	59.8	Low	68.1	Low	118 Å²	118	71.1 Å²	71.1	55%	0.551	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	-4.8	-178	-68.6	-179.9	169.8	0	0	114.3	R344	R344-E347 HydrophobicContact CB-CB 4.31Å; R344-E347 HydrophobicContact CB-CG 4.45Å; R344-E347 WeakPolarHBondContact CB-OE2 3.3Å; R344-E347 WeakPolarHBondContact CD-OE2 3.5Å; R344-E347 PolarHBondContact O-N 3.43Å
348	G	68	Low	68.9	Low	2 Å²	2	71.7 Å²	71.7	2%	0.021	42%	0.415	C	S	.	.			trans	-86.6	144.1	-177.4	0	0	0	0	0	114.2	D352 K429	G348-D352 WeakPolarHBondContact CA-OD2 3.33Å; G348-K429 WeakPolarHBondContact O-CB 3.34Å; G348-K429 PolarHBondContact O-N 3Å
349	T	82.6	Confident	70	Confident	53 Å²	53	70.1 Å²	70.1	33%	0.325	41%	0.41	S	S	.	.			trans	-78.4	156.4	164.6	-48	0	0	0	0	108.6	M351 D352 F353	T349-M351 PolarHBondContact O-N 3.31Å; T349-M351 VanDerWaalsContact O-N 3.12Å; T349-D352 PolarHBondContact N-OD2 3.33Å; T349-D352 WeakPolarHBondContact O-CB 3.46Å; T349-D352 PolarHBondContact O-N 3.24Å; T349-F353 VanDerWaalsContact O-CD2 3.31Å; T349-F353 WeakPolarHBondContact O-CD2 3.4Å
350	L	87.6	Confident	71.9	Confident	6 Å²	6	65.5 Å²	65.5	3%	0.031	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-51.9	-37.8	177.5	-176.5	64.2	0	0	0	112.7	D352 F353 V354 P362 L428 L432 A467 N468	L350-D352 PolarHBondContact O-N 3.42Å; L350-D352 VanDerWaalsContact O-N 3.12Å; L350-F353 PolarHBondContact O-N 2.95Å; L350-V354 HydrophobicContact CG-CG1 4.3Å; L350-P362 HydrophobicContact CD1-CG 3.5Å; L350-L428 HydrophobicContact CB-CD1 4.47Å; L350-L428 HydrophobicContact CD1-CD1 4.06Å; L350-L428 HydrophobicContact CD1-CD2 4.29Å; L350-L432 HydrophobicContact CD2-CD1 3.74Å; L350-A467 HydrophobicContact CD2-CB 4.24Å; L350-A467 HydrophobicContact CG-CB 4.38Å; L350-N468 HydrophobicContact CD2-CB 4.19Å
351	M	85.9	Confident	73.8	Confident	103 Å²	103	63.1 Å²	63.1	51%	0.507	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-54.8	-27.5	175.9	-73.3	-61.2	-64.1	0	0	114.1	T349 F353 V354 A467	T349-M351 PolarHBondContact O-N 3.31Å; T349-M351 VanDerWaalsContact O-N 3.12Å; M351-F353 PolarHBondContact O-N 2.94Å; M351-V354 WeakPolarHBondContact O-CG2 3.14Å; M351-V354 HydrophobicContact SD-CG2 4.31Å; M351-A467 HydrophobicContact CG-CB 4.47Å; M351-A467 HydrophobicContact SD-CB 3.4Å; M351-A467 WeakPolarHBondContact SD-CB 3.32Å
352	D	84.4	Confident	75.8	Confident	74 Å²	74	57 Å²	57	40%	0.396	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-77.7	-9.4	-179.2	-55.9	-42.4	0	0	0	112.7	L338 V343 G348 T349 L350	L338-D352 WeakPolarHBondContact CD1-O 3.21Å; V343-D352 HydrophobicContact CG2-CB 4.02Å; G348-D352 WeakPolarHBondContact CA-OD2 3.33Å; T349-D352 PolarHBondContact N-OD2 3.33Å; T349-D352 WeakPolarHBondContact O-CB 3.46Å; T349-D352 PolarHBondContact O-N 3.24Å; L350-D352 PolarHBondContact O-N 3.42Å; L350-D352 VanDerWaalsContact O-N 3.12Å
353	F	85.3	Confident	77.3	Confident	34 Å²	34	54.2 Å²	54.2	15%	0.149	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-6.6	-175.5	-58.3	-72.3	0	0	0	114.1	V343 T349 L350 M351 P362 L400 F424 L428	V343-F353 HydrophobicContact CB-CE1 4.09Å; V343-F353 HydrophobicContact CB-CZ 4.17Å; V343-F353 HydrophobicContact CG1-CE1 4.29Å; V343-F353 HydrophobicContact CG1-CZ 3.85Å; T349-F353 VanDerWaalsContact O-CD2 3.31Å; T349-F353 WeakPolarHBondContact O-CD2 3.4Å; L350-F353 PolarHBondContact O-N 2.95Å; M351-F353 PolarHBondContact O-N 2.94Å; F353-P362 HydrophobicContact CB-CB 4.05Å; F353-P362 HydrophobicContact CB-CG 4.18Å; F353-P362 WeakPolarHBondContact O-CA 3.46Å; F353-L400 HydrophobicContact CD1-CD2 4.17Å; F353-L400 HydrophobicContact CE1-CD2 3.64Å; F353-L400 HydrophobicContact CZ-CD2 4.42Å; F353-F424 HydrophobicContact CB-CZ 4.05Å; F353-F424 HydrophobicContact CD1-CE2 4.26Å; F353-F424 HydrophobicContact CD2-CE2 4.19Å; F353-F424 HydrophobicContact CD2-CZ 4.1Å; F353-F424 HydrophobicContact CE2-CE2 4.49Å; F353-F424 HydrophobicContact CG-CE2 4.06Å; F353-F424 HydrophobicContact CG-CZ 4Å; F353-L428 HydrophobicContact CD2-CD2 4.19Å; F353-L428 HydrophobicContact CE2-CD2 4.25Å
354	V	86.3	Confident	78.8	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.03	29%	0.286	C	S	.	.	S	Bend	trans	-95.6	151.7	-177.3	-63	0	0	0	0	112.3	L338 L350 M351 M360 P362 A467	L338-V354 WeakPolarHBondContact CD2-O 3.34Å; L350-V354 HydrophobicContact CG-CG1 4.3Å; M351-V354 WeakPolarHBondContact O-CG2 3.14Å; M351-V354 HydrophobicContact SD-CG2 4.31Å; V354-M360 HydrophobicContact CB-CB 4.05Å; V354-M360 HydrophobicContact CG1-CB 4.4Å; V354-M360 WeakPolarHBondContact CG1-O 3.39Å; V354-M360 HydrophobicContact CG2-CB 4.21Å; V354-P362 HydrophobicContact CG1-CG 3.83Å; V354-A467 HydrophobicContact CG1-CB 4.02Å; V354-A467 HydrophobicContact CG2-CB 4.09Å
355	P	81.6	Confident	80.6	Confident	14 Å²	14	43.7 Å²	43.7	9%	0.091	25%	0.254	C	S	.	.			trans	-63.6	156	170.2	28.9	-35.6	0	0	0	111.3	T357 I361	P355-T357 PolarHBondContact O-N 2.98Å; P355-I361 WeakPolarHBondContact CD-O 3.24Å
356	T	76.1	Confident	82.2	Confident	127 Å²	127	40 Å²	40	78%	0.779	24%	0.235	S	C	*	.	S	Bend	trans	-70.6	-15.1	177.4	48	0	0	0	0	113.7
357	T	76.9	Confident	83.8	Confident	66 Å²	66	39 Å²	39	41%	0.405	22%	0.219	S	C	.	.	S	Bend	trans	-113.1	138.4	179.9	56.4	0	0	0	0	110.4	P355	P355-T357 PolarHBondContact O-N 2.98Å
358	P	79	Confident	85.5	Confident	62 Å²	62	33.3 Å²	33.3	40%	0.403	19%	0.193	S	C	.	.	S	Bend	trans	-58.1	151.4	171.7	-24.3	34.5	0	0	0	113.3	M360	P358-M360 HydrophobicContact CG-CE 4.26Å
359	P	83.3	Confident	86.8	Confident	41 Å²	41	33.3 Å²	33.3	27%	0.266	19%	0.192	S	C	.	.	S	Bend	cis	-69.8	131.2	-7.2	28.9	-35	0	0	0	111.8	I361	P359-I361 VanDerWaalsContact C-N 3.32Å; P359-I361 HydrophobicContact CB-CD1 3.82Å; P359-I361 HydrophobicContact CB-CG1 4.2Å; P359-I361 HydrophobicContact CG-CD1 4.16Å; P359-I361 PolarHBondContact O-N 3.34Å
360	M	88.4	Confident	87.3	Confident	24 Å²	24	33 Å²	33	12%	0.118	19%	0.189	C	C	.	.			trans	-82.8	73.6	-173.2	-68.2	-172.8	-178.9	0	0	111.1	V354 P358 Q466 A467 D470 T471	V354-M360 HydrophobicContact CB-CB 4.05Å; V354-M360 HydrophobicContact CG1-CB 4.4Å; V354-M360 WeakPolarHBondContact CG1-O 3.39Å; V354-M360 HydrophobicContact CG2-CB 4.21Å; P358-M360 HydrophobicContact CG-CE 4.26Å; M360-Q466 HydrophobicContact SD-CB 4.34Å; M360-Q466 HydrophobicContact SD-CG 4.07Å; M360-A467 HydrophobicContact CB-CB 4.18Å; M360-D470 PolarHBondContact N-OD2 2.92Å; M360-T471 PolarHBondContact O-OG1 3.21Å
361	I	90.6	Very high	87.6	Confident	9 Å²	9	34 Å²	34	5%	0.046	19%	0.193	C	C	.	.			trans	-117.6	133.3	-175.7	-52.7	160.3	0	0	0	110.4	P355 P359 S363 I365 V366 D470 F474 M542	P355-I361 WeakPolarHBondContact CD-O 3.24Å; P359-I361 VanDerWaalsContact C-N 3.32Å; P359-I361 HydrophobicContact CB-CD1 3.82Å; P359-I361 HydrophobicContact CB-CG1 4.2Å; P359-I361 HydrophobicContact CG-CD1 4.16Å; P359-I361 PolarHBondContact O-N 3.34Å; I361-S363 PolarHBondContact O-N 3.23Å; I361-I365 HydrophobicContact CG2-CB 4.26Å; I361-I365 HydrophobicContact CG2-CG2 4.13Å; I361-V366 HydrophobicContact CB-CG2 4.06Å; I361-V366 HydrophobicContact CG2-CG2 3.59Å; I361-D470 HydrophobicContact CG1-CB 4.25Å; I361-F474 HydrophobicContact CD1-CB 3.64Å; I361-F474 HydrophobicContact CD1-CD1 4.5Å; I361-F474 HydrophobicContact CD1-CD2 3.91Å; I361-F474 HydrophobicContact CD1-CG 3.77Å; I361-F474 HydrophobicContact CG1-CB 4.26Å; I361-F474 HydrophobicContact CG2-CB 4.48Å; I361-F474 HydrophobicContact CG2-CD1 4.04Å; I361-F474 HydrophobicContact CG2-CG 4.34Å; I361-M542 HydrophobicContact CD1-CE 4.12Å; I361-M542 HydrophobicContact CD1-SD 3.98Å
362	P	90.6	Very high	88.1	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.169	C	C	.	.			trans	-61.6	135.3	177.4	-24.3	35.2	0	0	0	112.8	L350 F353 V354 I364 I365 V366 F424 T471	L350-P362 HydrophobicContact CD1-CG 3.5Å; F353-P362 HydrophobicContact CB-CB 4.05Å; F353-P362 HydrophobicContact CB-CG 4.18Å; F353-P362 WeakPolarHBondContact O-CA 3.46Å; V354-P362 HydrophobicContact CG1-CG 3.83Å; P362-I364 HydrophobicContact CB-CG2 3.97Å; P362-I364 PolarHBondContact O-N 3.06Å; P362-I364 VanDerWaalsContact O-N 3.15Å; P362-I365 HydrophobicContact CB-CG1 4.2Å; P362-I365 HydrophobicContact CG-CG1 4.36Å; P362-I365 WeakPolarHBondContact O-CB 3.43Å; P362-I365 PolarHBondContact O-N 3.08Å; P362-V366 PolarHBondContact O-N 2.71Å; P362-F424 HydrophobicContact CB-CE1 3.98Å; P362-F424 HydrophobicContact CB-CZ 3.89Å; P362-F424 HydrophobicContact CG-CE1 3.99Å; P362-F424 HydrophobicContact CG-CZ 4.05Å; P362-T471 VanDerWaalsContact CD-OG1 3.27Å; P362-T471 WeakPolarHBondContact CD-OG1 3.47Å
363	S	86.6	Confident	88.6	Confident	41 Å²	41	27.5 Å²	27.5	29%	0.287	16%	0.159	S	C	.	.	H	α-helix	trans	-55.6	-36	180	60.7	0	0	0	0	113.4	I361 I365 V366 H367	I361-S363 PolarHBondContact O-N 3.23Å; S363-I365 VanDerWaalsContact C-N 3.34Å; S363-I365 PolarHBondContact O-N 3.38Å; S363-V366 PolarHBondContact O-N 3.47Å; S363-H367 WeakPolarHBondContact O-CB 3.43Å; S363-H367 PolarHBondContact O-CD2 3.42Å; S363-H367 PolarHBondContact O-N 2.71Å
364	I	90.7	Very high	89	Confident	7 Å²	7	33.4 Å²	33.4	4%	0.036	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-41.5	175.7	-173.1	171.6	0	0	0	112.2	P362 C368 F399 L420 F424	P362-I364 HydrophobicContact CB-CG2 3.97Å; P362-I364 PolarHBondContact O-N 3.06Å; P362-I364 VanDerWaalsContact O-N 3.15Å; I364-C368 WeakPolarHBondContact O-CB 3.23Å; I364-C368 PolarHBondContact O-N 3.31Å; I364-C368 PolarHBondContact O-SG 3.38Å; I364-F399 HydrophobicContact CB-CD1 3.84Å; I364-F399 HydrophobicContact CB-CE1 4.11Å; I364-F399 HydrophobicContact CB-CG 4.28Å; I364-F399 HydrophobicContact CD1-CB 3.83Å; I364-F399 HydrophobicContact CD1-CD1 4.24Å; I364-F399 HydrophobicContact CD1-CD2 4.04Å; I364-F399 HydrophobicContact CD1-CG 3.79Å; I364-F399 HydrophobicContact CG1-CB 4.36Å; I364-F399 HydrophobicContact CG1-CD1 3.82Å; I364-F399 HydrophobicContact CG1-CD2 4.06Å; I364-F399 HydrophobicContact CG1-CE1 4.05Å; I364-F399 HydrophobicContact CG1-CE2 4.28Å; I364-F399 HydrophobicContact CG1-CG 3.83Å; I364-F399 HydrophobicContact CG1-CZ 4.29Å; I364-L420 HydrophobicContact CD1-CD1 4.07Å; I364-L420 HydrophobicContact CD1-CG 4.24Å; I364-F424 HydrophobicContact CD1-CB 4.06Å; I364-F424 HydrophobicContact CD1-CD2 3.98Å; I364-F424 HydrophobicContact CD1-CG 4.09Å; I364-F424 HydrophobicContact CG2-CD1 3.76Å; I364-F424 HydrophobicContact CG2-CD2 3.73Å; I364-F424 HydrophobicContact CG2-CE1 3.69Å; I364-F424 HydrophobicContact CG2-CE2 3.67Å; I364-F424 HydrophobicContact CG2-CG 3.77Å; I364-F424 HydrophobicContact CG2-CZ 3.64Å
365	I	93.8	Very high	89.4	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-66.3	-48.4	178.8	-66.4	-62	0	0	0	109.8	I361 P362 S363 H367 C368 V369 L421 F424 L425 F474	I361-I365 HydrophobicContact CG2-CB 4.26Å; I361-I365 HydrophobicContact CG2-CG2 4.13Å; P362-I365 HydrophobicContact CB-CG1 4.2Å; P362-I365 HydrophobicContact CG-CG1 4.36Å; P362-I365 WeakPolarHBondContact O-CB 3.43Å; P362-I365 PolarHBondContact O-N 3.08Å; S363-I365 VanDerWaalsContact C-N 3.34Å; S363-I365 PolarHBondContact O-N 3.38Å; I365-H367 PolarHBondContact O-N 3.32Å; I365-C368 PolarHBondContact O-N 2.98Å; I365-V369 HydrophobicContact CG2-CG2 4.31Å; I365-V369 WeakPolarHBondContact O-CB 3.21Å; I365-V369 WeakPolarHBondContact O-CG2 3.42Å; I365-V369 PolarHBondContact O-N 3.38Å; I365-L421 HydrophobicContact CD1-CD1 4.38Å; I365-L421 HydrophobicContact CD1-CG 3.86Å; I365-F424 HydrophobicContact CD1-CD1 3.62Å; I365-F424 HydrophobicContact CD1-CE1 4.07Å; I365-F424 HydrophobicContact CG1-CD1 3.9Å; I365-F424 HydrophobicContact CG1-CE1 3.84Å; I365-L425 HydrophobicContact CD1-CD1 4.42Å; I365-L425 HydrophobicContact CD1-CD2 3.94Å; I365-L425 HydrophobicContact CD1-CG 3.99Å; I365-F474 HydrophobicContact CG2-CD1 3.79Å; I365-F474 HydrophobicContact CG2-CE1 3.98Å
366	V	91.6	Very high	90	Very high	10 Å²	10	36.2 Å²	36.2	6%	0.061	20%	0.196	C	C	.	.	H	α-helix	trans	-61.2	-46.5	-179.3	-177.3	0	0	0	0	111.5	P333 I335 I361 P362 S363 C368 V369 N370 F474	P333-V366 HydrophobicContact CG-CG1 4Å; I335-V366 HydrophobicContact CD1-CB 3.42Å; I335-V366 VanDerWaalsContact CD1-CB 3.42Å; I335-V366 HydrophobicContact CD1-CG1 3.56Å; I335-V366 HydrophobicContact CD1-CG2 3.78Å; I361-V366 HydrophobicContact CB-CG2 4.06Å; I361-V366 HydrophobicContact CG2-CG2 3.59Å; P362-V366 PolarHBondContact O-N 2.71Å; S363-V366 PolarHBondContact O-N 3.47Å; V366-C368 PolarHBondContact O-N 3.47Å; V366-V369 PolarHBondContact O-N 3.27Å; V366-N370 WeakPolarHBondContact O-CB 3.48Å; V366-N370 PolarHBondContact O-N 2.88Å; V366-N370 PolarHBondContact O-OD1 3.44Å; V366-F474 HydrophobicContact CB-CE1 4.39Å; V366-F474 HydrophobicContact CB-CZ 4.34Å; V366-F474 HydrophobicContact CG1-CZ 4.15Å; V366-F474 HydrophobicContact CG2-CE1 4.14Å; V366-F474 HydrophobicContact CG2-CZ 4.23Å
367	H	90.5	Very high	90.9	Very high	21 Å²	21	32.3 Å²	32.3	10%	0.097	17%	0.17	C	C	.	.	H	α-helix	trans	-65.1	-39.9	178.6	-73.1	-53.4	0	0	0	112.6	S363 I365 E371 F399 V405 L408	S363-H367 WeakPolarHBondContact O-CB 3.43Å; S363-H367 PolarHBondContact O-CD2 3.42Å; S363-H367 PolarHBondContact O-N 2.71Å; I365-H367 PolarHBondContact O-N 3.32Å; H367-E371 WeakPolarHBondContact O-CB 3.32Å; H367-E371 PolarHBondContact O-N 2.83Å; H367-E371 VanDerWaalsContact O-N 3.16Å; H367-F399 HydrophobicContact CB-CE1 4.39Å; H367-F399 HydrophobicContact CB-CZ 4.26Å; H367-V405 HydrophobicContact CB-CG1 4.48Å; H367-L408 HydrophobicContact CB-CD1 3.97Å; H367-L408 WeakPolarHBondContact O-CD1 3.5Å
368	C	95	Very high	91.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-48.6	175.7	-69.4	0	0	0	0	111.5	I364 I365 V366 N370 E371 I372 I417 L421	I364-C368 WeakPolarHBondContact O-CB 3.23Å; I364-C368 PolarHBondContact O-N 3.31Å; I364-C368 PolarHBondContact O-SG 3.38Å; I365-C368 PolarHBondContact O-N 2.98Å; V366-C368 PolarHBondContact O-N 3.47Å; C368-N370 PolarHBondContact O-N 2.88Å; C368-E371 PolarHBondContact O-N 3.42Å; C368-I372 WeakPolarHBondContact O-CB 3.48Å; C368-I372 WeakPolarHBondContact O-CD1 3.07Å; C368-I372 WeakPolarHBondContact O-CG1 3.31Å; C368-I372 PolarHBondContact O-N 3.19Å; C368-I417 HydrophobicContact CB-CG2 3.89Å; C368-L421 HydrophobicContact CB-CB 4.1Å; C368-L421 HydrophobicContact CB-CD1 3.94Å; C368-L421 HydrophobicContact CB-CG 4.5Å
369	V	96.1	Very high	92.4	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-47.8	179.7	164.9	0	0	0	0	111	I365 V366 E371 I372 E373 L421 F474 H478	I365-V369 HydrophobicContact CG2-CG2 4.31Å; I365-V369 WeakPolarHBondContact O-CB 3.21Å; I365-V369 WeakPolarHBondContact O-CG2 3.42Å; I365-V369 PolarHBondContact O-N 3.38Å; V366-V369 PolarHBondContact O-N 3.27Å; V369-E371 VanDerWaalsContact C-N 3.32Å; V369-E371 PolarHBondContact O-N 2.89Å; V369-I372 PolarHBondContact O-N 3.34Å; V369-E373 HydrophobicContact CG1-CG 4.34Å; V369-E373 WeakPolarHBondContact O-CG 3.44Å; V369-E373 PolarHBondContact O-N 2.97Å; V369-L421 HydrophobicContact CG2-CD1 3.74Å; V369-F474 HydrophobicContact CB-CE1 3.61Å; V369-F474 HydrophobicContact CB-CZ 3.94Å; V369-F474 HydrophobicContact CG1-CE1 3.74Å; V369-F474 HydrophobicContact CG1-CZ 3.68Å; V369-F474 HydrophobicContact CG2-CD1 4.32Å; V369-F474 HydrophobicContact CG2-CE1 3.66Å; V369-F474 HydrophobicContact CG2-CZ 4.45Å; V369-H478 HydrophobicContact CG1-CB 3.86Å; V369-H478 HydrophobicContact CG2-CB 4.25Å
370	N	92.9	Very high	93	Very high	48 Å²	48	42.7 Å²	42.7	26%	0.257	20%	0.198	S	C	.	.	H	α-helix	trans	-60.9	-42.2	-179.7	-70.4	-2.2	0	0	0	112	L332 P333 V366 C368 Q374	L332-N370 PolarHBondContact O-ND2 3.31Å; P333-N370 WeakPolarHBondContact CD-ND2 3.49Å; V366-N370 WeakPolarHBondContact O-CB 3.48Å; V366-N370 PolarHBondContact O-N 2.88Å; V366-N370 PolarHBondContact O-OD1 3.44Å; C368-N370 PolarHBondContact O-N 2.88Å; N370-Q374 VanDerWaalsContact O-CB 3.24Å; N370-Q374 WeakPolarHBondContact O-CB 3.03Å; N370-Q374 PolarHBondContact O-N 3.33Å
371	E	93.8	Very high	93.3	Very high	25 Å²	25	42 Å²	42	12%	0.117	20%	0.196	C	C	.	.	H	α-helix	trans	-67.4	-41.7	177.3	-172.6	74.7	-155.1	0	0	111.5	H367 C368 V369 Q374 R375 L408 I417	H367-E371 WeakPolarHBondContact O-CB 3.32Å; H367-E371 PolarHBondContact O-N 2.83Å; H367-E371 VanDerWaalsContact O-N 3.16Å; C368-E371 PolarHBondContact O-N 3.42Å; V369-E371 VanDerWaalsContact C-N 3.32Å; V369-E371 PolarHBondContact O-N 2.89Å; E371-Q374 PolarHBondContact O-N 3.31Å; E371-R375 WeakPolarHBondContact O-CG 3.21Å; E371-R375 PolarHBondContact O-N 3.17Å; E371-R375 WeakPolarHBondContact OE1-CD 3.36Å; E371-R375 IonicContact OE1-CZ 2.99Å; E371-R375 IonicContact OE1-NE 3.8Å; E371-R375 PolarHBondContact OE1-NE 2.98Å; E371-L408 HydrophobicContact CB-CB 4.31Å; E371-L408 HydrophobicContact CB-CD1 4.12Å; E371-L408 HydrophobicContact CG-CB 3.92Å; E371-I417 HydrophobicContact CB-CD1 4.3Å; E371-I417 HydrophobicContact CG-CD1 3.5Å
372	I	96.6	Very high	93.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.194	C	C	.	.	I	π-helix	trans	-63.5	-42.6	176.7	-68.6	166.2	0	0	0	111.3	C368 V369 Q374 G376 L377 L382 Y383 I414 I417 L421	C368-I372 WeakPolarHBondContact O-CB 3.48Å; C368-I372 WeakPolarHBondContact O-CD1 3.07Å; C368-I372 WeakPolarHBondContact O-CG1 3.31Å; C368-I372 PolarHBondContact O-N 3.19Å; V369-I372 PolarHBondContact O-N 3.34Å; I372-Q374 VanDerWaalsContact C-N 3.33Å; I372-G376 CarbonylContact O-C 3.57Å; I372-G376 WeakPolarHBondContact O-CA 3.44Å; I372-G376 PolarHBondContact O-N 3.43Å; I372-L377 PolarHBondContact O-N 3.31Å; I372-L382 HydrophobicContact CG2-CD1 3.92Å; I372-L382 HydrophobicContact CG2-CD2 3.68Å; I372-L382 HydrophobicContact CG2-CG 4.34Å; I372-Y383 HydrophobicContact CD1-CE1 4.11Å; I372-Y383 VanDerWaalsContact CD1-OH 3.31Å; I372-Y383 WeakPolarHBondContact CD1-OH 3.44Å; I372-I414 HydrophobicContact CB-CD1 4.44Å; I372-I414 HydrophobicContact CG1-CD1 3.9Å; I372-I414 HydrophobicContact CG1-CG1 4.33Å; I372-I417 HydrophobicContact CD1-CG2 4.06Å; I372-I417 HydrophobicContact CG1-CB 4.39Å; I372-I417 HydrophobicContact CG1-CG2 3.93Å; I372-L421 HydrophobicContact CD1-CD1 4.46Å
373	E	95.4	Very high	94	Very high	42 Å²	42	41.5 Å²	41.5	20%	0.196	19%	0.194	C	C	.	.	I	π-helix	trans	-68.1	-35.8	177	-70.1	-169.7	173.2	0	0	112.2	V369 L377 H478 R481	V369-E373 HydrophobicContact CG1-CG 4.34Å; V369-E373 WeakPolarHBondContact O-CG 3.44Å; V369-E373 PolarHBondContact O-N 2.97Å; E373-L377 HydrophobicContact CB-CD1 4.36Å; E373-H478 VanDerWaalsContact CG-ND1 3.29Å; E373-H478 WeakPolarHBondContact CG-ND1 3.48Å; E373-H478 IonicContact OE1-CE1 2.67Å; E373-H478 IonicContact OE1-CG 2.89Å; E373-H478 IonicContact OE1-ND1 3.75Å; E373-H478 PolarHBondContact OE1-ND1 3.3Å; E373-R481 VanDerWaalsContact CD-NH1 3.29Å; E373-R481 VanDerWaalsContact OE1-CD 3.27Å; E373-R481 WeakPolarHBondContact OE1-CD 3.35Å; E373-R481 IonicContact OE1-CZ 3.93Å; E373-R481 IonicContact OE1-NH1 2.76Å; E373-R481 PolarHBondContact OE1-NH1 2.81Å; E373-R481 IonicContact OE2-CZ 3.67Å; E373-R481 IonicContact OE2-NH1 2.71Å; E373-R481 PolarHBondContact OE2-NH1 3.35Å
374	Q	93.8	Very high	94.5	Very high	158 Å²	158	47.7 Å²	47.7	74%	0.738	21%	0.211	S	C	*	.	I	π-helix	trans	-66.9	-41.4	-177.4	-176.3	173.8	24	0	0	113.3	N370 E371 I372	N370-Q374 VanDerWaalsContact O-CB 3.24Å; N370-Q374 WeakPolarHBondContact O-CB 3.03Å; N370-Q374 PolarHBondContact O-N 3.33Å; E371-Q374 PolarHBondContact O-N 3.31Å; I372-Q374 VanDerWaalsContact C-N 3.33Å
375	R	94.4	Very high	94.7	Very high	78 Å²	78	51.1 Å²	51.1	29%	0.294	23%	0.229	S	C	.	.	I	π-helix	trans	-127.6	-17	-174.5	70.8	-173.9	176.8	94.4	-4.7	115.2	E371 V411 D412 I414	E371-R375 WeakPolarHBondContact O-CG 3.21Å; E371-R375 PolarHBondContact O-N 3.17Å; E371-R375 WeakPolarHBondContact OE1-CD 3.36Å; E371-R375 IonicContact OE1-CZ 2.99Å; E371-R375 IonicContact OE1-NE 3.8Å; E371-R375 PolarHBondContact OE1-NE 2.98Å; R375-V411 PolarHBondContact NH2-O 3.28Å; R375-D412 PolarHBondContact NH1-O 2.85Å; R375-I414 HydrophobicContact CG-CD1 3.93Å
376	G	93.5	Very high	94.7	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.258	C	S	.	.	I	π-helix	trans	-89.2	-24	-170.9	0	0	0	0	0	115	I372 R378 E379 L382	I372-G376 CarbonylContact O-C 3.57Å; I372-G376 WeakPolarHBondContact O-CA 3.44Å; I372-G376 PolarHBondContact O-N 3.43Å; G376-R378 PolarHBondContact O-N 2.94Å; G376-E379 WeakPolarHBondContact O-CB 3.42Å; G376-E379 PolarHBondContact O-N 3.28Å; G376-L382 WeakPolarHBondContact O-CD1 3.44Å
377	L	95.3	Very high	94.8	Very high	45 Å²	45	55.3 Å²	55.3	24%	0.236	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-8.6	-172.7	-64.2	178.8	0	0	0	115.3	I372 E373 V482 S485 T488	I372-L377 PolarHBondContact O-N 3.31Å; E373-L377 HydrophobicContact CB-CD1 4.36Å; L377-V482 HydrophobicContact CD2-CG2 3.81Å; L377-S485 PolarHBondContact O-OG 3.17Å; L377-T488 VanDerWaalsContact O-CG2 3.26Å; L377-T488 WeakPolarHBondContact O-CG2 3.49Å
378	R	93.1	Very high	94.9	Very high	193 Å²	193	57.6 Å²	57.6	73%	0.728	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-6.9	175.9	-61.4	-165.7	-175.9	168.3	0.2	113.7	G376 E487	G376-R378 PolarHBondContact O-N 2.94Å; R378-E487 WeakPolarHBondContact CA-OE2 3.5Å; R378-E487 WeakPolarHBondContact CB-OE2 3.3Å; R378-E487 WeakPolarHBondContact CG-OE2 3.42Å
379	E	95.3	Very high	94.8	Very high	94 Å²	94	63 Å²	63	44%	0.439	31%	0.307	S	S	.	.	S	Bend	trans	-89.8	130	-175.8	-65.1	-66.1	159.3	0	0	111.1	G376 I414 T488	G376-E379 WeakPolarHBondContact O-CB 3.42Å; G376-E379 PolarHBondContact O-N 3.28Å; E379-I414 HydrophobicContact CB-CG2 4.15Å; E379-I414 HydrophobicContact CG-CG2 3.92Å; E379-T488 WeakPolarHBondContact O-CA 3.48Å
380	M	95.4	Very high	94.7	Very high	99 Å²	99	69.9 Å²	69.9	49%	0.488	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	139.5	-178.9	-167.5	-178.8	-49.3	0	0	111.1	L382 I385 K489	M380-L382 PolarHBondContact O-N 2.94Å; M380-I385 VanDerWaalsContact O-CD1 3.3Å; M380-I385 WeakPolarHBondContact O-CD1 3.43Å; M380-K489 HydrophobicContact CE-CD 4.15Å; M380-K489 VanDerWaalsContact CE-NZ 3.28Å; M380-K489 HydrophobicContact CG-CB 4.35Å; M380-K489 HydrophobicContact CG-CD 3.87Å; M380-K489 HydrophobicContact CG-CG 4.13Å; M380-K489 HydrophobicContact SD-CD 3.71Å; M380-K489 PolarHBondContact SD-NZ 2.95Å
381	G	94.9	Very high	94.7	Very high	9 Å²	9	69.8 Å²	69.8	9%	0.093	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	71	29.2	174.2	0	0	0	0	0	114	Y383 R384 I385 T488	G381-Y383 PolarHBondContact O-N 3.23Å; G381-R384 PolarHBondContact O-N 2.95Å; G381-I385 PolarHBondContact O-N 3.48Å; G381-T488 PolarHBondContact N-O 3.47Å
382	L	96.9	Very high	94.8	Very high	0 Å²	0	69 Å²	69	0%	0	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	135	174.6	-148.3	158.1	0	0	0	110.8	I372 G376 M380 R384 C418 V482 T488 M490	I372-L382 HydrophobicContact CG2-CD1 3.92Å; I372-L382 HydrophobicContact CG2-CD2 3.68Å; I372-L382 HydrophobicContact CG2-CG 4.34Å; G376-L382 WeakPolarHBondContact O-CD1 3.44Å; M380-L382 PolarHBondContact O-N 2.94Å; L382-R384 PolarHBondContact O-N 3.35Å; L382-C418 WeakPolarHBondContact CD2-SG 3.47Å; L382-V482 HydrophobicContact CB-CG1 4.3Å; L382-V482 HydrophobicContact CD2-CG1 4.44Å; L382-V482 HydrophobicContact CD2-CG2 4.45Å; L382-T488 HydrophobicContact CB-CG2 4.44Å; L382-T488 HydrophobicContact CD1-CG2 4.28Å; L382-M490 WeakPolarHBondContact O-CE 3.42Å; L382-M490 WeakPolarHBondContact O-CG 3.48Å
383	Y	97.8	Very high	94.5	Very high	0 Å²	0	76 Å²	76	0%	0	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	-24.6	-170.5	-61.7	-66.1	0	0	0	117.2	I372 G381 C418 L421 K422 H478 L479 V482 L495 V498 F499	I372-Y383 HydrophobicContact CD1-CE1 4.11Å; I372-Y383 VanDerWaalsContact CD1-OH 3.31Å; I372-Y383 WeakPolarHBondContact CD1-OH 3.44Å; G381-Y383 PolarHBondContact O-N 3.23Å; Y383-C418 HydrophobicContact CD1-CB 3.66Å; Y383-C418 HydrophobicContact CE1-CB 3.88Å; Y383-C418 HydrophobicContact CG-CB 4.45Å; Y383-L421 HydrophobicContact CE1-CD2 4.19Å; Y383-K422 HydrophobicContact CD1-CD 4.23Å; Y383-K422 HydrophobicContact CD1-CG 4.22Å; Y383-K422 PolarHBondContact O-NZ 3.43Å; Y383-H478 AromaticContact CE2-NE2 3.44Å; Y383-H478 WeakPolarHBondContact CE2-NE2 3.49Å; Y383-H478 AromaticContact CZ-CD2 3.96Å; Y383-H478 AromaticContact CZ-NE2 3.45Å; Y383-H478 PolarHBondContact OH-CD2 2.99Å; Y383-H478 PolarHBondContact OH-NE2 3.42Å; Y383-L479 HydrophobicContact CD2-CD2 3.84Å; Y383-L479 HydrophobicContact CE2-CD2 3.49Å; Y383-L479 VanDerWaalsContact CE2-CD2 3.49Å; Y383-V482 HydrophobicContact CE2-CG2 4.21Å; Y383-L495 HydrophobicContact CD2-CD2 4.03Å; Y383-V498 WeakPolarHBondContact O-CG1 3.2Å; Y383-F499 AromaticContact CD1-CE2 3.88Å; Y383-F499 HydrophobicContact CD1-CE2 3.88Å; Y383-F499 AromaticContact CD1-CZ 3.59Å; Y383-F499 HydrophobicContact CD1-CZ 3.59Å; Y383-F499 AromaticContact CD2-CE2 3.77Å; Y383-F499 HydrophobicContact CD2-CE2 3.77Å; Y383-F499 HydrophobicContact CD2-CZ 4.09Å; Y383-F499 HydrophobicContact CE1-CE2 4.36Å; Y383-F499 AromaticContact CE1-CZ 3.73Å; Y383-F499 HydrophobicContact CE1-CZ 3.73Å; Y383-F499 HydrophobicContact CE2-CE2 4.25Å; Y383-F499 HydrophobicContact CE2-CZ 4.2Å; Y383-F499 AromaticContact CG-CE2 3.57Å; Y383-F499 HydrophobicContact CG-CE2 3.57Å; Y383-F499 AromaticContact CG-CZ 3.79Å; Y383-F499 HydrophobicContact CG-CZ 3.79Å
384	R	96.9	Very high	94.3	Very high	171 Å²	171	77.8 Å²	77.8	65%	0.645	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-47.1	175.2	178.4	178.3	174.8	-179.8	-1.7	112.1	G381 L382 M490 V498	G381-R384 PolarHBondContact O-N 2.95Å; L382-R384 PolarHBondContact O-N 3.35Å; R384-M490 HydrophobicContact CB-CE 3.76Å; R384-M490 HydrophobicContact CB-SD 3.71Å; R384-V498 HydrophobicContact CB-CG2 4.43Å
385	I	96.2	Very high	94.2	Very high	78 Å²	78	70.7 Å²	70.7	40%	0.4	34%	0.341	S	S	.	.	S	Bend	trans	-71.2	134.9	176.9	-59.9	176.9	0	0	0	108.6	M380 G381 H415	M380-I385 VanDerWaalsContact O-CD1 3.3Å; M380-I385 WeakPolarHBondContact O-CD1 3.43Å; G381-I385 PolarHBondContact O-N 3.48Å; I385-H415 HydrophobicContact CG2-CB 4.3Å
386	S	93.3	Very high	93.9	Very high	90 Å²	90	67.7 Å²	67.7	63%	0.629	33%	0.33	S	S	*	.			trans	-93.6	128.9	177.5	-61.4	0	0	0	0	109.7
387	G	93.3	Very high	93.6	Very high	10 Å²	10	71.5 Å²	71.5	10%	0.103	35%	0.347	C	S	.	.			trans	-75.8	-178.5	169.8	0	0	0	0	0	112.2	D389 D413 H415	G387-D389 PolarHBondContact O-N 3.37Å; G387-D413 WeakPolarHBondContact CA-OD2 3.43Å; G387-H415 PolarHBondContact N-O 3.35Å
388	C	94.2	Very high	93.1	Very high	69 Å²	69	74 Å²	74	47%	0.466	36%	0.357	S	S	.	.			trans	-65	116.2	178.9	-175.1	0	0	0	0	112.2	K390 T391 V392	C388-K390 PolarHBondContact O-N 3.46Å; C388-T391 WeakPolarHBondContact O-CA 3.32Å; C388-T391 WeakPolarHBondContact O-CB 3.5Å; C388-T391 PolarHBondContact O-N 2.84Å; C388-V392 WeakPolarHBondContact O-CG2 3.22Å; C388-V392 PolarHBondContact O-N 3.21Å
389	D	92.4	Very high	92.7	Very high	113 Å²	113	66 Å²	66	60%	0.604	33%	0.327	S	S	*	.	H	α-helix	trans	-54.5	-37	-178.9	-76	-12.8	0	0	0	113.8	G387 V392 K393	G387-D389 PolarHBondContact O-N 3.37Å; D389-V392 PolarHBondContact O-N 2.85Å; D389-K393 WeakPolarHBondContact O-CG 3.27Å; D389-K393 PolarHBondContact O-N 3.27Å
390	K	93.9	Very high	92	Very high	145 Å²	145	62.9 Å²	62.9	63%	0.63	31%	0.313	S	S	*	.	H	α-helix	trans	-61.6	-46.4	177	-174.3	179.3	176	-177.2	0	110.6	C388 K393 E394	C388-K390 PolarHBondContact O-N 3.46Å; K390-K393 PolarHBondContact O-N 3.31Å; K390-E394 WeakPolarHBondContact CE-OE1 3.41Å; K390-E394 WeakPolarHBondContact O-CB 3.26Å; K390-E394 WeakPolarHBondContact O-CG 3.49Å; K390-E394 PolarHBondContact O-N 2.9Å
391	T	93.3	Very high	91	Very high	46 Å²	46	66.9 Å²	66.9	28%	0.282	32%	0.323	S	S	.	.	H	α-helix	trans	-63	-42.9	177	-52.8	0	0	0	0	111.3	C388 K393 E394 L395 V411 A416	C388-T391 WeakPolarHBondContact O-CA 3.32Å; C388-T391 WeakPolarHBondContact O-CB 3.5Å; C388-T391 PolarHBondContact O-N 2.84Å; T391-K393 PolarHBondContact O-N 3.45Å; T391-E394 PolarHBondContact O-N 2.72Å; T391-L395 HydrophobicContact CG2-CD1 3.98Å; T391-L395 HydrophobicContact CG2-CG 4.34Å; T391-L395 WeakPolarHBondContact O-CB 3.39Å; T391-L395 VanDerWaalsContact O-CG 3.24Å; T391-L395 WeakPolarHBondContact O-CG 3.37Å; T391-L395 PolarHBondContact O-N 3.43Å; T391-V411 HydrophobicContact CG2-CG1 4.24Å; T391-A416 HydrophobicContact CG2-CB 4.07Å
392	V	94.4	Very high	89.4	Confident	9 Å²	9	68.9 Å²	68.9	6%	0.055	34%	0.338	C	S	.	.	H	α-helix	trans	-57.6	-50.7	176.7	175.4	0	0	0	0	110.9	C388 D389 L395 K396 A416 D423	C388-V392 WeakPolarHBondContact O-CG2 3.22Å; C388-V392 PolarHBondContact O-N 3.21Å; D389-V392 PolarHBondContact O-N 2.85Å; V392-L395 PolarHBondContact O-N 2.89Å; V392-K396 WeakPolarHBondContact O-CB 3.44Å; V392-K396 PolarHBondContact O-N 2.68Å; V392-A416 HydrophobicContact CG2-CB 4.4Å; V392-A416 WeakPolarHBondContact CG2-O 3.47Å; V392-D423 HydrophobicContact CG1-CB 4.04Å
393	K	91.8	Very high	87.5	Confident	147 Å²	147	77 Å²	77	64%	0.639	37%	0.374	S	S	*	.	H	α-helix	trans	-62.7	-44.3	179.3	-72	179	-179.2	-179.8	0	112.2	D389 K390 T391 L395 K396 E397	D389-K393 WeakPolarHBondContact O-CG 3.27Å; D389-K393 PolarHBondContact O-N 3.27Å; K390-K393 PolarHBondContact O-N 3.31Å; T391-K393 PolarHBondContact O-N 3.45Å; K393-L395 VanDerWaalsContact C-N 3.35Å; K393-L395 PolarHBondContact O-N 2.87Å; K393-K396 PolarHBondContact O-N 3.19Å; K393-E397 PolarHBondContact O-N 3.39Å
394	E	90.8	Very high	85.8	Confident	80 Å²	80	80.1 Å²	80.1	37%	0.374	39%	0.39	S	S	.	.	H	α-helix	trans	-62.5	-39.9	177	-75.8	-179.8	-162.8	0	0	112.5	K390 T391 K398	K390-E394 WeakPolarHBondContact CE-OE1 3.41Å; K390-E394 WeakPolarHBondContact O-CB 3.26Å; K390-E394 WeakPolarHBondContact O-CG 3.49Å; K390-E394 PolarHBondContact O-N 2.9Å; T391-E394 PolarHBondContact O-N 2.72Å; E394-K398 WeakPolarHBondContact O-CD 3.3Å; E394-K398 VanDerWaalsContact O-CG 3.24Å; E394-K398 WeakPolarHBondContact O-CG 3.37Å; E394-K398 PolarHBondContact O-N 3.24Å
395	L	90.9	Very high	84.5	Confident	9 Å²	9	74 Å²	74	5%	0.047	37%	0.372	C	S	.	.	H	α-helix	trans	-67.3	-44	176.7	-71.9	170.7	0	0	0	111.2	T391 V392 K393 E397 K398 F399 L408 V411 L420	T391-L395 HydrophobicContact CG2-CD1 3.98Å; T391-L395 HydrophobicContact CG2-CG 4.34Å; T391-L395 WeakPolarHBondContact O-CB 3.39Å; T391-L395 VanDerWaalsContact O-CG 3.24Å; T391-L395 WeakPolarHBondContact O-CG 3.37Å; T391-L395 PolarHBondContact O-N 3.43Å; V392-L395 PolarHBondContact O-N 2.89Å; K393-L395 VanDerWaalsContact C-N 3.35Å; K393-L395 PolarHBondContact O-N 2.87Å; L395-E397 PolarHBondContact O-N 3.37Å; L395-K398 WeakPolarHBondContact O-CB 3.48Å; L395-K398 PolarHBondContact O-N 3.33Å; L395-F399 WeakPolarHBondContact O-CD2 3.39Å; L395-F399 PolarHBondContact O-N 2.95Å; L395-L408 HydrophobicContact CD2-CD2 4.47Å; L395-V411 HydrophobicContact CD1-CG1 4.19Å; L395-V411 HydrophobicContact CD1-CG2 3.87Å; L395-V411 HydrophobicContact CD2-CG2 3.79Å; L395-V411 HydrophobicContact CG-CG2 4.41Å; L395-L420 HydrophobicContact CB-CD1 4.15Å; L395-L420 HydrophobicContact CB-CD2 3.85Å; L395-L420 HydrophobicContact CD1-CD2 4.36Å
396	K	88.7	Confident	83.5	Confident	15 Å²	15	71.2 Å²	71.2	7%	0.065	36%	0.359	C	S	.	.	H	α-helix	trans	-60.5	-45.8	177	-176	168.6	174.9	178.5	0	111.9	V392 K393 K398 F399 L400 L420 D423 S427	V392-K396 WeakPolarHBondContact O-CB 3.44Å; V392-K396 PolarHBondContact O-N 2.68Å; K393-K396 PolarHBondContact O-N 3.19Å; K396-K398 VanDerWaalsContact C-N 3.3Å; K396-K398 PolarHBondContact O-N 3.3Å; K396-F399 PolarHBondContact O-N 3.35Å; K396-L400 HydrophobicContact CG-CD1 3.81Å; K396-L400 HydrophobicContact CG-CG 4.44Å; K396-L400 WeakPolarHBondContact O-CG 3.38Å; K396-L400 PolarHBondContact O-N 3.16Å; K396-L420 HydrophobicContact CB-CD1 3.59Å; K396-L420 HydrophobicContact CG-CD1 4.37Å; K396-D423 WeakPolarHBondContact CD-OD2 3.27Å; K396-D423 WeakPolarHBondContact CE-OD2 2.75Å; K396-D423 PolarHBondContact NZ-O 3.48Å; K396-D423 IonicContact NZ-OD1 2.65Å; K396-D423 IonicContact NZ-OD2 3.32Å; K396-D423 PolarHBondContact NZ-OD2 2.86Å; K396-S427 VanDerWaalsContact CE-OG 3.28Å; K396-S427 WeakPolarHBondContact CE-OG 3.42Å; K396-S427 PolarHBondContact NZ-OG 3.37Å
397	E	86.8	Confident	82.8	Confident	79 Å²	79	68.9 Å²	68.9	37%	0.369	34%	0.339	S	S	.	.	H	α-helix	trans	-60	-42.4	175.3	-169.6	-171.6	171.3	0	0	111.3	I345 K393 L395 F399 L400 R401	I345-E397 HydrophobicContact CD1-CB 4.33Å; I345-E397 HydrophobicContact CD1-CG 4.16Å; K393-E397 PolarHBondContact O-N 3.39Å; L395-E397 PolarHBondContact O-N 3.37Å; E397-F399 PolarHBondContact O-N 3.07Å; E397-L400 PolarHBondContact O-N 3.04Å; E397-R401 HydrophobicContact CG-CB 4.48Å; E397-R401 WeakPolarHBondContact O-CB 3.42Å; E397-R401 PolarHBondContact O-N 2.94Å; E397-R401 IonicContact OE1-CZ 3.61Å; E397-R401 VanDerWaalsContact OE1-CZ 3.32Å; E397-R401 IonicContact OE1-NE 3.88Å; E397-R401 IonicContact OE1-NH1 3.63Å; E397-R401 PolarHBondContact OE1-NH1 2.81Å
398	K	84.4	Confident	82.5	Confident	99 Å²	99	68.8 Å²	68.8	43%	0.43	34%	0.336	S	S	.	.	H	α-helix	trans	-61.9	-43.5	175.9	-74	166.8	-172.5	161.9	0	111.8	E394 L395 K396 A402 P406	E394-K398 WeakPolarHBondContact O-CD 3.3Å; E394-K398 VanDerWaalsContact O-CG 3.24Å; E394-K398 WeakPolarHBondContact O-CG 3.37Å; E394-K398 PolarHBondContact O-N 3.24Å; L395-K398 WeakPolarHBondContact O-CB 3.48Å; L395-K398 PolarHBondContact O-N 3.33Å; K396-K398 VanDerWaalsContact C-N 3.3Å; K396-K398 PolarHBondContact O-N 3.3Å; K398-A402 WeakPolarHBondContact O-CA 3.48Å; K398-A402 WeakPolarHBondContact O-CB 3.36Å; K398-A402 PolarHBondContact O-N 2.81Å; K398-P406 HydrophobicContact CB-CB 4.03Å; K398-P406 HydrophobicContact CB-CG 4.13Å; K398-P406 HydrophobicContact CD-CB 4.39Å
399	F	84.3	Confident	81.9	Confident	25 Å²	25	68.8 Å²	68.8	11%	0.11	34%	0.337	C	S	.	.	H	α-helix	trans	-62.8	-42.5	177.2	-93.8	-80.2	0	0	0	113	I364 H367 L395 K396 E397 V405 P406 L408 L420	I364-F399 HydrophobicContact CB-CD1 3.84Å; I364-F399 HydrophobicContact CB-CE1 4.11Å; I364-F399 HydrophobicContact CB-CG 4.28Å; I364-F399 HydrophobicContact CD1-CB 3.83Å; I364-F399 HydrophobicContact CD1-CD1 4.24Å; I364-F399 HydrophobicContact CD1-CD2 4.04Å; I364-F399 HydrophobicContact CD1-CG 3.79Å; I364-F399 HydrophobicContact CG1-CB 4.36Å; I364-F399 HydrophobicContact CG1-CD1 3.82Å; I364-F399 HydrophobicContact CG1-CD2 4.06Å; I364-F399 HydrophobicContact CG1-CE1 4.05Å; I364-F399 HydrophobicContact CG1-CE2 4.28Å; I364-F399 HydrophobicContact CG1-CG 3.83Å; I364-F399 HydrophobicContact CG1-CZ 4.29Å; H367-F399 HydrophobicContact CB-CE1 4.39Å; H367-F399 HydrophobicContact CB-CZ 4.26Å; L395-F399 WeakPolarHBondContact O-CD2 3.39Å; L395-F399 PolarHBondContact O-N 2.95Å; K396-F399 PolarHBondContact O-N 3.35Å; E397-F399 PolarHBondContact O-N 3.07Å; F399-V405 HydrophobicContact CE1-CG1 3.75Å; F399-V405 HydrophobicContact CZ-CG1 3.97Å; F399-P406 HydrophobicContact CD1-CG 4.31Å; F399-P406 HydrophobicContact CD2-CG 3.28Å; F399-P406 HydrophobicContact CE1-CG 4.25Å; F399-P406 HydrophobicContact CE2-CG 3.18Å; F399-P406 HydrophobicContact CG-CG 3.87Å; F399-P406 HydrophobicContact CZ-CG 3.71Å; F399-L408 HydrophobicContact CE2-CD2 3.79Å; F399-L408 HydrophobicContact CE2-CG 4.34Å; F399-L408 HydrophobicContact CZ-CD1 4.13Å; F399-L408 HydrophobicContact CZ-CD2 4.15Å; F399-L408 HydrophobicContact CZ-CG 4.19Å; F399-L420 HydrophobicContact CD2-CD2 3.85Å; F399-L420 HydrophobicContact CE2-CD2 3.66Å
400	L	80.5	Confident	81.6	Confident	28 Å²	28	69.6 Å²	69.6	15%	0.147	34%	0.335	C	S	.	.	H	α-helix	trans	-83.8	-30.7	-173.6	-61.8	176.6	0	0	0	113.1	I345 F353 K396 E397	I345-L400 HydrophobicContact CB-CD1 4.06Å; I345-L400 HydrophobicContact CD1-CD1 4.3Å; I345-L400 HydrophobicContact CG1-CB 4.18Å; I345-L400 HydrophobicContact CG1-CD1 3.67Å; I345-L400 HydrophobicContact CG2-CD1 3.83Å; F353-L400 HydrophobicContact CD1-CD2 4.17Å; F353-L400 HydrophobicContact CE1-CD2 3.64Å; F353-L400 HydrophobicContact CZ-CD2 4.42Å; K396-L400 HydrophobicContact CG-CD1 3.81Å; K396-L400 HydrophobicContact CG-CG 4.44Å; K396-L400 WeakPolarHBondContact O-CG 3.38Å; K396-L400 PolarHBondContact O-N 3.16Å; E397-L400 PolarHBondContact O-N 3.04Å
401	R	74.4	Confident	81.4	Confident	183 Å²	183	63.6 Å²	63.6	69%	0.691	31%	0.31	S	S	*	.	H	α-helix	trans	-100.5	-30.9	-175.4	-157.7	178.8	88.3	176.7	10	113.6	E397	E397-R401 HydrophobicContact CG-CB 4.48Å; E397-R401 WeakPolarHBondContact O-CB 3.42Å; E397-R401 PolarHBondContact O-N 2.94Å; E397-R401 IonicContact OE1-CZ 3.61Å; E397-R401 VanDerWaalsContact OE1-CZ 3.32Å; E397-R401 IonicContact OE1-NE 3.88Å; E397-R401 IonicContact OE1-NH1 3.63Å; E397-R401 PolarHBondContact OE1-NH1 2.81Å
402	A	62.9	Low	81.3	Confident	50 Å²	50	68.7 Å²	68.7	41%	0.413	34%	0.336	S	S	.	.			trans	-82.9	144.9	-175.6	0	0	0	0	0	111.3	K398 N404	K398-A402 WeakPolarHBondContact O-CA 3.48Å; K398-A402 WeakPolarHBondContact O-CB 3.36Å; K398-A402 PolarHBondContact O-N 2.81Å; A402-N404 PolarHBondContact O-N 3.4Å
403	K	56.6	Low	81.2	Confident	171 Å²	171	71 Å²	71	74%	0.743	35%	0.348	S	S	*	.	S	Bend	trans	-69.7	-8.7	173.3	-65.8	-175.2	178.6	-176.3	0	113.4
404	N	62.2	Low	81.5	Confident	66 Å²	66	64.3 Å²	64.3	35%	0.353	32%	0.319	S	S	.	.	S	Bend	trans	-129.5	142.9	-174.3	-61	-16.2	0	0	0	109.4	A402	A402-N404 PolarHBondContact O-N 3.4Å
405	V	68.9	Low	81.8	Confident	43 Å²	43	61.6 Å²	61.6	26%	0.261	31%	0.306	S	S	.	.			trans	-60.7	126.6	172.7	176.1	0	0	0	0	109.6	H367 F399	H367-V405 HydrophobicContact CB-CG1 4.48Å; F399-V405 HydrophobicContact CE1-CG1 3.75Å; F399-V405 HydrophobicContact CZ-CG1 3.97Å
406	P	76.3	Confident	82	Confident	19 Å²	19	61.2 Å²	61.2	12%	0.123	30%	0.304	C	S	.	.			trans	-64.1	145.6	175.2	27.3	-33.2	0	0	0	110.1	K398 F399 L408	K398-P406 HydrophobicContact CB-CB 4.03Å; K398-P406 HydrophobicContact CB-CG 4.13Å; K398-P406 HydrophobicContact CD-CB 4.39Å; F399-P406 HydrophobicContact CD1-CG 4.31Å; F399-P406 HydrophobicContact CD2-CG 3.28Å; F399-P406 HydrophobicContact CE1-CG 4.25Å; F399-P406 HydrophobicContact CE2-CG 3.18Å; F399-P406 HydrophobicContact CG-CG 3.87Å; F399-P406 HydrophobicContact CZ-CG 3.71Å; P406-L408 PolarHBondContact O-N 3.45Å
407	L	78.6	Confident	82.4	Confident	40 Å²	40	60.5 Å²	60.5	21%	0.209	30%	0.301	C	S	.	.			trans	-75	95.1	-178.7	-173.7	58.8	0	0	0	110	V300 S409 K410	V300-L407 HydrophobicContact CG1-CD1 4.18Å; V300-L407 WeakPolarHBondContact O-CD1 3.45Å; V300-L407 VanDerWaalsContact O-CD2 3.3Å; V300-L407 WeakPolarHBondContact O-CD2 3.5Å; L407-S409 WeakPolarHBondContact CD1-OG 3.26Å; L407-S409 VanDerWaalsContact CG-OG 3.3Å; L407-S409 WeakPolarHBondContact CG-OG 3.49Å; L407-S409 PolarHBondContact O-N 3.2Å; L407-K410 HydrophobicContact CB-CD 4.43Å; L407-K410 HydrophobicContact CD2-CD 3.77Å; L407-K410 HydrophobicContact CD2-CG 3.75Å; L407-K410 HydrophobicContact CG-CD 4.37Å; L407-K410 HydrophobicContact CG-CG 4.09Å; L407-K410 PolarHBondContact O-N 2.86Å
408	L	85.2	Confident	82.9	Confident	8 Å²	8	56.7 Å²	56.7	4%	0.042	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-62.9	-29	-178.3	-70.1	-175.4	0	0	0	113.3	H367 E371 L395 F399 P406 K410 V411 I417 L420	H367-L408 HydrophobicContact CB-CD1 3.97Å; H367-L408 WeakPolarHBondContact O-CD1 3.5Å; E371-L408 HydrophobicContact CB-CB 4.31Å; E371-L408 HydrophobicContact CB-CD1 4.12Å; E371-L408 HydrophobicContact CG-CB 3.92Å; L395-L408 HydrophobicContact CD2-CD2 4.47Å; F399-L408 HydrophobicContact CE2-CD2 3.79Å; F399-L408 HydrophobicContact CE2-CG 4.34Å; F399-L408 HydrophobicContact CZ-CD1 4.13Å; F399-L408 HydrophobicContact CZ-CD2 4.15Å; F399-L408 HydrophobicContact CZ-CG 4.19Å; P406-L408 PolarHBondContact O-N 3.45Å; L408-K410 PolarHBondContact O-N 3.4Å; L408-K410 VanDerWaalsContact O-N 3.12Å; L408-V411 WeakPolarHBondContact O-CB 3.46Å; L408-V411 PolarHBondContact O-N 2.96Å; L408-I417 HydrophobicContact CB-CD1 3.99Å; L408-I417 HydrophobicContact CD1-CG2 4.47Å; L408-I417 HydrophobicContact CD2-CD1 4.16Å; L408-I417 HydrophobicContact CG-CD1 4.47Å; L408-L420 HydrophobicContact CD2-CD2 4.4Å
409	S	83.3	Confident	83.5	Confident	69 Å²	69	52.6 Å²	52.6	48%	0.483	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-65.7	-11.7	176.2	62.6	0	0	0	0	114.9	L407	L407-S409 WeakPolarHBondContact CD1-OG 3.26Å; L407-S409 VanDerWaalsContact CG-OG 3.3Å; L407-S409 WeakPolarHBondContact CG-OG 3.49Å; L407-S409 PolarHBondContact O-N 3.2Å
410	K	85.4	Confident	84.1	Confident	131 Å²	131	51.4 Å²	51.4	57%	0.57	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-87.6	-5.3	171.4	-75.3	-176.9	172.9	173.3	0	113.4	G303 L407 L408	G303-K410 PolarHBondContact O-NZ 3.42Å; L407-K410 HydrophobicContact CB-CD 4.43Å; L407-K410 HydrophobicContact CD2-CD 3.77Å; L407-K410 HydrophobicContact CD2-CG 3.75Å; L407-K410 HydrophobicContact CG-CD 4.37Å; L407-K410 HydrophobicContact CG-CG 4.09Å; L407-K410 PolarHBondContact O-N 2.86Å; L408-K410 PolarHBondContact O-N 3.4Å; L408-K410 VanDerWaalsContact O-N 3.12Å
411	V	90.4	Very high	84.9	Confident	18 Å²	18	50 Å²	50	11%	0.109	26%	0.257	C	S	.	.			trans	-90.5	105.1	179.6	-175.2	0	0	0	0	107.4	R375 T391 L395 L408 D413 A416 I417	R375-V411 PolarHBondContact NH2-O 3.28Å; T391-V411 HydrophobicContact CG2-CG1 4.24Å; L395-V411 HydrophobicContact CD1-CG1 4.19Å; L395-V411 HydrophobicContact CD1-CG2 3.87Å; L395-V411 HydrophobicContact CD2-CG2 3.79Å; L395-V411 HydrophobicContact CG-CG2 4.41Å; L408-V411 WeakPolarHBondContact O-CB 3.46Å; L408-V411 PolarHBondContact O-N 2.96Å; V411-D413 WeakPolarHBondContact CG1-O 3.12Å; V411-D413 PolarHBondContact O-N 3.18Å; V411-A416 HydrophobicContact CG1-CB 4.09Å; V411-I417 HydrophobicContact CB-CD1 4.29Å; V411-I417 HydrophobicContact CB-CG1 4.38Å; V411-I417 HydrophobicContact CG1-CG1 4.21Å
412	D	90.1	Very high	85.9	Confident	154 Å²	154	42.1 Å²	42.1	82%	0.824	23%	0.227	S	C	*	.			trans	-60.2	-49.8	-176.6	-56.1	-48.1	0	0	0	111.2	R375 I414	R375-D412 PolarHBondContact NH1-O 2.85Å; D412-I414 PolarHBondContact O-N 3.26Å
413	D	93.8	Very high	87.5	Confident	57 Å²	57	41.8 Å²	41.8	31%	0.305	22%	0.219	S	C	.	.			trans	-74.8	112.6	-179.3	176.9	19.9	0	0	0	112.4	G387 V411 H415 A416	G387-D413 WeakPolarHBondContact CA-OD2 3.43Å; V411-D413 WeakPolarHBondContact CG1-O 3.12Å; V411-D413 PolarHBondContact O-N 3.18Å; D413-H415 VanDerWaalsContact C-N 3.26Å; D413-H415 PolarHBondContact O-N 2.6Å; D413-H415 WeakPolarHBondContact OD1-CA 3.24Å; D413-H415 VanDerWaalsContact OD1-CB 3.24Å; D413-H415 WeakPolarHBondContact OD1-CB 3.47Å; D413-H415 IonicContact OD1-CD2 4Å; D413-H415 PolarHBondContact OD1-CD2 2.89Å; D413-H415 VanDerWaalsContact OD1-CD2 3.31Å; D413-H415 IonicContact OD1-CG 3.3Å; D413-H415 PolarHBondContact OD1-N 3.4Å; D413-A416 HydrophobicContact CB-CB 4.33Å; D413-A416 WeakPolarHBondContact O-CB 3.49Å; D413-A416 PolarHBondContact O-N 2.84Å; D413-A416 PolarHBondContact OD2-N 3.39Å
414	I	96.4	Very high	89.3	Confident	6 Å²	6	33.8 Å²	33.8	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-68.2	-27.5	175.9	-165.8	62.5	0	0	0	112.4	I372 R375 E379 D412 A416 I417 C418	I372-I414 HydrophobicContact CB-CD1 4.44Å; I372-I414 HydrophobicContact CG1-CD1 3.9Å; I372-I414 HydrophobicContact CG1-CG1 4.33Å; R375-I414 HydrophobicContact CG-CD1 3.93Å; E379-I414 HydrophobicContact CB-CG2 4.15Å; E379-I414 HydrophobicContact CG-CG2 3.92Å; D412-I414 PolarHBondContact O-N 3.26Å; I414-A416 PolarHBondContact O-N 3.05Å; I414-I417 HydrophobicContact CD1-CB 4.24Å; I414-I417 HydrophobicContact CD1-CD1 4.13Å; I414-I417 HydrophobicContact CD1-CG1 4.44Å; I414-I417 WeakPolarHBondContact O-CB 3.48Å; I414-I417 PolarHBondContact O-N 2.9Å; I414-C418 PolarHBondContact O-N 3.02Å; I414-C418 PolarHBondContact O-SG 3.29Å
415	H	96.9	Very high	90.9	Very high	24 Å²	24	30.8 Å²	30.8	11%	0.111	17%	0.168	C	C	.	.	H	α-helix	trans	-68.5	-24	-180	-55.1	-63.2	0	0	0	111.4	I385 G387 D413 G419	I385-H415 HydrophobicContact CG2-CB 4.3Å; G387-H415 PolarHBondContact N-O 3.35Å; D413-H415 VanDerWaalsContact C-N 3.26Å; D413-H415 PolarHBondContact O-N 2.6Å; D413-H415 WeakPolarHBondContact OD1-CA 3.24Å; D413-H415 VanDerWaalsContact OD1-CB 3.24Å; D413-H415 WeakPolarHBondContact OD1-CB 3.47Å; D413-H415 IonicContact OD1-CD2 4Å; D413-H415 PolarHBondContact OD1-CD2 2.89Å; D413-H415 VanDerWaalsContact OD1-CD2 3.31Å; D413-H415 IonicContact OD1-CG 3.3Å; D413-H415 PolarHBondContact OD1-N 3.4Å; H415-G419 PolarHBondContact O-N 3.33Å
416	A	96.4	Very high	92	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66.7	-36	169.1	0	0	0	0	0	111.9	T391 V392 V411 D413 I414 G419 L420	T391-A416 HydrophobicContact CG2-CB 4.07Å; V392-A416 HydrophobicContact CG2-CB 4.4Å; V392-A416 WeakPolarHBondContact CG2-O 3.47Å; V411-A416 HydrophobicContact CG1-CB 4.09Å; D413-A416 HydrophobicContact CB-CB 4.33Å; D413-A416 WeakPolarHBondContact O-CB 3.49Å; D413-A416 PolarHBondContact O-N 2.84Å; D413-A416 PolarHBondContact OD2-N 3.39Å; I414-A416 PolarHBondContact O-N 3.05Å; A416-G419 PolarHBondContact O-N 3.42Å; A416-L420 WeakPolarHBondContact O-CB 3.49Å; A416-L420 PolarHBondContact O-N 3.39Å
417	I	96.6	Very high	92.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-73.1	-40.3	175.5	-53.3	-167.5	0	0	0	110.8	C368 E371 I372 L408 V411 I414 G419 L420 L421	C368-I417 HydrophobicContact CB-CG2 3.89Å; E371-I417 HydrophobicContact CB-CD1 4.3Å; E371-I417 HydrophobicContact CG-CD1 3.5Å; I372-I417 HydrophobicContact CD1-CG2 4.06Å; I372-I417 HydrophobicContact CG1-CB 4.39Å; I372-I417 HydrophobicContact CG1-CG2 3.93Å; L408-I417 HydrophobicContact CB-CD1 3.99Å; L408-I417 HydrophobicContact CD1-CG2 4.47Å; L408-I417 HydrophobicContact CD2-CD1 4.16Å; L408-I417 HydrophobicContact CG-CD1 4.47Å; V411-I417 HydrophobicContact CB-CD1 4.29Å; V411-I417 HydrophobicContact CB-CG1 4.38Å; V411-I417 HydrophobicContact CG1-CG1 4.21Å; I414-I417 HydrophobicContact CD1-CB 4.24Å; I414-I417 HydrophobicContact CD1-CD1 4.13Å; I414-I417 HydrophobicContact CD1-CG1 4.44Å; I414-I417 WeakPolarHBondContact O-CB 3.48Å; I414-I417 PolarHBondContact O-N 2.9Å; I417-G419 VanDerWaalsContact C-N 3.26Å; I417-G419 PolarHBondContact O-N 2.87Å; I417-L420 WeakPolarHBondContact O-CB 3.33Å; I417-L420 PolarHBondContact O-N 2.72Å; I417-L421 PolarHBondContact O-N 2.73Å
418	C	97.5	Very high	93.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.4	-42.8	171	-60.6	0	0	0	0	111	L382 Y383 I414 K422	L382-C418 WeakPolarHBondContact CD2-SG 3.47Å; Y383-C418 HydrophobicContact CD1-CB 3.66Å; Y383-C418 HydrophobicContact CE1-CB 3.88Å; Y383-C418 HydrophobicContact CG-CB 4.45Å; I414-C418 PolarHBondContact O-N 3.02Å; I414-C418 PolarHBondContact O-SG 3.29Å; C418-K422 WeakPolarHBondContact O-CG 3.12Å; C418-K422 PolarHBondContact O-N 2.62Å; C418-K422 VanDerWaalsContact O-N 3.15Å
419	G	97.1	Very high	93.5	Very high	12 Å²	12	41.6 Å²	41.6	12%	0.124	21%	0.207	C	C	.	.	H	α-helix	trans	-61.1	-45.1	174.7	0	0	0	0	0	112.3	H415 A416 I417 K422 D423	H415-G419 PolarHBondContact O-N 3.33Å; A416-G419 PolarHBondContact O-N 3.42Å; I417-G419 VanDerWaalsContact C-N 3.26Å; I417-G419 PolarHBondContact O-N 2.87Å; G419-K422 PolarHBondContact O-N 3.32Å; G419-D423 WeakPolarHBondContact O-CB 3.02Å; G419-D423 PolarHBondContact O-N 2.72Å
420	L	96.2	Very high	93.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-58.6	-47.3	176.5	175.9	64.5	0	0	0	112.6	I364 L395 K396 F399 L408 A416 I417 D423 F424	I364-L420 HydrophobicContact CD1-CD1 4.07Å; I364-L420 HydrophobicContact CD1-CG 4.24Å; L395-L420 HydrophobicContact CB-CD1 4.15Å; L395-L420 HydrophobicContact CB-CD2 3.85Å; L395-L420 HydrophobicContact CD1-CD2 4.36Å; K396-L420 HydrophobicContact CB-CD1 3.59Å; K396-L420 HydrophobicContact CG-CD1 4.37Å; F399-L420 HydrophobicContact CD2-CD2 3.85Å; F399-L420 HydrophobicContact CE2-CD2 3.66Å; L408-L420 HydrophobicContact CD2-CD2 4.4Å; A416-L420 WeakPolarHBondContact O-CB 3.49Å; A416-L420 PolarHBondContact O-N 3.39Å; I417-L420 WeakPolarHBondContact O-CB 3.33Å; I417-L420 PolarHBondContact O-N 2.72Å; L420-D423 PolarHBondContact O-N 3.28Å; L420-F424 WeakPolarHBondContact O-CB 3.49Å; L420-F424 PolarHBondContact O-N 3.13Å
421	L	96.9	Very high	94.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.6	-49	177.7	-177	151.8	0	0	0	110.8	I365 C368 V369 I372 Y383 I417 D423 F424 L425 L475 F499	I365-L421 HydrophobicContact CD1-CD1 4.38Å; I365-L421 HydrophobicContact CD1-CG 3.86Å; C368-L421 HydrophobicContact CB-CB 4.1Å; C368-L421 HydrophobicContact CB-CD1 3.94Å; C368-L421 HydrophobicContact CB-CG 4.5Å; V369-L421 HydrophobicContact CG2-CD1 3.74Å; I372-L421 HydrophobicContact CD1-CD1 4.46Å; Y383-L421 HydrophobicContact CE1-CD2 4.19Å; I417-L421 PolarHBondContact O-N 2.73Å; L421-D423 PolarHBondContact O-N 2.99Å; L421-F424 PolarHBondContact O-N 3.12Å; L421-L425 HydrophobicContact CD2-CD1 3.75Å; L421-L425 WeakPolarHBondContact O-CG 3.33Å; L421-L425 PolarHBondContact O-N 3.2Å; L421-L475 HydrophobicContact CD2-CD1 4.13Å; L421-F499 HydrophobicContact CD2-CE1 3.96Å; L421-F499 HydrophobicContact CD2-CZ 4.21Å
422	K	96.7	Very high	94.6	Very high	17 Å²	17	34.9 Å²	34.9	7%	0.074	17%	0.17	C	C	.	.	H	α-helix	trans	-63.4	-41.2	178.4	-69.2	-176.5	-60.2	174.1	0	112.2	Y383 C418 G419 R426 V498 F499 T502	Y383-K422 HydrophobicContact CD1-CD 4.23Å; Y383-K422 HydrophobicContact CD1-CG 4.22Å; Y383-K422 PolarHBondContact O-NZ 3.43Å; C418-K422 WeakPolarHBondContact O-CG 3.12Å; C418-K422 PolarHBondContact O-N 2.62Å; C418-K422 VanDerWaalsContact O-N 3.15Å; G419-K422 PolarHBondContact O-N 3.32Å; K422-R426 WeakPolarHBondContact O-CB 3.41Å; K422-R426 PolarHBondContact O-N 3.5Å; K422-V498 HydrophobicContact CD-CG1 3.75Å; K422-F499 HydrophobicContact CG-CE1 4.26Å; K422-F499 HydrophobicContact CG-CZ 4.26Å; K422-T502 HydrophobicContact CB-CG2 4.38Å
423	D	95.4	Very high	94.9	Very high	43 Å²	43	27.5 Å²	27.5	23%	0.23	13%	0.131	C	C	.	.	H	α-helix	trans	-71.3	-31.4	-178.8	-172.4	57.1	0	0	0	112.2	V392 K396 G419 L420 L421 S427	V392-D423 HydrophobicContact CG1-CB 4.04Å; K396-D423 WeakPolarHBondContact CD-OD2 3.27Å; K396-D423 WeakPolarHBondContact CE-OD2 2.75Å; K396-D423 PolarHBondContact NZ-O 3.48Å; K396-D423 IonicContact NZ-OD1 2.65Å; K396-D423 IonicContact NZ-OD2 3.32Å; K396-D423 PolarHBondContact NZ-OD2 2.86Å; G419-D423 WeakPolarHBondContact O-CB 3.02Å; G419-D423 PolarHBondContact O-N 2.72Å; L420-D423 PolarHBondContact O-N 3.28Å; L421-D423 PolarHBondContact O-N 2.99Å; D423-S427 WeakPolarHBondContact O-CB 3.41Å; D423-S427 PolarHBondContact O-N 3.29Å; D423-S427 PolarHBondContact O-OG 3.46Å
424	F	94.7	Very high	95	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.009	12%	0.118	C	C	.	.	H	α-helix	trans	-64.2	-54	170.8	172.9	-100.2	0	0	0	111	F353 P362 I364 I365 L420 L421 R426 S427 L428	F353-F424 HydrophobicContact CB-CZ 4.05Å; F353-F424 HydrophobicContact CD1-CE2 4.26Å; F353-F424 HydrophobicContact CD2-CE2 4.19Å; F353-F424 HydrophobicContact CD2-CZ 4.1Å; F353-F424 HydrophobicContact CE2-CE2 4.49Å; F353-F424 HydrophobicContact CG-CE2 4.06Å; F353-F424 HydrophobicContact CG-CZ 4Å; P362-F424 HydrophobicContact CB-CE1 3.98Å; P362-F424 HydrophobicContact CB-CZ 3.89Å; P362-F424 HydrophobicContact CG-CE1 3.99Å; P362-F424 HydrophobicContact CG-CZ 4.05Å; I364-F424 HydrophobicContact CD1-CB 4.06Å; I364-F424 HydrophobicContact CD1-CD2 3.98Å; I364-F424 HydrophobicContact CD1-CG 4.09Å; I364-F424 HydrophobicContact CG2-CD1 3.76Å; I364-F424 HydrophobicContact CG2-CD2 3.73Å; I364-F424 HydrophobicContact CG2-CE1 3.69Å; I364-F424 HydrophobicContact CG2-CE2 3.67Å; I364-F424 HydrophobicContact CG2-CG 3.77Å; I364-F424 HydrophobicContact CG2-CZ 3.64Å; I365-F424 HydrophobicContact CD1-CD1 3.62Å; I365-F424 HydrophobicContact CD1-CE1 4.07Å; I365-F424 HydrophobicContact CG1-CD1 3.9Å; I365-F424 HydrophobicContact CG1-CE1 3.84Å; L420-F424 WeakPolarHBondContact O-CB 3.49Å; L420-F424 PolarHBondContact O-N 3.13Å; L421-F424 PolarHBondContact O-N 3.12Å; F424-R426 VanDerWaalsContact C-N 3.31Å; F424-R426 PolarHBondContact O-N 3.5Å; F424-S427 PolarHBondContact O-N 2.96Å; F424-S427 VanDerWaalsContact O-N 3.08Å; F424-S427 PolarHBondContact O-OG 3.36Å; F424-L428 HydrophobicContact CE1-CD2 4.35Å; F424-L428 HydrophobicContact CE2-CD2 4.45Å; F424-L428 HydrophobicContact CZ-CD2 4.07Å; F424-L428 PolarHBondContact O-N 3.05Å
425	L	95.4	Very high	94.9	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.016	13%	0.128	C	C	.	.	H	α-helix	trans	-58.5	-41.6	-179.6	-69.2	173.5	0	0	0	112.4	I365 L421 S427 L428 L432 L475 F499 T502 I503	I365-L425 HydrophobicContact CD1-CD1 4.42Å; I365-L425 HydrophobicContact CD1-CD2 3.94Å; I365-L425 HydrophobicContact CD1-CG 3.99Å; L421-L425 HydrophobicContact CD2-CD1 3.75Å; L421-L425 WeakPolarHBondContact O-CG 3.33Å; L421-L425 PolarHBondContact O-N 3.2Å; L425-S427 VanDerWaalsContact C-N 3.29Å; L425-S427 PolarHBondContact O-N 2.87Å; L425-L428 HydrophobicContact CD2-CD1 4.38Å; L425-L428 WeakPolarHBondContact O-CG 3.47Å; L425-L428 PolarHBondContact O-N 2.95Å; L425-L432 HydrophobicContact CD2-CD2 4.4Å; L425-L475 HydrophobicContact CD1-CD2 3.87Å; L425-F499 HydrophobicContact CD1-CE1 4.45Å; L425-T502 HydrophobicContact CB-CG2 3.83Å; L425-T502 HydrophobicContact CD1-CG2 4.4Å; L425-I503 HydrophobicContact CD1-CG2 4.1Å
426	R	93.4	Very high	94.9	Very high	152 Å²	152	35.6 Å²	35.6	57%	0.574	16%	0.158	S	C	*	.	H	α-helix	trans	-70	-24.4	178.7	-161	-171.9	-38.3	174.5	13.5	113.7	K422 F424	K422-R426 WeakPolarHBondContact O-CB 3.41Å; K422-R426 PolarHBondContact O-N 3.5Å; F424-R426 VanDerWaalsContact C-N 3.31Å; F424-R426 PolarHBondContact O-N 3.5Å
427	S	91.4	Very high	94.9	Very high	30 Å²	30	35.9 Å²	35.9	21%	0.21	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	3	-178.5	66.8	0	0	0	0	114.7	K396 D423 F424 L425	K396-S427 VanDerWaalsContact CE-OG 3.28Å; K396-S427 WeakPolarHBondContact CE-OG 3.42Å; K396-S427 PolarHBondContact NZ-OG 3.37Å; D423-S427 WeakPolarHBondContact O-CB 3.41Å; D423-S427 PolarHBondContact O-N 3.29Å; D423-S427 PolarHBondContact O-OG 3.46Å; F424-S427 PolarHBondContact O-N 2.96Å; F424-S427 VanDerWaalsContact O-N 3.08Å; F424-S427 PolarHBondContact O-OG 3.36Å; L425-S427 VanDerWaalsContact C-N 3.29Å; L425-S427 PolarHBondContact O-N 2.87Å
428	L	91.1	Very high	94.9	Very high	16 Å²	16	36.1 Å²	36.1	8%	0.084	16%	0.161	C	C	.	.	S	Bend	trans	-63.6	146.5	170.8	-63.9	174	0	0	0	109.2	L350 F353 F424 L425 E430	L350-L428 HydrophobicContact CB-CD1 4.47Å; L350-L428 HydrophobicContact CD1-CD1 4.06Å; L350-L428 HydrophobicContact CD1-CD2 4.29Å; F353-L428 HydrophobicContact CD2-CD2 4.19Å; F353-L428 HydrophobicContact CE2-CD2 4.25Å; F424-L428 HydrophobicContact CE1-CD2 4.35Å; F424-L428 HydrophobicContact CE2-CD2 4.45Å; F424-L428 HydrophobicContact CZ-CD2 4.07Å; F424-L428 PolarHBondContact O-N 3.05Å; L425-L428 HydrophobicContact CD2-CD1 4.38Å; L425-L428 WeakPolarHBondContact O-CG 3.47Å; L425-L428 PolarHBondContact O-N 2.95Å; L428-E430 WeakPolarHBondContact CB-O 3.12Å; L428-E430 PolarHBondContact O-N 3.47Å; L428-E430 VanDerWaalsContact O-N 3.14Å
429	K	89.4	Confident	94.8	Very high	139 Å²	139	42.2 Å²	42.2	60%	0.604	19%	0.188	S	C	*	.	S	Bend	trans	-56.8	-28.8	176.4	-177.2	177.2	178.6	179.6	0	112.9	G348	G348-K429 WeakPolarHBondContact O-CB 3.34Å; G348-K429 PolarHBondContact O-N 3Å
430	E	89.7	Confident	94.8	Very high	63 Å²	63	44.1 Å²	44.1	29%	0.294	20%	0.197	S	C	.	.	S	Bend	trans	-137	141.9	178.7	177.1	173.7	-155.3	0	0	108.3	L428 T434 F435	L428-E430 WeakPolarHBondContact CB-O 3.12Å; L428-E430 PolarHBondContact O-N 3.47Å; L428-E430 VanDerWaalsContact O-N 3.14Å; E430-T434 VanDerWaalsContact OE1-CA 3.25Å; E430-T434 WeakPolarHBondContact OE1-CA 3.26Å; E430-T434 WeakPolarHBondContact OE1-CB 3.21Å; E430-F435 HydrophobicContact CB-CD2 4.06Å; E430-F435 HydrophobicContact CB-CE2 3.86Å; E430-F435 HydrophobicContact CG-CD2 3.57Å; E430-F435 HydrophobicContact CG-CE2 3.86Å; E430-F435 HydrophobicContact CG-CG 4.09Å; E430-F435 PolarHBondContact OE1-N 2.86Å
431	P	94.8	Very high	94.9	Very high	13 Å²	13	44.1 Å²	44.1	8%	0.084	20%	0.197	C	C	.	.			trans	-58.6	158.6	177.9	23.6	-35.7	0	0	0	112.4	L433 T434 F435 A505	P431-L433 PolarHBondContact O-N 3Å; P431-T434 WeakPolarHBondContact O-CA 3.42Å; P431-T434 PolarHBondContact O-N 3.49Å; P431-F435 VanDerWaalsContact CD-CE1 3.45Å; P431-F435 HydrophobicContact CG-CD1 4.08Å; P431-F435 HydrophobicContact CG-CE1 4.07Å; P431-A505 HydrophobicContact CB-CB 3.82Å; P431-A505 HydrophobicContact CG-CB 4.22Å
432	L	96.4	Very high	94.9	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-34.8	-179.5	-177.4	61.4	0	0	0	112.3	L350 L425 T434 N468 T471 L472 L475 I503	L350-L432 HydrophobicContact CD2-CD1 3.74Å; L425-L432 HydrophobicContact CD2-CD2 4.4Å; L432-T434 VanDerWaalsContact C-N 3.3Å; L432-T434 PolarHBondContact O-N 2.91Å; L432-N468 HydrophobicContact CD1-CB 4.38Å; L432-N468 WeakPolarHBondContact O-CB 3.49Å; L432-N468 PolarHBondContact O-ND2 2.94Å; L432-T471 HydrophobicContact CD1-CG2 3.87Å; L432-T471 HydrophobicContact CD2-CG2 4.46Å; L432-L472 HydrophobicContact CD2-CB 4.2Å; L432-L472 HydrophobicContact CD2-CD1 3.94Å; L432-L472 HydrophobicContact CG-CB 4.48Å; L432-L475 HydrophobicContact CD2-CD2 4.22Å; L432-I503 HydrophobicContact CB-CB 4.15Å; L432-I503 HydrophobicContact CB-CG2 4.47Å; L432-I503 HydrophobicContact CD2-CB 4.31Å; L432-I503 HydrophobicContact CD2-CG2 4.12Å; L432-I503 PolarHBondContact N-O 2.7Å
433	L	97.1	Very high	95	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	4.4	175.7	-61.3	-169.4	0	0	0	114.9	P431 F441 L464 L472 I503 V504 V526 L530	P431-L433 PolarHBondContact O-N 3Å; L433-F441 HydrophobicContact CB-CD2 4.02Å; L433-F441 HydrophobicContact CB-CE2 4.14Å; L433-F441 HydrophobicContact CD1-CB 4.37Å; L433-F441 HydrophobicContact CD1-CD1 4.27Å; L433-F441 HydrophobicContact CD1-CD2 4.01Å; L433-F441 HydrophobicContact CD1-CE2 4.4Å; L433-F441 HydrophobicContact CD1-CG 3.96Å; L433-F441 HydrophobicContact CD2-CD2 4.49Å; L433-F441 HydrophobicContact CD2-CE2 4.08Å; L433-F441 HydrophobicContact CD2-CZ 4.1Å; L433-F441 HydrophobicContact CG-CD2 4.41Å; L433-F441 HydrophobicContact CG-CE2 4.44Å; L433-L464 HydrophobicContact CD2-CD1 4.28Å; L433-L472 HydrophobicContact CD2-CD1 4.05Å; L433-L472 HydrophobicContact CD2-CD2 3.67Å; L433-L472 HydrophobicContact CD2-CG 4.48Å; L433-I503 WeakPolarHBondContact CG-O 3.39Å; L433-I503 PolarHBondContact N-O 3.18Å; L433-I503 VanDerWaalsContact N-O 3.12Å; L433-V504 HydrophobicContact CD1-CB 4.26Å; L433-V504 HydrophobicContact CD1-CG1 4.28Å; L433-V504 HydrophobicContact CD1-CG2 3.82Å; L433-V526 HydrophobicContact CD1-CG1 3.81Å; L433-L530 HydrophobicContact CD1-CD1 4.21Å; L433-L530 HydrophobicContact CD2-CD1 4.45Å
434	T	95.6	Very high	95.1	Very high	6 Å²	6	46 Å²	46	4%	0.037	21%	0.205	C	C	.	.			trans	65.9	150.5	-177.5	75.8	0	0	0	0	114.8	E430 P431 L432 R436 L437 N438 L464 P465	E430-T434 VanDerWaalsContact OE1-CA 3.25Å; E430-T434 WeakPolarHBondContact OE1-CA 3.26Å; E430-T434 WeakPolarHBondContact OE1-CB 3.21Å; P431-T434 WeakPolarHBondContact O-CA 3.42Å; P431-T434 PolarHBondContact O-N 3.49Å; L432-T434 VanDerWaalsContact C-N 3.3Å; L432-T434 PolarHBondContact O-N 2.91Å; T434-R436 VanDerWaalsContact C-N 3.3Å; T434-L437 WeakPolarHBondContact OG1-CB 3.36Å; T434-L437 PolarHBondContact OG1-N 2.79Å; T434-L437 VanDerWaalsContact OG1-N 3.16Å; T434-N438 WeakPolarHBondContact O-CB 3.21Å; T434-N438 PolarHBondContact O-N 3.47Å; T434-L464 HydrophobicContact CG2-CD2 4.06Å; T434-P465 HydrophobicContact CG2-CG 4.28Å
435	F	94.9	Very high	95.2	Very high	54 Å²	54	46.2 Å²	46.2	24%	0.237	21%	0.207	C	C	.	.	H	α-helix	trans	-63.7	-40.5	171.5	-69.5	-51.4	0	0	0	110.9	E430 P431 L437 N438 H506 A507 P509	E430-F435 HydrophobicContact CB-CD2 4.06Å; E430-F435 HydrophobicContact CB-CE2 3.86Å; E430-F435 HydrophobicContact CG-CD2 3.57Å; E430-F435 HydrophobicContact CG-CE2 3.86Å; E430-F435 HydrophobicContact CG-CG 4.09Å; E430-F435 PolarHBondContact OE1-N 2.86Å; P431-F435 VanDerWaalsContact CD-CE1 3.45Å; P431-F435 HydrophobicContact CG-CD1 4.08Å; P431-F435 HydrophobicContact CG-CE1 4.07Å; F435-L437 PolarHBondContact O-N 3.5Å; F435-N438 PolarHBondContact O-N 3.25Å; F435-H506 WeakPolarHBondContact CD1-O 3.3Å; F435-H506 WeakPolarHBondContact CE1-O 3.22Å; F435-A507 WeakPolarHBondContact CB-O 3.44Å; F435-A507 VanDerWaalsContact CD1-C 3.41Å; F435-A507 VanDerWaalsContact CD1-O 3.3Å; F435-A507 WeakPolarHBondContact CD1-O 3.37Å; F435-P509 HydrophobicContact CE1-CG 4.42Å; F435-P509 HydrophobicContact CE2-CG 4.12Å; F435-P509 HydrophobicContact CZ-CB 4.43Å; F435-P509 HydrophobicContact CZ-CG 3.78Å
436	R	95.5	Very high	95.3	Very high	197 Å²	197	49.9 Å²	49.9	74%	0.743	22%	0.224	S	C	*	.	H	α-helix	trans	-62	-43.7	-177.4	179.3	180	164.4	-153.7	-8.9	112.6	T434	T434-R436 VanDerWaalsContact C-N 3.3Å
437	L	96.6	Very high	95.5	Very high	5 Å²	5	45.4 Å²	45.4	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-95	-5.1	-175.5	-60.2	172.3	0	0	0	113.4	T434 F435 K439 T440 F441 E463 L464	T434-L437 WeakPolarHBondContact OG1-CB 3.36Å; T434-L437 PolarHBondContact OG1-N 2.79Å; T434-L437 VanDerWaalsContact OG1-N 3.16Å; F435-L437 PolarHBondContact O-N 3.5Å; L437-K439 VanDerWaalsContact C-N 3.31Å; L437-K439 PolarHBondContact O-N 3.34Å; L437-T440 WeakPolarHBondContact O-CB 3.41Å; L437-T440 PolarHBondContact O-N 3.21Å; L437-F441 HydrophobicContact CB-CD2 3.91Å; L437-F441 HydrophobicContact CB-CE2 3.88Å; L437-F441 HydrophobicContact CD1-CE2 4.42Å; L437-F441 VanDerWaalsContact O-CD2 3.3Å; L437-F441 WeakPolarHBondContact O-CD2 3.31Å; L437-F441 PolarHBondContact O-N 3.03Å; L437-E463 HydrophobicContact CD1-CB 3.96Å; L437-E463 HydrophobicContact CD2-CB 3.99Å; L437-E463 WeakPolarHBondContact CD2-OE2 3.39Å; L437-L464 HydrophobicContact CD1-CD2 3.75Å; L437-L464 HydrophobicContact CD1-CG 3.96Å
438	N	96.6	Very high	95.6	Very high	5 Å²	5	52 Å²	52	3%	0.027	24%	0.243	C	C	.	.	H	α-helix	trans	-49.6	-50.8	180	178	-83.3	0	0	0	111.9	T434 F435 T440 F441 M442 V504 A505 A507	T434-N438 WeakPolarHBondContact O-CB 3.21Å; T434-N438 PolarHBondContact O-N 3.47Å; F435-N438 PolarHBondContact O-N 3.25Å; N438-T440 PolarHBondContact O-N 3.15Å; N438-F441 PolarHBondContact O-N 3.13Å; N438-M442 VanDerWaalsContact O-CG 3.27Å; N438-M442 WeakPolarHBondContact O-CG 3.47Å; N438-M442 PolarHBondContact O-N 2.69Å; N438-V504 PolarHBondContact ND2-O 3.4Å; N438-A505 PolarHBondContact ND2-O 2.99Å; N438-A507 HydrophobicContact CB-CB 4.14Å
439	K	95.8	Very high	95.9	Very high	129 Å²	129	55 Å²	55	56%	0.561	26%	0.259	S	S	*	.	H	α-helix	trans	-62.8	-43.9	178.6	-176.5	174.7	170.5	179.8	0	112.3	L437 F441 M442 E443	L437-K439 VanDerWaalsContact C-N 3.31Å; L437-K439 PolarHBondContact O-N 3.34Å; K439-F441 VanDerWaalsContact C-N 3.33Å; K439-F441 PolarHBondContact O-N 2.95Å; K439-M442 PolarHBondContact O-N 3.08Å; K439-E443 WeakPolarHBondContact CE-OE1 3.43Å; K439-E443 HydrophobicContact CG-CG 4.33Å; K439-E443 IonicContact NZ-OE1 2.82Å; K439-E443 WeakPolarHBondContact O-CG 3.43Å; K439-E443 PolarHBondContact O-N 2.8Å
440	T	97.5	Very high	96.1	Very high	51 Å²	51	53 Å²	53	31%	0.313	25%	0.252	S	S	.	.	H	α-helix	trans	-57.7	-44.8	177.8	-48.8	0	0	0	0	111.6	L437 N438 A444 A460	L437-T440 WeakPolarHBondContact O-CB 3.41Å; L437-T440 PolarHBondContact O-N 3.21Å; N438-T440 PolarHBondContact O-N 3.15Å; T440-A444 VanDerWaalsContact O-CB 3.3Å; T440-A444 WeakPolarHBondContact O-CB 3.23Å; T440-A444 PolarHBondContact O-N 3.02Å; T440-A460 HydrophobicContact CG2-CB 4.05Å
441	F	98.3	Very high	96.4	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64.7	-43.4	176.4	-84.3	-70.8	0	0	0	112.6	L433 L437 N438 K439 A444 A445 M457 A460 I461 L464 V526 L530	L433-F441 HydrophobicContact CB-CD2 4.02Å; L433-F441 HydrophobicContact CB-CE2 4.14Å; L433-F441 HydrophobicContact CD1-CB 4.37Å; L433-F441 HydrophobicContact CD1-CD1 4.27Å; L433-F441 HydrophobicContact CD1-CD2 4.01Å; L433-F441 HydrophobicContact CD1-CE2 4.4Å; L433-F441 HydrophobicContact CD1-CG 3.96Å; L433-F441 HydrophobicContact CD2-CD2 4.49Å; L433-F441 HydrophobicContact CD2-CE2 4.08Å; L433-F441 HydrophobicContact CD2-CZ 4.1Å; L433-F441 HydrophobicContact CG-CD2 4.41Å; L433-F441 HydrophobicContact CG-CE2 4.44Å; L437-F441 HydrophobicContact CB-CD2 3.91Å; L437-F441 HydrophobicContact CB-CE2 3.88Å; L437-F441 HydrophobicContact CD1-CE2 4.42Å; L437-F441 VanDerWaalsContact O-CD2 3.3Å; L437-F441 WeakPolarHBondContact O-CD2 3.31Å; L437-F441 PolarHBondContact O-N 3.03Å; N438-F441 PolarHBondContact O-N 3.13Å; K439-F441 VanDerWaalsContact C-N 3.33Å; K439-F441 PolarHBondContact O-N 2.95Å; F441-A444 PolarHBondContact O-N 2.98Å; F441-A445 WeakPolarHBondContact O-CB 3.41Å; F441-A445 PolarHBondContact O-N 3.04Å; F441-M457 HydrophobicContact CD1-CE 3.86Å; F441-M457 HydrophobicContact CD1-SD 4.14Å; F441-M457 HydrophobicContact CE1-CE 4.16Å; F441-A460 HydrophobicContact CD1-CB 3.9Å; F441-A460 HydrophobicContact CD2-CB 4.37Å; F441-A460 HydrophobicContact CE1-CB 3.61Å; F441-A460 HydrophobicContact CE2-CB 4.1Å; F441-A460 HydrophobicContact CG-CB 4.26Å; F441-A460 HydrophobicContact CZ-CB 3.71Å; F441-I461 HydrophobicContact CE1-CG1 3.98Å; F441-I461 HydrophobicContact CZ-CG1 4.18Å; F441-L464 HydrophobicContact CE2-CD1 4.25Å; F441-L464 HydrophobicContact CE2-CD2 4.17Å; F441-L464 HydrophobicContact CE2-CG 4.2Å; F441-L464 HydrophobicContact CZ-CD1 3.86Å; F441-L464 HydrophobicContact CZ-CG 4.17Å; F441-V526 HydrophobicContact CB-CG1 3.89Å; F441-V526 HydrophobicContact CB-CG2 4.43Å; F441-V526 HydrophobicContact CD1-CG1 4.17Å; F441-V526 HydrophobicContact CG-CG1 4.32Å; F441-L530 HydrophobicContact CE1-CD2 4.22Å
442	M	97.3	Very high	96.5	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-63.3	-43.7	178.3	-64.2	-69.1	-166.7	0	0	112	N438 K439 A445 E446 V504 D519 R522 Q523 V526	N438-M442 VanDerWaalsContact O-CG 3.27Å; N438-M442 WeakPolarHBondContact O-CG 3.47Å; N438-M442 PolarHBondContact O-N 2.69Å; K439-M442 PolarHBondContact O-N 3.08Å; M442-A445 PolarHBondContact O-N 3.21Å; M442-E446 WeakPolarHBondContact O-CG 3.45Å; M442-E446 PolarHBondContact O-N 3.33Å; M442-V504 HydrophobicContact CE-CG1 3.36Å; M442-V504 HydrophobicContact SD-CG1 4.13Å; M442-D519 HydrophobicContact CE-CB 4.46Å; M442-R522 HydrophobicContact CE-CB 4.35Å; M442-R522 HydrophobicContact SD-CB 3.47Å; M442-R522 WeakPolarHBondContact SD-CB 3.37Å; M442-Q523 HydrophobicContact CE-CB 4.32Å; M442-Q523 HydrophobicContact CE-CG 3.49Å; M442-Q523 VanDerWaalsContact CE-CG 3.49Å; M442-V526 HydrophobicContact CG-CG2 4.38Å; M442-V526 HydrophobicContact SD-CG2 3.57Å; M442-V526 VanDerWaalsContact SD-CG2 3.57Å
443	E	97.3	Very high	96.6	Very high	96 Å²	96	60.3 Å²	60.3	45%	0.449	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-44.9	178.1	-72.2	177	167.9	0	0	111.3	K439 A445 E446 I447	K439-E443 WeakPolarHBondContact CE-OE1 3.43Å; K439-E443 HydrophobicContact CG-CG 4.33Å; K439-E443 IonicContact NZ-OE1 2.82Å; K439-E443 WeakPolarHBondContact O-CG 3.43Å; K439-E443 PolarHBondContact O-N 2.8Å; E443-A445 VanDerWaalsContact C-N 3.26Å; E443-A445 PolarHBondContact O-N 3.22Å; E443-E446 PolarHBondContact O-N 3.21Å; E443-E446 VanDerWaalsContact O-N 3.08Å; E443-I447 PolarHBondContact O-N 2.92Å
444	A	97.9	Very high	96.6	Very high	4 Å²	4	62.6 Å²	62.6	3%	0.033	31%	0.306	C	S	.	.	H	α-helix	trans	-57.4	-39.1	175.8	0	0	0	0	0	112.3	T440 F441 E446 S453 A456 M457	T440-A444 VanDerWaalsContact O-CB 3.3Å; T440-A444 WeakPolarHBondContact O-CB 3.23Å; T440-A444 PolarHBondContact O-N 3.02Å; F441-A444 PolarHBondContact O-N 2.98Å; A444-E446 VanDerWaalsContact C-N 3.32Å; A444-E446 PolarHBondContact O-N 3.28Å; A444-S453 PolarHBondContact O-OG 2.95Å; A444-A456 HydrophobicContact CB-CB 3.64Å; A444-M457 HydrophobicContact CB-CG 4.17Å; A444-M457 HydrophobicContact CB-SD 3.7Å
445	A	97.3	Very high	96.7	Very high	5 Å²	5	64.9 Å²	64.9	4%	0.041	33%	0.325	C	S	.	.	H	α-helix	trans	-74.8	-17.4	178.7	0	0	0	0	0	114.4	F441 M442 E443 K525 V526 R529	F441-A445 WeakPolarHBondContact O-CB 3.41Å; F441-A445 PolarHBondContact O-N 3.04Å; M442-A445 PolarHBondContact O-N 3.21Å; E443-A445 VanDerWaalsContact C-N 3.26Å; E443-A445 PolarHBondContact O-N 3.22Å; A445-K525 HydrophobicContact CB-CB 4.21Å; A445-V526 HydrophobicContact CB-CB 4.38Å; A445-V526 HydrophobicContact CB-CG2 3.79Å; A445-R529 HydrophobicContact CB-CG 3.98Å
446	E	96.6	Very high	96.8	Very high	80 Å²	80	63.4 Å²	63.4	37%	0.374	32%	0.323	S	S	.	.	H	α-helix	trans	-92.1	-9.2	178.9	-75.5	179.3	155.3	0	0	114	M442 E443 A444 L448 R522	M442-E446 WeakPolarHBondContact O-CG 3.45Å; M442-E446 PolarHBondContact O-N 3.33Å; E443-E446 PolarHBondContact O-N 3.21Å; E443-E446 VanDerWaalsContact O-N 3.08Å; A444-E446 VanDerWaalsContact C-N 3.32Å; A444-E446 PolarHBondContact O-N 3.28Å; E446-L448 PolarHBondContact O-N 3.01Å; E446-R522 VanDerWaalsContact CD-NE 3.29Å; E446-R522 WeakPolarHBondContact OE1-CD 3.36Å; E446-R522 WeakPolarHBondContact OE1-CG 3.36Å; E446-R522 IonicContact OE1-CZ 2.99Å; E446-R522 IonicContact OE1-NE 3.7Å; E446-R522 PolarHBondContact OE1-NE 2.9Å; E446-R522 IonicContact OE1-NH2 3.63Å; E446-R522 IonicContact OE2-CZ 3.89Å; E446-R522 IonicContact OE2-NE 3.87Å; E446-R522 PolarHBondContact OE2-NE 3.2Å; E446-R522 IonicContact OE2-NH2 3.62Å; E446-R522 PolarHBondContact OE2-NH2 2.96Å
447	I	97.4	Very high	97	Very high	59 Å²	59	54 Å²	54	30%	0.303	29%	0.288	S	S	.	.			trans	-60.2	125.5	172.9	-60.9	173.3	0	0	0	108.8	E443 D449 N452 A456	E443-I447 PolarHBondContact O-N 2.92Å; I447-D449 HydrophobicContact CG2-CB 4.28Å; I447-D449 WeakPolarHBondContact CG2-O 3.4Å; I447-N452 HydrophobicContact CG2-CB 3.88Å; I447-A456 HydrophobicContact CD1-CB 3.81Å
448	L	94.9	Very high	97	Very high	167 Å²	167	57.3 Å²	57.3	87%	0.874	30%	0.301	S	S	*	.	S	Bend	trans	-74.6	-30.4	-178.5	-64.7	176.1	0	0	0	112.8	E446	E446-L448 PolarHBondContact O-N 3.01Å
449	D	97.1	Very high	97.1	Very high	79 Å²	79	63.1 Å²	63.1	42%	0.422	33%	0.327	S	S	.	.	S	Bend	trans	-79.9	117.6	175.7	-178.5	78.4	0	0	0	109.8	I447 D451 N452 S453	I447-D449 HydrophobicContact CG2-CB 4.28Å; I447-D449 WeakPolarHBondContact CG2-O 3.4Å; D449-D451 PolarHBondContact O-N 2.98Å; D449-N452 HydrophobicContact CB-CB 4.19Å; D449-N452 PolarHBondContact O-N 3.48Å; D449-N452 VanDerWaalsContact OD2-CB 3.3Å; D449-N452 WeakPolarHBondContact OD2-CB 3.3Å; D449-N452 PolarHBondContact OD2-N 3.42Å; D449-N452 PolarHBondContact OD2-ND2 3.43Å; D449-S453 WeakPolarHBondContact O-CB 3.43Å; D449-S453 PolarHBondContact O-N 3.2Å
450	E	94.4	Very high	97.2	Very high	99 Å²	99	57 Å²	57	46%	0.463	30%	0.301	S	S	.	.	H	α-helix	trans	-61.1	-44.4	-172	-68.3	-67.5	129.1	0	0	112.3	S453 V454 R529	E450-S453 WeakPolarHBondContact O-CB 3.45Å; E450-S453 PolarHBondContact O-N 3.39Å; E450-V454 WeakPolarHBondContact O-CB 3.41Å; E450-V454 VanDerWaalsContact O-CG2 3.3Å; E450-V454 WeakPolarHBondContact O-CG2 3.46Å; E450-V454 PolarHBondContact O-N 3.5Å; E450-R529 IonicContact OE1-CZ 3.31Å; E450-R529 VanDerWaalsContact OE1-CZ 3.31Å; E450-R529 IonicContact OE1-NH1 3.78Å; E450-R529 PolarHBondContact OE1-NH1 3.38Å; E450-R529 IonicContact OE1-NH2 3.76Å; E450-R529 PolarHBondContact OE1-NH2 3.1Å; E450-R529 IonicContact OE2-CZ 3.57Å; E450-R529 IonicContact OE2-NH1 3.46Å; E450-R529 PolarHBondContact OE2-NH1 3.22Å; E450-R529 IonicContact OE2-NH2 2.81Å
451	D	95.6	Very high	97.2	Very high	129 Å²	129	54.5 Å²	54.5	69%	0.69	29%	0.286	S	S	*	.	H	α-helix	trans	-66.4	-43.8	-178.2	-67	-34.5	0	0	0	111.3	D449 V454 A455	D449-D451 PolarHBondContact O-N 2.98Å; D451-V454 PolarHBondContact O-N 3.48Å; D451-A455 WeakPolarHBondContact O-CB 3.41Å; D451-A455 PolarHBondContact O-N 2.72Å
452	N	97	Very high	97.2	Very high	100 Å²	100	56.9 Å²	56.9	54%	0.535	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-36.7	174.5	-73.9	-51.1	0	0	0	112.4	I447 D449 A455 A456	I447-N452 HydrophobicContact CG2-CB 3.88Å; D449-N452 HydrophobicContact CB-CB 4.19Å; D449-N452 PolarHBondContact O-N 3.48Å; D449-N452 VanDerWaalsContact OD2-CB 3.3Å; D449-N452 WeakPolarHBondContact OD2-CB 3.3Å; D449-N452 PolarHBondContact OD2-N 3.42Å; D449-N452 PolarHBondContact OD2-ND2 3.43Å; N452-A455 PolarHBondContact O-N 3.02Å; N452-A456 WeakPolarHBondContact O-CB 3.46Å; N452-A456 PolarHBondContact O-N 3Å
453	S	97.6	Very high	97.2	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.4	-49.4	174.2	-174.5	0	0	0	0	110.5	A444 D449 E450 A455 A456 M457 R529	A444-S453 PolarHBondContact O-OG 2.95Å; D449-S453 WeakPolarHBondContact O-CB 3.43Å; D449-S453 PolarHBondContact O-N 3.2Å; E450-S453 WeakPolarHBondContact O-CB 3.45Å; E450-S453 PolarHBondContact O-N 3.39Å; S453-A455 PolarHBondContact O-N 2.88Å; S453-A456 PolarHBondContact O-N 3.25Å; S453-M457 WeakPolarHBondContact O-CG 3.06Å; S453-M457 PolarHBondContact O-N 2.9Å; S453-R529 PolarHBondContact OG-NE 2.99Å
454	V	97.3	Very high	97.1	Very high	48 Å²	48	56.4 Å²	56.4	29%	0.291	31%	0.308	S	S	.	.	H	α-helix	trans	-60.6	-44.6	177.7	169.9	0	0	0	0	111.3	E450 D451 A456 M457 Y458 L533	E450-V454 WeakPolarHBondContact O-CB 3.41Å; E450-V454 VanDerWaalsContact O-CG2 3.3Å; E450-V454 WeakPolarHBondContact O-CG2 3.46Å; E450-V454 PolarHBondContact O-N 3.5Å; D451-V454 PolarHBondContact O-N 3.48Å; V454-A456 PolarHBondContact O-N 3.48Å; V454-M457 PolarHBondContact O-N 3.41Å; V454-Y458 HydrophobicContact CG1-CD2 3.84Å; V454-Y458 HydrophobicContact CG1-CE2 3.39Å; V454-Y458 VanDerWaalsContact O-CD2 3.31Å; V454-Y458 WeakPolarHBondContact O-CD2 3.31Å; V454-Y458 PolarHBondContact O-N 3.04Å; V454-L533 HydrophobicContact CG1-CD2 4.04Å
455	A	97.6	Very high	97	Very high	54 Å²	54	59.1 Å²	59.1	45%	0.446	33%	0.325	S	S	.	.	H	α-helix	trans	-60.6	-44.8	176.7	0	0	0	0	0	112.4	D451 N452 S453 M457 Y458 Q459	D451-A455 WeakPolarHBondContact O-CB 3.41Å; D451-A455 PolarHBondContact O-N 2.72Å; N452-A455 PolarHBondContact O-N 3.02Å; S453-A455 PolarHBondContact O-N 2.88Å; A455-M457 VanDerWaalsContact C-N 3.34Å; A455-M457 PolarHBondContact O-N 3.34Å; A455-Y458 PolarHBondContact O-N 3.27Å; A455-Q459 PolarHBondContact O-N 3Å
456	A	98.1	Very high	96.8	Very high	23 Å²	23	62.8 Å²	62.8	19%	0.19	34%	0.341	C	S	.	.	H	α-helix	trans	-65.1	-36.9	176.7	0	0	0	0	0	112.2	A444 I447 N452 S453 V454 Q459 A460	A444-A456 HydrophobicContact CB-CB 3.64Å; I447-A456 HydrophobicContact CD1-CB 3.81Å; N452-A456 WeakPolarHBondContact O-CB 3.46Å; N452-A456 PolarHBondContact O-N 3Å; S453-A456 PolarHBondContact O-N 3.25Å; V454-A456 PolarHBondContact O-N 3.48Å; A456-Q459 PolarHBondContact O-N 3.42Å; A456-A460 WeakPolarHBondContact O-CB 3.3Å; A456-A460 PolarHBondContact O-N 3.33Å
457	M	98.2	Very high	96.6	Very high	1 Å²	1	59 Å²	59	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-63.4	-44	174.1	-69.8	-64.7	-64	0	0	111.5	F441 A444 S453 V454 A455 Q459 A460 I461 V526 R529 L530	F441-M457 HydrophobicContact CD1-CE 3.86Å; F441-M457 HydrophobicContact CD1-SD 4.14Å; F441-M457 HydrophobicContact CE1-CE 4.16Å; A444-M457 HydrophobicContact CB-CG 4.17Å; A444-M457 HydrophobicContact CB-SD 3.7Å; S453-M457 WeakPolarHBondContact O-CG 3.06Å; S453-M457 PolarHBondContact O-N 2.9Å; V454-M457 PolarHBondContact O-N 3.41Å; A455-M457 VanDerWaalsContact C-N 3.34Å; A455-M457 PolarHBondContact O-N 3.34Å; M457-Q459 VanDerWaalsContact C-N 3.33Å; M457-Q459 PolarHBondContact O-N 3.37Å; M457-A460 PolarHBondContact O-N 2.88Å; M457-I461 WeakPolarHBondContact O-CD1 3.46Å; M457-I461 WeakPolarHBondContact O-CG1 3.46Å; M457-I461 PolarHBondContact O-N 3.5Å; M457-V526 HydrophobicContact CE-CG1 4.44Å; M457-R529 HydrophobicContact CE-CB 3.84Å; M457-R529 HydrophobicContact CG-CB 4.15Å; M457-R529 HydrophobicContact SD-CB 4.15Å; M457-L530 HydrophobicContact CE-CD2 3.38Å; M457-L530 HydrophobicContact CE-CG 3.53Å
458	Y	98.1	Very high	96.6	Very high	74 Å²	74	56.7 Å²	56.7	29%	0.29	31%	0.312	S	S	.	.	H	α-helix	trans	-60.5	-41.9	175.1	-75.2	-47.6	0	0	0	112.6	V454 A455 I461 G462 L533 P534 Y537	V454-Y458 HydrophobicContact CG1-CD2 3.84Å; V454-Y458 HydrophobicContact CG1-CE2 3.39Å; V454-Y458 VanDerWaalsContact O-CD2 3.31Å; V454-Y458 WeakPolarHBondContact O-CD2 3.31Å; V454-Y458 PolarHBondContact O-N 3.04Å; A455-Y458 PolarHBondContact O-N 3.27Å; Y458-I461 PolarHBondContact O-N 3.13Å; Y458-G462 PolarHBondContact O-N 2.76Å; Y458-L533 HydrophobicContact CD1-CD1 4.29Å; Y458-L533 HydrophobicContact CE1-CD1 3.99Å; Y458-L533 HydrophobicContact CE1-CD2 3.96Å; Y458-L533 HydrophobicContact CE1-CG 4.47Å; Y458-L533 HydrophobicContact CE2-CD2 4.48Å; Y458-P534 WeakPolarHBondContact OH-CD 3.44Å; Y458-Y537 HydrophobicContact CD1-CD1 4.28Å; Y458-Y537 AromaticContact CD1-CD2 3.87Å; Y458-Y537 HydrophobicContact CD1-CD2 3.87Å; Y458-Y537 AromaticContact CD1-CE1 3.84Å; Y458-Y537 HydrophobicContact CD1-CE1 3.84Å; Y458-Y537 AromaticContact CD1-CE2 3.37Å; Y458-Y537 HydrophobicContact CD1-CE2 3.37Å; Y458-Y537 HydrophobicContact CD1-CG 4.29Å; Y458-Y537 AromaticContact CD1-CZ 3.35Å; Y458-Y537 AromaticContact CE1-CD1 3.71Å; Y458-Y537 HydrophobicContact CE1-CD1 3.71Å; Y458-Y537 AromaticContact CE1-CD2 3.35Å; Y458-Y537 HydrophobicContact CE1-CD2 3.35Å; Y458-Y537 AromaticContact CE1-CE1 3.75Å; Y458-Y537 HydrophobicContact CE1-CE1 3.75Å; Y458-Y537 AromaticContact CE1-CE2 3.39Å; Y458-Y537 HydrophobicContact CE1-CE2 3.39Å; Y458-Y537 AromaticContact CE1-CG 3.51Å; Y458-Y537 HydrophobicContact CE1-CG 3.51Å; Y458-Y537 AromaticContact CE1-CZ 3.6Å; Y458-Y537 HydrophobicContact CG-CE2 4.47Å
459	Q	97.9	Very high	96.7	Very high	126 Å²	126	51.3 Å²	51.3	59%	0.589	28%	0.28	S	S	*	.	H	α-helix	trans	-61.3	-48.4	175.3	-173.8	-176.1	-18	0	0	111.2	A455 A456 M457 I461 G462 E463	A455-Q459 PolarHBondContact O-N 3Å; A456-Q459 PolarHBondContact O-N 3.42Å; M457-Q459 VanDerWaalsContact C-N 3.33Å; M457-Q459 PolarHBondContact O-N 3.37Å; Q459-I461 VanDerWaalsContact C-N 3.31Å; Q459-I461 PolarHBondContact O-N 3.3Å; Q459-G462 PolarHBondContact O-N 3.31Å; Q459-G462 VanDerWaalsContact O-N 3.1Å; Q459-E463 PolarHBondContact NE2-OE1 2.72Å; Q459-E463 PolarHBondContact O-N 3.5Å; Q459-E463 VanDerWaalsContact O-N 3.17Å
460	A	98.1	Very high	96.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.6	-38.8	179.2	0	0	0	0	0	112.5	T440 F441 A456 M457 E463	T440-A460 HydrophobicContact CG2-CB 4.05Å; F441-A460 HydrophobicContact CD1-CB 3.9Å; F441-A460 HydrophobicContact CD2-CB 4.37Å; F441-A460 HydrophobicContact CE1-CB 3.61Å; F441-A460 HydrophobicContact CE2-CB 4.1Å; F441-A460 HydrophobicContact CG-CB 4.26Å; F441-A460 HydrophobicContact CZ-CB 3.71Å; A456-A460 WeakPolarHBondContact O-CB 3.3Å; A456-A460 PolarHBondContact O-N 3.33Å; M457-A460 PolarHBondContact O-N 2.88Å; A460-E463 PolarHBondContact O-N 3.19Å
461	I	98.1	Very high	96.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-67.2	-37.8	175.3	-64.2	159.1	0	0	0	111.3	F441 M457 Y458 Q459 E463 L464 R469 L530 L533 Y537 W538	F441-I461 HydrophobicContact CE1-CG1 3.98Å; F441-I461 HydrophobicContact CZ-CG1 4.18Å; M457-I461 WeakPolarHBondContact O-CD1 3.46Å; M457-I461 WeakPolarHBondContact O-CG1 3.46Å; M457-I461 PolarHBondContact O-N 3.5Å; Y458-I461 PolarHBondContact O-N 3.13Å; Q459-I461 VanDerWaalsContact C-N 3.31Å; Q459-I461 PolarHBondContact O-N 3.3Å; I461-E463 PolarHBondContact O-N 2.96Å; I461-L464 WeakPolarHBondContact O-CB 3.12Å; I461-L464 PolarHBondContact O-N 3.31Å; I461-R469 HydrophobicContact CG2-CG 4.02Å; I461-L530 HydrophobicContact CD1-CD2 3.83Å; I461-L530 HydrophobicContact CG1-CD2 4.1Å; I461-L533 HydrophobicContact CD1-CD1 3.43Å; I461-L533 VanDerWaalsContact CD1-CD1 3.43Å; I461-Y537 HydrophobicContact CD1-CE1 4.02Å; I461-Y537 HydrophobicContact CG2-CE1 4.24Å; I461-Y537 VanDerWaalsContact CG2-OH 3.3Å; I461-Y537 WeakPolarHBondContact CG2-OH 3.44Å; I461-W538 HydrophobicContact CD1-CH2 3.56Å; I461-W538 HydrophobicContact CD1-CZ2 4.1Å; I461-W538 HydrophobicContact CD1-CZ3 4.3Å; I461-W538 HydrophobicContact CG1-CH2 4.12Å; I461-W538 HydrophobicContact CG2-CH2 4.32Å; I461-W538 HydrophobicContact CG2-CZ3 4.08Å
462	G	96.6	Very high	96.8	Very high	50 Å²	50	37 Å²	37	52%	0.515	21%	0.207	S	C	.	.	H	α-helix	trans	-63.3	-28.4	176.5	0	0	0	0	0	113.7	Y458 Q459	Y458-G462 PolarHBondContact O-N 2.76Å; Q459-G462 PolarHBondContact O-N 3.31Å; Q459-G462 VanDerWaalsContact O-N 3.1Å
463	E	97.4	Very high	96.8	Very high	81 Å²	81	32.2 Å²	32.2	38%	0.379	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-10.4	178.2	-67.9	-176.5	-162.6	0	0	114	L437 Q459 A460 I461	L437-E463 HydrophobicContact CD1-CB 3.96Å; L437-E463 HydrophobicContact CD2-CB 3.99Å; L437-E463 WeakPolarHBondContact CD2-OE2 3.39Å; Q459-E463 PolarHBondContact NE2-OE1 2.72Å; Q459-E463 PolarHBondContact O-N 3.5Å; Q459-E463 VanDerWaalsContact O-N 3.17Å; A460-E463 PolarHBondContact O-N 3.19Å; I461-E463 PolarHBondContact O-N 2.96Å
464	L	96.9	Very high	96.8	Very high	6 Å²	6	33.8 Å²	33.8	3%	0.031	19%	0.188	C	C	.	.	S	Bend	trans	-66.7	143.7	178.6	-78.2	168.6	0	0	0	111.7	L433 T434 L437 F441 I461 N468 R469 L472	L433-L464 HydrophobicContact CD2-CD1 4.28Å; T434-L464 HydrophobicContact CG2-CD2 4.06Å; L437-L464 HydrophobicContact CD1-CD2 3.75Å; L437-L464 HydrophobicContact CD1-CG 3.96Å; F441-L464 HydrophobicContact CE2-CD1 4.25Å; F441-L464 HydrophobicContact CE2-CD2 4.17Å; F441-L464 HydrophobicContact CE2-CG 4.2Å; F441-L464 HydrophobicContact CZ-CD1 3.86Å; F441-L464 HydrophobicContact CZ-CG 4.17Å; I461-L464 WeakPolarHBondContact O-CB 3.12Å; I461-L464 PolarHBondContact O-N 3.31Å; L464-N468 HydrophobicContact CB-CB 4.46Å; L464-N468 HydrophobicContact CD2-CB 4.19Å; L464-R469 HydrophobicContact CB-CB 4.1Å; L464-L472 HydrophobicContact CD1-CD2 3.74Å
465	P	95.1	Very high	96.8	Very high	60 Å²	60	31.6 Å²	31.6	39%	0.39	18%	0.175	S	C	.	.			trans	-54.5	146.5	166.4	-22.5	32.6	0	0	0	111.4	T434 A467 N468 R469	T434-P465 HydrophobicContact CG2-CG 4.28Å; P465-A467 PolarHBondContact O-N 2.92Å; P465-N468 HydrophobicContact CB-CB 4.46Å; P465-N468 WeakPolarHBondContact O-CB 3.24Å; P465-N468 PolarHBondContact O-N 3.39Å; P465-R469 PolarHBondContact O-N 3.03Å
466	Q	93	Very high	96.9	Very high	82 Å²	82	29 Å²	29	38%	0.383	15%	0.153	S	C	.	.	H	α-helix	trans	-54.2	-47.2	-173.8	-176	170.2	24	0	0	113.1	M360 N468 R469 D470	M360-Q466 HydrophobicContact SD-CB 4.34Å; M360-Q466 HydrophobicContact SD-CG 4.07Å; Q466-N468 VanDerWaalsContact C-N 3.31Å; Q466-N468 PolarHBondContact O-N 3.44Å; Q466-R469 PolarHBondContact O-N 2.95Å; Q466-D470 WeakPolarHBondContact O-CB 3.43Å; Q466-D470 VanDerWaalsContact O-CG 3.23Å; Q466-D470 PolarHBondContact O-N 3.13Å
467	A	92.7	Very high	96.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58	-41.4	176.6	0	0	0	0	0	113.2	L350 M351 V354 M360 P465 T471	L350-A467 HydrophobicContact CD2-CB 4.24Å; L350-A467 HydrophobicContact CG-CB 4.38Å; M351-A467 HydrophobicContact CG-CB 4.47Å; M351-A467 HydrophobicContact SD-CB 3.4Å; M351-A467 WeakPolarHBondContact SD-CB 3.32Å; V354-A467 HydrophobicContact CG1-CB 4.02Å; V354-A467 HydrophobicContact CG2-CB 4.09Å; M360-A467 HydrophobicContact CB-CB 4.18Å; P465-A467 PolarHBondContact O-N 2.92Å; A467-T471 WeakPolarHBondContact O-CB 3.43Å; A467-T471 PolarHBondContact O-N 2.86Å; A467-T471 PolarHBondContact O-OG1 3.4Å
468	N	96.2	Very high	96.9	Very high	12 Å²	12	28.4 Å²	28.4	6%	0.064	15%	0.147	C	C	.	.	H	α-helix	trans	-67.2	-45	177.9	-66.1	63.6	0	0	0	110.8	L350 L432 L464 P465 Q466 L472	L350-N468 HydrophobicContact CD2-CB 4.19Å; L432-N468 HydrophobicContact CD1-CB 4.38Å; L432-N468 WeakPolarHBondContact O-CB 3.49Å; L432-N468 PolarHBondContact O-ND2 2.94Å; L464-N468 HydrophobicContact CB-CB 4.46Å; L464-N468 HydrophobicContact CD2-CB 4.19Å; P465-N468 HydrophobicContact CB-CB 4.46Å; P465-N468 WeakPolarHBondContact O-CB 3.24Å; P465-N468 PolarHBondContact O-N 3.39Å; Q466-N468 VanDerWaalsContact C-N 3.31Å; Q466-N468 PolarHBondContact O-N 3.44Å; N468-L472 WeakPolarHBondContact O-CB 3.41Å; N468-L472 PolarHBondContact O-N 3.2Å
469	R	96.8	Very high	96.9	Very high	54 Å²	54	24.9 Å²	24.9	20%	0.204	13%	0.133	C	C	.	.	H	α-helix	trans	-64.7	-47.8	179.7	-171.5	-176.2	65.6	-140.8	-0.6	112.1	I461 L464 P465 Q466 L472 A473 F541	I461-R469 HydrophobicContact CG2-CG 4.02Å; L464-R469 HydrophobicContact CB-CB 4.1Å; P465-R469 PolarHBondContact O-N 3.03Å; Q466-R469 PolarHBondContact O-N 2.95Å; R469-L472 PolarHBondContact O-N 3.19Å; R469-A473 WeakPolarHBondContact O-CB 3.46Å; R469-A473 PolarHBondContact O-N 3.48Å; R469-F541 HydrophobicContact CG-CD1 4.49Å; R469-F541 HydrophobicContact CG-CE1 4.34Å; R469-F541 HydrophobicContact CG-CE2 4.5Å; R469-F541 HydrophobicContact CG-CZ 4.33Å
470	D	95.4	Very high	96.9	Very high	4 Å²	4	19.6 Å²	19.6	2%	0.021	11%	0.108	C	C	.	.	H	α-helix	trans	-64.7	-43.2	179.6	-64.7	0.3	0	0	0	110.5	M360 I361 Q466 L472 A473 F474 M542	M360-D470 PolarHBondContact N-OD2 2.92Å; I361-D470 HydrophobicContact CG1-CB 4.25Å; Q466-D470 WeakPolarHBondContact O-CB 3.43Å; Q466-D470 VanDerWaalsContact O-CG 3.23Å; Q466-D470 PolarHBondContact O-N 3.13Å; D470-L472 PolarHBondContact O-N 3.32Å; D470-A473 PolarHBondContact O-N 3.22Å; D470-F474 WeakPolarHBondContact O-CB 3.48Å; D470-F474 PolarHBondContact O-N 2.96Å; D470-M542 WeakPolarHBondContact O-CE 3.44Å
471	T	96.9	Very high	96.9	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-64.2	-40.7	175.5	-59.6	0	0	0	0	111.9	M360 P362 L432 A467 L475	M360-T471 PolarHBondContact O-OG1 3.21Å; P362-T471 VanDerWaalsContact CD-OG1 3.27Å; P362-T471 WeakPolarHBondContact CD-OG1 3.47Å; L432-T471 HydrophobicContact CD1-CG2 3.87Å; L432-T471 HydrophobicContact CD2-CG2 4.46Å; A467-T471 WeakPolarHBondContact O-CB 3.43Å; A467-T471 PolarHBondContact O-N 2.86Å; A467-T471 PolarHBondContact O-OG1 3.4Å; T471-L475 WeakPolarHBondContact O-CB 3.26Å; T471-L475 PolarHBondContact O-N 3.04Å
472	L	98	Very high	96.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.6	-47.4	176.3	-179.3	66.5	0	0	0	111.1	L432 L433 L464 N468 R469 D470 F474 L475 M476 I503 L530 W538	L432-L472 HydrophobicContact CD2-CB 4.2Å; L432-L472 HydrophobicContact CD2-CD1 3.94Å; L432-L472 HydrophobicContact CG-CB 4.48Å; L433-L472 HydrophobicContact CD2-CD1 4.05Å; L433-L472 HydrophobicContact CD2-CD2 3.67Å; L433-L472 HydrophobicContact CD2-CG 4.48Å; L464-L472 HydrophobicContact CD1-CD2 3.74Å; N468-L472 WeakPolarHBondContact O-CB 3.41Å; N468-L472 PolarHBondContact O-N 3.2Å; R469-L472 PolarHBondContact O-N 3.19Å; D470-L472 PolarHBondContact O-N 3.32Å; L472-F474 PolarHBondContact O-N 3.31Å; L472-L475 PolarHBondContact O-N 2.99Å; L472-L475 VanDerWaalsContact O-N 3.17Å; L472-M476 HydrophobicContact CD1-CE 3.92Å; L472-M476 HydrophobicContact CD1-CG 4.17Å; L472-M476 HydrophobicContact CD1-SD 4.5Å; L472-M476 HydrophobicContact CG-CG 4.25Å; L472-M476 VanDerWaalsContact O-CG 3.3Å; L472-M476 WeakPolarHBondContact O-CG 3.5Å; L472-M476 PolarHBondContact O-N 3.46Å; L472-I503 HydrophobicContact CD1-CD1 4.29Å; L472-L530 HydrophobicContact CD1-CD1 4.33Å; L472-L530 HydrophobicContact CD2-CD2 4.36Å; L472-W538 HydrophobicContact CD2-CH2 3.88Å; L472-W538 HydrophobicContact CD2-CZ3 4.21Å; L472-W538 HydrophobicContact CG-CH2 4.06Å; L472-W538 HydrophobicContact CG-CZ3 4.22Å
473	A	97.2	Very high	96.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58.3	-47.8	179	0	0	0	0	0	111.8	R469 D470 L475 M476 I477 W538 F541 M542	R469-A473 WeakPolarHBondContact O-CB 3.46Å; R469-A473 PolarHBondContact O-N 3.48Å; D470-A473 PolarHBondContact O-N 3.22Å; A473-L475 VanDerWaalsContact C-N 3.31Å; A473-L475 PolarHBondContact O-N 3.28Å; A473-M476 PolarHBondContact O-N 3.35Å; A473-I477 WeakPolarHBondContact O-CG1 3.43Å; A473-I477 PolarHBondContact O-N 2.9Å; A473-I477 VanDerWaalsContact O-N 3.08Å; A473-W538 VanDerWaalsContact CA-CE3 3.42Å; A473-W538 HydrophobicContact CB-CB 4.43Å; A473-W538 HydrophobicContact CB-CD2 4.42Å; A473-W538 HydrophobicContact CB-CE3 3.54Å; A473-W538 HydrophobicContact CB-CZ3 4.17Å; A473-F541 HydrophobicContact CB-CB 3.97Å; A473-F541 HydrophobicContact CB-CD2 3.81Å; A473-F541 HydrophobicContact CB-CG 4.3Å; A473-M542 HydrophobicContact CB-CE 3.74Å
474	F	97.2	Very high	96.9	Very high	34 Å²	34	26.6 Å²	26.6	15%	0.149	13%	0.128	C	C	.	.	H	α-helix	trans	-59.9	-41.5	176.5	-174.5	-104.5	0	0	0	112.2	I361 I365 V366 V369 D470 L472 H478 M542	I361-F474 HydrophobicContact CD1-CB 3.64Å; I361-F474 HydrophobicContact CD1-CD1 4.5Å; I361-F474 HydrophobicContact CD1-CD2 3.91Å; I361-F474 HydrophobicContact CD1-CG 3.77Å; I361-F474 HydrophobicContact CG1-CB 4.26Å; I361-F474 HydrophobicContact CG2-CB 4.48Å; I361-F474 HydrophobicContact CG2-CD1 4.04Å; I361-F474 HydrophobicContact CG2-CG 4.34Å; I365-F474 HydrophobicContact CG2-CD1 3.79Å; I365-F474 HydrophobicContact CG2-CE1 3.98Å; V366-F474 HydrophobicContact CB-CE1 4.39Å; V366-F474 HydrophobicContact CB-CZ 4.34Å; V366-F474 HydrophobicContact CG1-CZ 4.15Å; V366-F474 HydrophobicContact CG2-CE1 4.14Å; V366-F474 HydrophobicContact CG2-CZ 4.23Å; V369-F474 HydrophobicContact CB-CE1 3.61Å; V369-F474 HydrophobicContact CB-CZ 3.94Å; V369-F474 HydrophobicContact CG1-CE1 3.74Å; V369-F474 HydrophobicContact CG1-CZ 3.68Å; V369-F474 HydrophobicContact CG2-CD1 4.32Å; V369-F474 HydrophobicContact CG2-CE1 3.66Å; V369-F474 HydrophobicContact CG2-CZ 4.45Å; D470-F474 WeakPolarHBondContact O-CB 3.48Å; D470-F474 PolarHBondContact O-N 2.96Å; L472-F474 PolarHBondContact O-N 3.31Å; F474-H478 PolarHBondContact O-N 2.65Å; F474-M542 HydrophobicContact CB-CE 4.2Å; F474-M542 HydrophobicContact CB-SD 3.85Å; F474-M542 HydrophobicContact CD2-SD 3.8Å; F474-M542 HydrophobicContact CG-SD 4.32Å
475	L	98.3	Very high	96.8	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-67	-42.8	176.8	-177	64.2	0	0	0	112.2	L421 L425 L432 T471 L472 A473 H478 L479 F499 I503	L421-L475 HydrophobicContact CD2-CD1 4.13Å; L425-L475 HydrophobicContact CD1-CD2 3.87Å; L432-L475 HydrophobicContact CD2-CD2 4.22Å; T471-L475 WeakPolarHBondContact O-CB 3.26Å; T471-L475 PolarHBondContact O-N 3.04Å; L472-L475 PolarHBondContact O-N 2.99Å; L472-L475 VanDerWaalsContact O-N 3.17Å; A473-L475 VanDerWaalsContact C-N 3.31Å; A473-L475 PolarHBondContact O-N 3.28Å; L475-H478 WeakPolarHBondContact O-CB 3.42Å; L475-H478 PolarHBondContact O-N 3.04Å; L475-L479 HydrophobicContact CD1-CD1 4.21Å; L475-L479 HydrophobicContact CD1-CG 4.13Å; L475-L479 HydrophobicContact CG-CD1 4Å; L475-L479 HydrophobicContact CG-CG 4.27Å; L475-L479 VanDerWaalsContact O-CG 3.31Å; L475-L479 WeakPolarHBondContact O-CG 3.41Å; L475-L479 PolarHBondContact O-N 2.96Å; L475-F499 HydrophobicContact CD1-CE1 4.19Å; L475-F499 HydrophobicContact CD2-CD1 4.31Å; L475-F499 HydrophobicContact CD2-CE1 4.28Å; L475-I503 HydrophobicContact CD2-CG2 3.96Å
476	M	98.3	Very high	96.8	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.9	-43.8	-179.2	-69.4	-58.4	103.1	0	0	111.6	L472 A473 H478 L479 Q480 I503 L530 L531 W538	L472-M476 HydrophobicContact CD1-CE 3.92Å; L472-M476 HydrophobicContact CD1-CG 4.17Å; L472-M476 HydrophobicContact CD1-SD 4.5Å; L472-M476 HydrophobicContact CG-CG 4.25Å; L472-M476 VanDerWaalsContact O-CG 3.3Å; L472-M476 WeakPolarHBondContact O-CG 3.5Å; L472-M476 PolarHBondContact O-N 3.46Å; A473-M476 PolarHBondContact O-N 3.35Å; M476-H478 VanDerWaalsContact C-N 3.3Å; M476-H478 PolarHBondContact O-N 3.47Å; M476-L479 HydrophobicContact CE-CD1 3.89Å; M476-L479 PolarHBondContact O-N 3.12Å; M476-Q480 WeakPolarHBondContact O-CB 3.48Å; M476-Q480 VanDerWaalsContact O-CG 3.27Å; M476-Q480 WeakPolarHBondContact O-CG 3.33Å; M476-Q480 PolarHBondContact O-N 3.15Å; M476-I503 HydrophobicContact CE-CD1 3.93Å; M476-L530 HydrophobicContact CG-CB 4.47Å; M476-L530 HydrophobicContact SD-CB 3.64Å; M476-L531 HydrophobicContact CE-CD2 4.44Å; M476-L531 HydrophobicContact SD-CD2 3.68Å; M476-L531 HydrophobicContact SD-CG 4Å; M476-W538 HydrophobicContact CB-CD2 3.93Å; M476-W538 HydrophobicContact CB-CG 4.07Å; M476-W538 HydrophobicContact CB-CZ2 4.09Å; M476-W538 HydrophobicContact CG-CD2 4.27Å; M476-W538 HydrophobicContact CG-CH2 4.06Å; M476-W538 HydrophobicContact CG-CZ2 3.6Å
477	I	97.8	Very high	96.9	Very high	12 Å²	12	30.7 Å²	30.7	6%	0.062	15%	0.154	C	C	.	.	H	α-helix	trans	-57	-46.4	174.8	-66.7	165	0	0	0	110.5	A473 Q480 R481 W538 M542	A473-I477 WeakPolarHBondContact O-CG1 3.43Å; A473-I477 PolarHBondContact O-N 2.9Å; A473-I477 VanDerWaalsContact O-N 3.08Å; I477-Q480 PolarHBondContact O-N 3.33Å; I477-R481 WeakPolarHBondContact O-CG 3.5Å; I477-R481 PolarHBondContact O-N 3.44Å; I477-W538 HydrophobicContact CD1-CB 3.87Å; I477-W538 HydrophobicContact CG1-CB 3.58Å; I477-W538 HydrophobicContact CG1-CG 4.48Å; I477-M542 HydrophobicContact CD1-CG 3.69Å; I477-M542 HydrophobicContact CD1-SD 4.49Å
478	H	98	Very high	97	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.3	-48.9	178.3	172.6	58.7	0	0	0	112.2	V369 E373 Y383 F474 L475 M476 Q480 R481 V482	V369-H478 HydrophobicContact CG1-CB 3.86Å; V369-H478 HydrophobicContact CG2-CB 4.25Å; E373-H478 VanDerWaalsContact CG-ND1 3.29Å; E373-H478 WeakPolarHBondContact CG-ND1 3.48Å; E373-H478 IonicContact OE1-CE1 2.67Å; E373-H478 IonicContact OE1-CG 2.89Å; E373-H478 IonicContact OE1-ND1 3.75Å; E373-H478 PolarHBondContact OE1-ND1 3.3Å; Y383-H478 AromaticContact CE2-NE2 3.44Å; Y383-H478 WeakPolarHBondContact CE2-NE2 3.49Å; Y383-H478 AromaticContact CZ-CD2 3.96Å; Y383-H478 AromaticContact CZ-NE2 3.45Å; Y383-H478 PolarHBondContact OH-CD2 2.99Å; Y383-H478 PolarHBondContact OH-NE2 3.42Å; F474-H478 PolarHBondContact O-N 2.65Å; L475-H478 WeakPolarHBondContact O-CB 3.42Å; L475-H478 PolarHBondContact O-N 3.04Å; M476-H478 VanDerWaalsContact C-N 3.3Å; M476-H478 PolarHBondContact O-N 3.47Å; H478-Q480 VanDerWaalsContact C-N 3.31Å; H478-Q480 PolarHBondContact O-N 2.95Å; H478-R481 WeakPolarHBondContact O-CB 3.39Å; H478-R481 PolarHBondContact O-N 3.04Å; H478-R481 VanDerWaalsContact O-N 3.14Å; H478-V482 WeakPolarHBondContact O-CG2 3.35Å; H478-V482 PolarHBondContact O-N 2.9Å
479	L	98.4	Very high	97	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.7	-32.7	-178.7	-68	-176.9	0	0	0	112.5	Y383 L475 M476 R481 V482 A483 L495 F499 L531	Y383-L479 HydrophobicContact CD2-CD2 3.84Å; Y383-L479 HydrophobicContact CE2-CD2 3.49Å; Y383-L479 VanDerWaalsContact CE2-CD2 3.49Å; L475-L479 HydrophobicContact CD1-CD1 4.21Å; L475-L479 HydrophobicContact CD1-CG 4.13Å; L475-L479 HydrophobicContact CG-CD1 4Å; L475-L479 HydrophobicContact CG-CG 4.27Å; L475-L479 VanDerWaalsContact O-CG 3.31Å; L475-L479 WeakPolarHBondContact O-CG 3.41Å; L475-L479 PolarHBondContact O-N 2.96Å; M476-L479 HydrophobicContact CE-CD1 3.89Å; M476-L479 PolarHBondContact O-N 3.12Å; L479-R481 VanDerWaalsContact C-N 3.35Å; L479-V482 PolarHBondContact O-N 3.05Å; L479-A483 WeakPolarHBondContact O-CB 3.46Å; L479-A483 PolarHBondContact O-N 2.71Å; L479-L495 HydrophobicContact CB-CD1 4.34Å; L479-L495 HydrophobicContact CD2-CD2 4.37Å; L479-L495 WeakPolarHBondContact O-CD1 3.22Å; L479-F499 HydrophobicContact CD1-CD1 4.21Å; L479-F499 HydrophobicContact CD1-CD2 3.74Å; L479-F499 HydrophobicContact CD1-CE1 4.31Å; L479-F499 HydrophobicContact CD1-CE2 3.86Å; L479-F499 HydrophobicContact CD1-CG 3.92Å; L479-F499 HydrophobicContact CD1-CZ 4.14Å; L479-F499 HydrophobicContact CD2-CD2 4.09Å; L479-F499 HydrophobicContact CD2-CE2 3.42Å; L479-F499 VanDerWaalsContact CD2-CE2 3.42Å; L479-F499 HydrophobicContact CD2-CZ 3.71Å; L479-F499 HydrophobicContact CG-CE2 4.29Å; L479-F499 HydrophobicContact CG-CZ 4.5Å; L479-L531 HydrophobicContact CB-CD2 3.53Å; L479-L531 HydrophobicContact CD1-CD2 4.35Å
480	Q	98.3	Very high	97	Very high	14 Å²	14	34.2 Å²	34.2	7%	0.065	17%	0.17	C	C	.	.	H	α-helix	trans	-62.1	-41.1	171.3	-75	173.5	-31.4	0	0	111.6	M476 I477 H478 A483 Q484 L531 L533	M476-Q480 WeakPolarHBondContact O-CB 3.48Å; M476-Q480 VanDerWaalsContact O-CG 3.27Å; M476-Q480 WeakPolarHBondContact O-CG 3.33Å; M476-Q480 PolarHBondContact O-N 3.15Å; I477-Q480 PolarHBondContact O-N 3.33Å; H478-Q480 VanDerWaalsContact C-N 3.31Å; H478-Q480 PolarHBondContact O-N 2.95Å; Q480-A483 PolarHBondContact O-N 3.29Å; Q480-Q484 WeakPolarHBondContact O-CG 3.47Å; Q480-Q484 PolarHBondContact O-N 3.24Å; Q480-L531 HydrophobicContact CG-CD2 4.08Å; Q480-L531 PolarHBondContact NE2-O 3.07Å; Q480-L533 PolarHBondContact NE2-O 2.95Å
481	R	97.8	Very high	97.1	Very high	111 Å²	111	38 Å²	38	42%	0.419	19%	0.19	S	C	.	.	H	α-helix	trans	-64.4	-40.1	173.8	-67.3	169.6	-175.5	162	3.6	112.4	E373 I477 H478 L479 A483 Q484 S485	E373-R481 VanDerWaalsContact CD-NH1 3.29Å; E373-R481 VanDerWaalsContact OE1-CD 3.27Å; E373-R481 WeakPolarHBondContact OE1-CD 3.35Å; E373-R481 IonicContact OE1-CZ 3.93Å; E373-R481 IonicContact OE1-NH1 2.76Å; E373-R481 PolarHBondContact OE1-NH1 2.81Å; E373-R481 IonicContact OE2-CZ 3.67Å; E373-R481 IonicContact OE2-NH1 2.71Å; E373-R481 PolarHBondContact OE2-NH1 3.35Å; I477-R481 WeakPolarHBondContact O-CG 3.5Å; I477-R481 PolarHBondContact O-N 3.44Å; H478-R481 WeakPolarHBondContact O-CB 3.39Å; H478-R481 PolarHBondContact O-N 3.04Å; H478-R481 VanDerWaalsContact O-N 3.14Å; L479-R481 VanDerWaalsContact C-N 3.35Å; R481-A483 VanDerWaalsContact C-N 3.31Å; R481-A483 PolarHBondContact O-N 3.27Å; R481-Q484 PolarHBondContact O-N 3.34Å; R481-S485 PolarHBondContact O-N 3.24Å; R481-S485 VanDerWaalsContact O-N 3.13Å
482	V	98.1	Very high	97.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-42.1	175.1	173.8	0	0	0	0	110.9	L377 L382 Y383 H478 L479 S485 T488 M490 L495	L377-V482 HydrophobicContact CD2-CG2 3.81Å; L382-V482 HydrophobicContact CB-CG1 4.3Å; L382-V482 HydrophobicContact CD2-CG1 4.44Å; L382-V482 HydrophobicContact CD2-CG2 4.45Å; Y383-V482 HydrophobicContact CE2-CG2 4.21Å; H478-V482 WeakPolarHBondContact O-CG2 3.35Å; H478-V482 PolarHBondContact O-N 2.9Å; L479-V482 PolarHBondContact O-N 3.05Å; V482-S485 PolarHBondContact O-N 2.82Å; V482-T488 HydrophobicContact CG1-CG2 4.23Å; V482-T488 PolarHBondContact O-OG1 3.46Å; V482-M490 HydrophobicContact CG1-CB 4.34Å; V482-L495 HydrophobicContact CB-CD1 4.31Å; V482-L495 HydrophobicContact CG1-CD1 4.15Å; V482-L495 HydrophobicContact CG1-CD2 4.12Å
483	A	97.6	Very high	97.2	Very high	28 Å²	28	41.9 Å²	41.9	23%	0.231	22%	0.215	C	C	.	.	H	α-helix	trans	-69	-31.4	177.2	0	0	0	0	0	113.9	L479 Q480 R481 S485 M490 I492 L495	L479-A483 WeakPolarHBondContact O-CB 3.46Å; L479-A483 PolarHBondContact O-N 2.71Å; Q480-A483 PolarHBondContact O-N 3.29Å; R481-A483 VanDerWaalsContact C-N 3.31Å; R481-A483 PolarHBondContact O-N 3.27Å; A483-S485 VanDerWaalsContact C-N 3.33Å; A483-M490 VanDerWaalsContact CA-O 3.3Å; A483-M490 WeakPolarHBondContact CA-O 3.43Å; A483-I492 HydrophobicContact CB-CG1 4.04Å; A483-L495 HydrophobicContact CB-CD1 3.94Å
484	Q	96.9	Very high	97.2	Very high	139 Å²	139	43.9 Å²	43.9	65%	0.65	23%	0.226	S	C	*	.	H	α-helix	trans	-74.3	-23.3	175.7	-72.6	166.3	10.7	0	0	112.8	Q480 R481 P486	Q480-Q484 WeakPolarHBondContact O-CG 3.47Å; Q480-Q484 PolarHBondContact O-N 3.24Å; R481-Q484 PolarHBondContact O-N 3.34Å; Q484-P486 WeakPolarHBondContact O-CD 3.46Å
485	S	95.9	Very high	97.2	Very high	23 Å²	23	42.3 Å²	42.3	16%	0.161	22%	0.219	C	C	.	.			trans	-75.1	118	177	-178.7	0	0	0	0	111	L377 R481 V482 A483 E487 T488	L377-S485 PolarHBondContact O-OG 3.17Å; R481-S485 PolarHBondContact O-N 3.24Å; R481-S485 VanDerWaalsContact O-N 3.13Å; V482-S485 PolarHBondContact O-N 2.82Å; A483-S485 VanDerWaalsContact C-N 3.33Å; S485-E487 VanDerWaalsContact C-N 3.26Å; S485-E487 PolarHBondContact O-N 3.3Å; S485-T488 PolarHBondContact O-N 3.28Å; S485-T488 PolarHBondContact O-OG1 3.16Å
486	P	93.3	Very high	97.2	Very high	113 Å²	113	42.2 Å²	42.2	73%	0.734	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-24.5	-178.6	28.4	-34.7	0	0	0	112.9	Q484 T488	Q484-P486 WeakPolarHBondContact O-CD 3.46Å; P486-T488 VanDerWaalsContact C-N 3.35Å
487	E	95.1	Very high	97.2	Very high	99 Å²	99	48.3 Å²	48.3	46%	0.463	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-30.2	-176.6	-64.7	-178.1	-152.2	0	0	112.2	R378 S485 K489	R378-E487 WeakPolarHBondContact CA-OE2 3.5Å; R378-E487 WeakPolarHBondContact CB-OE2 3.3Å; R378-E487 WeakPolarHBondContact CG-OE2 3.42Å; S485-E487 VanDerWaalsContact C-N 3.26Å; S485-E487 PolarHBondContact O-N 3.3Å; E487-K489 VanDerWaalsContact C-N 3.27Å; E487-K489 PolarHBondContact O-N 2.86Å
488	T	95.6	Very high	97.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-27.3	-178.2	69	0	0	0	0	112.3	L377 E379 G381 L382 V482 S485 P486 M490	L377-T488 VanDerWaalsContact O-CG2 3.26Å; L377-T488 WeakPolarHBondContact O-CG2 3.49Å; E379-T488 WeakPolarHBondContact O-CA 3.48Å; G381-T488 PolarHBondContact N-O 3.47Å; L382-T488 HydrophobicContact CB-CG2 4.44Å; L382-T488 HydrophobicContact CD1-CG2 4.28Å; V482-T488 HydrophobicContact CG1-CG2 4.23Å; V482-T488 PolarHBondContact O-OG1 3.46Å; S485-T488 PolarHBondContact O-N 3.28Å; S485-T488 PolarHBondContact O-OG1 3.16Å; P486-T488 VanDerWaalsContact C-N 3.35Å; T488-M490 WeakPolarHBondContact O-CG 3.38Å; T488-M490 PolarHBondContact O-N 3.38Å; T488-M490 PolarHBondContact OG1-N 3.06Å
489	K	95.9	Very high	97.2	Very high	136 Å²	136	49.3 Å²	49.3	59%	0.591	25%	0.252	S	S	*	.			trans	54	26.7	-170.2	-54.4	-172.5	-175.9	173.3	0	113.6	M380 E487	M380-K489 HydrophobicContact CE-CD 4.15Å; M380-K489 VanDerWaalsContact CE-NZ 3.28Å; M380-K489 HydrophobicContact CG-CB 4.35Å; M380-K489 HydrophobicContact CG-CD 3.87Å; M380-K489 HydrophobicContact CG-CG 4.13Å; M380-K489 HydrophobicContact SD-CD 3.71Å; M380-K489 PolarHBondContact SD-NZ 2.95Å; E487-K489 VanDerWaalsContact C-N 3.27Å; E487-K489 PolarHBondContact O-N 2.86Å
490	M	97.4	Very high	97.2	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.02	25%	0.252	C	S	.	.			trans	-114.7	85.2	-177.6	-70.4	-62.9	-59.9	0	0	110.1	L382 R384 V482 A483 T488 N494 L495 V498	L382-M490 WeakPolarHBondContact O-CE 3.42Å; L382-M490 WeakPolarHBondContact O-CG 3.48Å; R384-M490 HydrophobicContact CB-CE 3.76Å; R384-M490 HydrophobicContact CB-SD 3.71Å; V482-M490 HydrophobicContact CG1-CB 4.34Å; A483-M490 VanDerWaalsContact CA-O 3.3Å; A483-M490 WeakPolarHBondContact CA-O 3.43Å; T488-M490 WeakPolarHBondContact O-CG 3.38Å; T488-M490 PolarHBondContact O-N 3.38Å; T488-M490 PolarHBondContact OG1-N 3.06Å; M490-N494 HydrophobicContact CE-CB 3.74Å; M490-N494 HydrophobicContact SD-CB 4.15Å; M490-L495 HydrophobicContact CB-CD2 4.06Å; M490-L495 HydrophobicContact CB-CG 4.2Å; M490-L495 HydrophobicContact CE-CD2 3.86Å; M490-L495 HydrophobicContact CE-CG 4.34Å; M490-V498 HydrophobicContact CE-CG2 4.33Å
491	D	97.6	Very high	97.1	Very high	83 Å²	83	51.7 Å²	51.7	44%	0.444	27%	0.268	S	S	.	.			trans	-68.3	173	173.5	64.5	6.2	0	0	0	112.8	A493 N494 L495	D491-A493 VanDerWaalsContact C-N 3.26Å; D491-A493 PolarHBondContact O-N 3.31Å; D491-N494 PolarHBondContact O-N 3.04Å; D491-N494 WeakPolarHBondContact OD1-CB 3.37Å; D491-N494 PolarHBondContact OD1-N 3.37Å; D491-N494 PolarHBondContact OD1-ND2 3.33Å; D491-L495 WeakPolarHBondContact O-CG 3.5Å; D491-L495 PolarHBondContact O-N 3.41Å
492	I	98.1	Very high	97	Very high	50 Å²	50	46.8 Å²	46.8	26%	0.256	25%	0.251	S	S	.	.	H	α-helix	trans	-53.8	-44	179.6	-67.9	176.1	0	0	0	111.1	A483 L495 A496 E528 L531 L532	A483-I492 HydrophobicContact CB-CG1 4.04Å; I492-L495 PolarHBondContact O-N 2.96Å; I492-A496 VanDerWaalsContact O-CB 3.23Å; I492-A496 WeakPolarHBondContact O-CB 3.41Å; I492-A496 PolarHBondContact O-N 2.74Å; I492-E528 HydrophobicContact CG2-CB 4.31Å; I492-E528 HydrophobicContact CG2-CG 4.23Å; I492-L531 HydrophobicContact CG1-CB 4.36Å; I492-L531 HydrophobicContact CG2-CB 3.75Å; I492-L531 HydrophobicContact CG2-CD1 3.95Å; I492-L532 HydrophobicContact CD1-CD2 3.84Å; I492-L532 HydrophobicContact CD1-CG 4.47Å
493	A	97.8	Very high	97	Very high	32 Å²	32	46.8 Å²	46.8	26%	0.264	25%	0.251	S	S	.	.	H	α-helix	trans	-65.6	-40	-179	0	0	0	0	0	112.7	D491 K497 E528	D491-A493 VanDerWaalsContact C-N 3.26Å; D491-A493 PolarHBondContact O-N 3.31Å; A493-K497 WeakPolarHBondContact O-CG 3.36Å; A493-K497 PolarHBondContact O-N 2.84Å; A493-E528 WeakPolarHBondContact CA-OE1 3.27Å
494	N	97.8	Very high	97	Very high	43 Å²	43	45.5 Å²	45.5	23%	0.23	24%	0.24	C	C	.	.	H	α-helix	trans	-69.9	-41.2	176.8	-71.1	-29.2	0	0	0	111.7	M490 D491 A496 K497 V498	M490-N494 HydrophobicContact CE-CB 3.74Å; M490-N494 HydrophobicContact SD-CB 4.15Å; D491-N494 PolarHBondContact O-N 3.04Å; D491-N494 WeakPolarHBondContact OD1-CB 3.37Å; D491-N494 PolarHBondContact OD1-N 3.37Å; D491-N494 PolarHBondContact OD1-ND2 3.33Å; N494-A496 VanDerWaalsContact C-N 3.34Å; N494-K497 PolarHBondContact O-N 3.01Å; N494-V498 WeakPolarHBondContact O-CG2 3.31Å; N494-V498 PolarHBondContact O-N 2.93Å
495	L	98.4	Very high	96.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-41	174.6	-69.6	173.9	0	0	0	111.3	Y383 L479 V482 A483 M490 D491 I492 K497 V498 F499 L531	Y383-L495 HydrophobicContact CD2-CD2 4.03Å; L479-L495 HydrophobicContact CB-CD1 4.34Å; L479-L495 HydrophobicContact CD2-CD2 4.37Å; L479-L495 WeakPolarHBondContact O-CD1 3.22Å; V482-L495 HydrophobicContact CB-CD1 4.31Å; V482-L495 HydrophobicContact CG1-CD1 4.15Å; V482-L495 HydrophobicContact CG1-CD2 4.12Å; A483-L495 HydrophobicContact CB-CD1 3.94Å; M490-L495 HydrophobicContact CB-CD2 4.06Å; M490-L495 HydrophobicContact CB-CG 4.2Å; M490-L495 HydrophobicContact CE-CD2 3.86Å; M490-L495 HydrophobicContact CE-CG 4.34Å; D491-L495 WeakPolarHBondContact O-CG 3.5Å; D491-L495 PolarHBondContact O-N 3.41Å; I492-L495 PolarHBondContact O-N 2.96Å; L495-K497 VanDerWaalsContact C-N 3.34Å; L495-K497 PolarHBondContact O-N 2.98Å; L495-V498 PolarHBondContact O-N 2.84Å; L495-V498 VanDerWaalsContact O-N 3.07Å; L495-F499 WeakPolarHBondContact O-CD2 3.18Å; L495-F499 PolarHBondContact O-N 3.32Å; L495-L531 HydrophobicContact CB-CD1 4.2Å
496	A	98.4	Very high	96.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.4	-39.4	178.3	0	0	0	0	0	113.4	I492 N494 V498 F499 G500 P524 V527 E528	I492-A496 VanDerWaalsContact O-CB 3.23Å; I492-A496 WeakPolarHBondContact O-CB 3.41Å; I492-A496 PolarHBondContact O-N 2.74Å; N494-A496 VanDerWaalsContact C-N 3.34Å; A496-V498 VanDerWaalsContact C-N 3.28Å; A496-V498 PolarHBondContact O-N 3.43Å; A496-F499 PolarHBondContact O-N 3.18Å; A496-G500 WeakPolarHBondContact O-CA 3.31Å; A496-G500 PolarHBondContact O-N 3.07Å; A496-P524 HydrophobicContact CB-CB 4.31Å; A496-P524 WeakPolarHBondContact CB-O 3.35Å; A496-V527 HydrophobicContact CB-CB 3.88Å; A496-V527 HydrophobicContact CB-CG1 4.1Å; A496-E528 HydrophobicContact CB-CB 4.39Å; A496-E528 HydrophobicContact CB-CG 3.36Å
497	K	97.8	Very high	96.5	Very high	128 Å²	128	37 Å²	37	56%	0.557	20%	0.199	S	C	*	.	H	α-helix	trans	-62.5	-35	173.4	-70.1	167.6	-170.5	165.9	0	112.6	A493 N494 L495 P501 P524	A493-K497 WeakPolarHBondContact O-CG 3.36Å; A493-K497 PolarHBondContact O-N 2.84Å; N494-K497 PolarHBondContact O-N 3.01Å; L495-K497 VanDerWaalsContact C-N 3.34Å; L495-K497 PolarHBondContact O-N 2.98Å; K497-P501 WeakPolarHBondContact O-CD 3.33Å; K497-P524 HydrophobicContact CG-CB 4.38Å; K497-P524 HydrophobicContact CG-CG 4.47Å
498	V	97.8	Very high	96.3	Very high	33 Å²	33	35.9 Å²	35.9	20%	0.2	20%	0.199	C	C	.	.	H	α-helix	trans	-76.5	-44.2	179.1	176	0	0	0	0	111.3	Y383 R384 K422 M490 N494 L495 A496 T502	Y383-V498 WeakPolarHBondContact O-CG1 3.2Å; R384-V498 HydrophobicContact CB-CG2 4.43Å; K422-V498 HydrophobicContact CD-CG1 3.75Å; M490-V498 HydrophobicContact CE-CG2 4.33Å; N494-V498 WeakPolarHBondContact O-CG2 3.31Å; N494-V498 PolarHBondContact O-N 2.93Å; L495-V498 PolarHBondContact O-N 2.84Å; L495-V498 VanDerWaalsContact O-N 3.07Å; A496-V498 VanDerWaalsContact C-N 3.28Å; A496-V498 PolarHBondContact O-N 3.43Å; V498-T502 PolarHBondContact O-OG1 3.29Å
499	F	98.4	Very high	95.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-87.9	-21.3	-173.7	-81.3	-85.4	0	0	0	113.9	Y383 L421 K422 L425 L475 L479 L495 A496 T502 I503 V527	Y383-F499 AromaticContact CD1-CE2 3.88Å; Y383-F499 HydrophobicContact CD1-CE2 3.88Å; Y383-F499 AromaticContact CD1-CZ 3.59Å; Y383-F499 HydrophobicContact CD1-CZ 3.59Å; Y383-F499 AromaticContact CD2-CE2 3.77Å; Y383-F499 HydrophobicContact CD2-CE2 3.77Å; Y383-F499 HydrophobicContact CD2-CZ 4.09Å; Y383-F499 HydrophobicContact CE1-CE2 4.36Å; Y383-F499 AromaticContact CE1-CZ 3.73Å; Y383-F499 HydrophobicContact CE1-CZ 3.73Å; Y383-F499 HydrophobicContact CE2-CE2 4.25Å; Y383-F499 HydrophobicContact CE2-CZ 4.2Å; Y383-F499 AromaticContact CG-CE2 3.57Å; Y383-F499 HydrophobicContact CG-CE2 3.57Å; Y383-F499 AromaticContact CG-CZ 3.79Å; Y383-F499 HydrophobicContact CG-CZ 3.79Å; L421-F499 HydrophobicContact CD2-CE1 3.96Å; L421-F499 HydrophobicContact CD2-CZ 4.21Å; K422-F499 HydrophobicContact CG-CE1 4.26Å; K422-F499 HydrophobicContact CG-CZ 4.26Å; L425-F499 HydrophobicContact CD1-CE1 4.45Å; L475-F499 HydrophobicContact CD1-CE1 4.19Å; L475-F499 HydrophobicContact CD2-CD1 4.31Å; L475-F499 HydrophobicContact CD2-CE1 4.28Å; L479-F499 HydrophobicContact CD1-CD1 4.21Å; L479-F499 HydrophobicContact CD1-CD2 3.74Å; L479-F499 HydrophobicContact CD1-CE1 4.31Å; L479-F499 HydrophobicContact CD1-CE2 3.86Å; L479-F499 HydrophobicContact CD1-CG 3.92Å; L479-F499 HydrophobicContact CD1-CZ 4.14Å; L479-F499 HydrophobicContact CD2-CD2 4.09Å; L479-F499 HydrophobicContact CD2-CE2 3.42Å; L479-F499 VanDerWaalsContact CD2-CE2 3.42Å; L479-F499 HydrophobicContact CD2-CZ 3.71Å; L479-F499 HydrophobicContact CG-CE2 4.29Å; L479-F499 HydrophobicContact CG-CZ 4.5Å; L495-F499 WeakPolarHBondContact O-CD2 3.18Å; L495-F499 PolarHBondContact O-N 3.32Å; A496-F499 PolarHBondContact O-N 3.18Å; F499-T502 CarbonylContact O-C 3.58Å; F499-T502 WeakPolarHBondContact O-CA 3.4Å; F499-T502 WeakPolarHBondContact O-CB 3.17Å; F499-T502 PolarHBondContact O-N 3.42Å; F499-I503 HydrophobicContact CB-CD1 4.42Å; F499-I503 HydrophobicContact CD1-CG2 4.1Å; F499-I503 WeakPolarHBondContact O-CG1 3.1Å; F499-I503 PolarHBondContact O-N 3.12Å; F499-V527 HydrophobicContact CB-CG1 4.13Å
500	G	97.8	Very high	95.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.239	C	C	.	.	I	π-helix	trans	-49.1	-59.9	177.5	0	0	0	0	0	113	A496 T502 V504 A505	A496-G500 WeakPolarHBondContact O-CA 3.31Å; A496-G500 PolarHBondContact O-N 3.07Å; G500-T502 PolarHBondContact O-N 3.12Å; G500-T502 VanDerWaalsContact O-N 3.17Å; G500-V504 WeakPolarHBondContact O-CB 3.35Å; G500-V504 WeakPolarHBondContact O-CG2 3.25Å; G500-V504 PolarHBondContact O-N 3.01Å; G500-A505 PolarHBondContact O-N 3.07Å
501	P	96	Very high	95.1	Very high	64 Å²	64	42.2 Å²	42.2	42%	0.416	25%	0.245	S	C	.	.	I	π-helix	trans	-64.1	-20.4	176.2	-21.6	32.4	0	0	0	114.1	K497	K497-P501 WeakPolarHBondContact O-CD 3.33Å
502	T	96.3	Very high	94.8	Very high	8 Å²	8	42.1 Å²	42.1	5%	0.049	25%	0.245	C	C	.	.	I	π-helix	trans	-86.2	-41.7	-174.3	-56.8	0	0	0	0	112.7	K422 L425 V498 F499 G500	K422-T502 HydrophobicContact CB-CG2 4.38Å; L425-T502 HydrophobicContact CB-CG2 3.83Å; L425-T502 HydrophobicContact CD1-CG2 4.4Å; V498-T502 PolarHBondContact O-OG1 3.29Å; F499-T502 CarbonylContact O-C 3.58Å; F499-T502 WeakPolarHBondContact O-CA 3.4Å; F499-T502 WeakPolarHBondContact O-CB 3.17Å; F499-T502 PolarHBondContact O-N 3.42Å; G500-T502 PolarHBondContact O-N 3.12Å; G500-T502 VanDerWaalsContact O-N 3.17Å
503	I	97.5	Very high	94.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	27%	0.266	C	S	.	.	I	π-helix	trans	-108.8	-29.3	-173.7	71.1	-178.6	0	0	0	113.5	L425 L432 L433 L472 L475 M476 F499 V527	L425-I503 HydrophobicContact CD1-CG2 4.1Å; L432-I503 HydrophobicContact CB-CB 4.15Å; L432-I503 HydrophobicContact CB-CG2 4.47Å; L432-I503 HydrophobicContact CD2-CB 4.31Å; L432-I503 HydrophobicContact CD2-CG2 4.12Å; L432-I503 PolarHBondContact N-O 2.7Å; L433-I503 WeakPolarHBondContact CG-O 3.39Å; L433-I503 PolarHBondContact N-O 3.18Å; L433-I503 VanDerWaalsContact N-O 3.12Å; L472-I503 HydrophobicContact CD1-CD1 4.29Å; L475-I503 HydrophobicContact CD2-CG2 3.96Å; M476-I503 HydrophobicContact CE-CD1 3.93Å; F499-I503 HydrophobicContact CB-CD1 4.42Å; F499-I503 HydrophobicContact CD1-CG2 4.1Å; F499-I503 WeakPolarHBondContact O-CG1 3.1Å; F499-I503 PolarHBondContact O-N 3.12Å; I503-V527 HydrophobicContact CD1-CG1 4.33Å; I503-V527 HydrophobicContact CD1-CG2 3.88Å; I503-V527 HydrophobicContact CG1-CG2 4Å
504	V	96.8	Very high	94.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.28	C	S	.	.	I	π-helix	trans	-87.8	-48.6	178.1	-168.5	0	0	0	0	109.6	L433 N438 M442 G500 Q523 V526 V527	L433-V504 HydrophobicContact CD1-CB 4.26Å; L433-V504 HydrophobicContact CD1-CG1 4.28Å; L433-V504 HydrophobicContact CD1-CG2 3.82Å; N438-V504 PolarHBondContact ND2-O 3.4Å; M442-V504 HydrophobicContact CE-CG1 3.36Å; M442-V504 HydrophobicContact SD-CG1 4.13Å; G500-V504 WeakPolarHBondContact O-CB 3.35Å; G500-V504 WeakPolarHBondContact O-CG2 3.25Å; G500-V504 PolarHBondContact O-N 3.01Å; V504-Q523 HydrophobicContact CB-CB 4.33Å; V504-Q523 HydrophobicContact CB-CG 4.07Å; V504-Q523 HydrophobicContact CG1-CG 4.14Å; V504-V526 HydrophobicContact CG1-CG2 4.47Å; V504-V526 HydrophobicContact CG2-CB 4.05Å; V504-V526 HydrophobicContact CG2-CG1 3.99Å; V504-V527 HydrophobicContact CG2-CG2 3.77Å
505	A	92.9	Very high	93.9	Very high	22 Å²	22	48.8 Å²	48.8	18%	0.182	28%	0.282	C	S	.	.			trans	47.7	-138.2	-175.9	0	0	0	0	0	111.6	P431 N438 G500 Q523	P431-A505 HydrophobicContact CB-CB 3.82Å; P431-A505 HydrophobicContact CG-CB 4.22Å; N438-A505 PolarHBondContact ND2-O 2.99Å; G500-A505 PolarHBondContact O-N 3.07Å; A505-Q523 PolarHBondContact O-NE2 3.3Å
506	H	93.3	Very high	93.6	Very high	32 Å²	32	52.1 Å²	52.1	15%	0.148	30%	0.3	C	S	.	.			trans	-119.6	160.7	-176.8	-56.9	-71.5	0	0	0	110.4	F435 V508 P511 L516 D519 Q523	F435-H506 WeakPolarHBondContact CD1-O 3.3Å; F435-H506 WeakPolarHBondContact CE1-O 3.22Å; H506-V508 PolarHBondContact O-N 2.85Å; H506-P511 HydrophobicContact CB-CB 4.11Å; H506-P511 HydrophobicContact CB-CG 3.91Å; H506-L516 VanDerWaalsContact CE1-CD2 3.41Å; H506-L516 WeakPolarHBondContact CE1-CD2 3.35Å; H506-L516 WeakPolarHBondContact NE2-CD2 3.5Å; H506-D519 IonicContact CE1-OD2 3.91Å; H506-D519 IonicContact CG-OD2 3.68Å; H506-D519 IonicContact ND1-OD2 2.81Å; H506-D519 PolarHBondContact ND1-OD2 3.44Å; H506-Q523 PolarHBondContact CE1-NE2 2.91Å
507	A	90.6	Very high	93.2	Very high	43 Å²	43	57.2 Å²	57.2	36%	0.355	33%	0.326	S	S	.	.	S	Bend	trans	-69.1	-11.8	178.1	0	0	0	0	0	113.8	F435 N438	F435-A507 WeakPolarHBondContact CB-O 3.44Å; F435-A507 VanDerWaalsContact CD1-C 3.41Å; F435-A507 VanDerWaalsContact CD1-O 3.3Å; F435-A507 WeakPolarHBondContact CD1-O 3.37Å; N438-A507 HydrophobicContact CB-CB 4.14Å
508	V	90.8	Very high	92.9	Very high	76 Å²	76	56.3 Å²	56.3	46%	0.461	32%	0.324	S	S	.	.	S	Bend	trans	-138.6	156.8	178.3	-65.3	0	0	0	0	110.6	H506 P511	H506-V508 PolarHBondContact O-N 2.85Å; V508-P511 HydrophobicContact CG2-CB 4.04Å
509	P	84.9	Confident	92.7	Very high	94 Å²	94	55.1 Å²	55.1	61%	0.61	32%	0.317	S	S	*	.	S	Bend	trans	-60.8	-43.6	179.8	-24.5	33.7	0	0	0	114.2	F435 P511	F435-P509 HydrophobicContact CE1-CG 4.42Å; F435-P509 HydrophobicContact CE2-CG 4.12Å; F435-P509 HydrophobicContact CZ-CB 4.43Å; F435-P509 HydrophobicContact CZ-CG 3.78Å; P509-P511 VanDerWaalsContact O-CD 3.3Å; P509-P511 WeakPolarHBondContact O-CD 3.35Å
510	D	87.4	Confident	92.4	Very high	153 Å²	153	59.1 Å²	59.1	82%	0.818	34%	0.341	S	S	*	.	S	Bend	trans	-120.2	79.2	-177.6	-63.8	-51.5	0	0	0	110
511	P	90.4	Very high	92.2	Very high	25 Å²	25	66.5 Å²	66.5	16%	0.162	37%	0.373	C	S	.	.			trans	-71.4	152	177.9	32.4	-38.6	0	0	0	111.4	H506 V508 P509 T515 L516	H506-P511 HydrophobicContact CB-CB 4.11Å; H506-P511 HydrophobicContact CB-CG 3.91Å; V508-P511 HydrophobicContact CG2-CB 4.04Å; P509-P511 VanDerWaalsContact O-CD 3.3Å; P509-P511 WeakPolarHBondContact O-CD 3.35Å; P511-T515 HydrophobicContact CB-CG2 4.04Å; P511-L516 HydrophobicContact CB-CD2 4.27Å; P511-L516 HydrophobicContact CB-CG 4.37Å; P511-L516 HydrophobicContact CG-CD2 3.35Å; P511-L516 HydrophobicContact CG-CG 3.82Å
512	D	91.9	Very high	92.2	Very high	82 Å²	82	66 Å²	66	44%	0.439	36%	0.363	S	S	.	.			trans	-69.6	157.9	172.7	68.3	-86.2	0	0	0	111.9	M514 T515 L516	D512-M514 PolarHBondContact O-N 2.9Å; D512-M514 VanDerWaalsContact O-N 3.13Å; D512-M514 WeakPolarHBondContact OD2-CA 3.47Å; D512-M514 VanDerWaalsContact OD2-CB 3.24Å; D512-M514 WeakPolarHBondContact OD2-CB 3.5Å; D512-M514 PolarHBondContact OD2-N 2.94Å; D512-T515 VanDerWaalsContact CG-OG1 3.31Å; D512-T515 PolarHBondContact O-N 3.2Å; D512-T515 VanDerWaalsContact O-N 3.15Å; D512-T515 VanDerWaalsContact OD1-CB 3.31Å; D512-T515 WeakPolarHBondContact OD1-CB 3.5Å; D512-T515 PolarHBondContact OD1-OG1 3.22Å; D512-T515 PolarHBondContact OD2-N 3.43Å; D512-T515 PolarHBondContact OD2-OG1 3.35Å; D512-L516 PolarHBondContact O-N 3.36Å
513	P	92.7	Very high	92.2	Very high	108 Å²	108	65.8 Å²	65.8	70%	0.701	36%	0.361	S	S	*	.	H	α-helix	trans	-57.9	-27.9	-177.8	-27.3	35.9	0	0	0	115.4	L517	P513-L517 PolarHBondContact O-N 3.32Å
514	M	90.9	Very high	92.2	Very high	113 Å²	113	66.8 Å²	66.8	56%	0.557	37%	0.367	S	S	*	.	H	α-helix	trans	-74.5	-44	178.7	-171.3	60.2	59.1	0	0	110.5	D512 L516 L517 Q518	D512-M514 PolarHBondContact O-N 2.9Å; D512-M514 VanDerWaalsContact O-N 3.13Å; D512-M514 WeakPolarHBondContact OD2-CA 3.47Å; D512-M514 VanDerWaalsContact OD2-CB 3.24Å; D512-M514 WeakPolarHBondContact OD2-CB 3.5Å; D512-M514 PolarHBondContact OD2-N 2.94Å; M514-L516 VanDerWaalsContact C-N 3.32Å; M514-L516 PolarHBondContact O-N 3.04Å; M514-L517 PolarHBondContact O-N 2.86Å; M514-Q518 WeakPolarHBondContact O-CG 3.43Å; M514-Q518 PolarHBondContact O-N 3.35Å
515	T	90.4	Very high	92.3	Very high	44 Å²	44	71.5 Å²	71.5	27%	0.27	39%	0.388	S	S	.	.	H	α-helix	trans	-59.2	-43.2	173.8	-62.6	0	0	0	0	111	P511 D512 L517 Q518 D519	P511-T515 HydrophobicContact CB-CG2 4.04Å; D512-T515 VanDerWaalsContact CG-OG1 3.31Å; D512-T515 PolarHBondContact O-N 3.2Å; D512-T515 VanDerWaalsContact O-N 3.15Å; D512-T515 VanDerWaalsContact OD1-CB 3.31Å; D512-T515 WeakPolarHBondContact OD1-CB 3.5Å; D512-T515 PolarHBondContact OD1-OG1 3.22Å; D512-T515 PolarHBondContact OD2-N 3.43Å; D512-T515 PolarHBondContact OD2-OG1 3.35Å; T515-L517 VanDerWaalsContact C-N 3.33Å; T515-L517 PolarHBondContact O-N 3.12Å; T515-Q518 PolarHBondContact O-N 3.05Å; T515-D519 WeakPolarHBondContact CG2-OD2 3.5Å; T515-D519 WeakPolarHBondContact O-CB 3.48Å; T515-D519 PolarHBondContact O-N 3.48Å
516	L	91.4	Very high	92.5	Very high	70 Å²	70	70.4 Å²	70.4	37%	0.366	38%	0.379	S	S	.	.	H	α-helix	trans	-54.2	-47.8	174	-72.7	177.2	0	0	0	112.4	H506 P511 D512 M514 T520	H506-L516 VanDerWaalsContact CE1-CD2 3.41Å; H506-L516 WeakPolarHBondContact CE1-CD2 3.35Å; H506-L516 WeakPolarHBondContact NE2-CD2 3.5Å; P511-L516 HydrophobicContact CB-CD2 4.27Å; P511-L516 HydrophobicContact CB-CG 4.37Å; P511-L516 HydrophobicContact CG-CD2 3.35Å; P511-L516 HydrophobicContact CG-CG 3.82Å; D512-L516 PolarHBondContact O-N 3.36Å; M514-L516 VanDerWaalsContact C-N 3.32Å; M514-L516 PolarHBondContact O-N 3.04Å; L516-T520 WeakPolarHBondContact O-CB 3.35Å; L516-T520 PolarHBondContact O-N 3.5Å; L516-T520 VanDerWaalsContact O-N 3.08Å; L516-T520 PolarHBondContact O-OG1 2.9Å
517	L	91.4	Very high	92.8	Very high	106 Å²	106	68.9 Å²	68.9	56%	0.555	37%	0.372	S	S	*	.	H	α-helix	trans	-66.3	-38.5	-178.4	-178.4	63	0	0	0	112.4	P513 M514 T515	P513-L517 PolarHBondContact O-N 3.32Å; M514-L517 PolarHBondContact O-N 2.86Å; T515-L517 VanDerWaalsContact C-N 3.33Å; T515-L517 PolarHBondContact O-N 3.12Å
518	Q	90.8	Very high	93.2	Very high	109 Å²	109	69.8 Å²	69.8	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-68.7	-50.2	177.5	-70.1	-179.1	6	0	0	111	M514 T515 T520 K521 R522	M514-Q518 WeakPolarHBondContact O-CG 3.43Å; M514-Q518 PolarHBondContact O-N 3.35Å; T515-Q518 PolarHBondContact O-N 3.05Å; Q518-T520 VanDerWaalsContact C-N 3.3Å; Q518-T520 PolarHBondContact O-N 3.47Å; Q518-K521 PolarHBondContact O-N 3.48Å; Q518-R522 WeakPolarHBondContact O-CG 3.33Å
519	D	93.4	Very high	93.5	Very high	9 Å²	9	68.3 Å²	68.3	5%	0.048	36%	0.355	C	S	.	.	H	α-helix	trans	-64.1	-34.5	-176.5	-73.8	-13.6	0	0	0	112.3	M442 H506 T515 K521 R522 Q523	M442-D519 HydrophobicContact CE-CB 4.46Å; H506-D519 IonicContact CE1-OD2 3.91Å; H506-D519 IonicContact CG-OD2 3.68Å; H506-D519 IonicContact ND1-OD2 2.81Å; H506-D519 PolarHBondContact ND1-OD2 3.44Å; T515-D519 WeakPolarHBondContact CG2-OD2 3.5Å; T515-D519 WeakPolarHBondContact O-CB 3.48Å; T515-D519 PolarHBondContact O-N 3.48Å; D519-K521 PolarHBondContact O-N 2.94Å; D519-R522 PolarHBondContact O-N 2.93Å; D519-Q523 HydrophobicContact CB-CG 4.37Å; D519-Q523 WeakPolarHBondContact O-CB 3.45Å; D519-Q523 WeakPolarHBondContact O-CG 3.43Å; D519-Q523 PolarHBondContact O-N 3.48Å
520	T	93.2	Very high	94.2	Very high	83 Å²	83	63.8 Å²	63.8	51%	0.509	33%	0.326	S	S	.	.	H	α-helix	trans	-53.3	-31	177.8	-62	0	0	0	0	112.7	L516 Q518 P524	L516-T520 WeakPolarHBondContact O-CB 3.35Å; L516-T520 PolarHBondContact O-N 3.5Å; L516-T520 VanDerWaalsContact O-N 3.08Å; L516-T520 PolarHBondContact O-OG1 2.9Å; Q518-T520 VanDerWaalsContact C-N 3.3Å; Q518-T520 PolarHBondContact O-N 3.47Å; T520-P524 VanDerWaalsContact O-CD 3.3Å; T520-P524 WeakPolarHBondContact O-CD 3.06Å
521	K	92.3	Very high	94.7	Very high	156 Å²	156	56.7 Å²	56.7	68%	0.678	29%	0.288	S	S	*	.	H	α-helix	trans	-86.9	-24.8	177.9	-63.2	-178.9	-177.3	177	0	113.4	Q518 D519	Q518-K521 PolarHBondContact O-N 3.48Å; D519-K521 PolarHBondContact O-N 2.94Å
522	R	95.8	Very high	95	Very high	54 Å²	54	60.7 Å²	60.7	20%	0.204	31%	0.307	C	S	.	.	H	α-helix	trans	-90.8	-39.2	-174.5	-57.6	173.7	77.5	-152.9	5	111.6	M442 E446 Q518 D519 K525 V526	M442-R522 HydrophobicContact CE-CB 4.35Å; M442-R522 HydrophobicContact SD-CB 3.47Å; M442-R522 WeakPolarHBondContact SD-CB 3.37Å; E446-R522 VanDerWaalsContact CD-NE 3.29Å; E446-R522 WeakPolarHBondContact OE1-CD 3.36Å; E446-R522 WeakPolarHBondContact OE1-CG 3.36Å; E446-R522 IonicContact OE1-CZ 2.99Å; E446-R522 IonicContact OE1-NE 3.7Å; E446-R522 PolarHBondContact OE1-NE 2.9Å; E446-R522 IonicContact OE1-NH2 3.63Å; E446-R522 IonicContact OE2-CZ 3.89Å; E446-R522 IonicContact OE2-NE 3.87Å; E446-R522 PolarHBondContact OE2-NE 3.2Å; E446-R522 IonicContact OE2-NH2 3.62Å; E446-R522 PolarHBondContact OE2-NH2 2.96Å; Q518-R522 WeakPolarHBondContact O-CG 3.33Å; D519-R522 PolarHBondContact O-N 2.93Å; R522-K525 WeakPolarHBondContact O-CB 3.46Å; R522-K525 PolarHBondContact O-N 3.26Å; R522-V526 PolarHBondContact O-N 3.45Å
523	Q	97.4	Very high	95.3	Very high	3 Å²	3	57 Å²	57	1%	0.014	29%	0.288	C	S	.	.	H	α-helix	trans	-51.4	-45.3	-179.5	-70.6	166	-3.9	0	0	113.5	M442 V504 A505 H506 D519 K525 V526 V527	M442-Q523 HydrophobicContact CE-CB 4.32Å; M442-Q523 HydrophobicContact CE-CG 3.49Å; M442-Q523 VanDerWaalsContact CE-CG 3.49Å; V504-Q523 HydrophobicContact CB-CB 4.33Å; V504-Q523 HydrophobicContact CB-CG 4.07Å; V504-Q523 HydrophobicContact CG1-CG 4.14Å; A505-Q523 PolarHBondContact O-NE2 3.3Å; H506-Q523 PolarHBondContact CE1-NE2 2.91Å; D519-Q523 HydrophobicContact CB-CG 4.37Å; D519-Q523 WeakPolarHBondContact O-CB 3.45Å; D519-Q523 WeakPolarHBondContact O-CG 3.43Å; D519-Q523 PolarHBondContact O-N 3.48Å; Q523-K525 VanDerWaalsContact C-N 3.33Å; Q523-K525 PolarHBondContact O-N 3.42Å; Q523-V526 PolarHBondContact O-N 3.31Å; Q523-V527 PolarHBondContact O-N 3.33Å
524	P	98.2	Very high	95.5	Very high	20 Å²	20	54.8 Å²	54.8	13%	0.13	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-39.2	179.1	-23.2	36	0	0	0	112.3	A496 K497 T520 V526 V527 E528	A496-P524 HydrophobicContact CB-CB 4.31Å; A496-P524 WeakPolarHBondContact CB-O 3.35Å; K497-P524 HydrophobicContact CG-CB 4.38Å; K497-P524 HydrophobicContact CG-CG 4.47Å; T520-P524 VanDerWaalsContact O-CD 3.3Å; T520-P524 WeakPolarHBondContact O-CD 3.06Å; P524-V526 VanDerWaalsContact C-N 3.27Å; P524-V526 PolarHBondContact O-N 2.9Å; P524-V527 PolarHBondContact O-N 2.91Å; P524-E528 WeakPolarHBondContact O-CG 3.43Å; P524-E528 PolarHBondContact O-N 2.97Å
525	K	97.6	Very high	95.6	Very high	99 Å²	99	51.7 Å²	51.7	43%	0.43	26%	0.26	S	S	.	.	H	α-helix	trans	-58.4	-41.6	179.3	-63.1	-176.6	177	-177.4	0	111.7	A445 R522 Q523 V527 E528 R529	A445-K525 HydrophobicContact CB-CB 4.21Å; R522-K525 WeakPolarHBondContact O-CB 3.46Å; R522-K525 PolarHBondContact O-N 3.26Å; Q523-K525 VanDerWaalsContact C-N 3.33Å; Q523-K525 PolarHBondContact O-N 3.42Å; K525-V527 VanDerWaalsContact C-N 3.33Å; K525-V527 PolarHBondContact O-N 3.46Å; K525-E528 PolarHBondContact O-N 2.88Å; K525-R529 VanDerWaalsContact O-CG 3.27Å; K525-R529 WeakPolarHBondContact O-CG 3.27Å; K525-R529 PolarHBondContact O-N 3.49Å
526	V	98.5	Very high	95.8	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.1	-48.5	175.9	178.1	0	0	0	0	110.7	L433 F441 M442 A445 M457 V504 R522 Q523 P524 R529 L530	L433-V526 HydrophobicContact CD1-CG1 3.81Å; F441-V526 HydrophobicContact CB-CG1 3.89Å; F441-V526 HydrophobicContact CB-CG2 4.43Å; F441-V526 HydrophobicContact CD1-CG1 4.17Å; F441-V526 HydrophobicContact CG-CG1 4.32Å; M442-V526 HydrophobicContact CG-CG2 4.38Å; M442-V526 HydrophobicContact SD-CG2 3.57Å; M442-V526 VanDerWaalsContact SD-CG2 3.57Å; A445-V526 HydrophobicContact CB-CB 4.38Å; A445-V526 HydrophobicContact CB-CG2 3.79Å; M457-V526 HydrophobicContact CE-CG1 4.44Å; V504-V526 HydrophobicContact CG1-CG2 4.47Å; V504-V526 HydrophobicContact CG2-CB 4.05Å; V504-V526 HydrophobicContact CG2-CG1 3.99Å; R522-V526 PolarHBondContact O-N 3.45Å; Q523-V526 PolarHBondContact O-N 3.31Å; P524-V526 VanDerWaalsContact C-N 3.27Å; P524-V526 PolarHBondContact O-N 2.9Å; V526-R529 PolarHBondContact O-N 3.3Å; V526-L530 HydrophobicContact CG1-CD1 4.11Å; V526-L530 VanDerWaalsContact O-CG 3.31Å; V526-L530 WeakPolarHBondContact O-CG 3.22Å; V526-L530 PolarHBondContact O-N 2.9Å
527	V	98.6	Very high	96	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-69.4	-36.4	-178.6	-174.1	0	0	0	0	111.9	A496 F499 I503 V504 Q523 P524 K525 L530 L531	A496-V527 HydrophobicContact CB-CB 3.88Å; A496-V527 HydrophobicContact CB-CG1 4.1Å; F499-V527 HydrophobicContact CB-CG1 4.13Å; I503-V527 HydrophobicContact CD1-CG1 4.33Å; I503-V527 HydrophobicContact CD1-CG2 3.88Å; I503-V527 HydrophobicContact CG1-CG2 4Å; V504-V527 HydrophobicContact CG2-CG2 3.77Å; Q523-V527 PolarHBondContact O-N 3.33Å; P524-V527 PolarHBondContact O-N 2.91Å; K525-V527 VanDerWaalsContact C-N 3.33Å; K525-V527 PolarHBondContact O-N 3.46Å; V527-L530 PolarHBondContact O-N 3.36Å; V527-L531 HydrophobicContact CG1-CD1 3.93Å; V527-L531 HydrophobicContact CG1-CG 4.27Å; V527-L531 WeakPolarHBondContact O-CB 3.39Å; V527-L531 VanDerWaalsContact O-CG 3.32Å; V527-L531 WeakPolarHBondContact O-CG 3.39Å; V527-L531 PolarHBondContact O-N 3.05Å
528	E	98.2	Very high	96.2	Very high	62 Å²	62	49.6 Å²	49.6	29%	0.29	24%	0.242	S	C	.	.	H	α-helix	trans	-58.7	-47.9	172	-69.1	178.9	180	0	0	110.9	I492 A493 A496 P524 K525 L530 L531 L532	I492-E528 HydrophobicContact CG2-CB 4.31Å; I492-E528 HydrophobicContact CG2-CG 4.23Å; A493-E528 WeakPolarHBondContact CA-OE1 3.27Å; A496-E528 HydrophobicContact CB-CB 4.39Å; A496-E528 HydrophobicContact CB-CG 3.36Å; P524-E528 WeakPolarHBondContact O-CG 3.43Å; P524-E528 PolarHBondContact O-N 2.97Å; K525-E528 PolarHBondContact O-N 2.88Å; E528-L530 VanDerWaalsContact C-N 3.35Å; E528-L530 PolarHBondContact O-N 3.29Å; E528-L531 PolarHBondContact O-N 3.35Å; E528-L532 WeakPolarHBondContact O-CB 3.45Å; E528-L532 VanDerWaalsContact O-CG 3.26Å; E528-L532 WeakPolarHBondContact O-CG 3.32Å; E528-L532 PolarHBondContact O-N 3.17Å
529	R	98.1	Very high	96.3	Very high	44 Å²	44	46.4 Å²	46.4	17%	0.166	23%	0.232	C	C	.	.	H	α-helix	trans	-59.1	-43.9	176.6	-66.4	-64.5	-173.5	-167.3	6.9	112.1	A445 E450 S453 M457 K525 V526 L532 L533	A445-R529 HydrophobicContact CB-CG 3.98Å; E450-R529 IonicContact OE1-CZ 3.31Å; E450-R529 VanDerWaalsContact OE1-CZ 3.31Å; E450-R529 IonicContact OE1-NH1 3.78Å; E450-R529 PolarHBondContact OE1-NH1 3.38Å; E450-R529 IonicContact OE1-NH2 3.76Å; E450-R529 PolarHBondContact OE1-NH2 3.1Å; E450-R529 IonicContact OE2-CZ 3.57Å; E450-R529 IonicContact OE2-NH1 3.46Å; E450-R529 PolarHBondContact OE2-NH1 3.22Å; E450-R529 IonicContact OE2-NH2 2.81Å; S453-R529 PolarHBondContact OG-NE 2.99Å; M457-R529 HydrophobicContact CE-CB 3.84Å; M457-R529 HydrophobicContact CG-CB 4.15Å; M457-R529 HydrophobicContact SD-CB 4.15Å; K525-R529 VanDerWaalsContact O-CG 3.27Å; K525-R529 WeakPolarHBondContact O-CG 3.27Å; K525-R529 PolarHBondContact O-N 3.49Å; V526-R529 PolarHBondContact O-N 3.3Å; R529-L532 PolarHBondContact O-N 2.75Å; R529-L533 PolarHBondContact O-N 3.26Å
530	L	98.4	Very high	96.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-41.6	177.2	-68.9	170	0	0	0	112.5	L433 F441 M457 I461 L472 M476 V526 V527 E528 L532 L533 W538	L433-L530 HydrophobicContact CD1-CD1 4.21Å; L433-L530 HydrophobicContact CD2-CD1 4.45Å; F441-L530 HydrophobicContact CE1-CD2 4.22Å; M457-L530 HydrophobicContact CE-CD2 3.38Å; M457-L530 HydrophobicContact CE-CG 3.53Å; I461-L530 HydrophobicContact CD1-CD2 3.83Å; I461-L530 HydrophobicContact CG1-CD2 4.1Å; L472-L530 HydrophobicContact CD1-CD1 4.33Å; L472-L530 HydrophobicContact CD2-CD2 4.36Å; M476-L530 HydrophobicContact CG-CB 4.47Å; M476-L530 HydrophobicContact SD-CB 3.64Å; V526-L530 HydrophobicContact CG1-CD1 4.11Å; V526-L530 VanDerWaalsContact O-CG 3.31Å; V526-L530 WeakPolarHBondContact O-CG 3.22Å; V526-L530 PolarHBondContact O-N 2.9Å; V527-L530 PolarHBondContact O-N 3.36Å; E528-L530 VanDerWaalsContact C-N 3.35Å; E528-L530 PolarHBondContact O-N 3.29Å; L530-L532 VanDerWaalsContact C-N 3.32Å; L530-L533 PolarHBondContact O-N 3.18Å; L530-W538 HydrophobicContact CB-CZ2 4.35Å; L530-W538 HydrophobicContact CD2-CH2 3.99Å; L530-W538 HydrophobicContact CD2-CZ2 4.02Å; L530-W538 PolarHBondContact O-NE1 2.82Å
531	L	98.3	Very high	96	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-74.2	-20.3	179.5	-72.7	173	0	0	0	113.5	M476 L479 Q480 I492 L495 V527 E528	M476-L531 HydrophobicContact CE-CD2 4.44Å; M476-L531 HydrophobicContact SD-CD2 3.68Å; M476-L531 HydrophobicContact SD-CG 4Å; L479-L531 HydrophobicContact CB-CD2 3.53Å; L479-L531 HydrophobicContact CD1-CD2 4.35Å; Q480-L531 HydrophobicContact CG-CD2 4.08Å; Q480-L531 PolarHBondContact NE2-O 3.07Å; I492-L531 HydrophobicContact CG1-CB 4.36Å; I492-L531 HydrophobicContact CG2-CB 3.75Å; I492-L531 HydrophobicContact CG2-CD1 3.95Å; L495-L531 HydrophobicContact CB-CD1 4.2Å; V527-L531 HydrophobicContact CG1-CD1 3.93Å; V527-L531 HydrophobicContact CG1-CG 4.27Å; V527-L531 WeakPolarHBondContact O-CB 3.39Å; V527-L531 VanDerWaalsContact O-CG 3.32Å; V527-L531 WeakPolarHBondContact O-CG 3.39Å; V527-L531 PolarHBondContact O-N 3.05Å; E528-L531 PolarHBondContact O-N 3.35Å
532	L	97.7	Very high	95.8	Very high	108 Å²	108	43.1 Å²	43.1	57%	0.565	21%	0.213	S	C	*	.	H	α-helix	trans	-83.6	-12.7	174.6	-71.9	170.3	0	0	0	113.3	I492 E528 R529 L530	I492-L532 HydrophobicContact CD1-CD2 3.84Å; I492-L532 HydrophobicContact CD1-CG 4.47Å; E528-L532 WeakPolarHBondContact O-CB 3.45Å; E528-L532 VanDerWaalsContact O-CG 3.26Å; E528-L532 WeakPolarHBondContact O-CG 3.32Å; E528-L532 PolarHBondContact O-N 3.17Å; R529-L532 PolarHBondContact O-N 2.75Å; L530-L532 VanDerWaalsContact C-N 3.32Å
533	L	97.6	Very high	94.6	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.026	23%	0.231	C	C	.	.	S	Bend	trans	-65.2	145.1	173.6	-64	-177.7	0	0	0	111	V454 Y458 I461 Q480 R529 L530 Y537 W538	V454-L533 HydrophobicContact CG1-CD2 4.04Å; Y458-L533 HydrophobicContact CD1-CD1 4.29Å; Y458-L533 HydrophobicContact CE1-CD1 3.99Å; Y458-L533 HydrophobicContact CE1-CD2 3.96Å; Y458-L533 HydrophobicContact CE1-CG 4.47Å; Y458-L533 HydrophobicContact CE2-CD2 4.48Å; I461-L533 HydrophobicContact CD1-CD1 3.43Å; I461-L533 VanDerWaalsContact CD1-CD1 3.43Å; Q480-L533 PolarHBondContact NE2-O 2.95Å; R529-L533 PolarHBondContact O-N 3.26Å; L530-L533 PolarHBondContact O-N 3.18Å; L533-Y537 HydrophobicContact CD1-CD1 4.33Å; L533-Y537 HydrophobicContact CD1-CE1 4.28Å; L533-W538 HydrophobicContact CB-CZ2 4.46Å; L533-W538 HydrophobicContact CD1-CH2 4.46Å; L533-W538 HydrophobicContact CD1-CZ2 3.81Å
534	P	97.1	Very high	92.6	Very high	61 Å²	61	50.7 Å²	50.7	40%	0.396	26%	0.259	S	S	.	.			trans	-56.8	141.7	-178	-24.3	34	0	0	0	113.2	Y458 E536 Y537 W538	Y458-P534 WeakPolarHBondContact OH-CD 3.44Å; P534-E536 VanDerWaalsContact CB-OE2 3.25Å; P534-E536 WeakPolarHBondContact CB-OE2 3.29Å; P534-E536 PolarHBondContact O-N 2.91Å; P534-Y537 WeakPolarHBondContact O-CB 3.44Å; P534-Y537 PolarHBondContact O-N 2.99Å; P534-Y537 VanDerWaalsContact O-N 3.12Å; P534-W538 PolarHBondContact O-N 3.36Å
535	V	94.2	Very high	90	Very high	48 Å²	48	57.5 Å²	57.5	29%	0.291	29%	0.289	S	S	.	.	H	α-helix	trans	-59.1	-33	177.3	173.1	0	0	0	0	110.6	Y537 W538 S539	V535-Y537 VanDerWaalsContact C-N 3.33Å; V535-Y537 PolarHBondContact O-N 3.31Å; V535-W538 PolarHBondContact O-N 3.45Å; V535-S539 WeakPolarHBondContact O-CB 3.34Å; V535-S539 PolarHBondContact O-N 3.24Å; V535-S539 PolarHBondContact O-OG 2.91Å
536	E	94.3	Very high	87.3	Confident	140 Å²	140	62.1 Å²	62.1	65%	0.654	31%	0.312	S	S	*	.	H	α-helix	trans	-62	-41	179.1	-60.9	72.5	-158	0	0	111.2	P534 W538 S539 Q540	P534-E536 VanDerWaalsContact CB-OE2 3.25Å; P534-E536 WeakPolarHBondContact CB-OE2 3.29Å; P534-E536 PolarHBondContact O-N 2.91Å; E536-W538 VanDerWaalsContact C-N 3.34Å; E536-W538 PolarHBondContact O-N 3.3Å; E536-S539 PolarHBondContact O-N 3.4Å; E536-Q540 PolarHBondContact O-N 3.31Å
537	Y	95.5	Very high	84.5	Confident	37 Å²	37	69.6 Å²	69.6	15%	0.145	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-42.1	175.9	172.9	-97.4	0	0	0	111.3	Y458 I461 L533 P534 V535 Q540 F541	Y458-Y537 HydrophobicContact CD1-CD1 4.28Å; Y458-Y537 AromaticContact CD1-CD2 3.87Å; Y458-Y537 HydrophobicContact CD1-CD2 3.87Å; Y458-Y537 AromaticContact CD1-CE1 3.84Å; Y458-Y537 HydrophobicContact CD1-CE1 3.84Å; Y458-Y537 AromaticContact CD1-CE2 3.37Å; Y458-Y537 HydrophobicContact CD1-CE2 3.37Å; Y458-Y537 HydrophobicContact CD1-CG 4.29Å; Y458-Y537 AromaticContact CD1-CZ 3.35Å; Y458-Y537 AromaticContact CE1-CD1 3.71Å; Y458-Y537 HydrophobicContact CE1-CD1 3.71Å; Y458-Y537 AromaticContact CE1-CD2 3.35Å; Y458-Y537 HydrophobicContact CE1-CD2 3.35Å; Y458-Y537 AromaticContact CE1-CE1 3.75Å; Y458-Y537 HydrophobicContact CE1-CE1 3.75Å; Y458-Y537 AromaticContact CE1-CE2 3.39Å; Y458-Y537 HydrophobicContact CE1-CE2 3.39Å; Y458-Y537 AromaticContact CE1-CG 3.51Å; Y458-Y537 HydrophobicContact CE1-CG 3.51Å; Y458-Y537 AromaticContact CE1-CZ 3.6Å; Y458-Y537 HydrophobicContact CG-CE2 4.47Å; I461-Y537 HydrophobicContact CD1-CE1 4.02Å; I461-Y537 HydrophobicContact CG2-CE1 4.24Å; I461-Y537 VanDerWaalsContact CG2-OH 3.3Å; I461-Y537 WeakPolarHBondContact CG2-OH 3.44Å; L533-Y537 HydrophobicContact CD1-CD1 4.33Å; L533-Y537 HydrophobicContact CD1-CE1 4.28Å; P534-Y537 WeakPolarHBondContact O-CB 3.44Å; P534-Y537 PolarHBondContact O-N 2.99Å; P534-Y537 VanDerWaalsContact O-N 3.12Å; V535-Y537 VanDerWaalsContact C-N 3.33Å; V535-Y537 PolarHBondContact O-N 3.31Å; Y537-Q540 VanDerWaalsContact CD2-NE2 3.27Å; Y537-Q540 WeakPolarHBondContact O-CG 3.29Å; Y537-Q540 PolarHBondContact O-NE2 2.97Å; Y537-Q540 VanDerWaalsContact O-NE2 3.13Å; Y537-F541 HydrophobicContact CD1-CE2 4.27Å; Y537-F541 AromaticContact CE1-CE2 3.75Å; Y537-F541 HydrophobicContact CE1-CE2 3.75Å; Y537-F541 HydrophobicContact CE1-CZ 4.31Å; Y537-F541 HydrophobicContact CE2-CE2 4.37Å; Y537-F541 HydrophobicContact CE2-CZ 4.3Å; Y537-F541 AromaticContact CZ-CE2 3.8Å; Y537-F541 AromaticContact CZ-CZ 3.89Å; Y537-F541 WeakPolarHBondContact O-CE2 3.48Å
538	W	95.9	Very high	81.4	Confident	0 Å²	0	77 Å²	77	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-71	-35.3	176.9	-65.3	120.8	0	0	0	112.4	I461 L472 A473 M476 I477 L530 L533 P534 V535 E536 Q540 F541	I461-W538 HydrophobicContact CD1-CH2 3.56Å; I461-W538 HydrophobicContact CD1-CZ2 4.1Å; I461-W538 HydrophobicContact CD1-CZ3 4.3Å; I461-W538 HydrophobicContact CG1-CH2 4.12Å; I461-W538 HydrophobicContact CG2-CH2 4.32Å; I461-W538 HydrophobicContact CG2-CZ3 4.08Å; L472-W538 HydrophobicContact CD2-CH2 3.88Å; L472-W538 HydrophobicContact CD2-CZ3 4.21Å; L472-W538 HydrophobicContact CG-CH2 4.06Å; L472-W538 HydrophobicContact CG-CZ3 4.22Å; A473-W538 VanDerWaalsContact CA-CE3 3.42Å; A473-W538 HydrophobicContact CB-CB 4.43Å; A473-W538 HydrophobicContact CB-CD2 4.42Å; A473-W538 HydrophobicContact CB-CE3 3.54Å; A473-W538 HydrophobicContact CB-CZ3 4.17Å; M476-W538 HydrophobicContact CB-CD2 3.93Å; M476-W538 HydrophobicContact CB-CG 4.07Å; M476-W538 HydrophobicContact CB-CZ2 4.09Å; M476-W538 HydrophobicContact CG-CD2 4.27Å; M476-W538 HydrophobicContact CG-CH2 4.06Å; M476-W538 HydrophobicContact CG-CZ2 3.6Å; I477-W538 HydrophobicContact CD1-CB 3.87Å; I477-W538 HydrophobicContact CG1-CB 3.58Å; I477-W538 HydrophobicContact CG1-CG 4.48Å; L530-W538 HydrophobicContact CB-CZ2 4.35Å; L530-W538 HydrophobicContact CD2-CH2 3.99Å; L530-W538 HydrophobicContact CD2-CZ2 4.02Å; L530-W538 PolarHBondContact O-NE1 2.82Å; L533-W538 HydrophobicContact CB-CZ2 4.46Å; L533-W538 HydrophobicContact CD1-CH2 4.46Å; L533-W538 HydrophobicContact CD1-CZ2 3.81Å; P534-W538 PolarHBondContact O-N 3.36Å; V535-W538 PolarHBondContact O-N 3.45Å; E536-W538 VanDerWaalsContact C-N 3.34Å; E536-W538 PolarHBondContact O-N 3.3Å; W538-Q540 VanDerWaalsContact C-N 3.26Å; W538-Q540 PolarHBondContact O-N 2.95Å; W538-F541 HydrophobicContact CE3-CD2 4.22Å; W538-F541 HydrophobicContact CE3-CE2 4.21Å; W538-F541 PolarHBondContact O-N 3.29Å
539	S	92.4	Very high	78.3	Confident	42 Å²	42	82 Å²	82	29%	0.294	41%	0.414	S	S	.	.	H	α-helix	trans	-65.6	-28.5	-176.9	-61.4	0	0	0	0	112.8	V535 E536 F541 M542	V535-S539 WeakPolarHBondContact O-CB 3.34Å; V535-S539 PolarHBondContact O-N 3.24Å; V535-S539 PolarHBondContact O-OG 2.91Å; E536-S539 PolarHBondContact O-N 3.4Å; S539-F541 PolarHBondContact O-N 3.47Å; S539-M542 WeakPolarHBondContact O-CB 3.44Å; S539-M542 PolarHBondContact O-N 2.92Å
540	Q	91.3	Very high	75	Confident	97 Å²	97	85.5 Å²	85.5	45%	0.453	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-27.7	177.5	84.2	-160.3	-10	0	0	113	E536 Y537 W538 M542	E536-Q540 PolarHBondContact O-N 3.31Å; Y537-Q540 VanDerWaalsContact CD2-NE2 3.27Å; Y537-Q540 WeakPolarHBondContact O-CG 3.29Å; Y537-Q540 PolarHBondContact O-NE2 2.97Å; Y537-Q540 VanDerWaalsContact O-NE2 3.13Å; W538-Q540 VanDerWaalsContact C-N 3.26Å; W538-Q540 PolarHBondContact O-N 2.95Å; Q540-M542 VanDerWaalsContact C-N 3.34Å
541	F	89.4	Confident	72	Confident	37 Å²	37	91.4 Å²	91.4	16%	0.162	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-12.4	178	-55.5	-63.3	0	0	0	113.2	R469 A473 Y537 W538 S539	R469-F541 HydrophobicContact CG-CD1 4.49Å; R469-F541 HydrophobicContact CG-CE1 4.34Å; R469-F541 HydrophobicContact CG-CE2 4.5Å; R469-F541 HydrophobicContact CG-CZ 4.33Å; A473-F541 HydrophobicContact CB-CB 3.97Å; A473-F541 HydrophobicContact CB-CD2 3.81Å; A473-F541 HydrophobicContact CB-CG 4.3Å; Y537-F541 HydrophobicContact CD1-CE2 4.27Å; Y537-F541 AromaticContact CE1-CE2 3.75Å; Y537-F541 HydrophobicContact CE1-CE2 3.75Å; Y537-F541 HydrophobicContact CE1-CZ 4.31Å; Y537-F541 HydrophobicContact CE2-CE2 4.37Å; Y537-F541 HydrophobicContact CE2-CZ 4.3Å; Y537-F541 AromaticContact CZ-CE2 3.8Å; Y537-F541 AromaticContact CZ-CZ 3.89Å; Y537-F541 WeakPolarHBondContact O-CE2 3.48Å; W538-F541 HydrophobicContact CE3-CD2 4.22Å; W538-F541 HydrophobicContact CE3-CE2 4.21Å; W538-F541 PolarHBondContact O-N 3.29Å; S539-F541 PolarHBondContact O-N 3.47Å
542	M	86.5	Confident	69	Low	45 Å²	45	95.7 Å²	95.7	22%	0.222	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-13.5	179.2	-57.8	-63.8	97.5	0	0	112.6	I361 D470 A473 F474 I477 S539 Q540	I361-M542 HydrophobicContact CD1-CE 4.12Å; I361-M542 HydrophobicContact CD1-SD 3.98Å; D470-M542 WeakPolarHBondContact O-CE 3.44Å; A473-M542 HydrophobicContact CB-CE 3.74Å; F474-M542 HydrophobicContact CB-CE 4.2Å; F474-M542 HydrophobicContact CB-SD 3.85Å; F474-M542 HydrophobicContact CD2-SD 3.8Å; F474-M542 HydrophobicContact CG-SD 4.32Å; I477-M542 HydrophobicContact CD1-CG 3.69Å; I477-M542 HydrophobicContact CD1-SD 4.49Å; S539-M542 WeakPolarHBondContact O-CB 3.44Å; S539-M542 PolarHBondContact O-N 2.92Å; Q540-M542 VanDerWaalsContact C-N 3.34Å
543	I	71.6	Confident	65.9	Low	117 Å²	117	98.8 Å²	98.8	60%	0.6	51%	0.512	S	S	*	.			trans	-81.6	119.4	-179.9	-59.6	169.3	0	0	0	108	E545	I543-E545 PolarHBondContact O-N 3.04Å; I543-E545 VanDerWaalsContact O-N 3.16Å
544	V	54.7	Low	62.7	Low	98 Å²	98	106.4 Å²	106.4	59%	0.594	55%	0.551	S	S	*	*			trans	-76.1	100.2	166.7	-166.8	0	0	0	0	105.7	Q546	V544-Q546 PolarHBondContact O-N 3.18Å
545	E	43.3	Very low	59.7	Low	163 Å²	163	110 Å²	110	76%	0.762	57%	0.565	S	S	*	*			trans	-55.9	112.9	166.8	-75.4	179.6	168.8	0	0	107.8	I543 E547	I543-E545 PolarHBondContact O-N 3.04Å; I543-E545 VanDerWaalsContact O-N 3.16Å; E545-E547 PolarHBondContact O-N 3.02Å; E545-E547 VanDerWaalsContact O-N 3.14Å
546	Q	42.8	Very low	56.8	Low	196 Å²	196	115.8 Å²	115.8	92%	0.916	59%	0.589	S	S	*	*			trans	-84.8	54.2	169.4	-141.9	176.7	22.2	0	0	107.9	V544	V544-Q546 PolarHBondContact O-N 3.18Å
547	E	37.9	Very low	53.8	Low	158 Å²	158	116.5 Å²	116.5	74%	0.738	60%	0.598	S	S	*	*			trans	-133.1	97.6	178.6	-70	-162.1	176.2	0	0	110.5	E545	E545-E547 PolarHBondContact O-N 3.02Å; E545-E547 VanDerWaalsContact O-N 3.14Å
548	N	33.3	Very low	50.8	Low	155 Å²	155	120.4 Å²	120.4	83%	0.829	63%	0.626	S	S	*	*			trans	-167.3	73.5	135.8	-90.8	-40.4	0	0	0	107.9
549	I	34.5	Very low	47.7	Very low	166 Å²	166	128.1 Å²	128.1	85%	0.851	67%	0.667	S	S	*	*			trans	-100.7	100.3	146.4	-60.5	174.2	0	0	0	104.2	P551	I549-P551 WeakPolarHBondContact O-CD 3.38Å
550	D	28.7	Very low	44.7	Very low	119 Å²	119	129.6 Å²	129.6	64%	0.636	68%	0.682	S	S	*	*			trans	-50.1	125.1	170.1	-94	-46.5	0	0	0	110.5	T552	D550-T552 PolarHBondContact O-N 3.33Å; D550-T552 VanDerWaalsContact O-N 3.12Å
551	P	35.8	Very low	41.9	Very low	124 Å²	124	135.5 Å²	135.5	81%	0.805	70%	0.701	S	S	*	*	S	Bend	trans	-86.7	50.5	171.4	34.8	-31.7	0	0	0	110.7	I549	I549-P551 WeakPolarHBondContact O-CD 3.38Å
552	T	33.8	Very low	39	Very low	94 Å²	94	138.5 Å²	138.5	58%	0.577	73%	0.727	S	S	*	*			trans	-134.1	46.8	-180	53.6	0	0	0	0	113.6	D550	D550-T552 PolarHBondContact O-N 3.33Å; D550-T552 VanDerWaalsContact O-N 3.12Å
553	H	33.3	Very low	36.1	Very low	173 Å²	173	142.1 Å²	142.1	80%	0.801	75%	0.751	S	S	*	*			trans	-142.5	78.4	156.2	-82.5	-73.3	0	0	0	110.4	I555	H553-I555 VanDerWaalsContact C-N 3.31Å; H553-I555 PolarHBondContact O-N 2.92Å; H553-I555 VanDerWaalsContact O-N 3.11Å
554	I	31.1	Very low	34.8	Very low	164 Å²	164	141.6 Å²	141.6	84%	0.841	76%	0.756	S	S	*	*			trans	-69.9	97.8	154.7	-62.6	175.6	0	0	0	105.5
555	I	34.1	Very low	33.7	Very low	136 Å²	136	145 Å²	145	70%	0.697	77%	0.765	S	S	*	*			trans	-86.5	108.3	160.4	-64.6	176.4	0	0	0	105.7	H553 N557	H553-I555 VanDerWaalsContact C-N 3.31Å; H553-I555 PolarHBondContact O-N 2.92Å; H553-I555 VanDerWaalsContact O-N 3.11Å; I555-N557 PolarHBondContact O-N 2.94Å
556	E	33.4	Very low	33.3	Very low	171 Å²	171	143.1 Å²	143.1	80%	0.799	77%	0.765	S	S	*	*			trans	-52	127.4	163.1	-69.9	177.4	147.9	0	0	109.3
557	N	30.2	Very low	33.3	Very low	155 Å²	155	139 Å²	139	83%	0.829	76%	0.755	S	S	*	*			trans	-139.6	107.7	154.7	-102.9	-6.5	0	0	0	109.3	I555	I555-N557 PolarHBondContact O-N 2.94Å
558	T	32.8	Very low	32.9	Very low	119 Å²	119	138.1 Å²	138.1	73%	0.73	76%	0.756	S	S	*	*			trans	-62.9	153.3	164.6	12.7	0	0	0	0	111.3
559	N	31.1	Very low	32.8	Very low	162 Å²	162	137 Å²	137	87%	0.866	75%	0.754	S	S	*	*			trans	111.5	133.8	170.2	-56.9	-29.3	0	0	0	113
560	A	28.3	Very low	32.7	Very low	73 Å²	73	137.4 Å²	137.4	60%	0.603	75%	0.75	S	S	*	*			cis	-174	163.3	-20.3	0	0	0	0	0	106.2
561	Y	32.7	Very low	33	Very low	220 Å²	220	137.6 Å²	137.6	86%	0.863	76%	0.755	S	S	*	*			trans	96.7	83.6	163.5	-56.8	-76	0	0	0	120.1
562	S	28.2	Very low	33	Very low	100 Å²	100	136.8 Å²	136.8	70%	0.699	75%	0.752	S	S	*	*				52.1	105.7	109.7	-53.2	0	0	0	0	123.8
563	T	26.2	Very low	33.3	Very low	121 Å²	121	139.9 Å²	139.9	74%	0.742	76%	0.763	S	S	*	*				62.5	163.5	128.3	32.9	0	0	0	0	122.9
564	P	43.8	Very low	33.3	Very low	107 Å²	107	139.2 Å²	139.2	70%	0.695	77%	0.765	S	S	*	*			cis	-131.7	147.3	8.6	28.3	-4.6	0	0	0	117.6
565	Q	31.3	Very low	33.6	Very low	168 Å²	168	134.6 Å²	134.6	79%	0.785	76%	0.757	S	S	*	*				58.7	131.1	108.9	-53.8	-175.3	-6.1	0	0	116.8
566	T	35.4	Very low	34	Very low	125 Å²	125	133.4 Å²	133.4	77%	0.767	76%	0.759	S	S	*	*				-171.6	-172.6	52.6	49.1	0	0	0	0	109.9
567	P	43.1	Very low	33.7	Very low	108 Å²	108	132.4 Å²	132.4	70%	0.701	76%	0.758	S	S	*	*				-131.5	167.5	-62	38.8	-21.8	0	0	0	114.9
568	D	29	Very low	33.9	Very low	141 Å²	141	131.5 Å²	131.5	75%	0.754	76%	0.758	S	S	*	*			trans	49.7	129.7	149.7	-99	-32.1	0	0	0	120.2
569	V	32.3	Very low	33.9	Very low	131 Å²	131	132 Å²	132	79%	0.794	76%	0.761	S	S	*	*				-165	146.6	67.7	168.1	0	0	0	0	111.1
570	K	32.8	Very low	34.5	Very low	175 Å²	175	129.6 Å²	129.6	76%	0.761	75%	0.754	S	S	*	*			trans	-41	153	168.9	-59	162.4	178.1	172.4	0	113.9
571	V	34.7	Very low	34.4	Very low	123 Å²	123	134.4 Å²	134.4	75%	0.745	76%	0.764	S	S	*	*				-167.7	131.7	60.7	172.6	0	0	0	0	108.4	I573	V571-I573 HydrophobicContact CG1-CG1 4.22Å
572	S	35.8	Very low	34.4	Very low	106 Å²	106	131.3 Å²	131.3	74%	0.741	76%	0.758	S	S	*	*			trans	-102.1	125	156.5	-175.5	0	0	0	0	107.3	L574	S572-L574 VanDerWaalsContact C-N 3.34Å; S572-L574 PolarHBondContact O-N 2.93Å; S572-L574 VanDerWaalsContact O-N 3.12Å
573	I	40.2	Very low	34.5	Very low	159 Å²	159	133.6 Å²	133.6	82%	0.815	76%	0.758	S	S	*	*			trans	-77.1	95.5	167.4	-69.6	175.6	0	0	0	105.9	V571	V571-I573 HydrophobicContact CG1-CG1 4.22Å
574	L	33.4	Very low	34.6	Very low	160 Å²	160	134.9 Å²	134.9	84%	0.838	76%	0.759	S	S	*	*			trans	-30.3	144.5	167.6	-64.9	155.7	0	0	0	112.4	S572	S572-L574 VanDerWaalsContact C-N 3.34Å; S572-L574 PolarHBondContact O-N 2.93Å; S572-L574 VanDerWaalsContact O-N 3.12Å
575	G	36.3	Very low	33.8	Very low	66 Å²	66	134.5 Å²	134.5	68%	0.68	76%	0.759	S	S	*	*			cis	155.7	-171.2	24.7	0	0	0	0	0	109.7
576	P	43.6	Very low	33.6	Very low	111 Å²	111	135.5 Å²	135.5	72%	0.721	76%	0.761	S	S	*	*			trans	-119.6	177.8	-144.4	44.4	-34.9	0	0	0	115.5
577	L	27.4	Very low	33.4	Very low	150 Å²	150	135.5 Å²	135.5	79%	0.785	76%	0.761	S	S	*	*			trans	72.7	126.9	154.9	-63.8	161.8	0	0	0	119.9
578	T	32.9	Very low	33.3	Very low	137 Å²	137	135.4 Å²	135.4	84%	0.84	76%	0.76	S	S	*	*				153.6	136.9	108.8	48.5	0	0	0	0	113.5
579	T	34.1	Very low	33.2	Very low	129 Å²	129	133.6 Å²	133.6	79%	0.791	76%	0.759	S	S	*	*			trans	-72.7	165.7	167.6	50.1	0	0	0	0	111.3
580	P	42.6	Very low	33.2	Very low	111 Å²	111	132 Å²	132	72%	0.721	75%	0.753	S	S	*	*				-157.9	156.1	65.2	38.2	-13.8	0	0	0	120
581	E	26.8	Very low	33	Very low	174 Å²	174	128.7 Å²	128.7	81%	0.813	75%	0.752	S	S	*	*				47.4	147.2	124.7	-137.9	172.6	-166.6	0	0	124.8
582	Q	33.3	Very low	32.9	Very low	156 Å²	156	127.6 Å²	127.6	73%	0.729	75%	0.75	S	S	*	*			trans	91.8	142.2	162.6	-55.5	-170.8	-11.8	0	0	118.2
583	Q	29.9	Very low	32.7	Very low	148 Å²	148	130.5 Å²	130.5	69%	0.692	76%	0.756	S	S	*	*			cis	-170.2	145.8	-13.2	-108.2	-172.6	-17.1	0	0	106.9
584	L	27.2	Very low	32.3	Very low	147 Å²	147	127.2 Å²	127.2	77%	0.77	75%	0.748	S	S	*	*			trans	37.7	124.7	142.9	-71.5	139.7	0	0	0	120.4
585	S	27.8	Very low	32.3	Very low	99 Å²	99	128.2 Å²	128.2	69%	0.692	75%	0.748	S	S	*	*				169.6	133	95.9	48.7	0	0	0	0	116.2
586	K	28.1	Very low	32.2	Very low	190 Å²	190	134.9 Å²	134.9	83%	0.826	76%	0.758	S	S	*	*			trans	72.9	101.4	136.4	-64.9	168.7	-174.2	178.9	0	120.8
587	T	30.1	Very low	31.6	Very low	125 Å²	125	136.4 Å²	136.4	77%	0.767	77%	0.765	S	S	*	*				8.3	165.1	114	64.6	0	0	0	0	119.3
588	P	41.8	Very low	31.9	Very low	106 Å²	106	138.9 Å²	138.9	69%	0.688	77%	0.769	S	S	*	*			cis	-144.7	-178.3	14.2	29.5	-3.6	0	0	0	116.7
589	S	27.2	Very low	31.8	Very low	103 Å²	103	137 Å²	137	72%	0.72	76%	0.762	S	S	*	*			trans	64.2	144.3	141.8	39.8	0	0	0	0	120.5
590	S	30.9	Very low	31.6	Very low	96 Å²	96	136.2 Å²	136.2	67%	0.671	76%	0.757	S	S	*	*			cis	177.7	146.3	-18.8	47.5	0	0	0	0	105
591	S	29.1	Very low	31.1	Very low	106 Å²	106	140.3 Å²	140.3	74%	0.741	76%	0.764	S	S	*	*			trans	61.6	151.5	152.9	66.4	0	0	0	0	119.2
592	S	32.7	Very low	31.3	Very low	101 Å²	101	136.9 Å²	136.9	71%	0.706	76%	0.759	S	S	*	*			cis	177.6	163.6	-16.7	-89.3	0	0	0	0	104.8
593	L	32.3	Very low	31.2	Very low	166 Å²	166	138.6 Å²	138.6	87%	0.869	76%	0.764	S	S	*	*			trans	81.1	147.4	168.2	-58	146.8	0	0	0	116.1
594	S	31.8	Very low	31.4	Very low	91 Å²	91	138.6 Å²	138.6	64%	0.636	77%	0.774	S	S	*	*			cis	178.5	155.7	-22.3	-98.2	0	0	0	0	106.5
595	Q	31.7	Very low	31.9	Very low	181 Å²	181	137.5 Å²	137.5	85%	0.846	77%	0.774	S	S	*	*			trans	79.2	111.9	150.9	-75.3	175.8	-18.9	0	0	122.2
596	K	34.1	Very low	32.8	Very low	205 Å²	205	138.3 Å²	138.3	89%	0.891	78%	0.777	S	S	*	*				25.8	121.9	127.3	-87	179.6	171.8	176.1	0	119.2
597	V	32	Very low	33.1	Very low	143 Å²	143	138.1 Å²	138.1	87%	0.867	78%	0.776	S	S	*	*			trans	-143	133.4	140.3	-175.8	0	0	0	0	110
598	K	32.8	Very low	33.1	Very low	202 Å²	202	142.2 Å²	142.2	88%	0.878	78%	0.784	S	S	*	*			trans	-102.7	140	165.1	-85.8	179.6	171.3	-178.8	0	108.3
599	S	31.4	Very low	32.5	Very low	97 Å²	97	140.3 Å²	140.3	68%	0.678	78%	0.784	S	S	*	*			trans	160.4	106.1	144.5	58.2	0	0	0	0	110.2
600	T	30	Very low	32.8	Very low	114 Å²	114	141.3 Å²	141.3	70%	0.699	79%	0.79	S	S	*	*				83.5	138.4	91.8	56.7	0	0	0	0	118
601	F	31.5	Very low	33	Very low	196 Å²	196	146.2 Å²	146.2	86%	0.86	80%	0.8	S	S	*	*			trans	82.6	136	161.5	-61	-69.3	0	0	0	117.4
602	S	31.1	Very low	33.2	Very low	102 Å²	102	147 Å²	147	71%	0.713	81%	0.805	S	S	*	*			cis	-165.7	148.9	20.9	50	0	0	0	0	114.8
603	K	32.4	Very low	33.5	Very low	192 Å²	192	151.5 Å²	151.5	84%	0.835	81%	0.812	S	S	*	*			trans	45	121.8	136.6	-65.9	176.3	177.2	175.7	0	122.9
604	T	34.3	Very low	33.5	Very low	148 Å²	148	150 Å²	150	91%	0.908	82%	0.815	S	S	*	*				-154.4	126.7	113	40.8	0	0	0	0	112
605	T	37.2	Very low	33.6	Very low	124 Å²	124	149.8 Å²	149.8	76%	0.761	82%	0.819	S	S	*	*			trans	-92	176	168.3	25.7	0	0	0	0	110.7
606	P	45.7	Very low	33.7	Very low	116 Å²	116	147.3 Å²	147.3	75%	0.753	82%	0.817	S	S	*	*			cis	-136.7	149.8	28.9	22.5	4.7	0	0	0	117
607	K	34.1	Very low	33.5	Very low	187 Å²	187	145.6 Å²	145.6	81%	0.813	81%	0.812	S	S	*	*				58.1	120.5	90	-80.7	-173.9	177.3	177.7	0	117
608	F	31	Very low	33.6	Very low	210 Å²	210	146.3 Å²	146.3	92%	0.921	81%	0.81	S	S	*	*				-162.3	138.3	107.3	-114	-84.2	0	0	0	110.8
609	G	29.5	Very low	33.5	Very low	67 Å²	67	140 Å²	140	69%	0.691	80%	0.803	S	S	*	*			trans	-134.9	152.4	167.8	0	0	0	0	0	109
610	S	33	Very low	33.6	Very low	123 Å²	123	146.3 Å²	146.3	86%	0.86	81%	0.811	S	S	*	*			trans	-149.1	135.3	167.3	44.4	0	0	0	0	111.2
611	K	35.6	Very low	34	Very low	200 Å²	200	148.6 Å²	148.6	87%	0.87	81%	0.814	S	S	*	*			trans	-65.3	158.7	176.8	-58.1	170	176.8	177.9	0	109.7
612	S	33.4	Very low	34.2	Very low	121 Å²	121	143.1 Å²	143.1	85%	0.846	81%	0.813	S	S	*	*				178.3	160.2	78.4	50.5	0	0	0	0	112.4
613	K	38.5	Very low	34.5	Very low	196 Å²	196	145 Å²	145	85%	0.852	82%	0.815	S	S	*	*			trans	-71.5	153.2	169.4	-67.9	173.7	171.8	179.3	0	111.9
614	S	32.8	Very low	34.6	Very low	134 Å²	134	143.9 Å²	143.9	94%	0.937	81%	0.81	S	S	*	*			trans	-173	155.9	136.9	-79.5	0	0	0	0	112.1
615	A	32.8	Very low	34.7	Very low	88 Å²	88	146.6 Å²	146.6	73%	0.727	81%	0.81	S	S	*	*			trans	-113.4	159.7	-167.7	0	0	0	0	0	113.2
616	T	33.9	Very low	34.7	Very low	129 Å²	129	145 Å²	145	79%	0.791	81%	0.809	S	S	*	*			trans	64.9	118	148.8	3.4	0	0	0	0	122
617	Q	31.1	Very low	34.4	Very low	168 Å²	168	145 Å²	145	79%	0.785	81%	0.812	S	S	*	*				149.5	136.5	109.6	-90.7	-166	-4.7	0	0	116.2
618	L	33	Very low	35.5	Very low	159 Å²	159	142.2 Å²	142.2	83%	0.832	81%	0.813	S	S	*	*			trans	58.3	124.9	146.4	-85.7	92	0	0	0	124.4
619	G	30.6	Very low	36.2	Very low	70 Å²	70	140.7 Å²	140.7	72%	0.722	81%	0.811	S	S	*	*				133.5	113.1	111.8	0	0	0	0	0	121
620	R	33.8	Very low	36.8	Very low	228 Å²	228	144.9 Å²	144.9	86%	0.86	82%	0.817	S	S	*	*			trans	67.6	152	147.9	-81.9	-171.7	179.9	-155.4	1	119.8
621	Q	39.7	Very low	37.3	Very low	163 Å²	163	152.2 Å²	152.2	76%	0.762	83%	0.833	S	S	*	*			cis	-174.5	144.5	-17.8	-134.4	177.2	-3.5	0	0	104.9
622	G	34.5	Very low	37.4	Very low	80 Å²	80	149.8 Å²	149.8	83%	0.825	83%	0.831	S	S	*	*			trans	-179.5	106.2	176	0	0	0	0	0	115.3
623	N	38.7	Very low	37.6	Very low	142 Å²	142	151.3 Å²	151.3	76%	0.759	83%	0.83	S	S	*	*			trans	-70	155.9	-169.4	-91.5	-7.4	0	0	0	120.2
624	F	33.5	Very low	37.5	Very low	168 Å²	168	148.8 Å²	148.8	74%	0.737	83%	0.829	S	S	*	*			trans	83.8	119.1	138.6	-89.6	-118.9	0	0	0	122.6
625	F	36.1	Very low	37.8	Very low	205 Å²	205	149.7 Å²	149.7	90%	0.899	82%	0.823	S	S	*	*				-167.8	145.4	99.8	-114.5	-87.4	0	0	0	111.9
626	A	38.2	Very low	38.1	Very low	91 Å²	91	153.6 Å²	153.6	75%	0.752	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-102.2	154.9	-166.4	0	0	0	0	0	114.4
627	S	37.9	Very low	38.4	Very low	115 Å²	115	155.2 Å²	155.2	80%	0.804	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-80.9	162.6	165.5	-52.1	0	0	0	0	112.5
628	P	57.8	Low	38.9	Very low	129 Å²	129	154.3 Å²	154.3	84%	0.838	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-102.2	140.5	159.7	29.1	-15.9	0	0	0	112.5
629	M	45.9	Very low	39.4	Very low	178 Å²	178	153.9 Å²	153.9	88%	0.877	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-89.1	158.7	176.8	-78.9	-164.4	71.2	0	0	113.5
630	L	41.2	Very low	40.1	Very low	156 Å²	156	160.9 Å²	160.9	82%	0.817	84%	0.844	S	S	*	*			trans	-43.7	156.7	166.8	-69	138.7	0	0	0	116.3
631	K	43.8	Very low	40.7	Very low	276 Å²	276	154.8 Å²	154.8	100%	1.2	84%	0.843	S	S	*	*			trans	-114.5	0	140	-110.4	-176.2	-179.3	178.9	0	108.7

Retrieved 631 of 631 residues in 284.9 ms (Link to these results)

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