A0A087X8Y9_POEFO Loading...

DnaJ homolog subfamily C member 2

AlphaFold DB , UniProt , Accession A0A087X8Y9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 617 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.9	Very low	65.1	Low	243 Å²	243	161.4 Å²	161.4	100%	1.197	83%	0.832	S	S	*	*				0	118.1	0	-66.7	177.7	-156	0	0	106.3
2	L	35.1	Very low	65.1	Low	173 Å²	173	157.3 Å²	157.3	91%	0.906	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-71.8	138.8	173	-73.7	161.5	0	0	0	107.7
3	L	48.6	Very low	65.4	Low	177 Å²	177	154.8 Å²	154.8	93%	0.927	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-70.3	127.5	176.8	-73.1	158.3	0	0	0	108.3
4	E	65.4	Low	64.9	Low	187 Å²	187	158.6 Å²	158.6	87%	0.874	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-70	136.9	172.4	-69.8	178.7	165.8	0	0	109.5
5	A	73.5	Confident	64.3	Low	82 Å²	82	160.7 Å²	160.7	68%	0.678	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-66.8	145.5	175.6	0	0	0	0	0	110.3	D9	A5-D9 WeakPolarHBondContact CA-OD2 3.39Å; A5-D9 HydrophobicContact CB-CB 4.39Å
6	R	80	Confident	64.1	Low	190 Å²	190	156 Å²	156	72%	0.717	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-86.1	158.9	178.4	-61.8	179.5	178.3	173.4	-0.1	110.4	D8 D9	R6-D8 VanDerWaalsContact CB-OD1 3.23Å; R6-D8 WeakPolarHBondContact CB-OD1 3.48Å; R6-D8 PolarHBondContact O-N 3.49Å; R6-D9 PolarHBondContact N-OD2 2.69Å; R6-D9 WeakPolarHBondContact O-CB 3.45Å; R6-D9 PolarHBondContact O-N 3.41Å
7	D	74.8	Confident	64.2	Low	182 Å²	182	152.4 Å²	152.4	97%	0.973	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	-17.9	-175.8	-66.3	-32.1	0	0	0	113.9
8	D	80.4	Confident	64.5	Low	129 Å²	129	149.3 Å²	149.3	69%	0.69	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	2.7	180	50.5	-36.9	0	0	0	114.6	R6 E10	R6-D8 VanDerWaalsContact CB-OD1 3.23Å; R6-D8 WeakPolarHBondContact CB-OD1 3.48Å; R6-D8 PolarHBondContact O-N 3.49Å; D8-E10 PolarHBondContact O-N 3.42Å
9	D	77.1	Confident	64.6	Low	94 Å²	94	146.1 Å²	146.1	50%	0.503	81%	0.809	S	S	.	*			trans	-78.7	109	176.8	-72.3	-30.2	0	0	0	111.4	A5 R6 T11	A5-D9 WeakPolarHBondContact CA-OD2 3.39Å; A5-D9 HydrophobicContact CB-CB 4.39Å; R6-D9 PolarHBondContact N-OD2 2.69Å; R6-D9 WeakPolarHBondContact O-CB 3.45Å; R6-D9 PolarHBondContact O-N 3.41Å; D9-T11 PolarHBondContact O-N 3.05Å
10	E	73.2	Confident	64.8	Low	177 Å²	177	145.2 Å²	145.2	83%	0.827	81%	0.813	S	S	*	*			trans	-77	117.9	172.3	-80.9	-170.2	160.7	0	0	111.7	D8 T12	D8-E10 PolarHBondContact O-N 3.42Å; E10-T12 PolarHBondContact O-N 3.03Å
11	T	70	Confident	65.2	Low	141 Å²	141	144 Å²	144	87%	0.865	81%	0.809	S	S	*	*			trans	-76.5	110.4	173	-54.5	0	0	0	0	109.9	D9	D9-T11 PolarHBondContact O-N 3.05Å
12	T	65.8	Low	66.8	Low	113 Å²	113	142 Å²	142	69%	0.693	80%	0.797	S	S	*	*			trans	-110.8	130.3	177.1	32.4	0	0	0	0	111.6	E10 F14	E10-T12 PolarHBondContact O-N 3.03Å; T12-F14 PolarHBondContact O-N 3Å
13	V	68.8	Low	68.4	Low	125 Å²	125	138.8 Å²	138.8	76%	0.758	78%	0.784	S	S	*	*			trans	-78.4	105.4	178.2	178.9	0	0	0	0	109.2
14	F	58.1	Low	69.4	Low	208 Å²	208	138.6 Å²	138.6	91%	0.912	78%	0.783	S	S	*	*	S	Bend	trans	-75.3	-24.7	-178.1	-149.9	-99.8	0	0	0	113.2	T12	T12-F14 PolarHBondContact O-N 3Å
15	K	55.6	Low	69.7	Low	189 Å²	189	135 Å²	135	82%	0.822	77%	0.774	S	S	*	*	S	Bend	trans	-163.8	130	176.5	-155.7	170.8	-176.5	177.3	0	110.2	A17	K15-A17 PolarHBondContact O-N 3.3Å
16	A	62	Low	69.8	Low	86 Å²	86	138.7 Å²	138.7	71%	0.711	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-74.1	118.8	172.7	0	0	0	0	0	109.6
17	A	64.6	Low	69.4	Low	94 Å²	94	133.1 Å²	133.1	78%	0.777	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-64.5	147.7	157.4	0	0	0	0	0	108	K15	K15-A17 PolarHBondContact O-N 3.3Å
18	A	70.3	Confident	69.4	Low	98 Å²	98	130 Å²	130	81%	0.81	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-48	145	-178.3	0	0	0	0	0	111.7	S20	A18-S20 PolarHBondContact O-N 3.44Å
19	A	67.1	Low	68.8	Low	88 Å²	88	125.6 Å²	125.6	73%	0.727	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-53.1	133	-178.1	0	0	0	0	0	110.9	V21	A19-V21 PolarHBondContact O-N 3.04Å; A19-V21 VanDerWaalsContact O-N 3.11Å
20	S	67.4	Low	67.9	Low	128 Å²	128	128.4 Å²	128.4	90%	0.895	74%	0.742	S	S	*	*			trans	-58.4	115.6	177.4	-35.2	0	0	0	0	109.4	A18	A18-S20 PolarHBondContact O-N 3.44Å
21	V	74.3	Confident	67.6	Low	121 Å²	121	126 Å²	126	73%	0.733	73%	0.725	S	S	*	*			trans	-95.3	125.7	174.1	-174.5	0	0	0	0	108	A19 V23	A19-V21 PolarHBondContact O-N 3.04Å; A19-V21 VanDerWaalsContact O-N 3.11Å; V21-V23 HydrophobicContact CG1-CG2 4.41Å; V21-V23 PolarHBondContact O-N 3.34Å
22	Q	71.1	Confident	68	Low	199 Å²	199	123 Å²	123	93%	0.93	70%	0.7	S	S	*	*			trans	-71.2	112.4	166.9	-88	-176.2	-17.9	0	0	108.6
23	V	67.9	Low	68.4	Low	107 Å²	107	122.6 Å²	122.6	65%	0.648	69%	0.69	S	S	*	*			trans	-100.3	127.1	173.4	-174.3	0	0	0	0	107.7	V21 V25	V21-V23 HydrophobicContact CG1-CG2 4.41Å; V21-V23 PolarHBondContact O-N 3.34Å; V23-V25 HydrophobicContact CG1-CG1 4.28Å; V23-V25 PolarHBondContact O-N 3.13Å
24	L	70.3	Confident	68.4	Low	172 Å²	172	117.5 Å²	117.5	90%	0.901	66%	0.662	S	S	*	*			trans	-74.9	106.6	173	-135.3	154.5	0	0	0	107
25	V	72.5	Confident	69.1	Low	112 Å²	112	112.8 Å²	112.8	68%	0.679	64%	0.639	S	S	*	*			trans	-100.4	129.1	178.2	-65.8	0	0	0	0	109	V23	V23-V25 HydrophobicContact CG1-CG1 4.28Å; V23-V25 PolarHBondContact O-N 3.13Å
26	E	75.4	Confident	70.2	Confident	160 Å²	160	107.4 Å²	107.4	75%	0.748	62%	0.618	S	S	*	*			trans	-77.3	124.3	167.4	-70.6	-171.4	154	0	0	108.2	V28	E26-V28 HydrophobicContact CB-CG1 4.04Å; E26-V28 PolarHBondContact O-N 3.46Å
27	P	70.5	Confident	70.7	Confident	73 Å²	73	110.7 Å²	110.7	47%	0.474	61%	0.612	S	S	.	*			trans	-75.3	98.5	176	32.8	-34.1	0	0	0	107.8	F32	P27-F32 HydrophobicContact CB-CB 4.3Å; P27-F32 HydrophobicContact CB-CD1 3.96Å; P27-F32 HydrophobicContact CB-CD2 3.46Å; P27-F32 VanDerWaalsContact CB-CD2 3.46Å; P27-F32 HydrophobicContact CB-CE1 4.06Å; P27-F32 HydrophobicContact CB-CE2 3.57Å; P27-F32 HydrophobicContact CB-CG 3.64Å; P27-F32 HydrophobicContact CB-CZ 3.87Å; P27-F32 HydrophobicContact CG-CD1 4.14Å; P27-F32 HydrophobicContact CG-CD2 3.99Å; P27-F32 HydrophobicContact CG-CE1 3.73Å; P27-F32 HydrophobicContact CG-CE2 3.55Å; P27-F32 HydrophobicContact CG-CG 4.24Å; P27-F32 HydrophobicContact CG-CZ 3.4Å; P27-F32 WeakPolarHBondContact O-CD1 3.41Å; P27-F32 VanDerWaalsContact O-CE1 3.3Å; P27-F32 WeakPolarHBondContact O-CE1 3.49Å; P27-F32 WeakPolarHBondContact O-CG 3.27Å
28	V	75.9	Confident	71.1	Confident	115 Å²	115	109.5 Å²	109.5	70%	0.697	59%	0.587	S	S	*	*			trans	-117.3	153.8	179.6	-65.1	0	0	0	0	110.1	E26	E26-V28 HydrophobicContact CB-CG1 4.04Å; E26-V28 PolarHBondContact O-N 3.46Å
29	G	67.3	Low	71.3	Confident	38 Å²	38	112.7 Å²	112.7	39%	0.392	58%	0.579	S	S	.	*	S	Bend	trans	101.8	167.4	175	0	0	0	0	0	114.9	W31 F32 E33	G29-W31 PolarHBondContact O-N 3Å; G29-W31 VanDerWaalsContact O-N 3.09Å; G29-F32 PolarHBondContact O-N 3.23Å; G29-E33 PolarHBondContact O-N 3.1Å; G29-E33 VanDerWaalsContact O-N 3.11Å
30	R	58.4	Low	71.5	Confident	152 Å²	152	112.8 Å²	112.8	57%	0.574	57%	0.574	S	S	*	*	H	α-helix	trans	-57.3	-31.1	-165.5	68.9	-177.5	-176.1	-129.4	6.1	114.7	E33 A34	R30-E33 PolarHBondContact O-N 3.18Å; R30-A34 VanDerWaalsContact O-CB 3.23Å; R30-A34 WeakPolarHBondContact O-CB 3.4Å; R30-A34 PolarHBondContact O-N 3.39Å
31	W	66.5	Low	71.9	Confident	127 Å²	127	115.6 Å²	115.6	48%	0.481	57%	0.565	S	S	.	*	H	α-helix	trans	-70.7	-36.9	178.5	-66.5	113.8	0	0	0	112.7	G29 Y35	G29-W31 PolarHBondContact O-N 3Å; G29-W31 VanDerWaalsContact O-N 3.09Å; W31-Y35 WeakPolarHBondContact O-CB 3.43Å; W31-Y35 PolarHBondContact O-N 3.06Å
32	F	78.8	Confident	71.5	Confident	77 Å²	77	117.3 Å²	117.3	34%	0.338	57%	0.57	S	S	.	*	H	α-helix	trans	-70.9	-41.2	172.8	-178.7	-112.3	0	0	0	111	P27 G29 A34 Y35 I36	P27-F32 HydrophobicContact CB-CB 4.3Å; P27-F32 HydrophobicContact CB-CD1 3.96Å; P27-F32 HydrophobicContact CB-CD2 3.46Å; P27-F32 VanDerWaalsContact CB-CD2 3.46Å; P27-F32 HydrophobicContact CB-CE1 4.06Å; P27-F32 HydrophobicContact CB-CE2 3.57Å; P27-F32 HydrophobicContact CB-CG 3.64Å; P27-F32 HydrophobicContact CB-CZ 3.87Å; P27-F32 HydrophobicContact CG-CD1 4.14Å; P27-F32 HydrophobicContact CG-CD2 3.99Å; P27-F32 HydrophobicContact CG-CE1 3.73Å; P27-F32 HydrophobicContact CG-CE2 3.55Å; P27-F32 HydrophobicContact CG-CG 4.24Å; P27-F32 HydrophobicContact CG-CZ 3.4Å; P27-F32 WeakPolarHBondContact O-CD1 3.41Å; P27-F32 VanDerWaalsContact O-CE1 3.3Å; P27-F32 WeakPolarHBondContact O-CE1 3.49Å; P27-F32 WeakPolarHBondContact O-CG 3.27Å; G29-F32 PolarHBondContact O-N 3.23Å; F32-A34 VanDerWaalsContact C-N 3.34Å; F32-A34 PolarHBondContact O-N 3.21Å; F32-Y35 HydrophobicContact CD2-CD1 4.18Å; F32-Y35 HydrophobicContact CE2-CD1 4.2Å; F32-Y35 WeakPolarHBondContact O-CB 3.46Å; F32-Y35 PolarHBondContact O-N 3.02Å; F32-I36 HydrophobicContact CD1-CG1 4.25Å; F32-I36 HydrophobicContact CD2-CG1 4.47Å; F32-I36 HydrophobicContact CE1-CD1 4.35Å; F32-I36 HydrophobicContact CE1-CG1 3.91Å; F32-I36 HydrophobicContact CE2-CD1 4.13Å; F32-I36 HydrophobicContact CE2-CG1 4.15Å; F32-I36 HydrophobicContact CZ-CD1 3.85Å; F32-I36 HydrophobicContact CZ-CG1 3.86Å; F32-I36 WeakPolarHBondContact O-CG1 3.4Å; F32-I36 PolarHBondContact O-N 3.2Å
33	E	74.6	Confident	71.2	Confident	105 Å²	105	111.9 Å²	111.9	49%	0.491	55%	0.55	S	S	.	.	H	α-helix	trans	-60.9	-42.4	173.1	-67.4	-177.7	-173.9	0	0	112.2	G29 R30 I36 R37	G29-E33 PolarHBondContact O-N 3.1Å; G29-E33 VanDerWaalsContact O-N 3.11Å; R30-E33 PolarHBondContact O-N 3.18Å; E33-I36 PolarHBondContact O-N 3.35Å; E33-R37 WeakPolarHBondContact O-CB 3.34Å; E33-R37 VanDerWaalsContact O-CG 3.3Å; E33-R37 WeakPolarHBondContact O-CG 3.4Å; E33-R37 PolarHBondContact O-N 3.14Å
34	A	67.7	Low	70.8	Confident	19 Å²	19	112.3 Å²	112.3	16%	0.157	56%	0.558	C	S	.	*	H	α-helix	trans	-64.6	-39.6	175.1	0	0	0	0	0	111.5	R30 F32 R37 R38	R30-A34 VanDerWaalsContact O-CB 3.23Å; R30-A34 WeakPolarHBondContact O-CB 3.4Å; R30-A34 PolarHBondContact O-N 3.39Å; F32-A34 VanDerWaalsContact C-N 3.34Å; F32-A34 PolarHBondContact O-N 3.21Å; A34-R37 PolarHBondContact O-N 2.93Å; A34-R38 WeakPolarHBondContact O-CB 3.34Å; A34-R38 VanDerWaalsContact O-CG 3.26Å; A34-R38 WeakPolarHBondContact O-CG 3.49Å; A34-R38 PolarHBondContact O-N 3.4Å; A34-R38 PolarHBondContact O-NE 3.29Å
35	Y	72.3	Confident	70.1	Confident	109 Å²	109	106.4 Å²	106.4	43%	0.427	53%	0.534	S	S	.	.	H	α-helix	trans	-61.1	-45.9	171.6	168.6	-97.7	0	0	0	111.7	W31 F32 R38 R39	W31-Y35 WeakPolarHBondContact O-CB 3.43Å; W31-Y35 PolarHBondContact O-N 3.06Å; F32-Y35 HydrophobicContact CD2-CD1 4.18Å; F32-Y35 HydrophobicContact CE2-CD1 4.2Å; F32-Y35 WeakPolarHBondContact O-CB 3.46Å; F32-Y35 PolarHBondContact O-N 3.02Å; Y35-R38 PolarHBondContact O-N 2.97Å; Y35-R39 VanDerWaalsContact O-CB 3.28Å; Y35-R39 WeakPolarHBondContact O-CB 3.37Å; Y35-R39 PolarHBondContact O-N 3.49Å; Y35-R39 PolarHBondContact OH-NH1 3.38Å; Y35-R39 VanDerWaalsContact OH-NH1 3.13Å
36	I	78.9	Confident	69.3	Low	76 Å²	76	103.7 Å²	103.7	39%	0.39	52%	0.52	S	S	.	.	H	α-helix	trans	-63.8	-43.1	176.9	-67.9	-63.8	0	0	0	111.1	F32 E33 R39 S40	F32-I36 HydrophobicContact CD1-CG1 4.25Å; F32-I36 HydrophobicContact CD2-CG1 4.47Å; F32-I36 HydrophobicContact CE1-CD1 4.35Å; F32-I36 HydrophobicContact CE1-CG1 3.91Å; F32-I36 HydrophobicContact CE2-CD1 4.13Å; F32-I36 HydrophobicContact CE2-CG1 4.15Å; F32-I36 HydrophobicContact CZ-CD1 3.85Å; F32-I36 HydrophobicContact CZ-CG1 3.86Å; F32-I36 WeakPolarHBondContact O-CG1 3.4Å; F32-I36 PolarHBondContact O-N 3.2Å; E33-I36 PolarHBondContact O-N 3.35Å; I36-R39 PolarHBondContact O-N 3.35Å; I36-S40 VanDerWaalsContact O-CB 3.3Å; I36-S40 WeakPolarHBondContact O-CB 3.46Å; I36-S40 PolarHBondContact O-N 3.09Å; I36-S40 PolarHBondContact O-OG 3.31Å
37	R	72.9	Confident	68	Low	154 Å²	154	103.5 Å²	103.5	58%	0.581	52%	0.517	S	S	*	.	H	α-helix	trans	-60.9	-45.1	175.4	-74.8	177	-174.2	-176.5	5.5	111.5	E33 A34 S40 R41	E33-R37 WeakPolarHBondContact O-CB 3.34Å; E33-R37 VanDerWaalsContact O-CG 3.3Å; E33-R37 WeakPolarHBondContact O-CG 3.4Å; E33-R37 PolarHBondContact O-N 3.14Å; A34-R37 PolarHBondContact O-N 2.93Å; R37-S40 WeakPolarHBondContact CA-OG 3.4Å; R37-S40 PolarHBondContact O-N 3.36Å; R37-S40 PolarHBondContact O-OG 2.94Å; R37-R41 WeakPolarHBondContact O-CG 3.38Å; R37-R41 PolarHBondContact O-N 3.35Å; R37-R41 VanDerWaalsContact O-N 3.09Å
38	R	72.6	Confident	67	Low	69 Å²	69	106.3 Å²	106.3	26%	0.26	52%	0.523	S	S	.	.	H	α-helix	trans	-62.2	-47	176	-76.7	176.9	-77.6	-173.4	-5.7	112.1	A34 Y35 S40 R41 N42 V43	A34-R38 WeakPolarHBondContact O-CB 3.34Å; A34-R38 VanDerWaalsContact O-CG 3.26Å; A34-R38 WeakPolarHBondContact O-CG 3.49Å; A34-R38 PolarHBondContact O-N 3.4Å; A34-R38 PolarHBondContact O-NE 3.29Å; Y35-R38 PolarHBondContact O-N 2.97Å; R38-S40 VanDerWaalsContact C-N 3.3Å; R38-S40 PolarHBondContact O-N 3.08Å; R38-R41 CarbonylContact O-C 3.15Å; R38-R41 PolarHBondContact O-N 3.23Å; R38-R41 VanDerWaalsContact O-N 3.11Å; R38-N42 PolarHBondContact O-N 3Å; R38-V43 PolarHBondContact O-N 3.49Å
39	R	73.9	Confident	66.1	Low	166 Å²	166	105.4 Å²	105.4	63%	0.626	51%	0.512	S	S	*	.	H	α-helix	trans	-61.8	-37.6	176.2	-172.1	171.7	178.1	176.4	-5	112.1	Y35 I36 R41 N42	Y35-R39 VanDerWaalsContact O-CB 3.28Å; Y35-R39 WeakPolarHBondContact O-CB 3.37Å; Y35-R39 PolarHBondContact O-N 3.49Å; Y35-R39 PolarHBondContact OH-NH1 3.38Å; Y35-R39 VanDerWaalsContact OH-NH1 3.13Å; I36-R39 PolarHBondContact O-N 3.35Å; R39-R41 VanDerWaalsContact C-N 3.28Å; R39-R41 PolarHBondContact O-N 3.18Å; R39-N42 PolarHBondContact O-N 3.01Å
40	S	71.5	Confident	65.6	Low	90 Å²	90	106.9 Å²	106.9	63%	0.629	51%	0.51	S	S	*	.	H	α-helix	trans	-69.2	-26.1	176.4	73.9	0	0	0	0	113.4	I36 R37 R38	I36-S40 VanDerWaalsContact O-CB 3.3Å; I36-S40 WeakPolarHBondContact O-CB 3.46Å; I36-S40 PolarHBondContact O-N 3.09Å; I36-S40 PolarHBondContact O-OG 3.31Å; R37-S40 WeakPolarHBondContact CA-OG 3.4Å; R37-S40 PolarHBondContact O-N 3.36Å; R37-S40 PolarHBondContact O-OG 2.94Å; R38-S40 VanDerWaalsContact C-N 3.3Å; R38-S40 PolarHBondContact O-N 3.08Å
41	R	76.8	Confident	65.4	Low	186 Å²	186	104.4 Å²	104.4	70%	0.702	51%	0.505	S	S	*	.	H	α-helix	trans	-97.1	-5.1	179.6	-66.7	175.1	-179.5	178.4	-1.6	113.5	R37 R38 R39 V43	R37-R41 WeakPolarHBondContact O-CG 3.38Å; R37-R41 PolarHBondContact O-N 3.35Å; R37-R41 VanDerWaalsContact O-N 3.09Å; R38-R41 CarbonylContact O-C 3.15Å; R38-R41 PolarHBondContact O-N 3.23Å; R38-R41 VanDerWaalsContact O-N 3.11Å; R39-R41 VanDerWaalsContact C-N 3.28Å; R39-R41 PolarHBondContact O-N 3.18Å; R41-V43 VanDerWaalsContact C-N 3.34Å; R41-V43 HydrophobicContact CB-CG2 3.96Å; R41-V43 WeakPolarHBondContact O-CG2 3.46Å; R41-V43 PolarHBondContact O-N 3.37Å
42	N	65.4	Low	64.8	Low	157 Å²	157	103.6 Å²	103.6	84%	0.84	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	39.9	179.6	-136.5	29.3	0	0	0	114.1	R38 R39	R38-N42 PolarHBondContact O-N 3Å; R39-N42 PolarHBondContact O-N 3.01Å
43	V	64.4	Low	63.6	Low	85 Å²	85	103.9 Å²	103.9	52%	0.515	51%	0.509	S	S	.	.			trans	-115.1	136.3	180	-162.1	0	0	0	0	109.8	R38 R41	R38-V43 PolarHBondContact O-N 3.49Å; R41-V43 VanDerWaalsContact C-N 3.34Å; R41-V43 HydrophobicContact CB-CG2 3.96Å; R41-V43 WeakPolarHBondContact O-CG2 3.46Å; R41-V43 PolarHBondContact O-N 3.37Å
44	S	60.4	Low	62.5	Low	116 Å²	116	104.6 Å²	104.6	81%	0.811	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-91.6	141.2	171.1	-83.1	0	0	0	0	110.7	S46	S44-S46 PolarHBondContact O-N 2.98Å
45	A	55.3	Low	61.6	Low	48 Å²	48	110.4 Å²	110.4	40%	0.397	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-64.4	131.9	-177.8	0	0	0	0	0	111.6	L50	A45-L50 HydrophobicContact CB-CD1 4.26Å; A45-L50 HydrophobicContact CB-CG 4.31Å
46	S	55.5	Low	60.3	Low	55 Å²	55	108.1 Å²	108.1	39%	0.385	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-83.3	148.4	160.1	80	0	0	0	0	109.3	S44 Q48 E49 L50	S44-S46 PolarHBondContact O-N 2.98Å; S46-Q48 PolarHBondContact O-N 3.22Å; S46-Q48 VanDerWaalsContact O-N 3.15Å; S46-E49 PolarHBondContact O-N 2.83Å; S46-E49 PolarHBondContact OG-N 3.34Å; S46-L50 PolarHBondContact O-N 3.29Å
47	F	47.4	Very low	58.8	Low	156 Å²	156	106.1 Å²	106.1	68%	0.684	53%	0.529	S	S	*	.	H	α-helix	trans	-55.9	-29.8	177	-176.5	-101.5	0	0	0	112.3	L50 E51	F47-L50 PolarHBondContact O-N 3.34Å; F47-E51 HydrophobicContact CE1-CG 4.25Å; F47-E51 WeakPolarHBondContact CE1-OE1 3.34Å; F47-E51 PolarHBondContact O-N 3.02Å
48	Q	50.6	Low	57.5	Low	132 Å²	132	104.6 Å²	104.6	62%	0.617	53%	0.529	S	S	*	.	H	α-helix	trans	-74.9	-34.6	-178.5	-161.1	164.4	-17.1	0	0	113.1	S46 L50 E51 E52	S46-Q48 PolarHBondContact O-N 3.22Å; S46-Q48 VanDerWaalsContact O-N 3.15Å; Q48-L50 VanDerWaalsContact C-N 3.32Å; Q48-E51 PolarHBondContact O-N 3.23Å; Q48-E52 WeakPolarHBondContact O-CB 3.42Å; Q48-E52 WeakPolarHBondContact O-CG 3.38Å; Q48-E52 PolarHBondContact O-N 3.09Å
49	E	57	Low	56.3	Low	97 Å²	97	107.5 Å²	107.5	45%	0.453	55%	0.545	S	S	.	.	H	α-helix	trans	-70.2	-29.5	172.9	-79.1	178.4	153	0	0	112.3	S46 E53	S46-E49 PolarHBondContact O-N 2.83Å; S46-E49 PolarHBondContact OG-N 3.34Å; E49-E53 WeakPolarHBondContact O-CB 3.39Å; E49-E53 WeakPolarHBondContact O-CG 3.15Å; E49-E53 PolarHBondContact O-N 3.06Å
50	L	56	Low	54.8	Low	69 Å²	69	104.1 Å²	104.1	36%	0.361	55%	0.547	S	S	.	.	H	α-helix	trans	-72.7	-38.4	175.3	-70.5	170.3	0	0	0	111.6	A45 S46 F47 Q48 E54	A45-L50 HydrophobicContact CB-CD1 4.26Å; A45-L50 HydrophobicContact CB-CG 4.31Å; S46-L50 PolarHBondContact O-N 3.29Å; F47-L50 PolarHBondContact O-N 3.34Å; Q48-L50 VanDerWaalsContact C-N 3.32Å; L50-E54 WeakPolarHBondContact O-CB 3.41Å; L50-E54 PolarHBondContact O-N 3.24Å
51	E	54.3	Low	53.5	Low	100 Å²	100	107 Å²	107	47%	0.467	55%	0.551	S	S	.	*	H	α-helix	trans	-65.6	-43.2	171.7	-77.9	-178.9	155.8	0	0	111.3	F47 Q48 E54 E55	F47-E51 HydrophobicContact CE1-CG 4.25Å; F47-E51 WeakPolarHBondContact CE1-OE1 3.34Å; F47-E51 PolarHBondContact O-N 3.02Å; Q48-E51 PolarHBondContact O-N 3.23Å; E51-E54 PolarHBondContact O-N 2.72Å; E51-E55 VanDerWaalsContact O-CB 3.28Å; E51-E55 WeakPolarHBondContact O-CB 3.46Å; E51-E55 PolarHBondContact O-N 3.09Å
52	E	53.9	Low	52.1	Low	110 Å²	110	105.5 Å²	105.5	51%	0.514	56%	0.556	S	S	.	*	H	α-helix	trans	-66.6	-36.1	176.4	-74.9	174.4	-172.7	0	0	112.7	Q48 S56	Q48-E52 WeakPolarHBondContact O-CB 3.42Å; Q48-E52 WeakPolarHBondContact O-CG 3.38Å; Q48-E52 PolarHBondContact O-N 3.09Å; E52-S56 WeakPolarHBondContact O-CB 3.13Å; E52-S56 PolarHBondContact O-N 3.03Å
53	E	54.3	Low	51.5	Low	82 Å²	82	104.9 Å²	104.9	38%	0.383	55%	0.548	S	S	.	.	H	α-helix	trans	-73	-34.8	174.3	-82.2	-173.9	165.5	0	0	112.5	E49 S56 S57	E49-E53 WeakPolarHBondContact O-CB 3.39Å; E49-E53 WeakPolarHBondContact O-CG 3.15Å; E49-E53 PolarHBondContact O-N 3.06Å; E53-S56 PolarHBondContact O-OG 2.69Å; E53-S57 VanDerWaalsContact O-CB 3.28Å; E53-S57 WeakPolarHBondContact O-CB 3.26Å; E53-S57 PolarHBondContact O-N 3.01Å
54	E	50.8	Low	51.2	Low	121 Å²	121	109.5 Å²	109.5	57%	0.565	56%	0.564	S	S	*	*	H	α-helix	trans	-64.7	-46.5	172.3	-165.1	170.8	-154.4	0	0	110.1	L50 E51 S56 S57 E58	L50-E54 WeakPolarHBondContact O-CB 3.41Å; L50-E54 PolarHBondContact O-N 3.24Å; E51-E54 PolarHBondContact O-N 2.72Å; E54-S56 PolarHBondContact O-N 3.34Å; E54-S57 PolarHBondContact O-N 3.39Å; E54-S57 PolarHBondContact O-OG 3.49Å; E54-E58 PolarHBondContact O-N 3.15Å
55	E	50	Low	51.5	Low	140 Å²	140	106.7 Å²	106.7	65%	0.654	54%	0.54	S	S	*	.	H	α-helix	trans	-63.5	-40.1	176.9	-155.7	171.9	-153.2	0	0	111.8	E51 E58 E59	E51-E55 VanDerWaalsContact O-CB 3.28Å; E51-E55 WeakPolarHBondContact O-CB 3.46Å; E51-E55 PolarHBondContact O-N 3.09Å; E55-E58 PolarHBondContact O-N 3.26Å; E55-E59 PolarHBondContact O-N 3.24Å
56	S	45.2	Very low	52.4	Low	61 Å²	61	112.1 Å²	112.1	43%	0.427	56%	0.557	S	S	.	*	H	α-helix	trans	-74.4	-25.6	174.4	90.4	0	0	0	0	113.6	E52 E53 E54 E58 E59	E52-S56 WeakPolarHBondContact O-CB 3.13Å; E52-S56 PolarHBondContact O-N 3.03Å; E53-S56 PolarHBondContact O-OG 2.69Å; E54-S56 PolarHBondContact O-N 3.34Å; S56-E58 VanDerWaalsContact C-N 3.29Å; S56-E59 WeakPolarHBondContact O-CB 3.5Å; S56-E59 PolarHBondContact O-N 2.87Å; S56-E59 VanDerWaalsContact O-N 3.11Å
57	S	46.5	Very low	53.5	Low	34 Å²	34	111.7 Å²	111.7	24%	0.238	55%	0.55	C	S	.	*	H	α-helix	trans	-70.6	-30.3	175.4	81.2	0	0	0	0	111.9	E53 E54 E59 S60	E53-S57 VanDerWaalsContact O-CB 3.28Å; E53-S57 WeakPolarHBondContact O-CB 3.26Å; E53-S57 PolarHBondContact O-N 3.01Å; E54-S57 PolarHBondContact O-N 3.39Å; E54-S57 PolarHBondContact O-OG 3.49Å; S57-E59 VanDerWaalsContact C-N 3.3Å; S57-S60 PolarHBondContact O-OG 3.09Å; S57-S60 VanDerWaalsContact O-OG 3.11Å
58	E	46.7	Very low	55	Low	122 Å²	122	109.1 Å²	109.1	57%	0.57	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-73.9	-16.6	169.5	-66.9	-170.3	176.3	0	0	112.8	E54 E55 S56 S60 K102	E54-E58 PolarHBondContact O-N 3.15Å; E55-E58 PolarHBondContact O-N 3.26Å; S56-E58 VanDerWaalsContact C-N 3.29Å; E58-S60 VanDerWaalsContact C-N 3.29Å; E58-S60 PolarHBondContact O-N 3.4Å; E58-K102 PolarHBondContact O-NZ 3.34Å
59	E	46.7	Very low	56	Low	131 Å²	131	109.7 Å²	109.7	61%	0.612	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-72.8	-15.8	175.9	-71.5	-173.5	150.4	0	0	113.7	E55 S56 S57	E55-E59 PolarHBondContact O-N 3.24Å; S56-E59 WeakPolarHBondContact O-CB 3.5Å; S56-E59 PolarHBondContact O-N 2.87Å; S56-E59 VanDerWaalsContact O-N 3.11Å; S57-E59 VanDerWaalsContact C-N 3.3Å
60	S	41.7	Very low	56.7	Low	94 Å²	94	107.4 Å²	107.4	66%	0.657	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-87.9	-4.4	-171.8	68.5	0	0	0	0	116.6	S57 E58	S57-S60 PolarHBondContact O-OG 3.09Å; S57-S60 VanDerWaalsContact O-OG 3.11Å; E58-S60 VanDerWaalsContact C-N 3.29Å; E58-S60 PolarHBondContact O-N 3.4Å
61	E	44.7	Very low	57.3	Low	152 Å²	152	109.9 Å²	109.9	71%	0.71	55%	0.553	S	S	*	*			trans	-102.6	78.3	168.5	-71.3	179	-178.2	0	0	109	E63	E61-E63 PolarHBondContact O-N 3.15Å
62	D	47	Very low	58.4	Low	154 Å²	154	110.5 Å²	110.5	82%	0.824	56%	0.557	S	S	*	*			trans	-69.2	71.3	159.7	-81	-30.4	0	0	0	108.2	E64	D62-E64 PolarHBondContact O-N 3.4Å; D62-E64 VanDerWaalsContact O-N 3.15Å
63	E	52.3	Low	59.8	Low	143 Å²	143	105.8 Å²	105.8	67%	0.668	54%	0.535	S	S	*	.			trans	-61.7	114	155.8	-77	-171.3	160.1	0	0	106.5	E61 L65	E61-E63 PolarHBondContact O-N 3.15Å; E63-L65 PolarHBondContact O-N 3.18Å
64	E	59.2	Low	61.1	Low	183 Å²	183	108.7 Å²	108.7	86%	0.855	54%	0.542	S	S	*	.			trans	-52.5	103.5	173.8	-174.4	172.1	-163.5	0	0	108.5	D62 Q66	D62-E64 PolarHBondContact O-N 3.4Å; D62-E64 VanDerWaalsContact O-N 3.15Å; E64-Q66 PolarHBondContact O-N 3.15Å
65	L	67.1	Low	62.8	Low	56 Å²	56	107.3 Å²	107.3	29%	0.293	54%	0.543	S	S	.	.			trans	-63.3	108.1	-178.7	-73.6	169.8	0	0	0	108.3	E63 L67 Q103 A106	E63-L65 PolarHBondContact O-N 3.18Å; L65-L67 HydrophobicContact CB-CD2 4.42Å; L65-L67 HydrophobicContact CB-CG 4.47Å; L65-L67 PolarHBondContact O-N 3.04Å; L65-Q103 HydrophobicContact CD2-CB 4.24Å; L65-Q103 HydrophobicContact CD2-CG 3.75Å; L65-A106 HydrophobicContact CD1-CB 3.44Å; L65-A106 VanDerWaalsContact CD1-CB 3.44Å
66	Q	74.3	Confident	64.6	Low	163 Å²	163	102.2 Å²	102.2	76%	0.762	52%	0.52	S	S	*	.			trans	-70.1	79.8	175.6	-69.2	-176.7	-6.7	0	0	109.5	E64 E68 H94	E64-Q66 PolarHBondContact O-N 3.15Å; Q66-E68 PolarHBondContact O-N 3.46Å; Q66-H94 PolarHBondContact O-CE1 2.96Å
67	L	78.3	Confident	66.6	Low	46 Å²	46	103.5 Å²	103.5	24%	0.241	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-73.2	125.5	175.4	-60.6	178.3	0	0	0	109.6	L65 G91 L92 A107 S110	L65-L67 HydrophobicContact CB-CD2 4.42Å; L65-L67 HydrophobicContact CB-CG 4.47Å; L65-L67 PolarHBondContact O-N 3.04Å; L67-G91 WeakPolarHBondContact CA-O 3.38Å; L67-L92 HydrophobicContact CD2-CD2 3.59Å; L67-L92 HydrophobicContact CD2-CG 4.37Å; L67-A107 HydrophobicContact CD2-CB 3.57Å; L67-S110 VanDerWaalsContact CD1-OG 3.3Å; L67-S110 WeakPolarHBondContact CD1-OG 3.14Å
68	E	77.8	Confident	68.7	Low	101 Å²	101	102.5 Å²	102.5	47%	0.472	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-88.3	126.3	171.8	-73.4	172.3	-128.9	0	0	109.2	Q66 H70 G91 P93 H94	Q66-E68 PolarHBondContact O-N 3.46Å; E68-H70 PolarHBondContact O-N 3.34Å; E68-G91 PolarHBondContact N-O 2.98Å; E68-G91 VanDerWaalsContact N-O 3.09Å; E68-G91 WeakPolarHBondContact O-CA 3.29Å; E68-P93 HydrophobicContact CB-CG 3.92Å; E68-P93 HydrophobicContact CG-CG 4.41Å; E68-P93 WeakPolarHBondContact OE2-CG 3.21Å; E68-H94 IonicContact OE1-CE1 3.44Å; E68-H94 IonicContact OE1-CG 2.93Å; E68-H94 IonicContact OE1-ND1 3.39Å; E68-H94 PolarHBondContact OE1-ND1 3.05Å
69	E	71.9	Confident	70.7	Confident	145 Å²	145	104.5 Å²	104.5	68%	0.678	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-68.9	118.8	175.1	-68.3	-166.8	164	0	0	109.6	P71 K114	E69-P71 WeakPolarHBondContact O-CD 3.35Å; E69-P71 VanDerWaalsContact O-N 3.11Å; E69-K114 IonicContact OE1-NZ 3.75Å; E69-K114 PolarHBondContact OE1-NZ 2.63Å
70	H	72.1	Confident	72.7	Confident	49 Å²	49	101.9 Å²	101.9	23%	0.227	51%	0.512	C	S	.	.			trans	-62.2	113.2	177.2	-176.2	-82.3	0	0	0	109.7	E68 M72 L73 A88	E68-H70 PolarHBondContact O-N 3.34Å; H70-M72 PolarHBondContact ND1-N 2.8Å; H70-M72 PolarHBondContact O-N 3.18Å; H70-L73 HydrophobicContact CB-CB 4.06Å; H70-L73 HydrophobicContact CB-CD1 4.47Å; H70-L73 PolarHBondContact ND1-N 2.9Å; H70-L73 VanDerWaalsContact ND1-N 3.1Å; H70-L73 WeakPolarHBondContact O-CB 3.39Å; H70-L73 PolarHBondContact O-N 3.43Å; H70-A88 WeakPolarHBondContact CB-O 3.43Å
71	P	68.8	Low	75	Confident	121 Å²	121	100.5 Å²	100.5	79%	0.786	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.3	-167	-28.1	35.7	0	0	0	114.7	E69	E69-P71 WeakPolarHBondContact O-CD 3.35Å; E69-P71 VanDerWaalsContact O-N 3.11Å
72	M	76.9	Confident	77.2	Confident	112 Å²	112	96.6 Å²	96.6	55%	0.552	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	22.1	-174.5	-66.2	-64.6	-81.6	0	0	112.5	H70 R74 T75 L76	H70-M72 PolarHBondContact ND1-N 2.8Å; H70-M72 PolarHBondContact O-N 3.18Å; M72-R74 VanDerWaalsContact C-N 3.3Å; M72-R74 PolarHBondContact O-N 2.84Å; M72-T75 WeakPolarHBondContact CB-OG1 3.46Å; M72-T75 HydrophobicContact CE-CG2 4.23Å; M72-T75 WeakPolarHBondContact CE-OG1 3.36Å; M72-T75 PolarHBondContact O-N 3.36Å; M72-T75 VanDerWaalsContact O-N 3.1Å; M72-T75 PolarHBondContact O-OG1 2.93Å; M72-L76 WeakPolarHBondContact O-CG 3.48Å; M72-L76 PolarHBondContact O-N 2.8Å
73	L	82.8	Confident	79.3	Confident	12 Å²	12	95.4 Å²	95.4	6%	0.063	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-57.5	-42.7	-173.9	-171.6	59.6	0	0	0	112.6	H70 T75 L76 V89 Y134 I138	H70-L73 HydrophobicContact CB-CB 4.06Å; H70-L73 HydrophobicContact CB-CD1 4.47Å; H70-L73 PolarHBondContact ND1-N 2.9Å; H70-L73 VanDerWaalsContact ND1-N 3.1Å; H70-L73 WeakPolarHBondContact O-CB 3.39Å; H70-L73 PolarHBondContact O-N 3.43Å; L73-T75 PolarHBondContact O-N 3.12Å; L73-L76 HydrophobicContact CD1-CD1 3.91Å; L73-L76 PolarHBondContact O-N 3.26Å; L73-V89 HydrophobicContact CD1-CB 4.49Å; L73-V89 HydrophobicContact CD1-CG1 4.02Å; L73-Y134 HydrophobicContact CG-CD2 4.17Å; L73-Y134 HydrophobicContact CG-CE2 4.21Å; L73-I138 HydrophobicContact CD1-CG1 4.35Å; L73-I138 HydrophobicContact CD2-CD1 4.3Å
74	R	83.5	Confident	81.2	Confident	142 Å²	142	89.5 Å²	89.5	54%	0.536	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-72.7	-15.2	-178.2	-62.6	-175.6	177.7	-143.7	-6.3	113.5	M72 E125 Y134	M72-R74 VanDerWaalsContact C-N 3.3Å; M72-R74 PolarHBondContact O-N 2.84Å; R74-E125 IonicContact CZ-OE1 3.69Å; R74-E125 IonicContact NH1-OE1 3.93Å; R74-E125 PolarHBondContact NH1-OE1 3.45Å; R74-E125 IonicContact NH1-OE2 3.39Å; R74-E125 IonicContact NH2-OE1 2.81Å; R74-E125 PolarHBondContact NH2-OE1 3.21Å; R74-E125 IonicContact NH2-OE2 3.25Å; R74-Y134 HydrophobicContact CB-CD1 4.3Å; R74-Y134 HydrophobicContact CB-CE1 4.17Å; R74-Y134 HydrophobicContact CG-CD1 4.47Å; R74-Y134 HydrophobicContact CG-CE1 3.88Å
75	T	84.8	Confident	82.8	Confident	93 Å²	93	82.8 Å²	82.8	57%	0.571	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-101.7	1.4	-179.1	56.9	0	0	0	0	112.8	M72 L73	M72-T75 WeakPolarHBondContact CB-OG1 3.46Å; M72-T75 HydrophobicContact CE-CG2 4.23Å; M72-T75 WeakPolarHBondContact CE-OG1 3.36Å; M72-T75 PolarHBondContact O-N 3.36Å; M72-T75 VanDerWaalsContact O-N 3.1Å; M72-T75 PolarHBondContact O-OG1 2.93Å; L73-T75 PolarHBondContact O-N 3.12Å
76	L	87.9	Confident	84.1	Confident	33 Å²	33	80.1 Å²	80.1	17%	0.173	40%	0.395	C	S	.	.			trans	-68	136.4	177.2	-66	-179.6	0	0	0	110.4	M72 L73 P78 Q84 V89 C137	M72-L76 WeakPolarHBondContact O-CG 3.48Å; M72-L76 PolarHBondContact O-N 2.8Å; L73-L76 HydrophobicContact CD1-CD1 3.91Å; L73-L76 PolarHBondContact O-N 3.26Å; L76-P78 WeakPolarHBondContact O-CD 3.5Å; L76-Q84 HydrophobicContact CD2-CG 4.26Å; L76-V89 HydrophobicContact CD1-CG2 3.68Å; L76-C137 HydrophobicContact CD1-CB 4.32Å
77	D	87.9	Confident	85.1	Confident	88 Å²	88	72.5 Å²	72.5	47%	0.471	36%	0.359	S	S	.	.			trans	-84.9	117.4	173	-176.3	-5.9	0	0	0	109.8	K79 D80 Q84	D77-K79 PolarHBondContact O-N 2.96Å; D77-K79 VanDerWaalsContact O-N 3.13Å; D77-K79 WeakPolarHBondContact OD1-CB 3.43Å; D77-K79 PolarHBondContact OD1-N 3.44Å; D77-D80 HydrophobicContact CB-CB 4.35Å; D77-D80 PolarHBondContact O-N 3.45Å; D77-Q84 PolarHBondContact O-NE2 2.87Å
78	P	89.9	Confident	85.8	Confident	13 Å²	13	70.8 Å²	70.8	8%	0.084	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-55.3	-26.8	174.9	-30.8	40.9	0	0	0	114.9	L76 D80 W81 D131 D133 T136	L76-P78 WeakPolarHBondContact O-CD 3.5Å; P78-D80 VanDerWaalsContact C-N 3.3Å; P78-W81 VanDerWaalsContact O-CD1 3.23Å; P78-D131 VanDerWaalsContact CB-O 3.31Å; P78-D131 WeakPolarHBondContact CB-O 3.3Å; P78-D133 VanDerWaalsContact CG-C 3.5Å; P78-D133 WeakPolarHBondContact CG-O 3.33Å; P78-T136 HydrophobicContact CB-CG2 4.19Å
79	K	88.8	Confident	86.6	Confident	163 Å²	163	66 Å²	66	71%	0.709	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-74.1	-24.8	179.3	-64.5	177.6	-179.1	174.4	0	112.3	D77	D77-K79 PolarHBondContact O-N 2.96Å; D77-K79 VanDerWaalsContact O-N 3.13Å; D77-K79 WeakPolarHBondContact OD1-CB 3.43Å; D77-K79 PolarHBondContact OD1-N 3.44Å
80	D	89.8	Confident	87.6	Confident	77 Å²	77	59 Å²	59	41%	0.412	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-100.7	23.8	178.5	-165.3	34.2	0	0	0	112.6	D77 P78 K82 N83	D77-D80 HydrophobicContact CB-CB 4.35Å; D77-D80 PolarHBondContact O-N 3.45Å; P78-D80 VanDerWaalsContact C-N 3.3Å; D80-K82 PolarHBondContact O-N 2.96Å; D80-K82 VanDerWaalsContact O-N 3.1Å; D80-N83 PolarHBondContact O-N 3.26Å; D80-N83 PolarHBondContact OD1-ND2 2.95Å
81	W	90.4	Very high	88.5	Confident	64 Å²	64	56.8 Å²	56.8	24%	0.242	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-56.1	-31.3	-177.8	72.5	-91.3	0	0	0	113.2	P78 N83 Q84 H86 K140 I144	P78-W81 VanDerWaalsContact O-CD1 3.23Å; W81-N83 VanDerWaalsContact C-N 3.26Å; W81-N83 PolarHBondContact O-N 3.06Å; W81-Q84 WeakPolarHBondContact O-CB 3.31Å; W81-Q84 PolarHBondContact O-N 2.92Å; W81-H86 AromaticContact CE3-CE1 3.77Å; W81-H86 PolarHBondContact O-CE1 3.06Å; W81-K140 HydrophobicContact CB-CB 4.2Å; W81-K140 HydrophobicContact CB-CG 4.21Å; W81-K140 HydrophobicContact CD2-CB 3.92Å; W81-K140 HydrophobicContact CD2-CD 3.85Å; W81-K140 HydrophobicContact CD2-CG 3.82Å; W81-K140 HydrophobicContact CE3-CB 3.72Å; W81-K140 HydrophobicContact CE3-CD 4.15Å; W81-K140 HydrophobicContact CE3-CG 4.13Å; W81-K140 HydrophobicContact CG-CB 4.13Å; W81-K140 HydrophobicContact CG-CD 4.27Å; W81-K140 HydrophobicContact CG-CG 3.85Å; W81-K140 HydrophobicContact CH2-CD 4.47Å; W81-K140 HydrophobicContact CZ2-CD 4.19Å; W81-K140 HydrophobicContact CZ3-CB 4.43Å; W81-K140 HydrophobicContact CZ3-CD 4.45Å; W81-I144 HydrophobicContact CH2-CD1 4.17Å; W81-I144 HydrophobicContact CZ3-CD1 3.9Å; W81-I144 HydrophobicContact CZ3-CG1 3.8Å
82	K	90.1	Very high	89.7	Confident	71 Å²	71	51.1 Å²	51.1	31%	0.309	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-66.2	-25.8	-176.9	-166	175.6	180	-179.4	0	113.1	D80 Y226 D228	D80-K82 PolarHBondContact O-N 2.96Å; D80-K82 VanDerWaalsContact O-N 3.1Å; K82-Y226 WeakPolarHBondContact CE-O 3.31Å; K82-Y226 HydrophobicContact CG-CE1 3.86Å; K82-Y226 PolarHBondContact NZ-O 2.98Å; K82-Y226 WeakPolarHBondContact O-CE1 3.38Å; K82-Y226 PolarHBondContact O-OH 2.87Å; K82-D228 PolarHBondContact NZ-O 2.77Å
83	N	90.6	Very high	90.4	Very high	129 Å²	129	47.6 Å²	47.6	69%	0.69	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-96.7	0.7	179.6	-65.2	-44.2	0	0	0	113.2	D80 W81	D80-N83 PolarHBondContact O-N 3.26Å; D80-N83 PolarHBondContact OD1-ND2 2.95Å; W81-N83 VanDerWaalsContact C-N 3.26Å; W81-N83 PolarHBondContact O-N 3.06Å
84	Q	91.8	Very high	90.7	Very high	19 Å²	19	51.2 Å²	51.2	9%	0.089	25%	0.251	C	S	.	.	S	Bend	trans	-82.1	153.6	179.5	-65	169	15.2	0	0	111.6	L76 D77 W81 H86 V89 C137	L76-Q84 HydrophobicContact CD2-CG 4.26Å; D77-Q84 PolarHBondContact O-NE2 2.87Å; W81-Q84 WeakPolarHBondContact O-CB 3.31Å; W81-Q84 PolarHBondContact O-N 2.92Å; Q84-H86 PolarHBondContact O-N 3.31Å; Q84-V89 HydrophobicContact CB-CG2 4.38Å; Q84-C137 VanDerWaalsContact OE1-CB 3.27Å; Q84-C137 PolarHBondContact OE1-SG 3.05Å; Q84-C137 VanDerWaalsContact OE1-SG 3.36Å
85	D	92.8	Very high	91.1	Very high	42 Å²	42	46.2 Å²	46.2	23%	0.225	24%	0.235	C	C	.	.			trans	-80.7	98.7	171.5	-171	-34.1	0	0	0	110.2	Y87 A88 V89 R96	D85-Y87 PolarHBondContact O-N 2.98Å; D85-Y87 WeakPolarHBondContact OD1-CB 3.41Å; D85-Y87 PolarHBondContact OD1-N 3.22Å; D85-A88 HydrophobicContact CB-CB 3.74Å; D85-A88 PolarHBondContact O-N 2.93Å; D85-A88 PolarHBondContact OD1-N 3.08Å; D85-V89 WeakPolarHBondContact O-CG2 3.43Å; D85-V89 PolarHBondContact O-N 3.04Å; D85-R96 IonicContact OD1-NH1 3.86Å; D85-R96 IonicContact OD2-CZ 3.4Å; D85-R96 VanDerWaalsContact OD2-CZ 3.24Å; D85-R96 IonicContact OD2-NH1 2.98Å; D85-R96 PolarHBondContact OD2-NH1 3.13Å; D85-R96 IonicContact OD2-NH2 2.73Å; D85-R96 PolarHBondContact OD2-NH2 2.93Å
86	H	95.2	Very high	91.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.9	-29.8	-177.8	-64.2	-50.4	0	0	0	113.7	W81 Q84 L90 A141 L145 F154 Y226	W81-H86 AromaticContact CE3-CE1 3.77Å; W81-H86 PolarHBondContact O-CE1 3.06Å; Q84-H86 PolarHBondContact O-N 3.31Å; H86-L90 PolarHBondContact O-N 3.25Å; H86-A141 HydrophobicContact CB-CB 3.9Å; H86-A141 WeakPolarHBondContact ND1-CA 3.33Å; H86-L145 HydrophobicContact CB-CD1 3.82Å; H86-L145 HydrophobicContact CB-CD2 4.22Å; H86-L145 HydrophobicContact CB-CG 3.84Å; H86-L145 WeakPolarHBondContact O-CD1 3.28Å; H86-F154 HydrophobicContact CB-CE1 4.06Å; H86-F154 HydrophobicContact CB-CZ 4.11Å; H86-F154 AromaticContact CD2-CD2 3.65Å; H86-F154 AromaticContact CD2-CE2 3.38Å; H86-F154 WeakPolarHBondContact CD2-CE2 3.32Å; H86-F154 AromaticContact CD2-CZ 3.59Å; H86-Y226 PolarHBondContact NE2-OH 3.45Å
87	Y	95	Very high	91.6	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.008	22%	0.223	C	C	.	.	H	α-helix	trans	-73.1	-43.1	175.6	-68	-77.3	0	0	0	110.8	D85 V89 L90 G91 L92 R96 A99 I104 L145 R151 F154 D155	D85-Y87 PolarHBondContact O-N 2.98Å; D85-Y87 WeakPolarHBondContact OD1-CB 3.41Å; D85-Y87 PolarHBondContact OD1-N 3.22Å; Y87-V89 VanDerWaalsContact C-N 3.31Å; Y87-V89 PolarHBondContact O-N 2.88Å; Y87-L90 CarbonylContact O-C 3.47Å; Y87-L90 PolarHBondContact O-N 3.12Å; Y87-L90 VanDerWaalsContact O-N 3.15Å; Y87-G91 PolarHBondContact O-N 3Å; Y87-G91 VanDerWaalsContact O-N 3.1Å; Y87-L92 WeakPolarHBondContact O-CA 3.48Å; Y87-L92 PolarHBondContact O-N 3.34Å; Y87-R96 WeakPolarHBondContact CD1-O 3.35Å; Y87-R96 HydrophobicContact CD2-CB 4.23Å; Y87-R96 VanDerWaalsContact CE1-C 3.42Å; Y87-R96 WeakPolarHBondContact CE1-O 3.36Å; Y87-R96 HydrophobicContact CE2-CB 4.49Å; Y87-R96 HydrophobicContact CG-CB 4.48Å; Y87-R96 VanDerWaalsContact CZ-O 3.28Å; Y87-A99 HydrophobicContact CD1-CB 4.43Å; Y87-A99 HydrophobicContact CE1-CB 4.14Å; Y87-I104 HydrophobicContact CE1-CD1 4.31Å; Y87-L145 HydrophobicContact CD1-CD1 3.71Å; Y87-L145 HydrophobicContact CD1-CD2 4.1Å; Y87-L145 HydrophobicContact CD2-CD2 4.21Å; Y87-L145 HydrophobicContact CE1-CD1 3.96Å; Y87-L145 HydrophobicContact CE1-CD2 3.61Å; Y87-L145 HydrophobicContact CE1-CG 4.39Å; Y87-L145 HydrophobicContact CE2-CD2 3.74Å; Y87-L145 HydrophobicContact CG-CD1 4.07Å; Y87-L145 HydrophobicContact CG-CD2 4.37Å; Y87-L145 VanDerWaalsContact CZ-CD2 3.42Å; Y87-R151 PolarHBondContact OH-NE 3.25Å; Y87-R151 PolarHBondContact OH-NH2 3.39Å; Y87-R151 VanDerWaalsContact OH-NH2 3.11Å; Y87-F154 AromaticContact CD2-CE1 3.82Å; Y87-F154 HydrophobicContact CD2-CE1 3.82Å; Y87-F154 HydrophobicContact CE2-CD1 4.09Å; Y87-F154 AromaticContact CE2-CE1 3.76Å; Y87-F154 HydrophobicContact CE2-CE1 3.76Å; Y87-D155 WeakPolarHBondContact CE2-OD1 3.23Å; Y87-D155 VanDerWaalsContact OH-CG 3.31Å; Y87-D155 PolarHBondContact OH-OD1 3.45Å; Y87-D155 PolarHBondContact OH-OD2 2.91Å
88	A	93.5	Very high	91.9	Very high	10 Å²	10	48.8 Å²	48.8	8%	0.083	23%	0.23	C	C	.	.	H	α-helix	trans	-64.4	-38.9	177.1	0	0	0	0	0	110.9	H70 D85 L90 G91 P93	H70-A88 WeakPolarHBondContact CB-O 3.43Å; D85-A88 HydrophobicContact CB-CB 3.74Å; D85-A88 PolarHBondContact O-N 2.93Å; D85-A88 PolarHBondContact OD1-N 3.08Å; A88-L90 VanDerWaalsContact C-N 3.26Å; A88-L90 PolarHBondContact O-N 3.43Å; A88-G91 PolarHBondContact O-N 3.19Å; A88-P93 HydrophobicContact CB-CB 4.12Å
89	V	93.9	Very high	92	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.7	-37.5	172.4	171.6	0	0	0	0	112	L73 L76 Q84 D85 Y87 G91 I111 I138 A141	L73-V89 HydrophobicContact CD1-CB 4.49Å; L73-V89 HydrophobicContact CD1-CG1 4.02Å; L76-V89 HydrophobicContact CD1-CG2 3.68Å; Q84-V89 HydrophobicContact CB-CG2 4.38Å; D85-V89 WeakPolarHBondContact O-CG2 3.43Å; D85-V89 PolarHBondContact O-N 3.04Å; Y87-V89 VanDerWaalsContact C-N 3.31Å; Y87-V89 PolarHBondContact O-N 2.88Å; V89-G91 VanDerWaalsContact C-N 3.3Å; V89-I111 WeakPolarHBondContact O-CD1 3.46Å; V89-I138 HydrophobicContact CG1-CG1 4.04Å; V89-A141 HydrophobicContact CB-CB 3.97Å; V89-A141 HydrophobicContact CG1-CB 3.65Å
90	L	93.5	Very high	92.2	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	7.8	174.3	-64.5	-170.9	0	0	0	114.1	H86 Y87 A88 L92 I104 A107 H108 I111 I138 A141 I142 L145	H86-L90 PolarHBondContact O-N 3.25Å; Y87-L90 CarbonylContact O-C 3.47Å; Y87-L90 PolarHBondContact O-N 3.12Å; Y87-L90 VanDerWaalsContact O-N 3.15Å; A88-L90 VanDerWaalsContact C-N 3.26Å; A88-L90 PolarHBondContact O-N 3.43Å; L90-L92 VanDerWaalsContact C-N 3.31Å; L90-L92 PolarHBondContact O-N 3.42Å; L90-I104 HydrophobicContact CD1-CG2 3.96Å; L90-A107 WeakPolarHBondContact O-CB 3.46Å; L90-H108 HydrophobicContact CD1-CB 4.49Å; L90-H108 HydrophobicContact CD2-CB 4.27Å; L90-I111 HydrophobicContact CB-CD1 4.48Å; L90-I111 WeakPolarHBondContact O-CD1 3.32Å; L90-I138 HydrophobicContact CD2-CG2 4.21Å; L90-A141 HydrophobicContact CD2-CB 4.17Å; L90-A141 HydrophobicContact CG-CB 4.03Å; L90-I142 HydrophobicContact CD1-CD1 4.23Å; L90-L145 HydrophobicContact CD1-CD1 3.74Å; L90-L145 HydrophobicContact CG-CD1 4.33Å
91	G	91	Very high	92.4	Very high	2 Å²	2	43 Å²	43	2%	0.021	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	23.4	178.5	0	0	0	0	0	114.6	L67 E68 Y87 A88 V89 P93	L67-G91 WeakPolarHBondContact CA-O 3.38Å; E68-G91 PolarHBondContact N-O 2.98Å; E68-G91 VanDerWaalsContact N-O 3.09Å; E68-G91 WeakPolarHBondContact O-CA 3.29Å; Y87-G91 PolarHBondContact O-N 3Å; Y87-G91 VanDerWaalsContact O-N 3.1Å; A88-G91 PolarHBondContact O-N 3.19Å; V89-G91 VanDerWaalsContact C-N 3.3Å; G91-P93 WeakPolarHBondContact O-CD 3.45Å
92	L	93.4	Very high	92.4	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	22%	0.216	C	C	.	.			trans	-114.8	39.2	178.4	-59.5	178.5	0	0	0	113.9	L67 Y87 L90 H94 L95 R96 A99 I104 A107	L67-L92 HydrophobicContact CD2-CD2 3.59Å; L67-L92 HydrophobicContact CD2-CG 4.37Å; Y87-L92 WeakPolarHBondContact O-CA 3.48Å; Y87-L92 PolarHBondContact O-N 3.34Å; L90-L92 VanDerWaalsContact C-N 3.31Å; L90-L92 PolarHBondContact O-N 3.42Å; L92-H94 PolarHBondContact O-N 2.74Å; L92-L95 HydrophobicContact CD2-CD1 4.04Å; L92-L95 PolarHBondContact O-N 3.32Å; L92-R96 PolarHBondContact O-N 2.87Å; L92-R96 VanDerWaalsContact O-N 3.12Å; L92-A99 HydrophobicContact CD1-CB 4.24Å; L92-I104 HydrophobicContact CD1-CG1 4.1Å; L92-A107 HydrophobicContact CD1-CB 3.69Å; L92-A107 HydrophobicContact CD2-CB 3.95Å; L92-A107 HydrophobicContact CG-CB 3.8Å
93	P	91.3	Very high	92.5	Very high	38 Å²	38	43 Å²	43	25%	0.247	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-26.7	-175.2	30.3	-36.8	0	0	0	113.4	E68 A88 G91 R96	E68-P93 HydrophobicContact CB-CG 3.92Å; E68-P93 HydrophobicContact CG-CG 4.41Å; E68-P93 WeakPolarHBondContact OE2-CG 3.21Å; A88-P93 HydrophobicContact CB-CB 4.12Å; G91-P93 WeakPolarHBondContact O-CD 3.45Å; P93-R96 WeakPolarHBondContact O-CG 3.4Å
94	H	89.9	Confident	92.7	Very high	88 Å²	88	36.8 Å²	36.8	41%	0.407	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-28.6	178.4	56.6	-84.8	0	0	0	113.4	Q66 E68 L92	Q66-H94 PolarHBondContact O-CE1 2.96Å; E68-H94 IonicContact OE1-CE1 3.44Å; E68-H94 IonicContact OE1-CG 2.93Å; E68-H94 IonicContact OE1-ND1 3.39Å; E68-H94 PolarHBondContact OE1-ND1 3.05Å; L92-H94 PolarHBondContact O-N 2.74Å
95	L	90.9	Very high	92.8	Very high	38 Å²	38	42 Å²	42	20%	0.199	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-43.5	178	-64.1	-177.6	0	0	0	112	L92 Y97 K98 A99 Q103	L92-L95 HydrophobicContact CD2-CD1 4.04Å; L92-L95 PolarHBondContact O-N 3.32Å; L95-Y97 PolarHBondContact O-N 3.38Å; L95-K98 WeakPolarHBondContact O-CA 3.49Å; L95-K98 VanDerWaalsContact O-CB 3.25Å; L95-K98 WeakPolarHBondContact O-CB 3.43Å; L95-K98 PolarHBondContact O-N 3.31Å; L95-A99 HydrophobicContact CB-CB 3.79Å; L95-A99 HydrophobicContact CD1-CB 4.15Å; L95-Q103 HydrophobicContact CD1-CB 4.45Å
96	R	92.7	Very high	92.8	Very high	33 Å²	33	41.9 Å²	41.9	13%	0.125	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	44.4	-129.3	-174.4	-50.3	-173.3	72	75.9	2.3	111.7	D85 Y87 L92 P93 K98 A99 D158 T160	D85-R96 IonicContact OD1-NH1 3.86Å; D85-R96 IonicContact OD2-CZ 3.4Å; D85-R96 VanDerWaalsContact OD2-CZ 3.24Å; D85-R96 IonicContact OD2-NH1 2.98Å; D85-R96 PolarHBondContact OD2-NH1 3.13Å; D85-R96 IonicContact OD2-NH2 2.73Å; D85-R96 PolarHBondContact OD2-NH2 2.93Å; Y87-R96 WeakPolarHBondContact CD1-O 3.35Å; Y87-R96 HydrophobicContact CD2-CB 4.23Å; Y87-R96 VanDerWaalsContact CE1-C 3.42Å; Y87-R96 WeakPolarHBondContact CE1-O 3.36Å; Y87-R96 HydrophobicContact CE2-CB 4.49Å; Y87-R96 HydrophobicContact CG-CB 4.48Å; Y87-R96 VanDerWaalsContact CZ-O 3.28Å; L92-R96 PolarHBondContact O-N 2.87Å; L92-R96 VanDerWaalsContact O-N 3.12Å; P93-R96 WeakPolarHBondContact O-CG 3.4Å; R96-K98 PolarHBondContact O-N 2.93Å; R96-A99 VanDerWaalsContact O-CB 3.25Å; R96-A99 WeakPolarHBondContact O-CB 3.42Å; R96-A99 PolarHBondContact O-N 3.35Å; R96-D158 IonicContact CZ-OD1 2.86Å; R96-D158 IonicContact NE-OD1 3.52Å; R96-D158 PolarHBondContact NE-OD1 3.27Å; R96-D158 IonicContact NE-OD2 3.56Å; R96-D158 PolarHBondContact NE-OD2 3.21Å; R96-D158 IonicContact NH2-OD1 2.85Å; R96-D158 PolarHBondContact NH2-OD1 2.86Å; R96-T160 PolarHBondContact NE-OG1 3Å; R96-T160 VanDerWaalsContact NE-OG1 3.14Å
97	Y	91.9	Very high	92.7	Very high	92 Å²	92	41.9 Å²	41.9	36%	0.361	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-56.6	-18.4	177.1	79.4	-84.6	0	0	0	114.9	L95 A99 R151 R188	L95-Y97 PolarHBondContact O-N 3.38Å; Y97-A99 VanDerWaalsContact C-N 3.33Å; Y97-R151 PolarHBondContact O-NH2 3Å; Y97-R188 VanDerWaalsContact CB-NH2 3.28Å; Y97-R188 VanDerWaalsContact CD1-CZ 3.43Å; Y97-R188 VanDerWaalsContact CD1-NH1 3.34Å; Y97-R188 HydrophobicContact CE2-CB 4.44Å; Y97-R188 VanDerWaalsContact CG-CZ 3.44Å; Y97-R188 VanDerWaalsContact CG-NH2 3.26Å
98	K	92.5	Very high	92.6	Very high	142 Å²	142	44.1 Å²	44.1	62%	0.617	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-80.9	-12.7	175.9	-57.2	-178.8	177.3	178.8	0	113	L95 R96 T100	L95-K98 WeakPolarHBondContact O-CA 3.49Å; L95-K98 VanDerWaalsContact O-CB 3.25Å; L95-K98 WeakPolarHBondContact O-CB 3.43Å; L95-K98 PolarHBondContact O-N 3.31Å; R96-K98 PolarHBondContact O-N 2.93Å; K98-T100 PolarHBondContact O-N 3.41Å
99	A	93.5	Very high	92.6	Very high	3 Å²	3	50.6 Å²	50.6	3%	0.025	24%	0.241	C	C	.	.			trans	-61.8	131.7	-179.1	0	0	0	0	0	111.4	Y87 L92 L95 R96 Y97 I104 R151	Y87-A99 HydrophobicContact CD1-CB 4.43Å; Y87-A99 HydrophobicContact CE1-CB 4.14Å; L92-A99 HydrophobicContact CD1-CB 4.24Å; L95-A99 HydrophobicContact CB-CB 3.79Å; L95-A99 HydrophobicContact CD1-CB 4.15Å; R96-A99 VanDerWaalsContact O-CB 3.25Å; R96-A99 WeakPolarHBondContact O-CB 3.42Å; R96-A99 PolarHBondContact O-N 3.35Å; Y97-A99 VanDerWaalsContact C-N 3.33Å; A99-I104 HydrophobicContact CB-CD1 4.19Å; A99-I104 HydrophobicContact CB-CG1 3.94Å; A99-R151 PolarHBondContact O-NH1 3.48Å; A99-R151 PolarHBondContact O-NH2 3.34Å
100	T	93.4	Very high	92.4	Very high	72 Å²	72	52.6 Å²	52.6	44%	0.442	26%	0.255	S	S	.	.			trans	-76.3	160.7	174.1	72.4	0	0	0	0	110.7	K98 K102 Q103 I104	K98-T100 PolarHBondContact O-N 3.41Å; T100-K102 PolarHBondContact O-N 2.88Å; T100-Q103 PolarHBondContact O-N 3.43Å; T100-Q103 VanDerWaalsContact OG1-CG 3.24Å; T100-Q103 WeakPolarHBondContact OG1-CG 3.29Å; T100-Q103 PolarHBondContact OG1-N 3Å; T100-Q103 PolarHBondContact OG1-OE1 3.47Å; T100-I104 WeakPolarHBondContact O-CG1 3.48Å; T100-I104 PolarHBondContact O-N 3.21Å
101	Q	92.6	Very high	92.3	Very high	58 Å²	58	53.3 Å²	53.3	27%	0.271	26%	0.258	S	S	.	.	H	α-helix	trans	-59.5	-35.8	176.5	-169	66.8	14.7	0	0	112	I104 K105 S146	Q101-I104 PolarHBondContact O-N 2.73Å; Q101-K105 WeakPolarHBondContact O-CG 3.49Å; Q101-K105 PolarHBondContact O-N 2.9Å; Q101-S146 VanDerWaalsContact NE2-CA 3.28Å; Q101-S146 PolarHBondContact NE2-O 3.41Å
102	K	90.8	Very high	92.3	Very high	95 Å²	95	54.7 Å²	54.7	41%	0.413	27%	0.266	S	S	.	.	H	α-helix	trans	-62.5	-48.2	175	-173.8	-176.9	177.8	-161.5	0	111	E58 T100 I104 K105 A106	E58-K102 PolarHBondContact O-NZ 3.34Å; T100-K102 PolarHBondContact O-N 2.88Å; K102-I104 VanDerWaalsContact C-N 3.35Å; K102-I104 PolarHBondContact O-N 3.43Å; K102-K105 PolarHBondContact O-N 2.98Å; K102-A106 WeakPolarHBondContact O-CB 3.26Å; K102-A106 PolarHBondContact O-N 2.95Å
103	Q	92.8	Very high	92.1	Very high	38 Å²	38	59.1 Å²	59.1	18%	0.178	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-42.5	177.8	-69.5	172.9	-33.2	0	0	111.9	L65 L95 T100 A106 A107	L65-Q103 HydrophobicContact CD2-CB 4.24Å; L65-Q103 HydrophobicContact CD2-CG 3.75Å; L95-Q103 HydrophobicContact CD1-CB 4.45Å; T100-Q103 PolarHBondContact O-N 3.43Å; T100-Q103 VanDerWaalsContact OG1-CG 3.24Å; T100-Q103 WeakPolarHBondContact OG1-CG 3.29Å; T100-Q103 PolarHBondContact OG1-N 3Å; T100-Q103 PolarHBondContact OG1-OE1 3.47Å; Q103-A106 PolarHBondContact O-N 3.48Å; Q103-A107 WeakPolarHBondContact O-CB 3.38Å; Q103-A107 PolarHBondContact O-N 3.43Å
104	I	94.9	Very high	91.9	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62	-46.8	176.8	-69.1	164.5	0	0	0	111.4	Y87 L90 L92 A99 T100 Q101 K102 A107 H108 I142 L145 R151	Y87-I104 HydrophobicContact CE1-CD1 4.31Å; L90-I104 HydrophobicContact CD1-CG2 3.96Å; L92-I104 HydrophobicContact CD1-CG1 4.1Å; A99-I104 HydrophobicContact CB-CD1 4.19Å; A99-I104 HydrophobicContact CB-CG1 3.94Å; T100-I104 WeakPolarHBondContact O-CG1 3.48Å; T100-I104 PolarHBondContact O-N 3.21Å; Q101-I104 PolarHBondContact O-N 2.73Å; K102-I104 VanDerWaalsContact C-N 3.35Å; K102-I104 PolarHBondContact O-N 3.43Å; I104-A107 PolarHBondContact O-N 3.1Å; I104-H108 WeakPolarHBondContact O-CB 3.49Å; I104-H108 PolarHBondContact O-N 3.32Å; I104-I142 HydrophobicContact CG2-CD1 3.63Å; I104-L145 HydrophobicContact CD1-CB 4.31Å; I104-L145 HydrophobicContact CG2-CB 3.89Å; I104-R151 VanDerWaalsContact CD1-CZ 3.47Å
105	K	93	Very high	91.9	Very high	128 Å²	128	59.4 Å²	59.4	56%	0.557	29%	0.286	S	S	*	.	H	α-helix	trans	-63.5	-42.9	178.1	-73.1	176.2	179.6	179	0	111.9	Q101 K102 H108 K109	Q101-K105 WeakPolarHBondContact O-CG 3.49Å; Q101-K105 PolarHBondContact O-N 2.9Å; K102-K105 PolarHBondContact O-N 2.98Å; K105-H108 PolarHBondContact O-N 3.14Å; K105-K109 PolarHBondContact O-N 3.19Å
106	A	92.3	Very high	91.8	Very high	39 Å²	39	60.3 Å²	60.3	32%	0.322	29%	0.289	S	S	.	.	H	α-helix	trans	-65.9	-44.1	178.7	0	0	0	0	0	112	L65 K102 Q103 K109 S110	L65-A106 HydrophobicContact CD1-CB 3.44Å; L65-A106 VanDerWaalsContact CD1-CB 3.44Å; K102-A106 WeakPolarHBondContact O-CB 3.26Å; K102-A106 PolarHBondContact O-N 2.95Å; Q103-A106 PolarHBondContact O-N 3.48Å; A106-K109 PolarHBondContact O-N 3.01Å; A106-S110 PolarHBondContact O-N 3.22Å
107	A	92.9	Very high	91.7	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.6	-45.8	175.2	0	0	0	0	0	112	L67 L90 L92 Q103 I104 K109 S110 I111	L67-A107 HydrophobicContact CD2-CB 3.57Å; L90-A107 WeakPolarHBondContact O-CB 3.46Å; L92-A107 HydrophobicContact CD1-CB 3.69Å; L92-A107 HydrophobicContact CD2-CB 3.95Å; L92-A107 HydrophobicContact CG-CB 3.8Å; Q103-A107 WeakPolarHBondContact O-CB 3.38Å; Q103-A107 PolarHBondContact O-N 3.43Å; I104-A107 PolarHBondContact O-N 3.1Å; A107-K109 PolarHBondContact O-N 3.44Å; A107-S110 WeakPolarHBondContact O-CB 2.93Å; A107-S110 PolarHBondContact O-N 2.86Å; A107-I111 PolarHBondContact O-N 3Å
108	H	94.4	Very high	91.4	Very high	49 Å²	49	61.2 Å²	61.2	23%	0.227	30%	0.304	C	S	.	.	H	α-helix	trans	-58.3	-47.1	174.1	171.7	-106.3	0	0	0	112.1	L90 I104 K105 S110 I111 V112 I142	L90-H108 HydrophobicContact CD1-CB 4.49Å; L90-H108 HydrophobicContact CD2-CB 4.27Å; I104-H108 WeakPolarHBondContact O-CB 3.49Å; I104-H108 PolarHBondContact O-N 3.32Å; K105-H108 PolarHBondContact O-N 3.14Å; H108-S110 VanDerWaalsContact C-N 3.31Å; H108-S110 PolarHBondContact O-N 3.01Å; H108-I111 PolarHBondContact O-N 3.42Å; H108-V112 VanDerWaalsContact NE2-CG2 3.3Å; H108-V112 WeakPolarHBondContact NE2-CG2 3.42Å; H108-V112 WeakPolarHBondContact O-CB 3.25Å; H108-V112 VanDerWaalsContact O-CG2 3.28Å; H108-V112 WeakPolarHBondContact O-CG2 3.44Å; H108-V112 PolarHBondContact O-N 3.36Å; H108-I142 HydrophobicContact CB-CB 4.49Å; H108-I142 HydrophobicContact CB-CD1 3.84Å; H108-I142 HydrophobicContact CB-CG1 4.14Å
109	K	92.4	Very high	91.1	Very high	147 Å²	147	59 Å²	59	64%	0.639	30%	0.295	S	S	*	.	H	α-helix	trans	-56.7	-45.9	176.2	-175.6	-178.5	177.9	-176.3	0	111.2	K105 A106 A107 L113	K105-K109 PolarHBondContact O-N 3.19Å; A106-K109 PolarHBondContact O-N 3.01Å; A107-K109 PolarHBondContact O-N 3.44Å; K109-L113 HydrophobicContact CG-CD1 4.38Å; K109-L113 WeakPolarHBondContact O-CG 3.23Å; K109-L113 PolarHBondContact O-N 3.11Å
110	S	90.5	Very high	90.9	Very high	42 Å²	42	59.6 Å²	59.6	29%	0.294	30%	0.296	S	S	.	.	H	α-helix	trans	-61.8	-45.4	178.7	-172.1	0	0	0	0	112.6	L67 A106 A107 H108 L113 K114	L67-S110 VanDerWaalsContact CD1-OG 3.3Å; L67-S110 WeakPolarHBondContact CD1-OG 3.14Å; A106-S110 PolarHBondContact O-N 3.22Å; A107-S110 WeakPolarHBondContact O-CB 2.93Å; A107-S110 PolarHBondContact O-N 2.86Å; H108-S110 VanDerWaalsContact C-N 3.31Å; H108-S110 PolarHBondContact O-N 3.01Å; S110-L113 PolarHBondContact O-N 3.28Å; S110-K114 PolarHBondContact O-N 3.37Å
111	I	90.4	Very high	90.6	Very high	14 Å²	14	63.4 Å²	63.4	7%	0.072	31%	0.307	C	S	.	.	H	α-helix	trans	-69.3	-40	179.7	-80.3	173	0	0	0	112.4	V89 L90 A107 H108 L113 K114 H115 I138	V89-I111 WeakPolarHBondContact O-CD1 3.46Å; L90-I111 HydrophobicContact CB-CD1 4.48Å; L90-I111 WeakPolarHBondContact O-CD1 3.32Å; A107-I111 PolarHBondContact O-N 3Å; H108-I111 PolarHBondContact O-N 3.42Å; I111-L113 VanDerWaalsContact C-N 3.29Å; I111-L113 PolarHBondContact O-N 3.41Å; I111-K114 PolarHBondContact O-N 3.39Å; I111-K114 VanDerWaalsContact O-N 3.12Å; I111-H115 WeakPolarHBondContact O-CB 3.39Å; I111-H115 PolarHBondContact O-CD2 3.43Å; I111-H115 PolarHBondContact O-N 2.95Å; I111-I138 HydrophobicContact CG2-CD1 3.58Å; I111-I138 HydrophobicContact CG2-CG1 3.96Å; I111-I138 HydrophobicContact CG2-CG2 3.74Å
112	V	91.8	Very high	90.3	Very high	32 Å²	32	65.1 Å²	65.1	19%	0.194	33%	0.331	C	S	.	.	H	α-helix	trans	-60.7	-41.6	174	170.1	0	0	0	0	110.4	H108 K114 H115 H116 F135 I138	H108-V112 VanDerWaalsContact NE2-CG2 3.3Å; H108-V112 WeakPolarHBondContact NE2-CG2 3.42Å; H108-V112 WeakPolarHBondContact O-CB 3.25Å; H108-V112 VanDerWaalsContact O-CG2 3.28Å; H108-V112 WeakPolarHBondContact O-CG2 3.44Å; H108-V112 PolarHBondContact O-N 3.36Å; V112-K114 PolarHBondContact O-N 2.92Å; V112-K114 VanDerWaalsContact O-N 3.15Å; V112-H115 PolarHBondContact O-N 2.92Å; V112-H116 HydrophobicContact CG1-CB 4.18Å; V112-H116 WeakPolarHBondContact O-CB 3.49Å; V112-H116 PolarHBondContact O-N 3.14Å; V112-F135 HydrophobicContact CG1-CZ 4.35Å; V112-F135 HydrophobicContact CG2-CE2 4.21Å; V112-F135 HydrophobicContact CG2-CZ 4.09Å; V112-I138 HydrophobicContact CG2-CG2 4.46Å
113	L	89.7	Confident	90.1	Very high	93 Å²	93	64.3 Å²	64.3	49%	0.487	34%	0.342	S	S	.	.	H	α-helix	trans	-61.2	-25.6	177.9	-71.3	170.3	0	0	0	113.3	K109 S110 I111 K119	K109-L113 HydrophobicContact CG-CD1 4.38Å; K109-L113 WeakPolarHBondContact O-CG 3.23Å; K109-L113 PolarHBondContact O-N 3.11Å; S110-L113 PolarHBondContact O-N 3.28Å; I111-L113 VanDerWaalsContact C-N 3.29Å; I111-L113 PolarHBondContact O-N 3.41Å; L113-K119 WeakPolarHBondContact O-CD 3.45Å; L113-K119 PolarHBondContact O-NZ 3.02Å
114	K	86.7	Confident	89.6	Confident	107 Å²	107	65.7 Å²	65.7	47%	0.465	37%	0.366	S	S	.	.	H	α-helix	trans	-91.2	-42.4	176.7	-69.1	-178.6	174.3	-173.5	0	113.1	E69 S110 I111 V112	E69-K114 IonicContact OE1-NZ 3.75Å; E69-K114 PolarHBondContact OE1-NZ 2.63Å; S110-K114 PolarHBondContact O-N 3.37Å; I111-K114 PolarHBondContact O-N 3.39Å; I111-K114 VanDerWaalsContact O-N 3.12Å; V112-K114 PolarHBondContact O-N 2.92Å; V112-K114 VanDerWaalsContact O-N 3.15Å
115	H	89.1	Confident	89.2	Confident	25 Å²	25	68.6 Å²	68.6	12%	0.116	38%	0.38	C	S	.	.	H	α-helix	trans	-110.5	0.5	-164.9	-64.6	-77.9	0	0	0	115.2	I111 V112 R120 Y134 F135 I138	I111-H115 WeakPolarHBondContact O-CB 3.39Å; I111-H115 PolarHBondContact O-CD2 3.43Å; I111-H115 PolarHBondContact O-N 2.95Å; V112-H115 PolarHBondContact O-N 2.92Å; H115-R120 WeakPolarHBondContact O-CD 3.39Å; H115-Y134 HydrophobicContact CB-CE2 4.11Å; H115-Y134 AromaticContact ND1-CE2 3.91Å; H115-Y134 AromaticContact ND1-CZ 3.84Å; H115-Y134 PolarHBondContact ND1-OH 2.89Å; H115-F135 HydrophobicContact CB-CD2 4.36Å; H115-F135 WeakPolarHBondContact O-CD2 3.28Å; H115-I138 HydrophobicContact CB-CD1 3.74Å
116	H	90.2	Very high	88.4	Confident	58 Å²	58	71.5 Å²	71.5	27%	0.269	40%	0.395	S	S	.	.			trans	-58.7	137.7	178.8	-167.6	-89	0	0	0	112.3	V112 D118 K119 R120 F135	V112-H116 HydrophobicContact CG1-CB 4.18Å; V112-H116 WeakPolarHBondContact O-CB 3.49Å; V112-H116 PolarHBondContact O-N 3.14Å; H116-D118 IonicContact CE1-OD2 3.34Å; H116-D118 PolarHBondContact CE1-OD2 3.46Å; H116-D118 VanDerWaalsContact CE1-OD2 3.26Å; H116-D118 PolarHBondContact ND1-N 3.1Å; H116-D118 VanDerWaalsContact ND1-N 3.16Å; H116-D118 IonicContact ND1-OD2 3.41Å; H116-D118 PolarHBondContact O-N 3.21Å; H116-K119 HydrophobicContact CB-CB 4.48Å; H116-K119 HydrophobicContact CB-CD 4.47Å; H116-K119 HydrophobicContact CB-CG 4.33Å; H116-K119 PolarHBondContact O-N 2.88Å; H116-K119 VanDerWaalsContact O-N 3.1Å; H116-R120 PolarHBondContact O-N 3.35Å; H116-F135 HydrophobicContact CB-CE2 4.21Å; H116-F135 HydrophobicContact CB-CZ 4.38Å; H116-F135 AromaticContact CD2-CZ 3.59Å
117	P	89.1	Confident	87.9	Confident	31 Å²	31	72 Å²	72	20%	0.201	39%	0.392	C	S	.	.	H	α-helix	trans	-51.1	-50.4	-180	-29.7	36.1	0	0	0	112.9	K119 R120 K121 I127 F135	P117-K119 VanDerWaalsContact C-N 3.27Å; P117-K119 PolarHBondContact O-N 3.27Å; P117-R120 PolarHBondContact O-N 3.05Å; P117-K121 WeakPolarHBondContact O-CB 3.37Å; P117-K121 PolarHBondContact O-N 3.25Å; P117-I127 HydrophobicContact CB-CD1 4.11Å; P117-I127 HydrophobicContact CB-CG2 4.34Å; P117-I127 WeakPolarHBondContact O-CD1 3.49Å; P117-F135 HydrophobicContact CG-CB 4.22Å; P117-F135 HydrophobicContact CG-CD1 3.96Å; P117-F135 HydrophobicContact CG-CG 4.05Å
118	D	86.8	Confident	87.2	Confident	112 Å²	112	75.9 Å²	75.9	60%	0.599	42%	0.415	S	S	*	.	H	α-helix	trans	-58.3	-37.2	-179.3	-64.4	-20.3	0	0	0	113.7	H116 A122	H116-D118 IonicContact CE1-OD2 3.34Å; H116-D118 PolarHBondContact CE1-OD2 3.46Å; H116-D118 VanDerWaalsContact CE1-OD2 3.26Å; H116-D118 PolarHBondContact ND1-N 3.1Å; H116-D118 VanDerWaalsContact ND1-N 3.16Å; H116-D118 IonicContact ND1-OD2 3.41Å; H116-D118 PolarHBondContact O-N 3.21Å; D118-A122 WeakPolarHBondContact O-CB 3.38Å; D118-A122 PolarHBondContact O-N 2.9Å
119	K	86.4	Confident	86.2	Confident	96 Å²	96	82 Å²	82	42%	0.417	44%	0.444	S	S	.	.	H	α-helix	trans	-74.2	-40.8	179.7	-67.4	-171	172.4	-151.5	0	112	L113 H116 P117 K121 A122 A123	L113-K119 WeakPolarHBondContact O-CD 3.45Å; L113-K119 PolarHBondContact O-NZ 3.02Å; H116-K119 HydrophobicContact CB-CB 4.48Å; H116-K119 HydrophobicContact CB-CD 4.47Å; H116-K119 HydrophobicContact CB-CG 4.33Å; H116-K119 PolarHBondContact O-N 2.88Å; H116-K119 VanDerWaalsContact O-N 3.1Å; P117-K119 VanDerWaalsContact C-N 3.27Å; P117-K119 PolarHBondContact O-N 3.27Å; K119-K121 VanDerWaalsContact C-N 3.31Å; K119-A122 PolarHBondContact O-N 3.5Å; K119-A123 PolarHBondContact O-N 2.86Å
120	R	88.3	Confident	85.4	Confident	15 Å²	15	78 Å²	78	6%	0.057	44%	0.444	C	S	.	.	H	α-helix	trans	-64.6	-37.1	174.1	-74.7	168.7	58.3	-150.5	-8	111.6	H115 H116 P117 A123 G124 E125 I127 D133 Y134	H115-R120 WeakPolarHBondContact O-CD 3.39Å; H116-R120 PolarHBondContact O-N 3.35Å; P117-R120 PolarHBondContact O-N 3.05Å; R120-A123 CarbonylContact O-C 3.53Å; R120-A123 PolarHBondContact O-N 3.42Å; R120-G124 PolarHBondContact O-N 2.96Å; R120-E125 HydrophobicContact CB-CB 4.21Å; R120-E125 HydrophobicContact CB-CG 4.48Å; R120-E125 WeakPolarHBondContact CG-OE2 3.41Å; R120-E125 IonicContact CZ-OE2 2.84Å; R120-E125 IonicContact NE-OE2 2.78Å; R120-E125 PolarHBondContact NE-OE2 3.31Å; R120-E125 IonicContact NH2-OE2 3.64Å; R120-E125 PolarHBondContact O-N 2.91Å; R120-I127 HydrophobicContact CB-CD1 4.35Å; R120-D133 IonicContact CZ-OD1 2.68Å; R120-D133 IonicContact CZ-OD2 3.82Å; R120-D133 IonicContact NH1-OD1 2.8Å; R120-D133 PolarHBondContact NH1-OD1 3.41Å; R120-D133 IonicContact NH1-OD2 3.56Å; R120-D133 PolarHBondContact NH1-OD2 3.01Å; R120-D133 IonicContact NH2-OD2 3.51Å; R120-D133 PolarHBondContact NH2-OD2 2.88Å; R120-Y134 WeakPolarHBondContact CD-OH 3.45Å; R120-Y134 VanDerWaalsContact CZ-OH 3.29Å; R120-Y134 PolarHBondContact NE-OH 3.07Å; R120-Y134 PolarHBondContact NH1-OH 2.92Å
121	K	87.1	Confident	84.8	Confident	152 Å²	152	82.2 Å²	82.2	66%	0.661	46%	0.464	S	S	*	.	H	α-helix	trans	-63.6	-44.6	174.3	-161.6	173.3	179.1	173.8	0	111	P117 K119 A123 G124 I127	P117-K121 WeakPolarHBondContact O-CB 3.37Å; P117-K121 PolarHBondContact O-N 3.25Å; K119-K121 VanDerWaalsContact C-N 3.31Å; K121-A123 PolarHBondContact O-N 2.94Å; K121-G124 PolarHBondContact O-N 3.41Å; K121-I127 HydrophobicContact CB-CD1 3.55Å; K121-I127 HydrophobicContact CG-CD1 4.2Å
122	A	87.2	Confident	84.4	Confident	94 Å²	94	86 Å²	86	78%	0.777	48%	0.484	S	S	*	.	H	α-helix	trans	-63.3	-29.9	174.8	0	0	0	0	0	112.6	D118 K119 G124	D118-A122 WeakPolarHBondContact O-CB 3.38Å; D118-A122 PolarHBondContact O-N 2.9Å; K119-A122 PolarHBondContact O-N 3.5Å; A122-G124 VanDerWaalsContact C-N 3.27Å; A122-G124 PolarHBondContact O-N 2.98Å
123	A	86.4	Confident	84.3	Confident	79 Å²	79	84.9 Å²	84.9	65%	0.653	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	0.2	172.7	0	0	0	0	0	114.1	K119 R120 K121	K119-A123 PolarHBondContact O-N 2.86Å; R120-A123 CarbonylContact O-C 3.53Å; R120-A123 PolarHBondContact O-N 3.42Å; K121-A123 PolarHBondContact O-N 2.94Å
124	G	82.9	Confident	84.3	Confident	66 Å²	66	81 Å²	81	68%	0.68	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	12.4	176.9	0	0	0	0	0	115.6	R120 K121 A122	R120-G124 PolarHBondContact O-N 2.96Å; K121-G124 PolarHBondContact O-N 3.41Å; A122-G124 VanDerWaalsContact C-N 3.27Å; A122-G124 PolarHBondContact O-N 2.98Å
125	E	84.9	Confident	84.5	Confident	61 Å²	61	77.2 Å²	77.2	29%	0.285	44%	0.439	S	S	.	.			trans	-74.6	143.5	175.1	-62	-169.6	175.1	0	0	111.5	R74 R120	R74-E125 IonicContact CZ-OE1 3.69Å; R74-E125 IonicContact NH1-OE1 3.93Å; R74-E125 PolarHBondContact NH1-OE1 3.45Å; R74-E125 IonicContact NH1-OE2 3.39Å; R74-E125 IonicContact NH2-OE1 2.81Å; R74-E125 PolarHBondContact NH2-OE1 3.21Å; R74-E125 IonicContact NH2-OE2 3.25Å; R120-E125 HydrophobicContact CB-CB 4.21Å; R120-E125 HydrophobicContact CB-CG 4.48Å; R120-E125 WeakPolarHBondContact CG-OE2 3.41Å; R120-E125 IonicContact CZ-OE2 2.84Å; R120-E125 IonicContact NE-OE2 2.78Å; R120-E125 PolarHBondContact NE-OE2 3.31Å; R120-E125 IonicContact NH2-OE2 3.64Å; R120-E125 PolarHBondContact O-N 2.91Å
126	Q	77.3	Confident	84.7	Confident	190 Å²	190	77.3 Å²	77.3	89%	0.888	44%	0.441	S	S	*	.			trans	-74.6	128.6	168.9	-71.5	-176	-7	0	0	109.7
127	I	80.9	Confident	84.9	Confident	49 Å²	49	74.5 Å²	74.5	25%	0.251	43%	0.429	S	S	.	.			trans	-112.7	134.4	-176.8	-59.3	170.6	0	0	0	108.5	P117 R120 K121	P117-I127 HydrophobicContact CB-CD1 4.11Å; P117-I127 HydrophobicContact CB-CG2 4.34Å; P117-I127 WeakPolarHBondContact O-CD1 3.49Å; R120-I127 HydrophobicContact CB-CD1 4.35Å; K121-I127 HydrophobicContact CB-CD1 3.55Å; K121-I127 HydrophobicContact CG-CD1 4.2Å
128	V	78.9	Confident	85.2	Confident	81 Å²	81	73 Å²	73	49%	0.491	42%	0.419	S	S	.	.			trans	-74.1	128	171.7	-174.5	0	0	0	0	108.1	N132 D133	V128-N132 HydrophobicContact CG1-CB 3.65Å; V128-D133 HydrophobicContact CB-CB 4.32Å
129	E	73.4	Confident	85.5	Confident	179 Å²	179	70 Å²	70	84%	0.836	41%	0.405	S	S	*	.			trans	-71.9	142.4	-176.8	-68.4	-174.7	165.2	0	0	112.7
130	G	76	Confident	86	Confident	61 Å²	61	68.1 Å²	68.1	63%	0.629	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	72.8	-151.5	175.7	0	0	0	0	0	114	N132	G130-N132 PolarHBondContact O-N 2.98Å
131	D	76.6	Confident	86.3	Confident	132 Å²	132	67.4 Å²	67.4	71%	0.706	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-73	0.7	-171.9	-61.3	-19.5	0	0	0	114.1	P78 T136	P78-D131 VanDerWaalsContact CB-O 3.31Å; P78-D131 WeakPolarHBondContact CB-O 3.3Å; D131-T136 PolarHBondContact O-OG1 3.28Å
132	N	83.3	Confident	86.8	Confident	92 Å²	92	61.2 Å²	61.2	49%	0.492	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-87.8	-3.5	-178.2	-60.4	-61.7	0	0	0	113.9	V128 G130	V128-N132 HydrophobicContact CG1-CB 3.65Å; G130-N132 PolarHBondContact O-N 2.98Å
133	D	89.3	Confident	87.2	Confident	9 Å²	9	60.2 Å²	60.2	5%	0.048	35%	0.347	C	S	.	.	S	Bend	trans	-81.1	145.5	172.7	-172.2	-93.4	0	0	0	111.5	P78 R120 V128 F135 T136	P78-D133 VanDerWaalsContact CG-C 3.5Å; P78-D133 WeakPolarHBondContact CG-O 3.33Å; R120-D133 IonicContact CZ-OD1 2.68Å; R120-D133 IonicContact CZ-OD2 3.82Å; R120-D133 IonicContact NH1-OD1 2.8Å; R120-D133 PolarHBondContact NH1-OD1 3.41Å; R120-D133 IonicContact NH1-OD2 3.56Å; R120-D133 PolarHBondContact NH1-OD2 3.01Å; R120-D133 IonicContact NH2-OD2 3.51Å; R120-D133 PolarHBondContact NH2-OD2 2.88Å; V128-D133 HydrophobicContact CB-CB 4.32Å; D133-F135 PolarHBondContact O-N 2.88Å; D133-F135 WeakPolarHBondContact OD1-CB 3.16Å; D133-F135 PolarHBondContact OD1-N 3.31Å; D133-T136 VanDerWaalsContact O-CB 3.32Å; D133-T136 WeakPolarHBondContact O-CB 3.2Å; D133-T136 PolarHBondContact O-N 2.96Å; D133-T136 PolarHBondContact O-OG1 2.9Å
134	Y	88.9	Confident	87.7	Confident	12 Å²	12	57 Å²	57	5%	0.047	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-19	179.2	77.4	-97.4	0	0	0	113.1	L73 R74 H115 R120 T136 C137 I138	L73-Y134 HydrophobicContact CG-CD2 4.17Å; L73-Y134 HydrophobicContact CG-CE2 4.21Å; R74-Y134 HydrophobicContact CB-CD1 4.3Å; R74-Y134 HydrophobicContact CB-CE1 4.17Å; R74-Y134 HydrophobicContact CG-CD1 4.47Å; R74-Y134 HydrophobicContact CG-CE1 3.88Å; H115-Y134 HydrophobicContact CB-CE2 4.11Å; H115-Y134 AromaticContact ND1-CE2 3.91Å; H115-Y134 AromaticContact ND1-CZ 3.84Å; H115-Y134 PolarHBondContact ND1-OH 2.89Å; R120-Y134 WeakPolarHBondContact CD-OH 3.45Å; R120-Y134 VanDerWaalsContact CZ-OH 3.29Å; R120-Y134 PolarHBondContact NE-OH 3.07Å; R120-Y134 PolarHBondContact NH1-OH 2.92Å; Y134-T136 PolarHBondContact O-N 2.97Å; Y134-C137 WeakPolarHBondContact O-CB 3.47Å; Y134-C137 PolarHBondContact O-N 3.42Å; Y134-I138 HydrophobicContact CD2-CD1 4.43Å; Y134-I138 HydrophobicContact CE2-CD1 4.12Å
135	F	92.1	Very high	88.3	Confident	28 Å²	28	53.9 Å²	53.9	12%	0.123	29%	0.286	C	S	.	.	H	α-helix	trans	-58	-28.7	172.7	-170.7	-100.1	0	0	0	112.5	V112 H115 H116 P117 D133 C137 I138 T139	V112-F135 HydrophobicContact CG1-CZ 4.35Å; V112-F135 HydrophobicContact CG2-CE2 4.21Å; V112-F135 HydrophobicContact CG2-CZ 4.09Å; H115-F135 HydrophobicContact CB-CD2 4.36Å; H115-F135 WeakPolarHBondContact O-CD2 3.28Å; H116-F135 HydrophobicContact CB-CE2 4.21Å; H116-F135 HydrophobicContact CB-CZ 4.38Å; H116-F135 AromaticContact CD2-CZ 3.59Å; P117-F135 HydrophobicContact CG-CB 4.22Å; P117-F135 HydrophobicContact CG-CD1 3.96Å; P117-F135 HydrophobicContact CG-CG 4.05Å; D133-F135 PolarHBondContact O-N 2.88Å; D133-F135 WeakPolarHBondContact OD1-CB 3.16Å; D133-F135 PolarHBondContact OD1-N 3.31Å; F135-C137 PolarHBondContact O-N 3.43Å; F135-I138 HydrophobicContact CD2-CB 4.49Å; F135-I138 HydrophobicContact CD2-CD1 3.84Å; F135-I138 HydrophobicContact CE2-CD1 4.32Å; F135-I138 WeakPolarHBondContact O-CB 3.43Å; F135-I138 PolarHBondContact O-N 2.9Å; F135-T139 PolarHBondContact O-N 3.24Å; F135-T139 PolarHBondContact O-OG1 3.43Å
136	T	93.1	Very high	88.8	Confident	26 Å²	26	53.1 Å²	53.1	16%	0.16	29%	0.288	C	S	.	.	H	α-helix	trans	-57.2	-35.7	170.8	-56.9	0	0	0	0	111.9	P78 D131 D133 Y134 I138 T139 K140	P78-T136 HydrophobicContact CB-CG2 4.19Å; D131-T136 PolarHBondContact O-OG1 3.28Å; D133-T136 VanDerWaalsContact O-CB 3.32Å; D133-T136 WeakPolarHBondContact O-CB 3.2Å; D133-T136 PolarHBondContact O-N 2.96Å; D133-T136 PolarHBondContact O-OG1 2.9Å; Y134-T136 PolarHBondContact O-N 2.97Å; T136-I138 VanDerWaalsContact C-N 3.32Å; T136-I138 PolarHBondContact O-N 3.48Å; T136-T139 PolarHBondContact O-N 3.46Å; T136-K140 HydrophobicContact CG2-CG 4.34Å; T136-K140 WeakPolarHBondContact O-CB 3.42Å; T136-K140 VanDerWaalsContact O-CG 3.29Å; T136-K140 WeakPolarHBondContact O-CG 3.34Å; T136-K140 PolarHBondContact O-N 3.35Å
137	C	94.2	Very high	89.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-62.1	-39.7	174.9	-55.8	0	0	0	0	111.6	L76 Q84 Y134 F135 K140 A141	L76-C137 HydrophobicContact CD1-CB 4.32Å; Q84-C137 VanDerWaalsContact OE1-CB 3.27Å; Q84-C137 PolarHBondContact OE1-SG 3.05Å; Q84-C137 VanDerWaalsContact OE1-SG 3.36Å; Y134-C137 WeakPolarHBondContact O-CB 3.47Å; Y134-C137 PolarHBondContact O-N 3.42Å; F135-C137 PolarHBondContact O-N 3.43Å; C137-K140 PolarHBondContact O-N 2.95Å; C137-A141 WeakPolarHBondContact O-CB 3.27Å; C137-A141 PolarHBondContact O-N 3.49Å
138	I	94.3	Very high	90.2	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65	-45	176.4	-62.7	164.6	0	0	0	110.1	L73 V89 L90 I111 V112 H115 Y134 F135 T136 K140 A141 I142	L73-I138 HydrophobicContact CD1-CG1 4.35Å; L73-I138 HydrophobicContact CD2-CD1 4.3Å; V89-I138 HydrophobicContact CG1-CG1 4.04Å; L90-I138 HydrophobicContact CD2-CG2 4.21Å; I111-I138 HydrophobicContact CG2-CD1 3.58Å; I111-I138 HydrophobicContact CG2-CG1 3.96Å; I111-I138 HydrophobicContact CG2-CG2 3.74Å; V112-I138 HydrophobicContact CG2-CG2 4.46Å; H115-I138 HydrophobicContact CB-CD1 3.74Å; Y134-I138 HydrophobicContact CD2-CD1 4.43Å; Y134-I138 HydrophobicContact CE2-CD1 4.12Å; F135-I138 HydrophobicContact CD2-CB 4.49Å; F135-I138 HydrophobicContact CD2-CD1 3.84Å; F135-I138 HydrophobicContact CE2-CD1 4.32Å; F135-I138 WeakPolarHBondContact O-CB 3.43Å; F135-I138 PolarHBondContact O-N 2.9Å; T136-I138 VanDerWaalsContact C-N 3.32Å; T136-I138 PolarHBondContact O-N 3.48Å; I138-K140 PolarHBondContact O-N 3.44Å; I138-A141 PolarHBondContact O-N 2.84Å; I138-I142 PolarHBondContact O-N 3.3Å; I138-I142 VanDerWaalsContact O-N 3.11Å
139	T	94.9	Very high	90.9	Very high	49 Å²	49	49.9 Å²	49.9	30%	0.301	28%	0.283	S	S	.	.	H	α-helix	trans	-59.3	-46	175.5	-55.1	0	0	0	0	111.3	F135 T136 A141 I142 E143	F135-T139 PolarHBondContact O-N 3.24Å; F135-T139 PolarHBondContact O-OG1 3.43Å; T136-T139 PolarHBondContact O-N 3.46Å; T139-A141 PolarHBondContact O-N 3.44Å; T139-I142 WeakPolarHBondContact O-CG2 3.17Å; T139-I142 PolarHBondContact O-N 3.34Å; T139-E143 WeakPolarHBondContact O-CG 3.41Å; T139-E143 PolarHBondContact O-N 3.48Å
140	K	95.3	Very high	92	Very high	55 Å²	55	45.9 Å²	45.9	24%	0.239	26%	0.263	C	S	.	.	H	α-helix	trans	-64.6	-40.4	177.3	-68.8	-71.4	158.2	-152.4	0	112.1	W81 T136 C137 I138 I142 E143 I144	W81-K140 HydrophobicContact CB-CB 4.2Å; W81-K140 HydrophobicContact CB-CG 4.21Å; W81-K140 HydrophobicContact CD2-CB 3.92Å; W81-K140 HydrophobicContact CD2-CD 3.85Å; W81-K140 HydrophobicContact CD2-CG 3.82Å; W81-K140 HydrophobicContact CE3-CB 3.72Å; W81-K140 HydrophobicContact CE3-CD 4.15Å; W81-K140 HydrophobicContact CE3-CG 4.13Å; W81-K140 HydrophobicContact CG-CB 4.13Å; W81-K140 HydrophobicContact CG-CD 4.27Å; W81-K140 HydrophobicContact CG-CG 3.85Å; W81-K140 HydrophobicContact CH2-CD 4.47Å; W81-K140 HydrophobicContact CZ2-CD 4.19Å; W81-K140 HydrophobicContact CZ3-CB 4.43Å; W81-K140 HydrophobicContact CZ3-CD 4.45Å; T136-K140 HydrophobicContact CG2-CG 4.34Å; T136-K140 WeakPolarHBondContact O-CB 3.42Å; T136-K140 VanDerWaalsContact O-CG 3.29Å; T136-K140 WeakPolarHBondContact O-CG 3.34Å; T136-K140 PolarHBondContact O-N 3.35Å; C137-K140 PolarHBondContact O-N 2.95Å; I138-K140 PolarHBondContact O-N 3.44Å; K140-I142 PolarHBondContact O-N 2.96Å; K140-E143 WeakPolarHBondContact CD-OE2 3.47Å; K140-E143 IonicContact NZ-OE1 3.74Å; K140-E143 IonicContact NZ-OE2 3.26Å; K140-E143 PolarHBondContact NZ-OE2 2.92Å; K140-E143 WeakPolarHBondContact O-CB 3.41Å; K140-E143 PolarHBondContact O-N 3.42Å; K140-I144 WeakPolarHBondContact O-CG1 3.48Å; K140-I144 PolarHBondContact O-N 3.47Å
141	A	96	Very high	92.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.4	-45.9	178.1	0	0	0	0	0	112.1	H86 V89 L90 C137 I138 T139 I144 L145	H86-A141 HydrophobicContact CB-CB 3.9Å; H86-A141 WeakPolarHBondContact ND1-CA 3.33Å; V89-A141 HydrophobicContact CB-CB 3.97Å; V89-A141 HydrophobicContact CG1-CB 3.65Å; L90-A141 HydrophobicContact CD2-CB 4.17Å; L90-A141 HydrophobicContact CG-CB 4.03Å; C137-A141 WeakPolarHBondContact O-CB 3.27Å; C137-A141 PolarHBondContact O-N 3.49Å; I138-A141 PolarHBondContact O-N 2.84Å; T139-A141 PolarHBondContact O-N 3.44Å; A141-I144 PolarHBondContact O-N 2.97Å; A141-L145 WeakPolarHBondContact O-CB 3.49Å; A141-L145 WeakPolarHBondContact O-CG 3.42Å; A141-L145 PolarHBondContact O-N 3.26Å
142	I	96.6	Very high	93.8	Very high	22 Å²	22	43.9 Å²	43.9	11%	0.113	23%	0.226	C	C	.	.	H	α-helix	trans	-69.9	-35.5	176.2	-169.2	59.7	0	0	0	112.3	L90 I104 H108 I138 T139 K140 I144 L145 S146	L90-I142 HydrophobicContact CD1-CD1 4.23Å; I104-I142 HydrophobicContact CG2-CD1 3.63Å; H108-I142 HydrophobicContact CB-CB 4.49Å; H108-I142 HydrophobicContact CB-CD1 3.84Å; H108-I142 HydrophobicContact CB-CG1 4.14Å; I138-I142 PolarHBondContact O-N 3.3Å; I138-I142 VanDerWaalsContact O-N 3.11Å; T139-I142 WeakPolarHBondContact O-CG2 3.17Å; T139-I142 PolarHBondContact O-N 3.34Å; K140-I142 PolarHBondContact O-N 2.96Å; I142-I144 VanDerWaalsContact C-N 3.26Å; I142-I144 PolarHBondContact O-N 3.47Å; I142-L145 PolarHBondContact O-N 3.5Å; I142-S146 WeakPolarHBondContact O-CA 3.39Å; I142-S146 WeakPolarHBondContact O-CB 3.12Å; I142-S146 PolarHBondContact O-N 3.44Å; I142-S146 PolarHBondContact O-OG 3.19Å
143	E	95.8	Very high	94.3	Very high	74 Å²	74	39.7 Å²	39.7	35%	0.346	20%	0.204	S	C	.	.	H	α-helix	trans	-58.6	-38.3	173.9	-78	174.9	-172	0	0	112.3	T139 K140	T139-E143 WeakPolarHBondContact O-CG 3.41Å; T139-E143 PolarHBondContact O-N 3.48Å; K140-E143 WeakPolarHBondContact CD-OE2 3.47Å; K140-E143 IonicContact NZ-OE1 3.74Å; K140-E143 IonicContact NZ-OE2 3.26Å; K140-E143 PolarHBondContact NZ-OE2 2.92Å; K140-E143 WeakPolarHBondContact O-CB 3.41Å; K140-E143 PolarHBondContact O-N 3.42Å
144	I	96.3	Very high	94.7	Very high	12 Å²	12	40 Å²	40	6%	0.062	21%	0.205	C	C	.	.	H	α-helix	trans	-76.3	-49.9	177	-63.9	-56.6	0	0	0	111.4	W81 K140 A141 I142 K150 R151 F154 Y226	W81-I144 HydrophobicContact CH2-CD1 4.17Å; W81-I144 HydrophobicContact CZ3-CD1 3.9Å; W81-I144 HydrophobicContact CZ3-CG1 3.8Å; K140-I144 WeakPolarHBondContact O-CG1 3.48Å; K140-I144 PolarHBondContact O-N 3.47Å; A141-I144 PolarHBondContact O-N 2.97Å; I142-I144 VanDerWaalsContact C-N 3.26Å; I142-I144 PolarHBondContact O-N 3.47Å; I144-K150 HydrophobicContact CD1-CB 4.27Å; I144-K150 HydrophobicContact CD1-CD 4.16Å; I144-R151 WeakPolarHBondContact O-CA 3.33Å; I144-R151 PolarHBondContact O-N 2.87Å; I144-R151 VanDerWaalsContact O-N 3.08Å; I144-F154 HydrophobicContact CG2-CB 3.71Å; I144-F154 HydrophobicContact CG2-CD1 4.42Å; I144-F154 HydrophobicContact CG2-CG 4.01Å; I144-Y226 HydrophobicContact CD1-CE2 4.28Å
145	L	96.7	Very high	95	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-78.4	-21.7	-171.6	-66.8	-178.5	0	0	0	113.7	H86 Y87 L90 I104 A141 I142 R151 F154	H86-L145 HydrophobicContact CB-CD1 3.82Å; H86-L145 HydrophobicContact CB-CD2 4.22Å; H86-L145 HydrophobicContact CB-CG 3.84Å; H86-L145 WeakPolarHBondContact O-CD1 3.28Å; Y87-L145 HydrophobicContact CD1-CD1 3.71Å; Y87-L145 HydrophobicContact CD1-CD2 4.1Å; Y87-L145 HydrophobicContact CD2-CD2 4.21Å; Y87-L145 HydrophobicContact CE1-CD1 3.96Å; Y87-L145 HydrophobicContact CE1-CD2 3.61Å; Y87-L145 HydrophobicContact CE1-CG 4.39Å; Y87-L145 HydrophobicContact CE2-CD2 3.74Å; Y87-L145 HydrophobicContact CG-CD1 4.07Å; Y87-L145 HydrophobicContact CG-CD2 4.37Å; Y87-L145 VanDerWaalsContact CZ-CD2 3.42Å; L90-L145 HydrophobicContact CD1-CD1 3.74Å; L90-L145 HydrophobicContact CG-CD1 4.33Å; I104-L145 HydrophobicContact CD1-CB 4.31Å; I104-L145 HydrophobicContact CG2-CB 3.89Å; A141-L145 WeakPolarHBondContact O-CB 3.49Å; A141-L145 WeakPolarHBondContact O-CG 3.42Å; A141-L145 PolarHBondContact O-N 3.26Å; I142-L145 PolarHBondContact O-N 3.5Å; L145-R151 HydrophobicContact CD2-CG 4.17Å; L145-R151 WeakPolarHBondContact O-CD 3.36Å; L145-F154 HydrophobicContact CD2-CD1 4.07Å; L145-F154 HydrophobicContact CD2-CE1 4.35Å
146	S	94.6	Very high	95.2	Very high	45 Å²	45	38.7 Å²	38.7	32%	0.315	20%	0.201	S	C	.	.	H	α-helix	trans	-81	-29.3	179.1	66.4	0	0	0	0	113.8	Q101 I142	Q101-S146 VanDerWaalsContact NE2-CA 3.28Å; Q101-S146 PolarHBondContact NE2-O 3.41Å; I142-S146 WeakPolarHBondContact O-CA 3.39Å; I142-S146 WeakPolarHBondContact O-CB 3.12Å; I142-S146 PolarHBondContact O-N 3.44Å; I142-S146 PolarHBondContact O-OG 3.19Å
147	D	94.8	Very high	95.2	Very high	57 Å²	57	39 Å²	39	31%	0.305	20%	0.202	S	C	.	.	S	Bend	trans	-86.7	119.7	177.9	179.7	-52.3	0	0	0	109.9	V149 K150 R151	D147-V149 PolarHBondContact O-N 2.97Å; D147-V149 WeakPolarHBondContact OD1-CA 3.38Å; D147-V149 WeakPolarHBondContact OD1-CB 3.23Å; D147-V149 PolarHBondContact OD1-N 3.01Å; D147-K150 HydrophobicContact CB-CB 4.04Å; D147-K150 HydrophobicContact CB-CD 4.03Å; D147-K150 HydrophobicContact CB-CG 4.02Å; D147-K150 PolarHBondContact O-N 3Å; D147-K150 PolarHBondContact OD1-N 3.44Å; D147-R151 WeakPolarHBondContact O-CB 3.42Å; D147-R151 PolarHBondContact O-N 3.35Å
148	P	94	Very high	95.1	Very high	94 Å²	94	39.5 Å²	39.5	61%	0.61	21%	0.205	S	C	*	.	H	α-helix	trans	-60.1	-29.2	-176.9	-25.9	35	0	0	0	114.9	R152	P148-R152 VanDerWaalsContact O-CB 3.27Å; P148-R152 WeakPolarHBondContact O-CB 3.32Å; P148-R152 PolarHBondContact O-N 2.83Å
149	V	94.1	Very high	94.9	Very high	100 Å²	100	45 Å²	45	61%	0.606	24%	0.241	S	C	*	.	H	α-helix	trans	-78.3	-47.3	179.9	-179.2	0	0	0	0	109.8	D147 R152 A153	D147-V149 PolarHBondContact O-N 2.97Å; D147-V149 WeakPolarHBondContact OD1-CA 3.38Å; D147-V149 WeakPolarHBondContact OD1-CB 3.23Å; D147-V149 PolarHBondContact OD1-N 3.01Å; V149-R152 WeakPolarHBondContact O-CB 3.48Å; V149-R152 PolarHBondContact O-N 3.01Å; V149-A153 PolarHBondContact O-N 3.23Å
150	K	94.6	Very high	94.7	Very high	95 Å²	95	46.7 Å²	46.7	41%	0.413	25%	0.251	S	S	.	.	H	α-helix	trans	-65.6	-41	177.6	-62.6	-178	-175.7	176	0	111.8	I144 D147 R152 A153 F154	I144-K150 HydrophobicContact CD1-CB 4.27Å; I144-K150 HydrophobicContact CD1-CD 4.16Å; D147-K150 HydrophobicContact CB-CB 4.04Å; D147-K150 HydrophobicContact CB-CD 4.03Å; D147-K150 HydrophobicContact CB-CG 4.02Å; D147-K150 PolarHBondContact O-N 3Å; D147-K150 PolarHBondContact OD1-N 3.44Å; K150-R152 VanDerWaalsContact C-N 3.33Å; K150-R152 PolarHBondContact O-N 3.42Å; K150-A153 WeakPolarHBondContact O-CB 3.49Å; K150-A153 PolarHBondContact O-N 2.98Å; K150-F154 PolarHBondContact O-N 2.92Å
151	R	95.9	Very high	94.7	Very high	29 Å²	29	44.7 Å²	44.7	11%	0.109	24%	0.242	C	C	.	.	H	α-helix	trans	-59.2	-45.3	174.6	-176.9	179.7	176.7	-175.6	1.6	111.2	Y87 Y97 A99 I104 I144 L145 D147 A153 F154 D155	Y87-R151 PolarHBondContact OH-NE 3.25Å; Y87-R151 PolarHBondContact OH-NH2 3.39Å; Y87-R151 VanDerWaalsContact OH-NH2 3.11Å; Y97-R151 PolarHBondContact O-NH2 3Å; A99-R151 PolarHBondContact O-NH1 3.48Å; A99-R151 PolarHBondContact O-NH2 3.34Å; I104-R151 VanDerWaalsContact CD1-CZ 3.47Å; I144-R151 WeakPolarHBondContact O-CA 3.33Å; I144-R151 PolarHBondContact O-N 2.87Å; I144-R151 VanDerWaalsContact O-N 3.08Å; L145-R151 HydrophobicContact CD2-CG 4.17Å; L145-R151 WeakPolarHBondContact O-CD 3.36Å; D147-R151 WeakPolarHBondContact O-CB 3.42Å; D147-R151 PolarHBondContact O-N 3.35Å; R151-A153 VanDerWaalsContact C-N 3.34Å; R151-A153 PolarHBondContact O-N 2.61Å; R151-F154 PolarHBondContact O-N 2.88Å; R151-D155 IonicContact NE-OD2 2.92Å; R151-D155 WeakPolarHBondContact O-CB 3.47Å; R151-D155 VanDerWaalsContact O-CG 3.27Å; R151-D155 PolarHBondContact O-N 2.9Å
152	R	94.9	Very high	94.6	Very high	122 Å²	122	47.9 Å²	47.9	46%	0.46	26%	0.259	S	S	.	.	H	α-helix	trans	-59	-44.4	175.7	-175	-170.4	-62.9	-158	-1.3	112.1	P148 V149 K150 F154 S156 W221	P148-R152 VanDerWaalsContact O-CB 3.27Å; P148-R152 WeakPolarHBondContact O-CB 3.32Å; P148-R152 PolarHBondContact O-N 2.83Å; V149-R152 WeakPolarHBondContact O-CB 3.48Å; V149-R152 PolarHBondContact O-N 3.01Å; K150-R152 VanDerWaalsContact C-N 3.33Å; K150-R152 PolarHBondContact O-N 3.42Å; R152-F154 VanDerWaalsContact C-N 3.35Å; R152-S156 WeakPolarHBondContact O-CB 3.45Å; R152-S156 PolarHBondContact O-N 3.28Å; R152-S156 PolarHBondContact O-OG 3.42Å; R152-W221 HydrophobicContact CB-CZ3 4.44Å; R152-W221 HydrophobicContact CG-CE3 3.38Å; R152-W221 HydrophobicContact CG-CZ3 3.4Å; R152-W221 VanDerWaalsContact CG-CZ3 3.4Å
153	A	95.3	Very high	94.5	Very high	4 Å²	4	49.7 Å²	49.7	3%	0.033	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-44.8	177.8	0	0	0	0	0	111.4	V149 K150 R151 E223 S225 Y226	V149-A153 PolarHBondContact O-N 3.23Å; K150-A153 WeakPolarHBondContact O-CB 3.49Å; K150-A153 PolarHBondContact O-N 2.98Å; R151-A153 VanDerWaalsContact C-N 3.34Å; R151-A153 PolarHBondContact O-N 2.61Å; A153-E223 WeakPolarHBondContact CB-OE1 3.49Å; A153-S225 WeakPolarHBondContact CB-OG 3.3Å; A153-Y226 WeakPolarHBondContact O-CB 3.48Å
154	F	96.1	Very high	94.4	Very high	16 Å²	16	49.2 Å²	49.2	7%	0.07	27%	0.274	C	S	.	.	H	α-helix	trans	-65.9	-50.3	177.5	176.2	-110.3	0	0	0	112.2	H86 Y87 I144 L145 K150 R151 R152 S156 V157 Y226	H86-F154 HydrophobicContact CB-CE1 4.06Å; H86-F154 HydrophobicContact CB-CZ 4.11Å; H86-F154 AromaticContact CD2-CD2 3.65Å; H86-F154 AromaticContact CD2-CE2 3.38Å; H86-F154 WeakPolarHBondContact CD2-CE2 3.32Å; H86-F154 AromaticContact CD2-CZ 3.59Å; Y87-F154 AromaticContact CD2-CE1 3.82Å; Y87-F154 HydrophobicContact CD2-CE1 3.82Å; Y87-F154 HydrophobicContact CE2-CD1 4.09Å; Y87-F154 AromaticContact CE2-CE1 3.76Å; Y87-F154 HydrophobicContact CE2-CE1 3.76Å; I144-F154 HydrophobicContact CG2-CB 3.71Å; I144-F154 HydrophobicContact CG2-CD1 4.42Å; I144-F154 HydrophobicContact CG2-CG 4.01Å; L145-F154 HydrophobicContact CD2-CD1 4.07Å; L145-F154 HydrophobicContact CD2-CE1 4.35Å; K150-F154 PolarHBondContact O-N 2.92Å; R151-F154 PolarHBondContact O-N 2.88Å; R152-F154 VanDerWaalsContact C-N 3.35Å; F154-S156 PolarHBondContact O-N 3.36Å; F154-V157 VanDerWaalsContact O-CG2 3.25Å; F154-V157 WeakPolarHBondContact O-CG2 3.48Å; F154-V157 PolarHBondContact O-N 2.9Å; F154-Y226 HydrophobicContact CB-CD2 4.07Å; F154-Y226 HydrophobicContact CB-CE2 4.14Å; F154-Y226 HydrophobicContact CD2-CD1 4.42Å; F154-Y226 HydrophobicContact CD2-CD2 4.4Å; F154-Y226 AromaticContact CD2-CE1 3.93Å; F154-Y226 HydrophobicContact CD2-CE1 3.93Å; F154-Y226 AromaticContact CD2-CE2 3.93Å; F154-Y226 HydrophobicContact CD2-CE2 3.93Å; F154-Y226 AromaticContact CD2-CZ 3.67Å; F154-Y226 HydrophobicContact CE2-CE1 4.49Å; F154-Y226 HydrophobicContact CG-CE2 4.48Å
155	D	95.7	Very high	94.4	Very high	13 Å²	13	50.9 Å²	50.9	7%	0.07	29%	0.285	C	S	.	.	H	α-helix	trans	-58.2	-35.3	179.2	-74.1	-16.3	0	0	0	111.1	Y87 R151 V157 D158 W189 W221	Y87-D155 WeakPolarHBondContact CE2-OD1 3.23Å; Y87-D155 VanDerWaalsContact OH-CG 3.31Å; Y87-D155 PolarHBondContact OH-OD1 3.45Å; Y87-D155 PolarHBondContact OH-OD2 2.91Å; R151-D155 IonicContact NE-OD2 2.92Å; R151-D155 WeakPolarHBondContact O-CB 3.47Å; R151-D155 VanDerWaalsContact O-CG 3.27Å; R151-D155 PolarHBondContact O-N 2.9Å; D155-V157 PolarHBondContact O-N 3.47Å; D155-V157 VanDerWaalsContact O-N 3.14Å; D155-D158 WeakPolarHBondContact O-CB 3.31Å; D155-D158 PolarHBondContact O-N 3.36Å; D155-W189 WeakPolarHBondContact O-CH2 3.32Å; D155-W221 HydrophobicContact CB-CH2 4.49Å
156	S	95.6	Very high	94.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.9	179.3	-65.3	0	0	0	0	113.9	R152 F154 R222 E223	R152-S156 WeakPolarHBondContact O-CB 3.45Å; R152-S156 PolarHBondContact O-N 3.28Å; R152-S156 PolarHBondContact O-OG 3.42Å; F154-S156 PolarHBondContact O-N 3.36Å; S156-R222 VanDerWaalsContact O-CZ 3.31Å; S156-R222 PolarHBondContact O-NE 3.27Å; S156-R222 PolarHBondContact O-NH2 2.81Å; S156-E223 WeakPolarHBondContact CB-O 3.37Å; S156-E223 PolarHBondContact OG-N 2.88Å; S156-E223 VanDerWaalsContact OG-N 3.11Å; S156-E223 PolarHBondContact OG-O 2.99Å
157	V	94.3	Very high	94.3	Very high	33 Å²	33	51.4 Å²	51.4	20%	0.2	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	24.1	-178	-58.6	0	0	0	0	112.5	F154 D155 P159 F224 Y226 L227	F154-V157 VanDerWaalsContact O-CG2 3.25Å; F154-V157 WeakPolarHBondContact O-CG2 3.48Å; F154-V157 PolarHBondContact O-N 2.9Å; D155-V157 PolarHBondContact O-N 3.47Å; D155-V157 VanDerWaalsContact O-N 3.14Å; V157-P159 WeakPolarHBondContact O-CD 3.32Å; V157-P159 VanDerWaalsContact O-N 3.15Å; V157-F224 HydrophobicContact CG1-CD1 3.88Å; V157-F224 HydrophobicContact CG1-CE1 4.49Å; V157-Y226 HydrophobicContact CG2-CD1 3.68Å; V157-Y226 HydrophobicContact CG2-CG 4.05Å; V157-L227 HydrophobicContact CB-CD1 4.35Å; V157-L227 HydrophobicContact CB-CG 4.41Å; V157-L227 HydrophobicContact CG1-CD1 3.66Å; V157-L227 HydrophobicContact CG1-CG 3.84Å
158	D	92.5	Very high	94.2	Very high	10 Å²	10	54.3 Å²	54.3	5%	0.053	30%	0.298	C	S	.	.			trans	-55	113	177.5	-175.1	-1.1	0	0	0	111.8	R96 D155 T160 F161 R188	R96-D158 IonicContact CZ-OD1 2.86Å; R96-D158 IonicContact NE-OD1 3.52Å; R96-D158 PolarHBondContact NE-OD1 3.27Å; R96-D158 IonicContact NE-OD2 3.56Å; R96-D158 PolarHBondContact NE-OD2 3.21Å; R96-D158 IonicContact NH2-OD1 2.85Å; R96-D158 PolarHBondContact NH2-OD1 2.86Å; D155-D158 WeakPolarHBondContact O-CB 3.31Å; D155-D158 PolarHBondContact O-N 3.36Å; D158-T160 VanDerWaalsContact CG-OG1 3.23Å; D158-T160 PolarHBondContact O-N 3.41Å; D158-T160 WeakPolarHBondContact OD1-CB 3.43Å; D158-T160 PolarHBondContact OD1-N 3.48Å; D158-T160 VanDerWaalsContact OD1-N 3.07Å; D158-T160 PolarHBondContact OD1-OG1 2.67Å; D158-T160 PolarHBondContact OD2-OG1 2.96Å; D158-F161 HydrophobicContact CB-CB 4.43Å; D158-F161 WeakPolarHBondContact O-CB 3.35Å; D158-F161 PolarHBondContact O-N 2.99Å; D158-F161 VanDerWaalsContact O-N 3.16Å; D158-R188 IonicContact OD2-NH1 3.21Å
159	P	90.2	Very high	94	Very high	115 Å²	115	53.6 Å²	53.6	75%	0.747	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-17.3	-177.3	28	-34.9	0	0	0	112.9	V157 F161	V157-P159 WeakPolarHBondContact O-CD 3.32Å; V157-P159 VanDerWaalsContact O-N 3.15Å; P159-F161 VanDerWaalsContact C-N 3.29Å
160	T	90.4	Very high	93.8	Very high	85 Å²	85	53.7 Å²	53.7	52%	0.521	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-10.1	177.7	69.6	0	0	0	0	112.8	R96 D158 D162	R96-T160 PolarHBondContact NE-OG1 3Å; R96-T160 VanDerWaalsContact NE-OG1 3.14Å; D158-T160 VanDerWaalsContact CG-OG1 3.23Å; D158-T160 PolarHBondContact O-N 3.41Å; D158-T160 WeakPolarHBondContact OD1-CB 3.43Å; D158-T160 PolarHBondContact OD1-N 3.48Å; D158-T160 VanDerWaalsContact OD1-N 3.07Å; D158-T160 PolarHBondContact OD1-OG1 2.67Å; D158-T160 PolarHBondContact OD2-OG1 2.96Å; T160-D162 PolarHBondContact O-N 2.92Å
161	F	94	Very high	93.5	Very high	12 Å²	12	49.2 Å²	49.2	5%	0.053	27%	0.27	C	S	.	.	S	Bend	trans	-74.9	117.9	178.1	-175.7	-87.6	0	0	0	110.9	D158 P159 N163 R185 R188 W189	D158-F161 HydrophobicContact CB-CB 4.43Å; D158-F161 WeakPolarHBondContact O-CB 3.35Å; D158-F161 PolarHBondContact O-N 2.99Å; D158-F161 VanDerWaalsContact O-N 3.16Å; P159-F161 VanDerWaalsContact C-N 3.29Å; F161-N163 HydrophobicContact CD1-CB 4.47Å; F161-N163 VanDerWaalsContact CD1-OD1 3.28Å; F161-N163 WeakPolarHBondContact CD1-OD1 3.17Å; F161-N163 WeakPolarHBondContact CE1-OD1 3.47Å; F161-N163 PolarHBondContact O-N 3.22Å; F161-N163 VanDerWaalsContact O-N 3.12Å; F161-N163 PolarHBondContact O-ND2 2.7Å; F161-R185 HydrophobicContact CD2-CG 4.19Å; F161-R185 HydrophobicContact CE2-CG 3.54Å; F161-R185 HydrophobicContact CZ-CG 4.03Å; F161-R188 HydrophobicContact CE2-CG 4.33Å; F161-W189 HydrophobicContact CD1-CZ2 4.46Å; F161-W189 AromaticContact CD2-CZ2 3.6Å; F161-W189 HydrophobicContact CD2-CZ2 3.6Å; F161-W189 AromaticContact CD2-NE1 3.87Å; F161-W189 AromaticContact CE1-NE1 3.59Å; F161-W189 AromaticContact CE2-CE2 3.73Å; F161-W189 AromaticContact CE2-CZ2 3.82Å; F161-W189 HydrophobicContact CE2-CZ2 3.82Å; F161-W189 AromaticContact CE2-NE1 3.19Å; F161-W189 AromaticContact CG-CZ2 3.95Å; F161-W189 HydrophobicContact CG-CZ2 3.95Å; F161-W189 AromaticContact CZ-CD1 3.91Å; F161-W189 HydrophobicContact CZ-CZ2 4.39Å; F161-W189 AromaticContact CZ-NE1 3.06Å
162	D	94.6	Very high	93.1	Very high	67 Å²	67	55.3 Å²	55.3	36%	0.358	30%	0.297	S	S	.	.			trans	-71.4	105.5	173	172.3	26.5	0	0	0	111.2	T160 S164 R185	T160-D162 PolarHBondContact O-N 2.92Å; D162-S164 VanDerWaalsContact C-N 3.34Å; D162-S164 VanDerWaalsContact CG-OG 3.25Å; D162-S164 WeakPolarHBondContact OD1-CB 3.47Å; D162-S164 PolarHBondContact OD1-N 2.89Å; D162-S164 PolarHBondContact OD1-OG 3.49Å; D162-S164 PolarHBondContact OD2-OG 3.31Å; D162-S164 VanDerWaalsContact OD2-OG 3.04Å; D162-R185 VanDerWaalsContact CG-NH1 3.26Å; D162-R185 PolarHBondContact O-NH1 3.46Å; D162-R185 IonicContact OD2-CZ 2.67Å; D162-R185 IonicContact OD2-NH1 3.99Å; D162-R185 PolarHBondContact OD2-NH1 3.36Å; D162-R185 IonicContact OD2-NH2 2.92Å
163	N	94.2	Very high	92.6	Very high	61 Å²	61	57.9 Å²	57.9	33%	0.326	31%	0.314	S	S	.	.			trans	-87	1.9	177.3	-66.2	-79.5	0	0	0	113.2	F161 R222 R262	F161-N163 HydrophobicContact CD1-CB 4.47Å; F161-N163 VanDerWaalsContact CD1-OD1 3.28Å; F161-N163 WeakPolarHBondContact CD1-OD1 3.17Å; F161-N163 WeakPolarHBondContact CE1-OD1 3.47Å; F161-N163 PolarHBondContact O-N 3.22Å; F161-N163 VanDerWaalsContact O-N 3.12Å; F161-N163 PolarHBondContact O-ND2 2.7Å; N163-R222 PolarHBondContact OD1-NH1 3.35Å; N163-R262 WeakPolarHBondContact O-CD 3.34Å; N163-R262 PolarHBondContact O-NH1 3.29Å
164	S	94.8	Very high	92.4	Very high	63 Å²	63	60 Å²	60	44%	0.441	33%	0.329	S	S	.	.			trans	-59.3	147.7	-178.4	69.5	0	0	0	0	112.2	D162	D162-S164 VanDerWaalsContact C-N 3.34Å; D162-S164 VanDerWaalsContact CG-OG 3.25Å; D162-S164 WeakPolarHBondContact OD1-CB 3.47Å; D162-S164 PolarHBondContact OD1-N 2.89Å; D162-S164 PolarHBondContact OD1-OG 3.49Å; D162-S164 PolarHBondContact OD2-OG 3.31Å; D162-S164 VanDerWaalsContact OD2-OG 3.04Å
165	V	94.9	Very high	92.4	Very high	47 Å²	47	59.6 Å²	59.6	29%	0.285	33%	0.327	S	S	.	.			trans	-115.2	123	176.3	176.8	0	0	0	0	107.5	R262 T265 L266	V165-R262 HydrophobicContact CG2-CG 3.7Å; V165-T265 HydrophobicContact CG1-CG2 4.43Å; V165-L266 HydrophobicContact CG1-CB 3.92Å; V165-L266 HydrophobicContact CG1-CD1 4.15Å; V165-L266 HydrophobicContact CG2-CB 4.22Å
166	P	95.3	Very high	92.4	Very high	13 Å²	13	61.4 Å²	61.4	8%	0.084	33%	0.334	C	S	.	.			trans	-58.8	145.3	178.6	-25.2	33.8	0	0	0	112.8	V178 F179 V182 T269	P166-V178 HydrophobicContact CB-CG1 3.41Å; P166-V178 VanDerWaalsContact CB-CG1 3.41Å; P166-V178 HydrophobicContact CG-CG1 3.65Å; P166-F179 HydrophobicContact CB-CD1 4.46Å; P166-F179 HydrophobicContact CB-CE1 3.89Å; P166-F179 HydrophobicContact CB-CZ 4.02Å; P166-F179 HydrophobicContact CG-CD1 4.17Å; P166-F179 HydrophobicContact CG-CE1 4Å; P166-V182 HydrophobicContact CG-CG2 3.82Å; P166-T269 WeakPolarHBondContact O-CG2 3.3Å
167	S	94	Very high	92.4	Very high	43 Å²	43	68.5 Å²	68.5	30%	0.301	37%	0.367	S	S	.	.			trans	-76.9	161.9	175.9	71	0	0	0	0	112.1	S169 E170 G171	S167-S169 PolarHBondContact O-N 3.4Å; S167-S169 PolarHBondContact OG-OG 2.86Å; S167-E170 VanDerWaalsContact CB-OE2 3.28Å; S167-E170 WeakPolarHBondContact CB-OE2 3.34Å; S167-E170 PolarHBondContact N-OE2 2.93Å; S167-E170 PolarHBondContact O-N 3.48Å; S167-E170 VanDerWaalsContact OG-CD 3.22Å; S167-E170 WeakPolarHBondContact OG-CG 3.19Å; S167-E170 PolarHBondContact OG-N 3.47Å; S167-E170 PolarHBondContact OG-OE2 3.39Å; S167-G171 PolarHBondContact O-N 3.42Å
168	K	92.6	Very high	92.5	Very high	119 Å²	119	68.7 Å²	68.7	52%	0.517	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-24.8	175.4	-69.7	-179	178.3	177.4	0	113.7	K172 T269	K168-K172 VanDerWaalsContact O-CG 3.31Å; K168-K172 WeakPolarHBondContact O-CG 3.44Å; K168-T269 HydrophobicContact CG-CG2 3.68Å
169	S	90.9	Very high	92.7	Very high	79 Å²	79	68.2 Å²	68.2	55%	0.552	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-51.7	177.2	26	0	0	0	0	110.9	S167 G171 K172	S167-S169 PolarHBondContact O-N 3.4Å; S167-S169 PolarHBondContact OG-OG 2.86Å; S169-G171 PolarHBondContact O-N 2.95Å; S169-K172 PolarHBondContact O-N 3.29Å; S169-K172 VanDerWaalsContact O-N 3.1Å
170	E	89.6	Confident	92.9	Very high	101 Å²	101	64.5 Å²	64.5	47%	0.472	35%	0.345	S	S	.	.	H	α-helix	trans	-58.8	-39.9	178.8	-66.4	160	141.3	0	0	111	S167 K172 E173 S174 V178	S167-E170 VanDerWaalsContact CB-OE2 3.28Å; S167-E170 WeakPolarHBondContact CB-OE2 3.34Å; S167-E170 PolarHBondContact N-OE2 2.93Å; S167-E170 PolarHBondContact O-N 3.48Å; S167-E170 VanDerWaalsContact OG-CD 3.22Å; S167-E170 WeakPolarHBondContact OG-CG 3.19Å; S167-E170 PolarHBondContact OG-N 3.47Å; S167-E170 PolarHBondContact OG-OE2 3.39Å; E170-K172 VanDerWaalsContact C-N 3.28Å; E170-K172 PolarHBondContact O-N 3.39Å; E170-E173 PolarHBondContact O-N 3.49Å; E170-S174 PolarHBondContact O-N 2.85Å; E170-V178 HydrophobicContact CB-CG1 4.3Å; E170-V178 HydrophobicContact CB-CG2 4.45Å
171	G	88.4	Confident	93.2	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-65.5	-21.4	178.4	0	0	0	0	0	116.2	S167 S169 F175	S167-G171 PolarHBondContact O-N 3.42Å; S169-G171 PolarHBondContact O-N 2.95Å; G171-F175 WeakPolarHBondContact O-CA 3.21Å; G171-F175 WeakPolarHBondContact O-CB 3.4Å
172	K	87.4	Confident	93.3	Very high	158 Å²	158	63 Å²	63	69%	0.687	34%	0.338	S	S	*	.	H	α-helix	trans	-84.5	-27.5	-177.8	-78.7	173	-177.7	-179.1	0	113.3	K168 S169 E170	K168-K172 VanDerWaalsContact O-CG 3.31Å; K168-K172 WeakPolarHBondContact O-CG 3.44Å; S169-K172 PolarHBondContact O-N 3.29Å; S169-K172 VanDerWaalsContact O-N 3.1Å; E170-K172 VanDerWaalsContact C-N 3.28Å; E170-K172 PolarHBondContact O-N 3.39Å
173	E	84.1	Confident	93.5	Very high	176 Å²	176	60 Å²	60	82%	0.822	32%	0.322	S	S	*	.	H	α-helix	trans	-85.4	-49.9	-178.1	-65.8	-178.6	177.3	0	0	110.8	E170	E170-E173 PolarHBondContact O-N 3.49Å
174	S	91.1	Very high	93.5	Very high	47 Å²	47	64.4 Å²	64.4	33%	0.329	34%	0.34	S	S	.	.	S	Bend	trans	-134.5	64.5	-176.1	-72.3	0	0	0	0	112	E170 F176 E177 V178	E170-S174 PolarHBondContact O-N 2.85Å; S174-F176 PolarHBondContact O-N 2.9Å; S174-E177 VanDerWaalsContact CB-OE2 3.25Å; S174-E177 WeakPolarHBondContact CB-OE2 3.27Å; S174-E177 PolarHBondContact O-N 2.88Å; S174-E177 PolarHBondContact OG-OE2 2.93Å; S174-V178 WeakPolarHBondContact O-CB 3.45Å; S174-V178 VanDerWaalsContact O-CG2 3.27Å; S174-V178 WeakPolarHBondContact O-CG2 3.35Å; S174-V178 PolarHBondContact O-N 3.35Å
175	F	95.9	Very high	93.5	Very high	9 Å²	9	65.1 Å²	65.1	4%	0.039	33%	0.333	C	S	.	.	H	α-helix	trans	-48.9	-54.7	-174	176.5	-102.5	0	0	0	114.2	G171 V178 F179 L198 A270 C273 D274 P275	G171-F175 WeakPolarHBondContact O-CA 3.21Å; G171-F175 WeakPolarHBondContact O-CB 3.4Å; F175-V178 PolarHBondContact O-N 2.84Å; F175-F179 AromaticContact CD2-CD2 3.46Å; F175-F179 HydrophobicContact CD2-CD2 3.46Å; F175-F179 VanDerWaalsContact CD2-CD2 3.46Å; F175-F179 AromaticContact CD2-CE2 3.84Å; F175-F179 HydrophobicContact CD2-CE2 3.84Å; F175-F179 HydrophobicContact CD2-CG 4.47Å; F175-F179 AromaticContact CE2-CD2 3.55Å; F175-F179 HydrophobicContact CE2-CD2 3.55Å; F175-F179 AromaticContact CE2-CE2 3.98Å; F175-F179 HydrophobicContact CE2-CE2 3.98Å; F175-F179 HydrophobicContact CE2-CG 4.22Å; F175-F179 HydrophobicContact CG-CD2 4.3Å; F175-F179 HydrophobicContact CZ-CD2 4.45Å; F175-F179 WeakPolarHBondContact O-CB 3.25Å; F175-F179 WeakPolarHBondContact O-CD2 3.43Å; F175-F179 PolarHBondContact O-N 3.44Å; F175-L198 HydrophobicContact CE1-CD1 3.96Å; F175-L198 HydrophobicContact CE1-CD2 3.9Å; F175-L198 HydrophobicContact CE1-CG 4.16Å; F175-L198 HydrophobicContact CZ-CD1 3.96Å; F175-L198 HydrophobicContact CZ-CD2 4.32Å; F175-A270 HydrophobicContact CE2-CB 4.23Å; F175-A270 WeakPolarHBondContact CE2-O 3.23Å; F175-C273 HydrophobicContact CD2-CB 4.45Å; F175-D274 HydrophobicContact CD2-CB 4.49Å; F175-D274 HydrophobicContact CE1-CB 4.13Å; F175-D274 WeakPolarHBondContact CE1-OD2 3.36Å; F175-D274 HydrophobicContact CE2-CB 3.78Å; F175-D274 HydrophobicContact CZ-CB 3.56Å; F175-D274 WeakPolarHBondContact CZ-OD2 3.41Å; F175-P275 HydrophobicContact CB-CG 4.33Å
176	F	95.8	Very high	93.5	Very high	51 Å²	51	62.9 Å²	62.9	22%	0.224	32%	0.32	C	S	.	.	H	α-helix	trans	-69.7	-42.1	-174.6	-65.3	-77.9	0	0	0	112.2	S174 V178 A180 L198 G199 T200 M201	S174-F176 PolarHBondContact O-N 2.9Å; F176-V178 VanDerWaalsContact C-N 3.27Å; F176-V178 PolarHBondContact O-N 2.77Å; F176-A180 WeakPolarHBondContact O-CB 3.37Å; F176-A180 PolarHBondContact O-N 3.23Å; F176-L198 HydrophobicContact CD1-CD2 4Å; F176-L198 HydrophobicContact CD1-CG 4.19Å; F176-L198 HydrophobicContact CE1-CG 4.41Å; F176-G199 WeakPolarHBondContact CD1-O 3.47Å; F176-G199 WeakPolarHBondContact CE1-O 3.46Å; F176-T200 VanDerWaalsContact CZ-C 3.45Å; F176-M201 HydrophobicContact CE2-CB 4.21Å; F176-M201 HydrophobicContact CE2-SD 4.3Å; F176-M201 HydrophobicContact CZ-CB 4.47Å
177	E	95.1	Very high	93.5	Very high	148 Å²	148	64 Å²	64	69%	0.692	33%	0.331	S	S	*	.	H	α-helix	trans	-64	-34.9	179.7	-57.8	175.9	163.7	0	0	111.7	S174 P181	S174-E177 VanDerWaalsContact CB-OE2 3.25Å; S174-E177 WeakPolarHBondContact CB-OE2 3.27Å; S174-E177 PolarHBondContact O-N 2.88Å; S174-E177 PolarHBondContact OG-OE2 2.93Å; E177-P181 WeakPolarHBondContact O-CD 3.38Å; E177-P181 VanDerWaalsContact O-CG 3.24Å; E177-P181 WeakPolarHBondContact O-CG 3.33Å
178	V	95.9	Very high	93.4	Very high	38 Å²	38	63.9 Å²	63.9	23%	0.23	32%	0.323	C	S	.	.	H	α-helix	trans	-80.7	-48.9	-179.4	172.4	0	0	0	0	111.7	P166 E170 S174 F175 F176 V182	P166-V178 HydrophobicContact CB-CG1 3.41Å; P166-V178 VanDerWaalsContact CB-CG1 3.41Å; P166-V178 HydrophobicContact CG-CG1 3.65Å; E170-V178 HydrophobicContact CB-CG1 4.3Å; E170-V178 HydrophobicContact CB-CG2 4.45Å; S174-V178 WeakPolarHBondContact O-CB 3.45Å; S174-V178 VanDerWaalsContact O-CG2 3.27Å; S174-V178 WeakPolarHBondContact O-CG2 3.35Å; S174-V178 PolarHBondContact O-N 3.35Å; F175-V178 PolarHBondContact O-N 2.84Å; F176-V178 VanDerWaalsContact C-N 3.27Å; F176-V178 PolarHBondContact O-N 2.77Å; V178-V182 WeakPolarHBondContact O-CG2 3.41Å
179	F	96.8	Very high	93.6	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-88.4	-31.8	-171.3	-76.1	-74.8	0	0	0	114.5	P166 F175 V182 F183 L198 L266 T269 A270	P166-F179 HydrophobicContact CB-CD1 4.46Å; P166-F179 HydrophobicContact CB-CE1 3.89Å; P166-F179 HydrophobicContact CB-CZ 4.02Å; P166-F179 HydrophobicContact CG-CD1 4.17Å; P166-F179 HydrophobicContact CG-CE1 4Å; F175-F179 AromaticContact CD2-CD2 3.46Å; F175-F179 HydrophobicContact CD2-CD2 3.46Å; F175-F179 VanDerWaalsContact CD2-CD2 3.46Å; F175-F179 AromaticContact CD2-CE2 3.84Å; F175-F179 HydrophobicContact CD2-CE2 3.84Å; F175-F179 HydrophobicContact CD2-CG 4.47Å; F175-F179 AromaticContact CE2-CD2 3.55Å; F175-F179 HydrophobicContact CE2-CD2 3.55Å; F175-F179 AromaticContact CE2-CE2 3.98Å; F175-F179 HydrophobicContact CE2-CE2 3.98Å; F175-F179 HydrophobicContact CE2-CG 4.22Å; F175-F179 HydrophobicContact CG-CD2 4.3Å; F175-F179 HydrophobicContact CZ-CD2 4.45Å; F175-F179 WeakPolarHBondContact O-CB 3.25Å; F175-F179 WeakPolarHBondContact O-CD2 3.43Å; F175-F179 PolarHBondContact O-N 3.44Å; F179-V182 PolarHBondContact O-N 3.43Å; F179-F183 HydrophobicContact CB-CD2 3.99Å; F179-F183 HydrophobicContact CB-CE2 3.92Å; F179-F183 HydrophobicContact CD1-CE2 4.04Å; F179-F183 HydrophobicContact CG-CE2 4.31Å; F179-F183 WeakPolarHBondContact O-CD2 3.47Å; F179-F183 PolarHBondContact O-N 3.37Å; F179-L198 HydrophobicContact CB-CD2 3.91Å; F179-L266 HydrophobicContact CD1-CD1 3.88Å; F179-L266 HydrophobicContact CE1-CD1 3.93Å; F179-T269 HydrophobicContact CZ-CG2 4.04Å; F179-A270 HydrophobicContact CD1-CB 3.7Å; F179-A270 HydrophobicContact CD2-CB 4.41Å; F179-A270 HydrophobicContact CE1-CB 3.71Å; F179-A270 HydrophobicContact CE2-CB 4.39Å; F179-A270 HydrophobicContact CG-CB 4.08Å; F179-A270 HydrophobicContact CZ-CB 4.08Å
180	A	96.1	Very high	93.8	Very high	37 Å²	37	55 Å²	55	31%	0.306	28%	0.276	S	S	.	.	H	α-helix	trans	-56	-52.5	-179.3	0	0	0	0	0	112.9	F176 V182 F183 E184 L198	F176-A180 WeakPolarHBondContact O-CB 3.37Å; F176-A180 PolarHBondContact O-N 3.23Å; A180-V182 VanDerWaalsContact C-N 3.25Å; A180-V182 PolarHBondContact O-N 2.88Å; A180-F183 PolarHBondContact O-N 2.81Å; A180-E184 WeakPolarHBondContact O-CB 3.21Å; A180-E184 PolarHBondContact O-N 3.23Å; A180-L198 HydrophobicContact CB-CD2 4.01Å
181	P	95.9	Very high	94	Very high	58 Å²	58	52.9 Å²	52.9	38%	0.377	27%	0.272	S	S	.	.	H	α-helix	trans	-65.6	-29.8	179.9	25.7	-35	0	0	0	112.4	E177 R185	E177-P181 WeakPolarHBondContact O-CD 3.38Å; E177-P181 VanDerWaalsContact O-CG 3.24Å; E177-P181 WeakPolarHBondContact O-CG 3.33Å; P181-R185 WeakPolarHBondContact O-CB 3.22Å; P181-R185 PolarHBondContact O-N 2.85Å
182	V	96.9	Very high	94.2	Very high	7 Å²	7	58.1 Å²	58.1	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-69.9	-45.7	177.6	178.8	0	0	0	0	110.5	P166 V178 F179 A180 R185 N186 L266	P166-V182 HydrophobicContact CG-CG2 3.82Å; V178-V182 WeakPolarHBondContact O-CG2 3.41Å; F179-V182 PolarHBondContact O-N 3.43Å; A180-V182 VanDerWaalsContact C-N 3.25Å; A180-V182 PolarHBondContact O-N 2.88Å; V182-R185 PolarHBondContact O-N 3.07Å; V182-N186 WeakPolarHBondContact O-CB 3.29Å; V182-N186 PolarHBondContact O-N 2.96Å; V182-N186 PolarHBondContact O-ND2 3.5Å; V182-L266 HydrophobicContact CG1-CD1 3.63Å; V182-L266 HydrophobicContact CG1-CD2 3.82Å; V182-L266 HydrophobicContact CG1-CG 4.4Å
183	F	97.2	Very high	93.9	Very high	5 Å²	5	60 Å²	60	2%	0.022	30%	0.303	C	S	.	.	H	α-helix	trans	-65.2	-42.7	176	-77.7	-62.6	0	0	0	112.1	F179 A180 R185 N186 A187 L198 F211 W215 L266 V267 A270	F179-F183 HydrophobicContact CB-CD2 3.99Å; F179-F183 HydrophobicContact CB-CE2 3.92Å; F179-F183 HydrophobicContact CD1-CE2 4.04Å; F179-F183 HydrophobicContact CG-CE2 4.31Å; F179-F183 WeakPolarHBondContact O-CD2 3.47Å; F179-F183 PolarHBondContact O-N 3.37Å; A180-F183 PolarHBondContact O-N 2.81Å; F183-R185 VanDerWaalsContact C-N 3.35Å; F183-R185 PolarHBondContact O-N 3.12Å; F183-N186 PolarHBondContact O-N 3.34Å; F183-A187 WeakPolarHBondContact O-CB 3.4Å; F183-A187 PolarHBondContact O-N 3.11Å; F183-L198 HydrophobicContact CD2-CD1 4.31Å; F183-L198 HydrophobicContact CE2-CD1 4.32Å; F183-F211 HydrophobicContact CB-CZ 4.33Å; F183-F211 HydrophobicContact CD1-CZ 4.04Å; F183-F211 HydrophobicContact CD2-CE1 4.38Å; F183-F211 AromaticContact CD2-CZ 3.64Å; F183-F211 HydrophobicContact CD2-CZ 3.64Å; F183-F211 HydrophobicContact CE1-CZ 4.21Å; F183-F211 HydrophobicContact CE2-CE1 4.12Å; F183-F211 AromaticContact CE2-CZ 3.82Å; F183-F211 HydrophobicContact CE2-CZ 3.82Å; F183-F211 HydrophobicContact CG-CE2 4.46Å; F183-F211 AromaticContact CG-CZ 3.75Å; F183-F211 HydrophobicContact CG-CZ 3.75Å; F183-F211 HydrophobicContact CZ-CE1 4.24Å; F183-F211 HydrophobicContact CZ-CZ 4.11Å; F183-W215 HydrophobicContact CB-CH2 4.43Å; F183-W215 HydrophobicContact CB-CZ2 3.79Å; F183-W215 AromaticContact CD1-CD2 3.61Å; F183-W215 HydrophobicContact CD1-CD2 3.61Å; F183-W215 AromaticContact CD1-CE2 3.38Å; F183-W215 AromaticContact CD1-CE3 3.96Å; F183-W215 HydrophobicContact CD1-CE3 3.96Å; F183-W215 HydrophobicContact CD1-CG 4.18Å; F183-W215 AromaticContact CD1-CH2 3.89Å; F183-W215 HydrophobicContact CD1-CH2 3.89Å; F183-W215 AromaticContact CD1-CZ2 3.55Å; F183-W215 HydrophobicContact CD1-CZ2 3.55Å; F183-W215 HydrophobicContact CD1-CZ3 4.08Å; F183-W215 AromaticContact CD1-NE1 3.8Å; F183-W215 AromaticContact CE1-CD2 3.84Å; F183-W215 HydrophobicContact CE1-CD2 3.84Å; F183-W215 HydrophobicContact CE1-CE3 4.15Å; F183-W215 HydrophobicContact CE1-CG 4.07Å; F183-W215 HydrophobicContact CG-CZ2 4.12Å; F183-W215 VanDerWaalsContact O-CH2 3.27Å; F183-W215 WeakPolarHBondContact O-CH2 3.23Å; F183-W215 VanDerWaalsContact O-CZ2 3.3Å; F183-W215 WeakPolarHBondContact O-CZ2 3.3Å; F183-L266 HydrophobicContact CD1-CD2 4.01Å; F183-L266 HydrophobicContact CD1-CG 4.44Å; F183-L266 HydrophobicContact CE1-CD2 3.83Å; F183-L266 HydrophobicContact CE1-CG 3.82Å; F183-L266 HydrophobicContact CZ-CD1 4.4Å; F183-L266 HydrophobicContact CZ-CD2 4.46Å; F183-L266 HydrophobicContact CZ-CG 4.01Å; F183-V267 HydrophobicContact CE1-CG2 4.05Å; F183-A270 HydrophobicContact CE2-CB 3.72Å; F183-A270 HydrophobicContact CZ-CB 3.7Å
184	E	94.7	Very high	93.9	Very high	153 Å²	153	59.8 Å²	59.8	72%	0.715	30%	0.302	S	S	*	.	H	α-helix	trans	-59.7	-45.4	176.4	-175.2	175.2	-164.8	0	0	111.7	A180 N186 A187	A180-E184 WeakPolarHBondContact O-CB 3.21Å; A180-E184 PolarHBondContact O-N 3.23Å; E184-N186 PolarHBondContact O-N 3.49Å; E184-A187 WeakPolarHBondContact O-CB 3.14Å; E184-A187 PolarHBondContact O-N 2.87Å
185	R	94.7	Very high	93.6	Very high	77 Å²	77	59.6 Å²	59.6	29%	0.291	31%	0.307	S	S	.	.	H	α-helix	trans	-62.1	-42.8	176.9	-164.4	-162.9	-50.9	140.7	2.3	112.2	F161 D162 P181 V182 F183 A187 R188	F161-R185 HydrophobicContact CD2-CG 4.19Å; F161-R185 HydrophobicContact CE2-CG 3.54Å; F161-R185 HydrophobicContact CZ-CG 4.03Å; D162-R185 VanDerWaalsContact CG-NH1 3.26Å; D162-R185 PolarHBondContact O-NH1 3.46Å; D162-R185 IonicContact OD2-CZ 2.67Å; D162-R185 IonicContact OD2-NH1 3.99Å; D162-R185 PolarHBondContact OD2-NH1 3.36Å; D162-R185 IonicContact OD2-NH2 2.92Å; P181-R185 WeakPolarHBondContact O-CB 3.22Å; P181-R185 PolarHBondContact O-N 2.85Å; V182-R185 PolarHBondContact O-N 3.07Å; F183-R185 VanDerWaalsContact C-N 3.35Å; F183-R185 PolarHBondContact O-N 3.12Å; R185-A187 VanDerWaalsContact C-N 3.31Å; R185-R188 VanDerWaalsContact O-CG 3.25Å; R185-R188 WeakPolarHBondContact O-CG 3.3Å
186	N	95.8	Very high	93.6	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-72.9	-23.5	178.4	-76.4	-81.3	0	0	0	112.7	V182 F183 E184 R188 W189 W215 R262 I263	V182-N186 WeakPolarHBondContact O-CB 3.29Å; V182-N186 PolarHBondContact O-N 2.96Å; V182-N186 PolarHBondContact O-ND2 3.5Å; F183-N186 PolarHBondContact O-N 3.34Å; E184-N186 PolarHBondContact O-N 3.49Å; N186-R188 PolarHBondContact O-N 3.44Å; N186-W189 WeakPolarHBondContact O-CB 3.28Å; N186-W189 PolarHBondContact O-N 2.95Å; N186-W215 HydrophobicContact CB-CH2 3.83Å; N186-W215 HydrophobicContact CB-CZ3 4.07Å; N186-R262 PolarHBondContact OD1-NH2 3.47Å; N186-I263 HydrophobicContact CB-CD1 4.17Å; N186-I263 WeakPolarHBondContact OD1-CD1 3.35Å
187	A	95	Very high	93.5	Very high	38 Å²	38	63 Å²	63	31%	0.314	34%	0.338	S	S	.	.	H	α-helix	trans	-62.6	-23	178.5	0	0	0	0	0	112.3	F183 E184 R185 W189 S190 W215	F183-A187 WeakPolarHBondContact O-CB 3.4Å; F183-A187 PolarHBondContact O-N 3.11Å; E184-A187 WeakPolarHBondContact O-CB 3.14Å; E184-A187 PolarHBondContact O-N 2.87Å; R185-A187 VanDerWaalsContact C-N 3.31Å; A187-W189 PolarHBondContact O-N 3.37Å; A187-W189 VanDerWaalsContact O-N 3.08Å; A187-S190 VanDerWaalsContact O-CB 3.27Å; A187-S190 WeakPolarHBondContact O-CB 3.35Å; A187-S190 PolarHBondContact O-N 3.21Å; A187-W215 HydrophobicContact CB-CH2 4.29Å; A187-W215 HydrophobicContact CB-CZ2 4.25Å
188	R	92.4	Very high	93.5	Very high	40 Å²	40	56.5 Å²	56.5	15%	0.151	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-29	172.9	83.7	179.1	-94.2	-162.9	-11.1	112.8	Y97 D158 F161 R185 N186 S190 W221	Y97-R188 VanDerWaalsContact CB-NH2 3.28Å; Y97-R188 VanDerWaalsContact CD1-CZ 3.43Å; Y97-R188 VanDerWaalsContact CD1-NH1 3.34Å; Y97-R188 HydrophobicContact CE2-CB 4.44Å; Y97-R188 VanDerWaalsContact CG-CZ 3.44Å; Y97-R188 VanDerWaalsContact CG-NH2 3.26Å; D158-R188 IonicContact OD2-NH1 3.21Å; F161-R188 HydrophobicContact CE2-CG 4.33Å; R185-R188 VanDerWaalsContact O-CG 3.25Å; R185-R188 WeakPolarHBondContact O-CG 3.3Å; N186-R188 PolarHBondContact O-N 3.44Å; R188-S190 VanDerWaalsContact C-N 3.33Å; R188-W221 VanDerWaalsContact O-CZ2 3.31Å; R188-W221 WeakPolarHBondContact O-CZ2 3.3Å; R188-W221 PolarHBondContact O-NE1 3.2Å
189	W	95.4	Very high	93.5	Very high	0 Å²	0	56 Å²	56	0%	0	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.3	-178.8	-53.3	127.2	0	0	0	113.6	D155 F161 N186 A187 F218 S220 W221 R222	D155-W189 WeakPolarHBondContact O-CH2 3.32Å; F161-W189 HydrophobicContact CD1-CZ2 4.46Å; F161-W189 AromaticContact CD2-CZ2 3.6Å; F161-W189 HydrophobicContact CD2-CZ2 3.6Å; F161-W189 AromaticContact CD2-NE1 3.87Å; F161-W189 AromaticContact CE1-NE1 3.59Å; F161-W189 AromaticContact CE2-CE2 3.73Å; F161-W189 AromaticContact CE2-CZ2 3.82Å; F161-W189 HydrophobicContact CE2-CZ2 3.82Å; F161-W189 AromaticContact CE2-NE1 3.19Å; F161-W189 AromaticContact CG-CZ2 3.95Å; F161-W189 HydrophobicContact CG-CZ2 3.95Å; F161-W189 AromaticContact CZ-CD1 3.91Å; F161-W189 HydrophobicContact CZ-CZ2 4.39Å; F161-W189 AromaticContact CZ-NE1 3.06Å; N186-W189 WeakPolarHBondContact O-CB 3.28Å; N186-W189 PolarHBondContact O-N 2.95Å; A187-W189 PolarHBondContact O-N 3.37Å; A187-W189 VanDerWaalsContact O-N 3.08Å; W189-F218 HydrophobicContact CB-CE1 4.48Å; W189-F218 HydrophobicContact CB-CZ 4.31Å; W189-S220 WeakPolarHBondContact CB-OG 3.43Å; W189-S220 CarbonylContact O-C 3.42Å; W189-S220 WeakPolarHBondContact O-CA 3.21Å; W189-S220 WeakPolarHBondContact O-CB 3.29Å; W189-S220 PolarHBondContact O-OG 2.93Å; W189-W221 HydrophobicContact CE3-CE3 4.48Å; W189-W221 AromaticContact CE3-CH2 3.52Å; W189-W221 HydrophobicContact CE3-CH2 3.52Å; W189-W221 AromaticContact CE3-CZ2 3.55Å; W189-W221 HydrophobicContact CE3-CZ2 3.55Å; W189-W221 AromaticContact CE3-CZ3 3.97Å; W189-W221 HydrophobicContact CE3-CZ3 3.97Å; W189-W221 AromaticContact CZ3-CH2 3.37Å; W189-W221 HydrophobicContact CZ3-CH2 3.37Å; W189-W221 AromaticContact CZ3-CZ2 3.84Å; W189-W221 HydrophobicContact CZ3-CZ2 3.84Å; W189-W221 AromaticContact CZ3-CZ3 3.9Å; W189-W221 HydrophobicContact CZ3-CZ3 3.9Å; W189-W221 VanDerWaalsContact O-CD1 3.23Å; W189-W221 PolarHBondContact O-N 3.26Å; W189-R222 HydrophobicContact CB-CB 4.33Å; W189-R222 HydrophobicContact CD2-CB 4.41Å; W189-R222 HydrophobicContact CD2-CG 4.25Å; W189-R222 HydrophobicContact CE3-CB 4.25Å; W189-R222 HydrophobicContact CE3-CG 4.12Å; W189-R222 HydrophobicContact CG-CB 4.46Å
190	S	95.6	Very high	93.4	Very high	11 Å²	11	60 Å²	60	8%	0.077	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-73.2	134.5	-177.2	-167.9	0	0	0	0	111.5	A187 R188 K192 F214 D219 W221	A187-S190 VanDerWaalsContact O-CB 3.27Å; A187-S190 WeakPolarHBondContact O-CB 3.35Å; A187-S190 PolarHBondContact O-N 3.21Å; R188-S190 VanDerWaalsContact C-N 3.33Å; S190-K192 PolarHBondContact O-N 3.46Å; S190-K192 PolarHBondContact OG-N 3.47Å; S190-K192 PolarHBondContact OG-O 3.04Å; S190-F214 WeakPolarHBondContact OG-CZ 3.29Å; S190-D219 WeakPolarHBondContact CA-O 2.8Å; S190-W221 VanDerWaalsContact C-CD1 3.49Å
191	S	94.4	Very high	93.3	Very high	56 Å²	56	62.4 Å²	62.4	39%	0.392	34%	0.34	S	S	.	.	S	Bend	trans	-63.3	-20.8	168.9	-57.5	0	0	0	0	112.5	D219 W221	S191-D219 WeakPolarHBondContact CB-OD2 3.41Å; S191-D219 PolarHBondContact N-O 2.93Å; S191-D219 PolarHBondContact OG-OD2 3.1Å; S191-W221 PolarHBondContact OG-N 2.84Å
192	K	92.1	Very high	93.2	Very high	111 Å²	111	66.9 Å²	66.9	48%	0.483	36%	0.361	S	S	.	.	S	Bend	trans	-94.9	123.9	179.1	-64.3	174.5	-179	173	0	109.4	S190 H194 F214	S190-K192 PolarHBondContact O-N 3.46Å; S190-K192 PolarHBondContact OG-N 3.47Å; S190-K192 PolarHBondContact OG-O 3.04Å; K192-H194 VanDerWaalsContact C-N 3.3Å; K192-H194 PolarHBondContact O-N 2.86Å; K192-F214 HydrophobicContact CB-CE2 4.09Å; K192-F214 HydrophobicContact CD-CD2 4.24Å; K192-F214 HydrophobicContact CD-CE2 3.78Å
193	K	81.1	Confident	93.1	Very high	198 Å²	198	67.2 Å²	67.2	86%	0.861	36%	0.363	S	S	*	.	S	Bend	trans	-62.2	-32.6	-176.8	-72.1	-171.9	176.9	-176	0	114.1
194	H	84.1	Confident	93.1	Very high	172 Å²	172	68.9 Å²	68.9	80%	0.796	38%	0.376	S	S	*	.			trans	-122.1	107.4	-177.8	-55.5	-57.5	0	0	0	109.6	K192	K192-H194 VanDerWaalsContact C-N 3.3Å; K192-H194 PolarHBondContact O-N 2.86Å
195	G	85.6	Confident	93.1	Very high	42 Å²	42	66.8 Å²	66.8	43%	0.433	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-99.4	151.9	172.5	0	0	0	0	0	111.3
196	P	94.5	Very high	93.1	Very high	37 Å²	37	69.6 Å²	69.6	24%	0.24	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-63.5	141.5	171.7	27.8	-33.6	0	0	0	110.8	F211 F214	P196-F211 HydrophobicContact CB-CB 4.37Å; P196-F211 HydrophobicContact CB-CD2 4.38Å; P196-F211 HydrophobicContact CG-CB 4.39Å; P196-F211 HydrophobicContact CG-CD2 4.3Å; P196-F211 WeakPolarHBondContact O-CD2 3.49Å; P196-F214 VanDerWaalsContact CD-CG 3.42Å; P196-F214 HydrophobicContact CG-CB 3.57Å; P196-F214 HydrophobicContact CG-CD1 4.15Å; P196-F214 HydrophobicContact CG-CD2 4.38Å; P196-F214 HydrophobicContact CG-CG 3.8Å
197	S	93.9	Very high	93.2	Very high	96 Å²	96	75 Å²	75	67%	0.671	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-75.3	159.7	171.6	91.2	0	0	0	0	110.9	G199 F211	S197-G199 PolarHBondContact O-N 2.64Å; S197-G199 VanDerWaalsContact O-N 3.17Å; S197-G199 PolarHBondContact OG-N 2.98Å; S197-G199 VanDerWaalsContact OG-N 3.16Å; S197-F211 VanDerWaalsContact C-CD2 3.44Å; S197-F211 WeakPolarHBondContact O-CD2 3.49Å
198	L	95.9	Very high	93.3	Very high	11 Å²	11	73.2 Å²	73.2	6%	0.058	39%	0.391	C	S	.	.			trans	-59.8	-24.7	174.9	-176.7	63.4	0	0	0	112.5	F175 F176 F179 A180 F183 F211 R276	F175-L198 HydrophobicContact CE1-CD1 3.96Å; F175-L198 HydrophobicContact CE1-CD2 3.9Å; F175-L198 HydrophobicContact CE1-CG 4.16Å; F175-L198 HydrophobicContact CZ-CD1 3.96Å; F175-L198 HydrophobicContact CZ-CD2 4.32Å; F176-L198 HydrophobicContact CD1-CD2 4Å; F176-L198 HydrophobicContact CD1-CG 4.19Å; F176-L198 HydrophobicContact CE1-CG 4.41Å; F179-L198 HydrophobicContact CB-CD2 3.91Å; A180-L198 HydrophobicContact CB-CD2 4.01Å; F183-L198 HydrophobicContact CD2-CD1 4.31Å; F183-L198 HydrophobicContact CE2-CD1 4.32Å; L198-F211 VanDerWaalsContact CA-CE2 3.47Å; L198-F211 HydrophobicContact CB-CE2 3.99Å; L198-F211 HydrophobicContact CB-CZ 4.06Å; L198-F211 HydrophobicContact CD1-CD1 3.99Å; L198-F211 HydrophobicContact CD1-CE1 3.35Å; L198-F211 HydrophobicContact CD1-CE2 4.13Å; L198-F211 HydrophobicContact CD1-CZ 3.43Å; L198-F211 VanDerWaalsContact CD1-CZ 3.43Å; L198-F211 HydrophobicContact CG-CZ 4.35Å; L198-R276 PolarHBondContact O-NH1 3.06Å; L198-R276 PolarHBondContact O-NH2 3.02Å
199	G	94.9	Very high	93.5	Very high	26 Å²	26	75.1 Å²	75.1	27%	0.268	41%	0.405	S	S	.	.			trans	78.7	-161.4	-179.5	0	0	0	0	0	113.4	F176 S197	F176-G199 WeakPolarHBondContact CD1-O 3.47Å; F176-G199 WeakPolarHBondContact CE1-O 3.46Å; S197-G199 PolarHBondContact O-N 2.64Å; S197-G199 VanDerWaalsContact O-N 3.17Å; S197-G199 PolarHBondContact OG-N 2.98Å; S197-G199 VanDerWaalsContact OG-N 3.16Å
200	T	94.4	Very high	93.5	Very high	84 Å²	84	79.8 Å²	79.8	52%	0.515	43%	0.43	S	S	.	.			trans	-122.7	-179.4	-178.8	66.6	0	0	0	0	110.3	F176 D202 S203 R276	F176-T200 VanDerWaalsContact CZ-C 3.45Å; T200-D202 PolarHBondContact O-N 3.49Å; T200-D202 PolarHBondContact OG1-N 2.76Å; T200-S203 PolarHBondContact N-OG 2.83Å; T200-S203 WeakPolarHBondContact O-CB 3.34Å; T200-S203 PolarHBondContact O-N 3.45Å; T200-S203 PolarHBondContact O-OG 2.81Å; T200-R276 WeakPolarHBondContact O-CD 3.33Å; T200-R276 PolarHBondContact O-NH1 3.5Å
201	M	94.3	Very high	93.6	Very high	88 Å²	88	79.4 Å²	79.4	43%	0.433	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-25.4	177	-169.5	61.3	-171.2	0	0	113.1	F176 P275 R276	F176-M201 HydrophobicContact CE2-CB 4.21Å; F176-M201 HydrophobicContact CE2-SD 4.3Å; F176-M201 HydrophobicContact CZ-CB 4.47Å; M201-P275 HydrophobicContact CE-CB 4.05Å; M201-P275 HydrophobicContact SD-CB 4.1Å; M201-R276 HydrophobicContact SD-CG 3.99Å
202	D	93.8	Very high	93.8	Very high	152 Å²	152	76.9 Å²	76.9	81%	0.813	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	0.8	-177.3	-58	-50.2	0	0	0	113.5	T200	T200-D202 PolarHBondContact O-N 3.49Å; T200-D202 PolarHBondContact OG1-N 2.76Å
203	S	95.8	Very high	94.1	Very high	14 Å²	14	73.8 Å²	73.8	10%	0.098	40%	0.401	C	S	.	.			trans	-59.1	141.5	177.8	-67.5	0	0	0	0	112.2	T200 E207	T200-S203 PolarHBondContact N-OG 2.83Å; T200-S203 WeakPolarHBondContact O-CB 3.34Å; T200-S203 PolarHBondContact O-N 3.45Å; T200-S203 PolarHBondContact O-OG 2.81Å; S203-E207 VanDerWaalsContact CA-OE2 3.23Å; S203-E207 WeakPolarHBondContact CA-OE2 3.35Å; S203-E207 WeakPolarHBondContact CB-OE2 3.3Å
204	S	96.3	Very high	94.9	Very high	41 Å²	41	65.2 Å²	65.2	29%	0.287	36%	0.364	S	S	.	.			trans	-69.3	163.8	-179.1	91.5	0	0	0	0	111.8	E206 E207 V208	S204-E206 VanDerWaalsContact C-N 3.27Å; S204-E206 WeakPolarHBondContact CB-OE2 3.37Å; S204-E206 PolarHBondContact O-N 2.83Å; S204-E206 PolarHBondContact OG-N 2.88Å; S204-E206 PolarHBondContact OG-OE2 3.29Å; S204-E207 PolarHBondContact N-OE2 3.44Å; S204-E207 PolarHBondContact O-N 2.93Å; S204-E207 PolarHBondContact OG-N 3.36Å; S204-V208 WeakPolarHBondContact O-CG2 3.04Å; S204-V208 PolarHBondContact O-N 3.43Å; S204-V208 VanDerWaalsContact O-N 3.09Å
205	F	94.4	Very high	95.5	Very high	108 Å²	108	57.4 Å²	57.4	47%	0.474	33%	0.327	S	S	.	.	H	α-helix	trans	-57.7	-41.6	173.2	176.2	-92.9	0	0	0	111.5	V208 D209 F280	F205-V208 PolarHBondContact O-N 2.96Å; F205-D209 HydrophobicContact CE1-CB 4.2Å; F205-D209 HydrophobicContact CZ-CB 4.42Å; F205-D209 VanDerWaalsContact O-CB 3.25Å; F205-D209 WeakPolarHBondContact O-CB 3.36Å; F205-D209 PolarHBondContact O-N 3.42Å; F205-F280 HydrophobicContact CB-CD1 4.49Å; F205-F280 HydrophobicContact CB-CD2 4.41Å; F205-F280 HydrophobicContact CB-CE1 4.29Å; F205-F280 HydrophobicContact CB-CE2 4.18Å; F205-F280 HydrophobicContact CB-CZ 4.13Å; F205-F280 HydrophobicContact CD2-CB 4.05Å; F205-F280 HydrophobicContact CD2-CD1 4.49Å; F205-F280 AromaticContact CD2-CD2 3.58Å; F205-F280 HydrophobicContact CD2-CD2 3.58Å; F205-F280 HydrophobicContact CD2-CE2 4.09Å; F205-F280 AromaticContact CD2-CG 3.81Å; F205-F280 HydrophobicContact CD2-CG 3.81Å; F205-F280 HydrophobicContact CE2-CD2 4.39Å; F205-F280 HydrophobicContact CG-CD2 4.47Å
206	E	96	Very high	96.1	Very high	136 Å²	136	58.9 Å²	58.9	64%	0.636	32%	0.32	S	S	*	.	H	α-helix	trans	-65.9	-38.9	-179.8	-56.9	92.8	-176.7	0	0	112.4	S204 D209 N210	S204-E206 VanDerWaalsContact C-N 3.27Å; S204-E206 WeakPolarHBondContact CB-OE2 3.37Å; S204-E206 PolarHBondContact O-N 2.83Å; S204-E206 PolarHBondContact OG-N 2.88Å; S204-E206 PolarHBondContact OG-OE2 3.29Å; E206-D209 PolarHBondContact O-N 3.45Å; E206-N210 VanDerWaalsContact O-CB 3.26Å; E206-N210 WeakPolarHBondContact O-CB 3.36Å; E206-N210 PolarHBondContact O-N 3.38Å
207	E	96.5	Very high	96.2	Very high	113 Å²	113	62.7 Å²	62.7	53%	0.528	34%	0.339	S	S	.	.	H	α-helix	trans	-63.9	-44.9	177	-68.2	177.3	147.4	0	0	111.2	S203 S204 N210 F211	S203-E207 VanDerWaalsContact CA-OE2 3.23Å; S203-E207 WeakPolarHBondContact CA-OE2 3.35Å; S203-E207 WeakPolarHBondContact CB-OE2 3.3Å; S204-E207 PolarHBondContact N-OE2 3.44Å; S204-E207 PolarHBondContact O-N 2.93Å; S204-E207 PolarHBondContact OG-N 3.36Å; E207-N210 PolarHBondContact O-N 3.19Å; E207-F211 WeakPolarHBondContact O-CB 3.34Å; E207-F211 PolarHBondContact O-N 2.97Å
208	V	97.4	Very high	96.3	Very high	1 Å²	1	59 Å²	59	1%	0.006	31%	0.31	C	S	.	.	H	α-helix	trans	-66.9	-41.5	178	176.9	0	0	0	0	111.1	S204 F205 F211 Y212 I277 F280	S204-V208 WeakPolarHBondContact O-CG2 3.04Å; S204-V208 PolarHBondContact O-N 3.43Å; S204-V208 VanDerWaalsContact O-N 3.09Å; F205-V208 PolarHBondContact O-N 2.96Å; V208-F211 WeakPolarHBondContact O-CB 3.14Å; V208-F211 PolarHBondContact O-N 3.23Å; V208-Y212 HydrophobicContact CG1-CD2 3.74Å; V208-Y212 HydrophobicContact CG1-CE2 3.68Å; V208-Y212 VanDerWaalsContact O-CD2 3.25Å; V208-Y212 WeakPolarHBondContact O-CD2 3.04Å; V208-Y212 PolarHBondContact O-N 3.01Å; V208-I277 HydrophobicContact CG1-CD1 3.58Å; V208-I277 HydrophobicContact CG1-CG1 4.24Å; V208-F280 HydrophobicContact CB-CE2 4.13Å; V208-F280 HydrophobicContact CG1-CE2 4.35Å; V208-F280 HydrophobicContact CG2-CE2 4.1Å
209	D	96.3	Very high	96.3	Very high	81 Å²	81	62.8 Å²	62.8	43%	0.433	33%	0.331	S	S	.	.	H	α-helix	trans	-65.1	-41.9	177	-174	68.2	0	0	0	112	F205 E206 F211 Y212 S213	F205-D209 HydrophobicContact CE1-CB 4.2Å; F205-D209 HydrophobicContact CZ-CB 4.42Å; F205-D209 VanDerWaalsContact O-CB 3.25Å; F205-D209 WeakPolarHBondContact O-CB 3.36Å; F205-D209 PolarHBondContact O-N 3.42Å; E206-D209 PolarHBondContact O-N 3.45Å; D209-F211 VanDerWaalsContact C-N 3.35Å; D209-F211 PolarHBondContact O-N 3.36Å; D209-Y212 PolarHBondContact O-N 3.33Å; D209-S213 WeakPolarHBondContact O-CB 3.46Å; D209-S213 PolarHBondContact O-N 2.86Å; D209-S213 PolarHBondContact O-OG 3.12Å
210	N	96.7	Very high	96.4	Very high	98 Å²	98	62.3 Å²	62.3	52%	0.524	32%	0.323	S	S	.	.	H	α-helix	trans	-62.8	-42	174.6	-174.4	19.5	0	0	0	111.5	E206 E207 S213 F214	E206-N210 VanDerWaalsContact O-CB 3.26Å; E206-N210 WeakPolarHBondContact O-CB 3.36Å; E206-N210 PolarHBondContact O-N 3.38Å; E207-N210 PolarHBondContact O-N 3.19Å; N210-S213 PolarHBondContact O-N 3.34Å; N210-F214 WeakPolarHBondContact O-CB 3.14Å; N210-F214 PolarHBondContact O-N 3.41Å
211	F	97.9	Very high	96.4	Very high	2 Å²	2	61.3 Å²	61.3	1%	0.009	31%	0.31	C	S	.	.	H	α-helix	trans	-56.5	-55.4	174.1	173.9	-94.5	0	0	0	111.8	F183 P196 S197 L198 E207 V208 D209 S213 F214 W215	F183-F211 HydrophobicContact CB-CZ 4.33Å; F183-F211 HydrophobicContact CD1-CZ 4.04Å; F183-F211 HydrophobicContact CD2-CE1 4.38Å; F183-F211 AromaticContact CD2-CZ 3.64Å; F183-F211 HydrophobicContact CD2-CZ 3.64Å; F183-F211 HydrophobicContact CE1-CZ 4.21Å; F183-F211 HydrophobicContact CE2-CE1 4.12Å; F183-F211 AromaticContact CE2-CZ 3.82Å; F183-F211 HydrophobicContact CE2-CZ 3.82Å; F183-F211 HydrophobicContact CG-CE2 4.46Å; F183-F211 AromaticContact CG-CZ 3.75Å; F183-F211 HydrophobicContact CG-CZ 3.75Å; F183-F211 HydrophobicContact CZ-CE1 4.24Å; F183-F211 HydrophobicContact CZ-CZ 4.11Å; P196-F211 HydrophobicContact CB-CB 4.37Å; P196-F211 HydrophobicContact CB-CD2 4.38Å; P196-F211 HydrophobicContact CG-CB 4.39Å; P196-F211 HydrophobicContact CG-CD2 4.3Å; P196-F211 WeakPolarHBondContact O-CD2 3.49Å; S197-F211 VanDerWaalsContact C-CD2 3.44Å; S197-F211 WeakPolarHBondContact O-CD2 3.49Å; L198-F211 VanDerWaalsContact CA-CE2 3.47Å; L198-F211 HydrophobicContact CB-CE2 3.99Å; L198-F211 HydrophobicContact CB-CZ 4.06Å; L198-F211 HydrophobicContact CD1-CD1 3.99Å; L198-F211 HydrophobicContact CD1-CE1 3.35Å; L198-F211 HydrophobicContact CD1-CE2 4.13Å; L198-F211 HydrophobicContact CD1-CZ 3.43Å; L198-F211 VanDerWaalsContact CD1-CZ 3.43Å; L198-F211 HydrophobicContact CG-CZ 4.35Å; E207-F211 WeakPolarHBondContact O-CB 3.34Å; E207-F211 PolarHBondContact O-N 2.97Å; V208-F211 WeakPolarHBondContact O-CB 3.14Å; V208-F211 PolarHBondContact O-N 3.23Å; D209-F211 VanDerWaalsContact C-N 3.35Å; D209-F211 PolarHBondContact O-N 3.36Å; F211-S213 VanDerWaalsContact C-N 3.33Å; F211-S213 PolarHBondContact O-N 3.47Å; F211-F214 WeakPolarHBondContact O-CB 3.34Å; F211-F214 PolarHBondContact O-N 2.95Å; F211-W215 AromaticContact CD2-CD1 3.73Å; F211-W215 AromaticContact CD2-NE1 3.74Å; F211-W215 AromaticContact CE1-CD1 3.74Å; F211-W215 AromaticContact CE2-CD1 3.36Å; F211-W215 AromaticContact CE2-NE1 3.07Å; F211-W215 AromaticContact CZ-CD1 3.34Å; F211-W215 HydrophobicContact CZ-CG 4.38Å; F211-W215 AromaticContact CZ-NE1 3.34Å; F211-W215 VanDerWaalsContact CZ-NE1 3.34Å; F211-W215 VanDerWaalsContact O-CD1 3.24Å; F211-W215 PolarHBondContact O-N 3.14Å; F211-W215 VanDerWaalsContact O-N 3.14Å
212	Y	98.1	Very high	96.4	Very high	4 Å²	4	57.9 Å²	57.9	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-67.4	-34.1	-179.2	-77.8	-66.1	0	0	0	112.8	V208 D209 W215 Y216 V267 A270 Y271 D274 I277	V208-Y212 HydrophobicContact CG1-CD2 3.74Å; V208-Y212 HydrophobicContact CG1-CE2 3.68Å; V208-Y212 VanDerWaalsContact O-CD2 3.25Å; V208-Y212 WeakPolarHBondContact O-CD2 3.04Å; V208-Y212 PolarHBondContact O-N 3.01Å; D209-Y212 PolarHBondContact O-N 3.33Å; Y212-W215 PolarHBondContact O-N 3.25Å; Y212-Y216 WeakPolarHBondContact O-CB 3.25Å; Y212-Y216 VanDerWaalsContact O-CD2 3.24Å; Y212-Y216 WeakPolarHBondContact O-CD2 3.48Å; Y212-Y216 PolarHBondContact O-N 2.87Å; Y212-V267 HydrophobicContact CD1-CG1 3.89Å; Y212-V267 HydrophobicContact CE1-CG1 4.36Å; Y212-A270 HydrophobicContact CE1-CB 4.39Å; Y212-Y271 AromaticContact CD1-CD2 3.81Å; Y212-Y271 HydrophobicContact CD1-CD2 3.81Å; Y212-Y271 HydrophobicContact CD1-CG 4.47Å; Y212-Y271 AromaticContact CD2-CD2 3.76Å; Y212-Y271 HydrophobicContact CD2-CD2 3.76Å; Y212-Y271 HydrophobicContact CD2-CE2 4.21Å; Y212-Y271 AromaticContact CE1-CD2 3.93Å; Y212-Y271 HydrophobicContact CE1-CD2 3.93Å; Y212-Y271 HydrophobicContact CE1-CG 4.34Å; Y212-Y271 AromaticContact CE2-CD2 3.87Å; Y212-Y271 HydrophobicContact CE2-CD2 3.87Å; Y212-Y271 AromaticContact CG-CD2 3.73Å; Y212-Y271 HydrophobicContact CG-CD2 3.73Å; Y212-Y271 HydrophobicContact CG-CE2 4.37Å; Y212-Y271 AromaticContact CZ-CD2 3.96Å; Y212-D274 WeakPolarHBondContact OH-CB 3.36Å; Y212-D274 PolarHBondContact OH-OD2 3.11Å; Y212-D274 VanDerWaalsContact OH-OD2 3.05Å; Y212-I277 HydrophobicContact CD2-CD1 4.21Å; Y212-I277 HydrophobicContact CE2-CD1 4.06Å; Y212-I277 HydrophobicContact CE2-CG1 3.94Å
213	S	97.4	Very high	96.4	Very high	46 Å²	46	51.9 Å²	51.9	32%	0.322	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-40.4	175	-70.3	0	0	0	0	112.1	D209 N210 F211 N217	D209-S213 WeakPolarHBondContact O-CB 3.46Å; D209-S213 PolarHBondContact O-N 2.86Å; D209-S213 PolarHBondContact O-OG 3.12Å; N210-S213 PolarHBondContact O-N 3.34Å; F211-S213 VanDerWaalsContact C-N 3.33Å; F211-S213 PolarHBondContact O-N 3.47Å; S213-N217 WeakPolarHBondContact O-CB 3.27Å; S213-N217 PolarHBondContact O-N 3Å; S213-N217 VanDerWaalsContact O-N 3.13Å; S213-N217 PolarHBondContact O-ND2 2.88Å
214	F	97.8	Very high	96.4	Very high	18 Å²	18	51.9 Å²	51.9	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-47.5	172.9	171.8	-89.8	0	0	0	111.3	S190 K192 P196 N210 F211 N217 F218	S190-F214 WeakPolarHBondContact OG-CZ 3.29Å; K192-F214 HydrophobicContact CB-CE2 4.09Å; K192-F214 HydrophobicContact CD-CD2 4.24Å; K192-F214 HydrophobicContact CD-CE2 3.78Å; P196-F214 VanDerWaalsContact CD-CG 3.42Å; P196-F214 HydrophobicContact CG-CB 3.57Å; P196-F214 HydrophobicContact CG-CD1 4.15Å; P196-F214 HydrophobicContact CG-CD2 4.38Å; P196-F214 HydrophobicContact CG-CG 3.8Å; N210-F214 WeakPolarHBondContact O-CB 3.14Å; N210-F214 PolarHBondContact O-N 3.41Å; F211-F214 WeakPolarHBondContact O-CB 3.34Å; F211-F214 PolarHBondContact O-N 2.95Å; F214-N217 CarbonylContact O-C 3.46Å; F214-N217 PolarHBondContact O-N 3.32Å; F214-F218 AromaticContact CE1-CD2 3.87Å; F214-F218 HydrophobicContact CE1-CD2 3.87Å; F214-F218 HydrophobicContact CE1-CE2 4.11Å; F214-F218 HydrophobicContact CZ-CD2 4.36Å; F214-F218 HydrophobicContact CZ-CE2 4.44Å; F214-F218 WeakPolarHBondContact O-CA 3.23Å; F214-F218 PolarHBondContact O-N 3.27Å
215	W	97.9	Very high	96.3	Very high	7 Å²	7	51.8 Å²	51.8	3%	0.027	26%	0.257	C	S	.	.	H	α-helix	trans	-75.8	-30.1	-175.9	-79.3	106.5	0	0	0	114.1	F183 N186 A187 F211 Y212 N217 F218 I263 V267	F183-W215 HydrophobicContact CB-CH2 4.43Å; F183-W215 HydrophobicContact CB-CZ2 3.79Å; F183-W215 AromaticContact CD1-CD2 3.61Å; F183-W215 HydrophobicContact CD1-CD2 3.61Å; F183-W215 AromaticContact CD1-CE2 3.38Å; F183-W215 AromaticContact CD1-CE3 3.96Å; F183-W215 HydrophobicContact CD1-CE3 3.96Å; F183-W215 HydrophobicContact CD1-CG 4.18Å; F183-W215 AromaticContact CD1-CH2 3.89Å; F183-W215 HydrophobicContact CD1-CH2 3.89Å; F183-W215 AromaticContact CD1-CZ2 3.55Å; F183-W215 HydrophobicContact CD1-CZ2 3.55Å; F183-W215 HydrophobicContact CD1-CZ3 4.08Å; F183-W215 AromaticContact CD1-NE1 3.8Å; F183-W215 AromaticContact CE1-CD2 3.84Å; F183-W215 HydrophobicContact CE1-CD2 3.84Å; F183-W215 HydrophobicContact CE1-CE3 4.15Å; F183-W215 HydrophobicContact CE1-CG 4.07Å; F183-W215 HydrophobicContact CG-CZ2 4.12Å; F183-W215 VanDerWaalsContact O-CH2 3.27Å; F183-W215 WeakPolarHBondContact O-CH2 3.23Å; F183-W215 VanDerWaalsContact O-CZ2 3.3Å; F183-W215 WeakPolarHBondContact O-CZ2 3.3Å; N186-W215 HydrophobicContact CB-CH2 3.83Å; N186-W215 HydrophobicContact CB-CZ3 4.07Å; A187-W215 HydrophobicContact CB-CH2 4.29Å; A187-W215 HydrophobicContact CB-CZ2 4.25Å; F211-W215 AromaticContact CD2-CD1 3.73Å; F211-W215 AromaticContact CD2-NE1 3.74Å; F211-W215 AromaticContact CE1-CD1 3.74Å; F211-W215 AromaticContact CE2-CD1 3.36Å; F211-W215 AromaticContact CE2-NE1 3.07Å; F211-W215 AromaticContact CZ-CD1 3.34Å; F211-W215 HydrophobicContact CZ-CG 4.38Å; F211-W215 AromaticContact CZ-NE1 3.34Å; F211-W215 VanDerWaalsContact CZ-NE1 3.34Å; F211-W215 VanDerWaalsContact O-CD1 3.24Å; F211-W215 PolarHBondContact O-N 3.14Å; F211-W215 VanDerWaalsContact O-N 3.14Å; Y212-W215 PolarHBondContact O-N 3.25Å; W215-N217 VanDerWaalsContact C-N 3.29Å; W215-F218 HydrophobicContact CD2-CD2 4.27Å; W215-F218 HydrophobicContact CE3-CB 4.37Å; W215-F218 AromaticContact CE3-CD2 3.52Å; W215-F218 HydrophobicContact CE3-CD2 3.52Å; W215-F218 AromaticContact CE3-CE2 3.89Å; W215-F218 HydrophobicContact CE3-CE2 3.89Å; W215-F218 AromaticContact CE3-CG 3.99Å; W215-F218 HydrophobicContact CE3-CG 3.99Å; W215-F218 HydrophobicContact CH2-CD2 4.28Å; W215-F218 AromaticContact CH2-CE2 3.79Å; W215-F218 HydrophobicContact CH2-CE2 3.79Å; W215-F218 HydrophobicContact CH2-CZ 4.33Å; W215-F218 AromaticContact CZ3-CD2 3.54Å; W215-F218 HydrophobicContact CZ3-CD2 3.54Å; W215-F218 HydrophobicContact CZ3-CE1 4.41Å; W215-F218 AromaticContact CZ3-CE2 3.38Å; W215-F218 HydrophobicContact CZ3-CE2 3.38Å; W215-F218 HydrophobicContact CZ3-CG 4.13Å; W215-F218 AromaticContact CZ3-CZ 3.86Å; W215-F218 HydrophobicContact CZ3-CZ 3.86Å; W215-F218 WeakPolarHBondContact O-CB 3.28Å; W215-F218 PolarHBondContact O-N 3.46Å; W215-I263 HydrophobicContact CE3-CG2 4.28Å; W215-V267 HydrophobicContact CB-CG1 4.09Å; W215-V267 HydrophobicContact CB-CG2 3.67Å; W215-V267 HydrophobicContact CE3-CG2 4.48Å; W215-V267 HydrophobicContact CG-CG2 4.41Å
216	Y	97.8	Very high	96.3	Very high	74 Å²	74	47.9 Å²	47.9	29%	0.29	24%	0.24	S	C	.	.	H	α-helix	trans	-72.5	-26.2	171.2	-78.2	-46.9	0	0	0	113.1	Y212 V267 D268	Y212-Y216 WeakPolarHBondContact O-CB 3.25Å; Y212-Y216 VanDerWaalsContact O-CD2 3.24Å; Y212-Y216 WeakPolarHBondContact O-CD2 3.48Å; Y212-Y216 PolarHBondContact O-N 2.87Å; Y216-V267 HydrophobicContact CD1-CB 4.2Å; Y216-V267 HydrophobicContact CD1-CG1 3.57Å; Y216-V267 HydrophobicContact CD2-CG1 4.25Å; Y216-V267 HydrophobicContact CE1-CB 3.97Å; Y216-V267 HydrophobicContact CE1-CG1 3.4Å; Y216-V267 HydrophobicContact CE2-CG1 4.07Å; Y216-V267 HydrophobicContact CG-CG1 4.05Å; Y216-D268 WeakPolarHBondContact CE1-OD1 3.21Å; Y216-D268 PolarHBondContact OH-OD1 2.81Å
217	N	96.6	Very high	96.1	Very high	117 Å²	117	44.7 Å²	44.7	63%	0.626	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104	32.3	171.7	-58.6	-61.4	0	0	0	111.3	S213 F214 W215 D219	S213-N217 WeakPolarHBondContact O-CB 3.27Å; S213-N217 PolarHBondContact O-N 3Å; S213-N217 VanDerWaalsContact O-N 3.13Å; S213-N217 PolarHBondContact O-ND2 2.88Å; F214-N217 CarbonylContact O-C 3.46Å; F214-N217 PolarHBondContact O-N 3.32Å; W215-N217 VanDerWaalsContact C-N 3.29Å; N217-D219 PolarHBondContact O-N 3.36Å; N217-D219 VanDerWaalsContact O-N 3.14Å
218	F	97.2	Very high	95.9	Very high	18 Å²	18	40.5 Å²	40.5	8%	0.079	21%	0.208	C	C	.	.			trans	-63.5	117.4	-175.9	-172.5	-106.1	0	0	0	109.8	W189 F214 W215 I263	W189-F218 HydrophobicContact CB-CE1 4.48Å; W189-F218 HydrophobicContact CB-CZ 4.31Å; F214-F218 AromaticContact CE1-CD2 3.87Å; F214-F218 HydrophobicContact CE1-CD2 3.87Å; F214-F218 HydrophobicContact CE1-CE2 4.11Å; F214-F218 HydrophobicContact CZ-CD2 4.36Å; F214-F218 HydrophobicContact CZ-CE2 4.44Å; F214-F218 WeakPolarHBondContact O-CA 3.23Å; F214-F218 PolarHBondContact O-N 3.27Å; W215-F218 HydrophobicContact CD2-CD2 4.27Å; W215-F218 HydrophobicContact CE3-CB 4.37Å; W215-F218 AromaticContact CE3-CD2 3.52Å; W215-F218 HydrophobicContact CE3-CD2 3.52Å; W215-F218 AromaticContact CE3-CE2 3.89Å; W215-F218 HydrophobicContact CE3-CE2 3.89Å; W215-F218 AromaticContact CE3-CG 3.99Å; W215-F218 HydrophobicContact CE3-CG 3.99Å; W215-F218 HydrophobicContact CH2-CD2 4.28Å; W215-F218 AromaticContact CH2-CE2 3.79Å; W215-F218 HydrophobicContact CH2-CE2 3.79Å; W215-F218 HydrophobicContact CH2-CZ 4.33Å; W215-F218 AromaticContact CZ3-CD2 3.54Å; W215-F218 HydrophobicContact CZ3-CD2 3.54Å; W215-F218 HydrophobicContact CZ3-CE1 4.41Å; W215-F218 AromaticContact CZ3-CE2 3.38Å; W215-F218 HydrophobicContact CZ3-CE2 3.38Å; W215-F218 HydrophobicContact CZ3-CG 4.13Å; W215-F218 AromaticContact CZ3-CZ 3.86Å; W215-F218 HydrophobicContact CZ3-CZ 3.86Å; W215-F218 WeakPolarHBondContact O-CB 3.28Å; W215-F218 PolarHBondContact O-N 3.46Å; F218-I263 HydrophobicContact CB-CG2 4.3Å; F218-I263 HydrophobicContact CD1-CG1 4.5Å; F218-I263 HydrophobicContact CD1-CG2 4.08Å; F218-I263 HydrophobicContact CG-CG2 4.32Å
219	D	95.8	Very high	95.2	Very high	90 Å²	90	47.8 Å²	47.8	48%	0.481	24%	0.242	S	C	.	.			trans	-102.2	125.6	173.3	-179.4	36.7	0	0	0	108.9	S190 S191 N217	S190-D219 WeakPolarHBondContact CA-O 2.8Å; S191-D219 WeakPolarHBondContact CB-OD2 3.41Å; S191-D219 PolarHBondContact N-O 2.93Å; S191-D219 PolarHBondContact OG-OD2 3.1Å; N217-D219 PolarHBondContact O-N 3.36Å; N217-D219 VanDerWaalsContact O-N 3.14Å
220	S	95.2	Very high	94.5	Very high	17 Å²	17	48.8 Å²	48.8	12%	0.119	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-117.2	131.8	-173.6	-172.6	0	0	0	0	112.2	W189 R222	W189-S220 WeakPolarHBondContact CB-OG 3.43Å; W189-S220 CarbonylContact O-C 3.42Å; W189-S220 WeakPolarHBondContact O-CA 3.21Å; W189-S220 WeakPolarHBondContact O-CB 3.29Å; W189-S220 PolarHBondContact O-OG 2.93Å; S220-R222 PolarHBondContact O-N 3.41Å; S220-R222 VanDerWaalsContact OG-CB 3.24Å; S220-R222 WeakPolarHBondContact OG-CB 3.4Å; S220-R222 PolarHBondContact OG-N 3.27Å
221	W	94.7	Very high	93.8	Very high	63 Å²	63	48.2 Å²	48.2	24%	0.239	24%	0.238	C	C	.	.			trans	-77.6	-9.7	171	62.6	-103.8	0	0	0	112.9	R152 D155 R188 W189 S190 S191 E223	R152-W221 HydrophobicContact CB-CZ3 4.44Å; R152-W221 HydrophobicContact CG-CE3 3.38Å; R152-W221 HydrophobicContact CG-CZ3 3.4Å; R152-W221 VanDerWaalsContact CG-CZ3 3.4Å; D155-W221 HydrophobicContact CB-CH2 4.49Å; R188-W221 VanDerWaalsContact O-CZ2 3.31Å; R188-W221 WeakPolarHBondContact O-CZ2 3.3Å; R188-W221 PolarHBondContact O-NE1 3.2Å; W189-W221 HydrophobicContact CE3-CE3 4.48Å; W189-W221 AromaticContact CE3-CH2 3.52Å; W189-W221 HydrophobicContact CE3-CH2 3.52Å; W189-W221 AromaticContact CE3-CZ2 3.55Å; W189-W221 HydrophobicContact CE3-CZ2 3.55Å; W189-W221 AromaticContact CE3-CZ3 3.97Å; W189-W221 HydrophobicContact CE3-CZ3 3.97Å; W189-W221 AromaticContact CZ3-CH2 3.37Å; W189-W221 HydrophobicContact CZ3-CH2 3.37Å; W189-W221 AromaticContact CZ3-CZ2 3.84Å; W189-W221 HydrophobicContact CZ3-CZ2 3.84Å; W189-W221 AromaticContact CZ3-CZ3 3.9Å; W189-W221 HydrophobicContact CZ3-CZ3 3.9Å; W189-W221 VanDerWaalsContact O-CD1 3.23Å; W189-W221 PolarHBondContact O-N 3.26Å; S190-W221 VanDerWaalsContact C-CD1 3.49Å; S191-W221 PolarHBondContact OG-N 2.84Å; W221-E223 PolarHBondContact O-N 3.35Å
222	R	95	Very high	93	Very high	15 Å²	15	53.2 Å²	53.2	6%	0.057	26%	0.259	C	S	.	.			trans	-57.2	131.4	-178	-164.3	176.6	-172.3	-176.5	4.6	110.4	S156 N163 W189 S220 F224 E259	S156-R222 VanDerWaalsContact O-CZ 3.31Å; S156-R222 PolarHBondContact O-NE 3.27Å; S156-R222 PolarHBondContact O-NH2 2.81Å; N163-R222 PolarHBondContact OD1-NH1 3.35Å; W189-R222 HydrophobicContact CB-CB 4.33Å; W189-R222 HydrophobicContact CD2-CB 4.41Å; W189-R222 HydrophobicContact CD2-CG 4.25Å; W189-R222 HydrophobicContact CE3-CB 4.25Å; W189-R222 HydrophobicContact CE3-CG 4.12Å; W189-R222 HydrophobicContact CG-CB 4.46Å; S220-R222 PolarHBondContact O-N 3.41Å; S220-R222 VanDerWaalsContact OG-CB 3.24Å; S220-R222 WeakPolarHBondContact OG-CB 3.4Å; S220-R222 PolarHBondContact OG-N 3.27Å; R222-F224 HydrophobicContact CG-CE1 4.49Å; R222-F224 HydrophobicContact CG-CZ 4.09Å; R222-E259 IonicContact CZ-OE1 2.94Å; R222-E259 IonicContact NH1-OE1 3.97Å; R222-E259 PolarHBondContact NH1-OE1 3.27Å; R222-E259 IonicContact NH1-OE2 3.58Å; R222-E259 PolarHBondContact NH1-OE2 2.87Å
223	E	94.3	Very high	92.2	Very high	26 Å²	26	60.5 Å²	60.5	12%	0.121	29%	0.294	C	S	.	.			trans	-145.4	154.7	-173.3	81.4	93.9	176.4	0	0	111.2	A153 S156 W221 S225	A153-E223 WeakPolarHBondContact CB-OE1 3.49Å; S156-E223 WeakPolarHBondContact CB-O 3.37Å; S156-E223 PolarHBondContact OG-N 2.88Å; S156-E223 VanDerWaalsContact OG-N 3.11Å; S156-E223 PolarHBondContact OG-O 2.99Å; W221-E223 PolarHBondContact O-N 3.35Å; E223-S225 VanDerWaalsContact CD-OG 3.24Å; E223-S225 PolarHBondContact OE1-OG 3.26Å; E223-S225 WeakPolarHBondContact OE2-CB 3.4Å; E223-S225 PolarHBondContact OE2-N 3.47Å; E223-S225 PolarHBondContact OE2-OG 3.45Å; E223-S225 VanDerWaalsContact OE2-OG 3.14Å
224	F	95.8	Very high	91.5	Very high	15 Å²	15	65.1 Å²	65.1	7%	0.066	31%	0.308	C	S	.	.			trans	-120.8	20.9	-162.4	-59.8	-80.2	0	0	0	113.4	V157 R222 Y226 L227 R252 R255 K256 E259	V157-F224 HydrophobicContact CG1-CD1 3.88Å; V157-F224 HydrophobicContact CG1-CE1 4.49Å; R222-F224 HydrophobicContact CG-CE1 4.49Å; R222-F224 HydrophobicContact CG-CZ 4.09Å; F224-Y226 PolarHBondContact O-N 2.91Å; F224-L227 PolarHBondContact O-N 3.47Å; F224-L227 VanDerWaalsContact O-N 3.13Å; F224-R252 HydrophobicContact CB-CG 4.34Å; F224-R255 HydrophobicContact CB-CB 4.12Å; F224-R255 HydrophobicContact CD1-CB 4.13Å; F224-R255 HydrophobicContact CD2-CB 3.64Å; F224-R255 HydrophobicContact CE1-CB 4.49Å; F224-R255 HydrophobicContact CE2-CB 4.06Å; F224-R255 HydrophobicContact CG-CB 3.69Å; F224-R255 HydrophobicContact CZ-CB 4.46Å; F224-K256 HydrophobicContact CD2-CG 3.76Å; F224-K256 HydrophobicContact CE2-CB 4.49Å; F224-K256 HydrophobicContact CE2-CG 3.87Å; F224-E259 HydrophobicContact CE2-CB 4.33Å; F224-E259 HydrophobicContact CZ-CB 4.05Å; F224-E259 HydrophobicContact CZ-CG 4.33Å
225	S	94	Very high	91	Very high	39 Å²	39	64.6 Å²	64.6	27%	0.273	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-63.4	-22.6	179.3	71.2	0	0	0	0	114.4	A153 E223 L227 D228	A153-S225 WeakPolarHBondContact CB-OG 3.3Å; E223-S225 VanDerWaalsContact CD-OG 3.24Å; E223-S225 PolarHBondContact OE1-OG 3.26Å; E223-S225 WeakPolarHBondContact OE2-CB 3.4Å; E223-S225 PolarHBondContact OE2-N 3.47Å; E223-S225 PolarHBondContact OE2-OG 3.45Å; E223-S225 VanDerWaalsContact OE2-OG 3.14Å; S225-L227 PolarHBondContact O-N 2.98Å; S225-D228 VanDerWaalsContact O-CB 3.26Å; S225-D228 WeakPolarHBondContact O-CB 3.36Å; S225-D228 PolarHBondContact O-N 2.92Å; S225-D228 VanDerWaalsContact O-N 3.1Å
226	Y	93.7	Very high	90.5	Very high	26 Å²	26	73.1 Å²	73.1	10%	0.102	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-62.3	-28.4	174	-162	-97.1	0	0	0	112.8	K82 H86 I144 A153 F154 V157 F224 D228	K82-Y226 WeakPolarHBondContact CE-O 3.31Å; K82-Y226 HydrophobicContact CG-CE1 3.86Å; K82-Y226 PolarHBondContact NZ-O 2.98Å; K82-Y226 WeakPolarHBondContact O-CE1 3.38Å; K82-Y226 PolarHBondContact O-OH 2.87Å; H86-Y226 PolarHBondContact NE2-OH 3.45Å; I144-Y226 HydrophobicContact CD1-CE2 4.28Å; A153-Y226 WeakPolarHBondContact O-CB 3.48Å; F154-Y226 HydrophobicContact CB-CD2 4.07Å; F154-Y226 HydrophobicContact CB-CE2 4.14Å; F154-Y226 HydrophobicContact CD2-CD1 4.42Å; F154-Y226 HydrophobicContact CD2-CD2 4.4Å; F154-Y226 AromaticContact CD2-CE1 3.93Å; F154-Y226 HydrophobicContact CD2-CE1 3.93Å; F154-Y226 AromaticContact CD2-CE2 3.93Å; F154-Y226 HydrophobicContact CD2-CE2 3.93Å; F154-Y226 AromaticContact CD2-CZ 3.67Å; F154-Y226 HydrophobicContact CE2-CE1 4.49Å; F154-Y226 HydrophobicContact CG-CE2 4.48Å; V157-Y226 HydrophobicContact CG2-CD1 3.68Å; V157-Y226 HydrophobicContact CG2-CG 4.05Å; F224-Y226 PolarHBondContact O-N 2.91Å; Y226-D228 VanDerWaalsContact C-N 3.33Å
227	L	92.8	Very high	90.1	Very high	69 Å²	69	72.6 Å²	72.6	36%	0.361	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-92	9.9	178.6	-60.8	173.3	0	0	0	113.1	V157 F224 S225 E229	V157-L227 HydrophobicContact CB-CD1 4.35Å; V157-L227 HydrophobicContact CB-CG 4.41Å; V157-L227 HydrophobicContact CG1-CD1 3.66Å; V157-L227 HydrophobicContact CG1-CG 3.84Å; F224-L227 PolarHBondContact O-N 3.47Å; F224-L227 VanDerWaalsContact O-N 3.13Å; S225-L227 PolarHBondContact O-N 2.98Å; L227-E229 PolarHBondContact O-N 2.88Å
228	D	92.3	Very high	89.8	Confident	25 Å²	25	75.2 Å²	75.2	13%	0.134	36%	0.355	C	S	.	.			trans	-61	125.9	170.1	-75.6	-5.4	0	0	0	108.6	K82 S225 Y226 N248 R252	K82-D228 PolarHBondContact NZ-O 2.77Å; S225-D228 VanDerWaalsContact O-CB 3.26Å; S225-D228 WeakPolarHBondContact O-CB 3.36Å; S225-D228 PolarHBondContact O-N 2.92Å; S225-D228 VanDerWaalsContact O-N 3.1Å; Y226-D228 VanDerWaalsContact C-N 3.33Å; D228-N248 HydrophobicContact CB-CB 4.24Å; D228-N248 WeakPolarHBondContact CB-ND2 3.4Å; D228-N248 WeakPolarHBondContact OD2-CB 3.26Å; D228-N248 PolarHBondContact OD2-ND2 3.49Å; D228-R252 WeakPolarHBondContact OD1-CG 3.43Å; D228-R252 IonicContact OD1-NE 2.84Å; D228-R252 IonicContact OD2-NE 3.83Å
229	E	82.1	Confident	89.4	Confident	154 Å²	154	79.9 Å²	79.9	72%	0.72	38%	0.381	S	S	*	.	S	Bend	trans	-73.2	-42	-174.7	-70.1	173.4	-166.9	0	0	110.9	L227	L227-E229 PolarHBondContact O-N 2.88Å
230	E	81.3	Confident	89	Confident	101 Å²	101	79 Å²	79	47%	0.472	37%	0.374	S	S	.	.	S	Bend	trans	-111.2	128.1	-175.9	-66.3	-63.8	163.3	0	0	111.3	K232 I244 N248	E230-K232 PolarHBondContact O-N 3.33Å; E230-I244 HydrophobicContact CB-CB 4.43Å; E230-I244 HydrophobicContact CB-CD1 4.22Å; E230-I244 HydrophobicContact CB-CG1 4.03Å; E230-I244 HydrophobicContact CB-CG2 3.64Å; E230-I244 WeakPolarHBondContact O-CG2 3.39Å; E230-N248 PolarHBondContact O-ND2 3.05Å
231	E	81.8	Confident	88.7	Confident	86 Å²	86	84 Å²	84	40%	0.402	39%	0.39	S	S	.	.			trans	-80.8	118.1	174.6	-72.6	165.2	-135.1	0	0	109.9	E233 K234	E231-E233 PolarHBondContact O-N 2.94Å; E231-K234 HydrophobicContact CB-CD 4.09Å; E231-K234 HydrophobicContact CB-CG 4.17Å; E231-K234 WeakPolarHBondContact O-CB 3.33Å; E231-K234 PolarHBondContact O-N 3.32Å; E231-K234 IonicContact OE1-NZ 3.25Å; E231-K234 PolarHBondContact OE1-NZ 2.81Å; E231-K234 WeakPolarHBondContact OE2-CE 3.47Å; E231-K234 IonicContact OE2-NZ 3.18Å; E231-K234 PolarHBondContact OE2-NZ 2.77Å
232	K	81.5	Confident	88.4	Confident	107 Å²	107	88.3 Å²	88.3	47%	0.465	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-19	179.1	75.2	-178.2	-178.8	-172.7	0	114.6	E230 A235 R241 I244	E230-K232 PolarHBondContact O-N 3.33Å; K232-A235 WeakPolarHBondContact O-CB 3.37Å; K232-R241 HydrophobicContact CB-CG 4.13Å; K232-R241 PolarHBondContact O-NE 3.13Å; K232-I244 HydrophobicContact CB-CG2 4.32Å
233	E	82.4	Confident	88.2	Confident	158 Å²	158	94.9 Å²	94.9	74%	0.738	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-23.2	-179.8	-65.3	-179.8	-177.1	0	0	112.2	E231 A235	E231-E233 PolarHBondContact O-N 2.94Å; E233-A235 VanDerWaalsContact C-N 3.3Å
234	K	82.9	Confident	88	Confident	142 Å²	142	93.9 Å²	93.9	62%	0.617	43%	0.427	S	S	*	.	S	Bend	trans	-81.2	-7.5	175.9	-66.2	176.6	177	155.9	0	113.5	E231 E236	E231-K234 HydrophobicContact CB-CD 4.09Å; E231-K234 HydrophobicContact CB-CG 4.17Å; E231-K234 WeakPolarHBondContact O-CB 3.33Å; E231-K234 PolarHBondContact O-N 3.32Å; E231-K234 IonicContact OE1-NZ 3.25Å; E231-K234 PolarHBondContact OE1-NZ 2.81Å; E231-K234 WeakPolarHBondContact OE2-CE 3.47Å; E231-K234 IonicContact OE2-NZ 3.18Å; E231-K234 PolarHBondContact OE2-NZ 2.77Å; K234-E236 PolarHBondContact O-N 2.81Å
235	A	87.1	Confident	87.8	Confident	8 Å²	8	95.6 Å²	95.6	7%	0.066	44%	0.435	C	S	.	.			trans	-66.2	128.6	178.6	0	0	0	0	0	112	K232 E233 E240 R241 I244	K232-A235 WeakPolarHBondContact O-CB 3.37Å; E233-A235 VanDerWaalsContact C-N 3.3Å; A235-E240 HydrophobicContact CB-CB 4.24Å; A235-E240 HydrophobicContact CB-CG 3.97Å; A235-R241 HydrophobicContact CB-CB 3.8Å; A235-R241 HydrophobicContact CB-CG 4.48Å; A235-I244 HydrophobicContact CB-CD1 4.02Å
236	E	87.3	Confident	87.8	Confident	185 Å²	185	101.1 Å²	101.1	86%	0.864	45%	0.454	S	S	*	.	S	Bend	trans	-75.5	-27.8	-179.2	-60.7	-175.7	169.3	0	0	111.9	K234 E240	K234-E236 PolarHBondContact O-N 2.81Å; E236-E240 PolarHBondContact N-OE2 3.14Å
237	C	88.2	Confident	87.8	Confident	64 Å²	64	104.8 Å²	104.8	43%	0.432	47%	0.472	S	S	.	.	S	Bend	trans	-135.8	167.5	-179.4	76.3	0	0	0	0	114.3	D239 E240 R241	C237-D239 VanDerWaalsContact C-N 3.34Å; C237-D239 PolarHBondContact O-N 3.05Å; C237-E240 PolarHBondContact O-N 3.45Å; C237-E240 WeakPolarHBondContact SG-CB 3.24Å; C237-E240 PolarHBondContact SG-N 3.11Å; C237-E240 VanDerWaalsContact SG-N 3.39Å; C237-R241 PolarHBondContact O-N 3.32Å
238	R	90.1	Very high	87.9	Confident	171 Å²	171	101.9 Å²	101.9	65%	0.645	46%	0.457	S	S	*	.	H	α-helix	trans	-62.6	-39.3	-179.2	-177.2	-174.9	178.4	-159.3	3.2	112.7	R241 R242	R238-R241 PolarHBondContact O-N 3.01Å; R238-R242 WeakPolarHBondContact O-CG 3.03Å; R238-R242 PolarHBondContact O-N 3.2Å
239	D	89	Confident	88	Confident	116 Å²	116	107.8 Å²	107.8	62%	0.62	48%	0.477	S	S	*	.	H	α-helix	trans	-73	-38.8	-176.9	-69	-26.5	0	0	0	111.3	C237 R242 W243	C237-D239 VanDerWaalsContact C-N 3.34Å; C237-D239 PolarHBondContact O-N 3.05Å; D239-R242 WeakPolarHBondContact O-CB 3.26Å; D239-R242 PolarHBondContact O-N 3.09Å; D239-W243 WeakPolarHBondContact O-CB 3.47Å; D239-W243 PolarHBondContact O-N 2.87Å
240	E	88	Confident	88.6	Confident	73 Å²	73	103.3 Å²	103.3	34%	0.341	47%	0.467	S	S	.	.	H	α-helix	trans	-61.3	-45.1	170.7	-177	177.1	-154.8	0	0	111.6	A235 E236 C237 R242 W243 I244	A235-E240 HydrophobicContact CB-CB 4.24Å; A235-E240 HydrophobicContact CB-CG 3.97Å; E236-E240 PolarHBondContact N-OE2 3.14Å; C237-E240 PolarHBondContact O-N 3.45Å; C237-E240 WeakPolarHBondContact SG-CB 3.24Å; C237-E240 PolarHBondContact SG-N 3.11Å; C237-E240 VanDerWaalsContact SG-N 3.39Å; E240-R242 VanDerWaalsContact C-N 3.27Å; E240-R242 PolarHBondContact O-N 2.76Å; E240-W243 WeakPolarHBondContact O-CB 2.93Å; E240-W243 PolarHBondContact O-N 3.3Å; E240-I244 HydrophobicContact CG-CD1 4.06Å; E240-I244 WeakPolarHBondContact O-CG1 3.41Å; E240-I244 PolarHBondContact O-N 3.36Å
241	R	88.6	Confident	89.2	Confident	120 Å²	120	100 Å²	100	45%	0.453	46%	0.455	S	S	.	.	H	α-helix	trans	-58	-40.1	174.5	-171.3	176.5	-64.9	140	8.1	112.3	K232 A235 C237 R238 E245	K232-R241 HydrophobicContact CB-CG 4.13Å; K232-R241 PolarHBondContact O-NE 3.13Å; A235-R241 HydrophobicContact CB-CB 3.8Å; A235-R241 HydrophobicContact CB-CG 4.48Å; C237-R241 PolarHBondContact O-N 3.32Å; R238-R241 PolarHBondContact O-N 3.01Å; R241-E245 WeakPolarHBondContact O-CB 3.49Å; R241-E245 PolarHBondContact O-N 3.06Å; R241-E245 VanDerWaalsContact O-N 3.08Å
242	R	89.2	Confident	89.8	Confident	155 Å²	155	98.7 Å²	98.7	59%	0.585	45%	0.446	S	S	*	.	H	α-helix	trans	-67.1	-38.7	175.6	-78.7	179.7	169	-154.4	-6	111.9	R238 D239 E240 K246	R238-R242 WeakPolarHBondContact O-CG 3.03Å; R238-R242 PolarHBondContact O-N 3.2Å; D239-R242 WeakPolarHBondContact O-CB 3.26Å; D239-R242 PolarHBondContact O-N 3.09Å; E240-R242 VanDerWaalsContact C-N 3.27Å; E240-R242 PolarHBondContact O-N 2.76Å; R242-K246 WeakPolarHBondContact O-CB 3.42Å; R242-K246 PolarHBondContact O-N 3.06Å
243	W	90.3	Very high	90.5	Very high	153 Å²	153	96.3 Å²	96.3	58%	0.58	45%	0.447	S	S	*	.	H	α-helix	trans	-67.6	-46.1	178.5	-178.6	89.9	0	0	0	111.7	D239 E240 K246 Q247	D239-W243 WeakPolarHBondContact O-CB 3.47Å; D239-W243 PolarHBondContact O-N 2.87Å; E240-W243 WeakPolarHBondContact O-CB 2.93Å; E240-W243 PolarHBondContact O-N 3.3Å; W243-K246 WeakPolarHBondContact O-CB 3.4Å; W243-K246 PolarHBondContact O-N 2.88Å; W243-K246 VanDerWaalsContact O-N 3.16Å; W243-Q247 HydrophobicContact CD2-CG 4.16Å; W243-Q247 HydrophobicContact CE3-CG 4.34Å; W243-Q247 HydrophobicContact CH2-CG 4.03Å; W243-Q247 HydrophobicContact CZ2-CG 3.85Å; W243-Q247 HydrophobicContact CZ3-CG 4.28Å; W243-Q247 PolarHBondContact O-N 3.47Å
244	I	90.2	Very high	91.2	Very high	5 Å²	5	93.3 Å²	93.3	3%	0.026	43%	0.433	C	S	.	.	H	α-helix	trans	-57.8	-51	174.4	-71.1	170.5	0	0	0	110.7	E230 K232 A235 E240 K246 Q247 N248	E230-I244 HydrophobicContact CB-CB 4.43Å; E230-I244 HydrophobicContact CB-CD1 4.22Å; E230-I244 HydrophobicContact CB-CG1 4.03Å; E230-I244 HydrophobicContact CB-CG2 3.64Å; E230-I244 WeakPolarHBondContact O-CG2 3.39Å; K232-I244 HydrophobicContact CB-CG2 4.32Å; A235-I244 HydrophobicContact CB-CD1 4.02Å; E240-I244 HydrophobicContact CG-CD1 4.06Å; E240-I244 WeakPolarHBondContact O-CG1 3.41Å; E240-I244 PolarHBondContact O-N 3.36Å; I244-K246 PolarHBondContact O-N 3.43Å; I244-Q247 PolarHBondContact O-N 2.92Å; I244-Q247 VanDerWaalsContact O-N 3.15Å; I244-N248 WeakPolarHBondContact O-CB 3.04Å; I244-N248 PolarHBondContact O-N 3.41Å
245	E	91.8	Very high	91.8	Very high	51 Å²	51	89.7 Å²	89.7	24%	0.238	42%	0.415	C	S	.	.	H	α-helix	trans	-60.7	-34.5	178.4	175.1	59.9	-152.5	0	0	112	R241 R249 R252	R241-E245 WeakPolarHBondContact O-CB 3.49Å; R241-E245 PolarHBondContact O-N 3.06Å; R241-E245 VanDerWaalsContact O-N 3.08Å; E245-R249 WeakPolarHBondContact O-CB 3.41Å; E245-R249 PolarHBondContact O-N 2.86Å; E245-R249 IonicContact OE1-CZ 2.76Å; E245-R249 IonicContact OE1-NE 3.83Å; E245-R249 IonicContact OE1-NH2 2.78Å; E245-R249 PolarHBondContact OE1-NH2 3.42Å; E245-R252 IonicContact OE1-NH2 3.75Å; E245-R252 PolarHBondContact OE1-NH2 3.49Å
246	K	93.6	Very high	92.2	Very high	155 Å²	155	93.9 Å²	93.9	67%	0.674	43%	0.432	S	S	*	.	H	α-helix	trans	-67.6	-45	175.7	-175.3	-178.2	177.9	-176	0	111.6	R242 W243 I244 A250	R242-K246 WeakPolarHBondContact O-CB 3.42Å; R242-K246 PolarHBondContact O-N 3.06Å; W243-K246 WeakPolarHBondContact O-CB 3.4Å; W243-K246 PolarHBondContact O-N 2.88Å; W243-K246 VanDerWaalsContact O-N 3.16Å; I244-K246 PolarHBondContact O-N 3.43Å; K246-A250 PolarHBondContact O-N 2.93Å
247	Q	93.8	Very high	92.7	Very high	102 Å²	102	91.1 Å²	91.1	48%	0.477	42%	0.417	S	S	.	.	H	α-helix	trans	-60.9	-52.5	175.5	-75.2	-72.6	-29.4	0	0	111	W243 I244 R249 A250 S251	W243-Q247 HydrophobicContact CD2-CG 4.16Å; W243-Q247 HydrophobicContact CE3-CG 4.34Å; W243-Q247 HydrophobicContact CH2-CG 4.03Å; W243-Q247 HydrophobicContact CZ2-CG 3.85Å; W243-Q247 HydrophobicContact CZ3-CG 4.28Å; W243-Q247 PolarHBondContact O-N 3.47Å; I244-Q247 PolarHBondContact O-N 2.92Å; I244-Q247 VanDerWaalsContact O-N 3.15Å; Q247-R249 VanDerWaalsContact C-N 3.33Å; Q247-R249 PolarHBondContact O-N 3.2Å; Q247-A250 WeakPolarHBondContact O-CB 3.45Å; Q247-A250 PolarHBondContact O-N 2.93Å; Q247-A250 VanDerWaalsContact O-N 3.09Å; Q247-S251 WeakPolarHBondContact O-CB 3.27Å; Q247-S251 PolarHBondContact O-N 3.44Å
248	N	93.8	Very high	93.1	Very high	9 Å²	9	93 Å²	93	5%	0.048	42%	0.419	C	S	.	.	H	α-helix	trans	-59.1	-43	178.6	-71.7	-2.1	0	0	0	111.8	D228 E230 I244 A250 S251 R252	D228-N248 HydrophobicContact CB-CB 4.24Å; D228-N248 WeakPolarHBondContact CB-ND2 3.4Å; D228-N248 WeakPolarHBondContact OD2-CB 3.26Å; D228-N248 PolarHBondContact OD2-ND2 3.49Å; E230-N248 PolarHBondContact O-ND2 3.05Å; I244-N248 WeakPolarHBondContact O-CB 3.04Å; I244-N248 PolarHBondContact O-N 3.41Å; N248-A250 VanDerWaalsContact C-N 3.35Å; N248-A250 PolarHBondContact O-N 3.01Å; N248-S251 PolarHBondContact O-N 2.72Å; N248-R252 WeakPolarHBondContact O-CB 3.46Å; N248-R252 WeakPolarHBondContact O-CG 3.42Å; N248-R252 PolarHBondContact O-N 3.15Å
249	R	94.3	Very high	93.4	Very high	148 Å²	148	85.5 Å²	85.5	56%	0.558	39%	0.392	S	S	*	.	H	α-helix	trans	-61.5	-41.8	175.7	-174.9	177.5	-56.7	165.7	5.8	112.4	E245 Q247 A253	E245-R249 WeakPolarHBondContact O-CB 3.41Å; E245-R249 PolarHBondContact O-N 2.86Å; E245-R249 IonicContact OE1-CZ 2.76Å; E245-R249 IonicContact OE1-NE 3.83Å; E245-R249 IonicContact OE1-NH2 2.78Å; E245-R249 PolarHBondContact OE1-NH2 3.42Å; Q247-R249 VanDerWaalsContact C-N 3.33Å; Q247-R249 PolarHBondContact O-N 3.2Å; R249-A253 VanDerWaalsContact O-CB 3.26Å; R249-A253 WeakPolarHBondContact O-CB 3.41Å; R249-A253 PolarHBondContact O-N 3.28Å
250	A	95.3	Very high	93.8	Very high	60 Å²	60	83.2 Å²	83.2	50%	0.496	38%	0.378	S	S	.	.	H	α-helix	trans	-64.3	-44.7	176.2	0	0	0	0	0	111.2	K246 Q247 N248 A253 Q254	K246-A250 PolarHBondContact O-N 2.93Å; Q247-A250 WeakPolarHBondContact O-CB 3.45Å; Q247-A250 PolarHBondContact O-N 2.93Å; Q247-A250 VanDerWaalsContact O-N 3.09Å; N248-A250 VanDerWaalsContact C-N 3.35Å; N248-A250 PolarHBondContact O-N 3.01Å; A250-A253 PolarHBondContact O-N 3.48Å; A250-Q254 PolarHBondContact O-N 2.9Å
251	S	94.8	Very high	94.2	Very high	33 Å²	33	84 Å²	84	23%	0.231	39%	0.385	C	S	.	.	H	α-helix	trans	-60.8	-44.9	177.6	-160.4	0	0	0	0	112.3	Q247 N248 Q254 R255	Q247-S251 WeakPolarHBondContact O-CB 3.27Å; Q247-S251 PolarHBondContact O-N 3.44Å; N248-S251 PolarHBondContact O-N 2.72Å; S251-Q254 PolarHBondContact O-N 3.44Å; S251-R255 PolarHBondContact O-N 2.89Å; S251-R255 VanDerWaalsContact O-N 3.14Å; S251-R255 PolarHBondContact O-NH1 3.45Å; S251-R255 PolarHBondContact OG-NH1 3.13Å
252	R	94.5	Very high	94.7	Very high	57 Å²	57	80.1 Å²	80.1	22%	0.215	37%	0.37	C	S	.	.	H	α-helix	trans	-65	-42.4	173.7	-71.9	-176	-71.5	147.2	-6.3	112.6	F224 D228 E245 N248 Q254 R255 K256	F224-R252 HydrophobicContact CB-CG 4.34Å; D228-R252 WeakPolarHBondContact OD1-CG 3.43Å; D228-R252 IonicContact OD1-NE 2.84Å; D228-R252 IonicContact OD2-NE 3.83Å; E245-R252 IonicContact OE1-NH2 3.75Å; E245-R252 PolarHBondContact OE1-NH2 3.49Å; N248-R252 WeakPolarHBondContact O-CB 3.46Å; N248-R252 WeakPolarHBondContact O-CG 3.42Å; N248-R252 PolarHBondContact O-N 3.15Å; R252-Q254 VanDerWaalsContact C-N 3.3Å; R252-Q254 PolarHBondContact O-N 2.73Å; R252-R255 PolarHBondContact O-N 2.87Å; R252-K256 WeakPolarHBondContact O-CB 3.45Å; R252-K256 WeakPolarHBondContact O-CG 3.28Å; R252-K256 PolarHBondContact O-N 3.36Å
253	A	96.2	Very high	95.1	Very high	58 Å²	58	73 Å²	73	48%	0.479	34%	0.343	S	S	.	.	H	α-helix	trans	-62.4	-39.4	178	0	0	0	0	0	111.6	R249 A250 K256 K257	R249-A253 VanDerWaalsContact O-CB 3.26Å; R249-A253 WeakPolarHBondContact O-CB 3.41Å; R249-A253 PolarHBondContact O-N 3.28Å; A250-A253 PolarHBondContact O-N 3.48Å; A253-K256 PolarHBondContact O-N 3.16Å; A253-K257 WeakPolarHBondContact O-CB 3.17Å; A253-K257 PolarHBondContact O-N 2.91Å
254	Q	96.8	Very high	95.4	Very high	94 Å²	94	71.2 Å²	71.2	44%	0.439	34%	0.337	S	S	.	.	H	α-helix	trans	-62.8	-49.5	175.4	-178.4	61.8	19.1	0	0	111.7	A250 S251 R252 K256 K257 E258	A250-Q254 PolarHBondContact O-N 2.9Å; S251-Q254 PolarHBondContact O-N 3.44Å; R252-Q254 VanDerWaalsContact C-N 3.3Å; R252-Q254 PolarHBondContact O-N 2.73Å; Q254-K256 PolarHBondContact O-N 2.87Å; Q254-K257 WeakPolarHBondContact O-CB 3.2Å; Q254-K257 PolarHBondContact O-N 3.49Å; Q254-K257 VanDerWaalsContact O-N 3.12Å; Q254-E258 PolarHBondContact NE2-OE1 3.05Å; Q254-E258 WeakPolarHBondContact O-CG 3.31Å; Q254-E258 PolarHBondContact O-N 2.83Å
255	R	95.8	Very high	95.8	Very high	67 Å²	67	74.5 Å²	74.5	25%	0.253	36%	0.357	S	S	.	.	H	α-helix	trans	-62.8	-39.4	177.1	-70.9	-173.7	-177.1	81.1	-5.5	112.9	F224 S251 R252 K257 E258 E259	F224-R255 HydrophobicContact CB-CB 4.12Å; F224-R255 HydrophobicContact CD1-CB 4.13Å; F224-R255 HydrophobicContact CD2-CB 3.64Å; F224-R255 HydrophobicContact CE1-CB 4.49Å; F224-R255 HydrophobicContact CE2-CB 4.06Å; F224-R255 HydrophobicContact CG-CB 3.69Å; F224-R255 HydrophobicContact CZ-CB 4.46Å; S251-R255 PolarHBondContact O-N 2.89Å; S251-R255 VanDerWaalsContact O-N 3.14Å; S251-R255 PolarHBondContact O-NH1 3.45Å; S251-R255 PolarHBondContact OG-NH1 3.13Å; R252-R255 PolarHBondContact O-N 2.87Å; R255-K257 VanDerWaalsContact C-N 3.32Å; R255-K257 PolarHBondContact O-N 3.28Å; R255-E258 PolarHBondContact O-N 2.91Å; R255-E259 WeakPolarHBondContact O-CB 3.43Å; R255-E259 PolarHBondContact O-N 3.46Å
256	K	95.9	Very high	96.1	Very high	96 Å²	96	72 Å²	72	42%	0.417	35%	0.346	S	S	.	.	H	α-helix	trans	-60.6	-41.9	172.5	-76.7	-165.9	175.8	-164.2	0	111.8	F224 R252 A253 Q254 E259 M260	F224-K256 HydrophobicContact CD2-CG 3.76Å; F224-K256 HydrophobicContact CE2-CB 4.49Å; F224-K256 HydrophobicContact CE2-CG 3.87Å; R252-K256 WeakPolarHBondContact O-CB 3.45Å; R252-K256 WeakPolarHBondContact O-CG 3.28Å; R252-K256 PolarHBondContact O-N 3.36Å; A253-K256 PolarHBondContact O-N 3.16Å; Q254-K256 PolarHBondContact O-N 2.87Å; K256-E259 PolarHBondContact O-N 3.48Å; K256-M260 VanDerWaalsContact O-CG 3.29Å; K256-M260 WeakPolarHBondContact O-CG 3.31Å; K256-M260 PolarHBondContact O-N 3.35Å
257	K	97	Very high	96.3	Very high	126 Å²	126	64.7 Å²	64.7	55%	0.548	31%	0.313	S	S	.	.	H	α-helix	trans	-64.1	-44.5	177	-177.5	-178	177.2	-175.8	0	111.7	A253 Q254 R255 M260 N261	A253-K257 WeakPolarHBondContact O-CB 3.17Å; A253-K257 PolarHBondContact O-N 2.91Å; Q254-K257 WeakPolarHBondContact O-CB 3.2Å; Q254-K257 PolarHBondContact O-N 3.49Å; Q254-K257 VanDerWaalsContact O-N 3.12Å; R255-K257 VanDerWaalsContact C-N 3.32Å; R255-K257 PolarHBondContact O-N 3.28Å; K257-M260 PolarHBondContact O-N 3.01Å; K257-N261 WeakPolarHBondContact O-CB 3.31Å; K257-N261 PolarHBondContact O-N 2.67Å; K257-N261 PolarHBondContact O-ND2 3.49Å
258	E	96.5	Very high	96.5	Very high	103 Å²	103	62.6 Å²	62.6	48%	0.481	31%	0.306	S	S	.	.	H	α-helix	trans	-61	-44	176.3	-73	166.7	-173.6	0	0	111.7	Q254 R255 N261 R262	Q254-E258 PolarHBondContact NE2-OE1 3.05Å; Q254-E258 WeakPolarHBondContact O-CG 3.31Å; Q254-E258 PolarHBondContact O-N 2.83Å; R255-E258 PolarHBondContact O-N 2.91Å; E258-N261 WeakPolarHBondContact O-CB 3.34Å; E258-N261 PolarHBondContact O-N 3.35Å; E258-R262 PolarHBondContact O-N 3.1Å
259	E	96.4	Very high	96.6	Very high	14 Å²	14	63 Å²	63	7%	0.065	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-45.3	176.8	177.1	62.7	173.2	0	0	112.3	R222 F224 R255 K256 N261 R262 I263	R222-E259 IonicContact CZ-OE1 2.94Å; R222-E259 IonicContact NH1-OE1 3.97Å; R222-E259 PolarHBondContact NH1-OE1 3.27Å; R222-E259 IonicContact NH1-OE2 3.58Å; R222-E259 PolarHBondContact NH1-OE2 2.87Å; F224-E259 HydrophobicContact CE2-CB 4.33Å; F224-E259 HydrophobicContact CZ-CB 4.05Å; F224-E259 HydrophobicContact CZ-CG 4.33Å; R255-E259 WeakPolarHBondContact O-CB 3.43Å; R255-E259 PolarHBondContact O-N 3.46Å; K256-E259 PolarHBondContact O-N 3.48Å; E259-N261 VanDerWaalsContact C-N 3.29Å; E259-N261 PolarHBondContact O-N 3Å; E259-R262 WeakPolarHBondContact O-CB 3.5Å; E259-R262 PolarHBondContact O-N 2.9Å; E259-R262 VanDerWaalsContact O-N 3.13Å; E259-R262 IonicContact OE1-CZ 2.82Å; E259-R262 IonicContact OE1-NE 3.73Å; E259-R262 IonicContact OE1-NH2 3.44Å; E259-R262 PolarHBondContact OE1-NH2 3.02Å; E259-R262 IonicContact OE2-CZ 2.74Å; E259-R262 IonicContact OE2-NE 3.71Å; E259-R262 PolarHBondContact OE2-NE 2.94Å; E259-R262 IonicContact OE2-NH2 2.82Å; E259-R262 PolarHBondContact OE2-NH2 3.49Å; E259-I263 WeakPolarHBondContact O-CG1 3.49Å; E259-I263 PolarHBondContact O-N 3Å
260	M	96.4	Very high	96.8	Very high	69 Å²	69	55.9 Å²	55.9	34%	0.34	28%	0.282	S	S	.	.	H	α-helix	trans	-64.5	-35.7	176.6	-68.7	-59.7	100.3	0	0	112	K256 K257 R262 I263 R264	K256-M260 VanDerWaalsContact O-CG 3.29Å; K256-M260 WeakPolarHBondContact O-CG 3.31Å; K256-M260 PolarHBondContact O-N 3.35Å; K257-M260 PolarHBondContact O-N 3.01Å; M260-R262 VanDerWaalsContact C-N 3.35Å; M260-I263 HydrophobicContact CE-CG1 4.48Å; M260-R264 WeakPolarHBondContact O-CB 3.43Å; M260-R264 PolarHBondContact O-N 3.38Å
261	N	97.7	Very high	96.9	Very high	90 Å²	90	56.7 Å²	56.7	48%	0.481	27%	0.272	S	S	.	.	H	α-helix	trans	-65	-39	172.7	-73.3	-18	0	0	0	111.8	K257 E258 E259 R264 T265	K257-N261 WeakPolarHBondContact O-CB 3.31Å; K257-N261 PolarHBondContact O-N 2.67Å; K257-N261 PolarHBondContact O-ND2 3.49Å; E258-N261 WeakPolarHBondContact O-CB 3.34Å; E258-N261 PolarHBondContact O-N 3.35Å; E259-N261 VanDerWaalsContact C-N 3.29Å; E259-N261 PolarHBondContact O-N 3Å; N261-R264 PolarHBondContact O-N 2.89Å; N261-T265 WeakPolarHBondContact O-CB 3.4Å; N261-T265 PolarHBondContact O-N 3.48Å; N261-T265 PolarHBondContact O-OG1 3.32Å
262	R	97.8	Very high	96.9	Very high	38 Å²	38	58.2 Å²	58.2	14%	0.143	28%	0.283	C	S	.	.	H	α-helix	trans	-63.3	-49.1	175.7	-171.7	-172.6	72.1	77.5	6.5	111.3	N163 V165 N186 E258 E259 M260 R264 T265 L266	N163-R262 WeakPolarHBondContact O-CD 3.34Å; N163-R262 PolarHBondContact O-NH1 3.29Å; V165-R262 HydrophobicContact CG2-CG 3.7Å; N186-R262 PolarHBondContact OD1-NH2 3.47Å; E258-R262 PolarHBondContact O-N 3.1Å; E259-R262 WeakPolarHBondContact O-CB 3.5Å; E259-R262 PolarHBondContact O-N 2.9Å; E259-R262 VanDerWaalsContact O-N 3.13Å; E259-R262 IonicContact OE1-CZ 2.82Å; E259-R262 IonicContact OE1-NE 3.73Å; E259-R262 IonicContact OE1-NH2 3.44Å; E259-R262 PolarHBondContact OE1-NH2 3.02Å; E259-R262 IonicContact OE2-CZ 2.74Å; E259-R262 IonicContact OE2-NE 3.71Å; E259-R262 PolarHBondContact OE2-NE 2.94Å; E259-R262 IonicContact OE2-NH2 2.82Å; E259-R262 PolarHBondContact OE2-NH2 3.49Å; M260-R262 VanDerWaalsContact C-N 3.35Å; R262-R264 VanDerWaalsContact C-N 3.34Å; R262-R264 PolarHBondContact O-N 3.17Å; R262-T265 WeakPolarHBondContact O-CB 3.26Å; R262-T265 PolarHBondContact O-N 2.92Å; R262-L266 PolarHBondContact O-N 2.89Å
263	I	97.9	Very high	96.9	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-59.4	-45.6	174.5	-64.2	-61.5	0	0	0	110.3	N186 W215 F218 E259 M260 T265 L266 V267	N186-I263 HydrophobicContact CB-CD1 4.17Å; N186-I263 WeakPolarHBondContact OD1-CD1 3.35Å; W215-I263 HydrophobicContact CE3-CG2 4.28Å; F218-I263 HydrophobicContact CB-CG2 4.3Å; F218-I263 HydrophobicContact CD1-CG1 4.5Å; F218-I263 HydrophobicContact CD1-CG2 4.08Å; F218-I263 HydrophobicContact CG-CG2 4.32Å; E259-I263 WeakPolarHBondContact O-CG1 3.49Å; E259-I263 PolarHBondContact O-N 3Å; M260-I263 HydrophobicContact CE-CG1 4.48Å; I263-T265 VanDerWaalsContact C-N 3.3Å; I263-T265 PolarHBondContact O-N 3.43Å; I263-L266 WeakPolarHBondContact O-CB 3.49Å; I263-L266 PolarHBondContact O-N 3.37Å; I263-L266 VanDerWaalsContact O-N 3.14Å; I263-V267 HydrophobicContact CG2-CG2 4.29Å; I263-V267 VanDerWaalsContact O-CG2 3.28Å; I263-V267 WeakPolarHBondContact O-CG2 3.25Å; I263-V267 PolarHBondContact O-N 2.92Å
264	R	97.9	Very high	96.9	Very high	117 Å²	117	53.6 Å²	53.6	44%	0.442	26%	0.255	S	S	.	.	H	α-helix	trans	-61.8	-39.4	177.9	-175.5	146.1	-178.4	90.8	27	112.7	M260 N261 R262 L266 V267 D268	M260-R264 WeakPolarHBondContact O-CB 3.43Å; M260-R264 PolarHBondContact O-N 3.38Å; N261-R264 PolarHBondContact O-N 2.89Å; R262-R264 VanDerWaalsContact C-N 3.34Å; R262-R264 PolarHBondContact O-N 3.17Å; R264-L266 VanDerWaalsContact C-N 3.34Å; R264-L266 PolarHBondContact O-N 3.49Å; R264-V267 PolarHBondContact O-N 3.3Å; R264-D268 WeakPolarHBondContact CG-OD2 3.44Å; R264-D268 IonicContact CZ-OD1 3.79Å; R264-D268 IonicContact CZ-OD2 3.64Å; R264-D268 IonicContact NE-OD2 3.85Å; R264-D268 PolarHBondContact NE-OD2 3.16Å; R264-D268 IonicContact NH2-OD1 3.74Å; R264-D268 PolarHBondContact NH2-OD1 3.34Å; R264-D268 IonicContact NH2-OD2 2.86Å; R264-D268 PolarHBondContact NH2-OD2 3.43Å; R264-D268 WeakPolarHBondContact O-CB 3.49Å; R264-D268 PolarHBondContact O-N 3.4Å
265	T	97.8	Very high	96.8	Very high	73 Å²	73	51.6 Å²	51.6	45%	0.448	25%	0.251	S	S	.	.	H	α-helix	trans	-61.9	-42	174.6	-57.6	0	0	0	0	111.6	V165 N261 R262 I263 T269	V165-T265 HydrophobicContact CG1-CG2 4.43Å; N261-T265 WeakPolarHBondContact O-CB 3.4Å; N261-T265 PolarHBondContact O-N 3.48Å; N261-T265 PolarHBondContact O-OG1 3.32Å; R262-T265 WeakPolarHBondContact O-CB 3.26Å; R262-T265 PolarHBondContact O-N 2.92Å; I263-T265 VanDerWaalsContact C-N 3.3Å; I263-T265 PolarHBondContact O-N 3.43Å; T265-T269 WeakPolarHBondContact O-CB 3.17Å; T265-T269 PolarHBondContact O-N 2.88Å; T265-T269 PolarHBondContact O-OG1 3.47Å
266	L	97.9	Very high	96.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-57.7	-51.1	173.2	170	66.1	0	0	0	111.1	V165 F179 V182 F183 R262 I263 R264 T269 A270	V165-L266 HydrophobicContact CG1-CB 3.92Å; V165-L266 HydrophobicContact CG1-CD1 4.15Å; V165-L266 HydrophobicContact CG2-CB 4.22Å; F179-L266 HydrophobicContact CD1-CD1 3.88Å; F179-L266 HydrophobicContact CE1-CD1 3.93Å; V182-L266 HydrophobicContact CG1-CD1 3.63Å; V182-L266 HydrophobicContact CG1-CD2 3.82Å; V182-L266 HydrophobicContact CG1-CG 4.4Å; F183-L266 HydrophobicContact CD1-CD2 4.01Å; F183-L266 HydrophobicContact CD1-CG 4.44Å; F183-L266 HydrophobicContact CE1-CD2 3.83Å; F183-L266 HydrophobicContact CE1-CG 3.82Å; F183-L266 HydrophobicContact CZ-CD1 4.4Å; F183-L266 HydrophobicContact CZ-CD2 4.46Å; F183-L266 HydrophobicContact CZ-CG 4.01Å; R262-L266 PolarHBondContact O-N 2.89Å; I263-L266 WeakPolarHBondContact O-CB 3.49Å; I263-L266 PolarHBondContact O-N 3.37Å; I263-L266 VanDerWaalsContact O-N 3.14Å; R264-L266 VanDerWaalsContact C-N 3.34Å; R264-L266 PolarHBondContact O-N 3.49Å; L266-T269 PolarHBondContact O-N 3.47Å; L266-A270 WeakPolarHBondContact O-CB 3.14Å; L266-A270 PolarHBondContact O-N 2.9Å
267	V	98.2	Very high	96.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.9	-45.3	-177	-175	0	0	0	0	111.6	F183 Y212 W215 Y216 I263 R264 T269 A270 Y271	F183-V267 HydrophobicContact CE1-CG2 4.05Å; Y212-V267 HydrophobicContact CD1-CG1 3.89Å; Y212-V267 HydrophobicContact CE1-CG1 4.36Å; W215-V267 HydrophobicContact CB-CG1 4.09Å; W215-V267 HydrophobicContact CB-CG2 3.67Å; W215-V267 HydrophobicContact CE3-CG2 4.48Å; W215-V267 HydrophobicContact CG-CG2 4.41Å; Y216-V267 HydrophobicContact CD1-CB 4.2Å; Y216-V267 HydrophobicContact CD1-CG1 3.57Å; Y216-V267 HydrophobicContact CD2-CG1 4.25Å; Y216-V267 HydrophobicContact CE1-CB 3.97Å; Y216-V267 HydrophobicContact CE1-CG1 3.4Å; Y216-V267 HydrophobicContact CE2-CG1 4.07Å; Y216-V267 HydrophobicContact CG-CG1 4.05Å; I263-V267 HydrophobicContact CG2-CG2 4.29Å; I263-V267 VanDerWaalsContact O-CG2 3.28Å; I263-V267 WeakPolarHBondContact O-CG2 3.25Å; I263-V267 PolarHBondContact O-N 2.92Å; R264-V267 PolarHBondContact O-N 3.3Å; V267-T269 VanDerWaalsContact C-N 3.32Å; V267-T269 PolarHBondContact O-N 2.89Å; V267-A270 PolarHBondContact O-N 3.47Å; V267-Y271 VanDerWaalsContact O-CB 3.3Å; V267-Y271 WeakPolarHBondContact O-CB 3.17Å; V267-Y271 PolarHBondContact O-N 3.33Å
268	D	97.7	Very high	96.6	Very high	59 Å²	59	44.8 Å²	44.8	32%	0.316	22%	0.223	S	C	.	.	H	α-helix	trans	-63.7	-38.7	178.1	-76.5	-25.3	0	0	0	111.6	Y216 R264 S272	Y216-D268 WeakPolarHBondContact CE1-OD1 3.21Å; Y216-D268 PolarHBondContact OH-OD1 2.81Å; R264-D268 WeakPolarHBondContact CG-OD2 3.44Å; R264-D268 IonicContact CZ-OD1 3.79Å; R264-D268 IonicContact CZ-OD2 3.64Å; R264-D268 IonicContact NE-OD2 3.85Å; R264-D268 PolarHBondContact NE-OD2 3.16Å; R264-D268 IonicContact NH2-OD1 3.74Å; R264-D268 PolarHBondContact NH2-OD1 3.34Å; R264-D268 IonicContact NH2-OD2 2.86Å; R264-D268 PolarHBondContact NH2-OD2 3.43Å; R264-D268 WeakPolarHBondContact O-CB 3.49Å; R264-D268 PolarHBondContact O-N 3.4Å; D268-S272 WeakPolarHBondContact O-CB 3.3Å; D268-S272 PolarHBondContact O-N 2.98Å; D268-S272 PolarHBondContact O-OG 3.5Å
269	T	96.7	Very high	96.5	Very high	16 Å²	16	44.7 Å²	44.7	10%	0.098	22%	0.221	C	C	.	.	H	α-helix	trans	-66.8	-47.4	177.3	-59.6	0	0	0	0	110.9	P166 K168 F179 T265 L266 V267 S272 C273	P166-T269 WeakPolarHBondContact O-CG2 3.3Å; K168-T269 HydrophobicContact CG-CG2 3.68Å; F179-T269 HydrophobicContact CZ-CG2 4.04Å; T265-T269 WeakPolarHBondContact O-CB 3.17Å; T265-T269 PolarHBondContact O-N 2.88Å; T265-T269 PolarHBondContact O-OG1 3.47Å; L266-T269 PolarHBondContact O-N 3.47Å; V267-T269 VanDerWaalsContact C-N 3.32Å; V267-T269 PolarHBondContact O-N 2.89Å; T269-S272 PolarHBondContact O-N 2.86Å; T269-S272 PolarHBondContact O-OG 3.3Å; T269-C273 PolarHBondContact O-N 3.36Å; T269-C273 PolarHBondContact O-SG 3.48Å
270	A	97.2	Very high	96.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59	-51.4	174.9	0	0	0	0	0	111.7	F175 F179 F183 Y212 L266 V267 S272 C273 D274	F175-A270 HydrophobicContact CE2-CB 4.23Å; F175-A270 WeakPolarHBondContact CE2-O 3.23Å; F179-A270 HydrophobicContact CD1-CB 3.7Å; F179-A270 HydrophobicContact CD2-CB 4.41Å; F179-A270 HydrophobicContact CE1-CB 3.71Å; F179-A270 HydrophobicContact CE2-CB 4.39Å; F179-A270 HydrophobicContact CG-CB 4.08Å; F179-A270 HydrophobicContact CZ-CB 4.08Å; F183-A270 HydrophobicContact CE2-CB 3.72Å; F183-A270 HydrophobicContact CZ-CB 3.7Å; Y212-A270 HydrophobicContact CE1-CB 4.39Å; L266-A270 WeakPolarHBondContact O-CB 3.14Å; L266-A270 PolarHBondContact O-N 2.9Å; V267-A270 PolarHBondContact O-N 3.47Å; A270-S272 PolarHBondContact O-N 3.45Å; A270-C273 CarbonylContact O-C 3.56Å; A270-C273 PolarHBondContact O-N 3.39Å; A270-D274 PolarHBondContact O-N 3.21Å
271	Y	97	Very high	96.2	Very high	76 Å²	76	47.9 Å²	47.9	30%	0.298	23%	0.233	S	C	.	.	H	α-helix	trans	-58.5	-35.3	-179.7	-174.1	-92.9	0	0	0	112.6	Y212 V267 C273 I277	Y212-Y271 AromaticContact CD1-CD2 3.81Å; Y212-Y271 HydrophobicContact CD1-CD2 3.81Å; Y212-Y271 HydrophobicContact CD1-CG 4.47Å; Y212-Y271 AromaticContact CD2-CD2 3.76Å; Y212-Y271 HydrophobicContact CD2-CD2 3.76Å; Y212-Y271 HydrophobicContact CD2-CE2 4.21Å; Y212-Y271 AromaticContact CE1-CD2 3.93Å; Y212-Y271 HydrophobicContact CE1-CD2 3.93Å; Y212-Y271 HydrophobicContact CE1-CG 4.34Å; Y212-Y271 AromaticContact CE2-CD2 3.87Å; Y212-Y271 HydrophobicContact CE2-CD2 3.87Å; Y212-Y271 AromaticContact CG-CD2 3.73Å; Y212-Y271 HydrophobicContact CG-CD2 3.73Å; Y212-Y271 HydrophobicContact CG-CE2 4.37Å; Y212-Y271 AromaticContact CZ-CD2 3.96Å; V267-Y271 VanDerWaalsContact O-CB 3.3Å; V267-Y271 WeakPolarHBondContact O-CB 3.17Å; V267-Y271 PolarHBondContact O-N 3.33Å; Y271-C273 VanDerWaalsContact C-N 3.31Å; Y271-C273 PolarHBondContact O-N 3.01Å; Y271-I277 HydrophobicContact CD2-CD1 4.17Å; Y271-I277 HydrophobicContact CD2-CG1 4.09Å; Y271-I277 HydrophobicContact CE1-CG2 4.04Å; Y271-I277 HydrophobicContact CE2-CD1 3.61Å; Y271-I277 HydrophobicContact CE2-CG1 3.93Å; Y271-I277 HydrophobicContact CE2-CG2 4.05Å
272	S	95.3	Very high	96	Very high	66 Å²	66	48.9 Å²	48.9	46%	0.462	24%	0.235	S	C	.	.	H	α-helix	trans	-72.8	-21.8	177.6	75.1	0	0	0	0	114.2	D268 T269 A270	D268-S272 WeakPolarHBondContact O-CB 3.3Å; D268-S272 PolarHBondContact O-N 2.98Å; D268-S272 PolarHBondContact O-OG 3.5Å; T269-S272 PolarHBondContact O-N 2.86Å; T269-S272 PolarHBondContact O-OG 3.3Å; A270-S272 PolarHBondContact O-N 3.45Å
273	C	94.7	Very high	95.8	Very high	14 Å²	14	51.9 Å²	51.9	10%	0.095	25%	0.25	C	S	.	.	H	α-helix	trans	-107.3	-12.6	-177.1	-56.4	0	0	0	0	113.4	F175 T269 A270 Y271 P275	F175-C273 HydrophobicContact CD2-CB 4.45Å; T269-C273 PolarHBondContact O-N 3.36Å; T269-C273 PolarHBondContact O-SG 3.48Å; A270-C273 CarbonylContact O-C 3.56Å; A270-C273 PolarHBondContact O-N 3.39Å; Y271-C273 VanDerWaalsContact C-N 3.31Å; Y271-C273 PolarHBondContact O-N 3.01Å; C273-P275 VanDerWaalsContact O-CD 3.3Å; C273-P275 WeakPolarHBondContact O-CD 3.31Å
274	D	96.6	Very high	95.5	Very high	3 Å²	3	54.3 Å²	54.3	2%	0.016	26%	0.262	C	S	.	.			trans	-61.2	117.5	-177.3	-169.8	-40	0	0	0	111.6	F175 Y212 A270 R276 I277 K278	F175-D274 HydrophobicContact CD2-CB 4.49Å; F175-D274 HydrophobicContact CE1-CB 4.13Å; F175-D274 WeakPolarHBondContact CE1-OD2 3.36Å; F175-D274 HydrophobicContact CE2-CB 3.78Å; F175-D274 HydrophobicContact CZ-CB 3.56Å; F175-D274 WeakPolarHBondContact CZ-OD2 3.41Å; Y212-D274 WeakPolarHBondContact OH-CB 3.36Å; Y212-D274 PolarHBondContact OH-OD2 3.11Å; Y212-D274 VanDerWaalsContact OH-OD2 3.05Å; A270-D274 PolarHBondContact O-N 3.21Å; D274-R276 VanDerWaalsContact C-N 3.25Å; D274-R276 PolarHBondContact O-N 3.07Å; D274-R276 WeakPolarHBondContact OD1-CA 3.45Å; D274-R276 WeakPolarHBondContact OD1-CB 3.08Å; D274-R276 WeakPolarHBondContact OD1-CG 3.33Å; D274-R276 PolarHBondContact OD1-N 3.36Å; D274-R276 IonicContact OD1-NE 3.88Å; D274-R276 PolarHBondContact OD1-NE 3.12Å; D274-R276 VanDerWaalsContact OD1-NE 3.13Å; D274-R276 IonicContact OD2-CZ 2.91Å; D274-R276 IonicContact OD2-NE 2.91Å; D274-R276 PolarHBondContact OD2-NE 3.34Å; D274-R276 IonicContact OD2-NH2 3.91Å; D274-R276 PolarHBondContact OD2-NH2 2.78Å; D274-I277 HydrophobicContact CB-CB 4.14Å; D274-I277 HydrophobicContact CB-CG1 3.8Å; D274-I277 PolarHBondContact O-N 3.29Å; D274-I277 PolarHBondContact OD1-N 2.82Å; D274-K278 PolarHBondContact O-N 3.5Å
275	P	94.8	Very high	95.4	Very high	52 Å²	52	55.1 Å²	55.1	34%	0.338	27%	0.269	S	S	.	.	H	α-helix	trans	-60	-32.6	179.6	-24.3	34.6	0	0	0	113.7	F175 M201 C273 K278 K279	F175-P275 HydrophobicContact CB-CG 4.33Å; M201-P275 HydrophobicContact CE-CB 4.05Å; M201-P275 HydrophobicContact SD-CB 4.1Å; C273-P275 VanDerWaalsContact O-CD 3.3Å; C273-P275 WeakPolarHBondContact O-CD 3.31Å; P275-K278 PolarHBondContact O-N 3.12Å; P275-K279 PolarHBondContact O-N 2.9Å
276	R	96	Very high	95.2	Very high	3 Å²	3	54.3 Å²	54.3	1%	0.011	27%	0.269	C	S	.	.	H	α-helix	trans	-70.5	-43.3	-178.6	-55	169.2	-67	-175.8	5.5	110.6	L198 T200 M201 D274 K278 K279 F280	L198-R276 PolarHBondContact O-NH1 3.06Å; L198-R276 PolarHBondContact O-NH2 3.02Å; T200-R276 WeakPolarHBondContact O-CD 3.33Å; T200-R276 PolarHBondContact O-NH1 3.5Å; M201-R276 HydrophobicContact SD-CG 3.99Å; D274-R276 VanDerWaalsContact C-N 3.25Å; D274-R276 PolarHBondContact O-N 3.07Å; D274-R276 WeakPolarHBondContact OD1-CA 3.45Å; D274-R276 WeakPolarHBondContact OD1-CB 3.08Å; D274-R276 WeakPolarHBondContact OD1-CG 3.33Å; D274-R276 PolarHBondContact OD1-N 3.36Å; D274-R276 IonicContact OD1-NE 3.88Å; D274-R276 PolarHBondContact OD1-NE 3.12Å; D274-R276 VanDerWaalsContact OD1-NE 3.13Å; D274-R276 IonicContact OD2-CZ 2.91Å; D274-R276 IonicContact OD2-NE 2.91Å; D274-R276 PolarHBondContact OD2-NE 3.34Å; D274-R276 IonicContact OD2-NH2 3.91Å; D274-R276 PolarHBondContact OD2-NH2 2.78Å; R276-K278 VanDerWaalsContact C-N 3.25Å; R276-K278 PolarHBondContact O-N 3.38Å; R276-K279 WeakPolarHBondContact O-CB 3.35Å; R276-K279 PolarHBondContact O-N 3.47Å; R276-K279 VanDerWaalsContact O-N 3.12Å; R276-F280 HydrophobicContact CB-CD2 4.41Å; R276-F280 HydrophobicContact CB-CE2 3.84Å; R276-F280 HydrophobicContact CB-CZ 4.15Å; R276-F280 WeakPolarHBondContact O-CD2 3.31Å; R276-F280 WeakPolarHBondContact O-CG 3.27Å; R276-F280 PolarHBondContact O-N 3.46Å
277	I	95.3	Very high	95	Very high	11 Å²	11	61.9 Å²	61.9	6%	0.056	30%	0.298	C	S	.	.	H	α-helix	trans	-59	-40.2	175.1	-64.8	-61.5	0	0	0	111	V208 Y212 Y271 D274 F280 K281	V208-I277 HydrophobicContact CG1-CD1 3.58Å; V208-I277 HydrophobicContact CG1-CG1 4.24Å; Y212-I277 HydrophobicContact CD2-CD1 4.21Å; Y212-I277 HydrophobicContact CE2-CD1 4.06Å; Y212-I277 HydrophobicContact CE2-CG1 3.94Å; Y271-I277 HydrophobicContact CD2-CD1 4.17Å; Y271-I277 HydrophobicContact CD2-CG1 4.09Å; Y271-I277 HydrophobicContact CE1-CG2 4.04Å; Y271-I277 HydrophobicContact CE2-CD1 3.61Å; Y271-I277 HydrophobicContact CE2-CG1 3.93Å; Y271-I277 HydrophobicContact CE2-CG2 4.05Å; D274-I277 HydrophobicContact CB-CB 4.14Å; D274-I277 HydrophobicContact CB-CG1 3.8Å; D274-I277 PolarHBondContact O-N 3.29Å; D274-I277 PolarHBondContact OD1-N 2.82Å; I277-F280 HydrophobicContact CD1-CD2 4.46Å; I277-K281 HydrophobicContact CG2-CD 4.1Å; I277-K281 WeakPolarHBondContact O-CB 3.38Å; I277-K281 VanDerWaalsContact O-CG 3.31Å; I277-K281 WeakPolarHBondContact O-CG 2.99Å; I277-K281 PolarHBondContact O-N 3.29Å
278	K	92.3	Very high	94.9	Very high	133 Å²	133	67.7 Å²	67.7	58%	0.578	32%	0.323	S	S	*	.	H	α-helix	trans	-63	-48.2	174.8	-173.9	-179.3	173.1	-171	0	111.2	D274 P275 R276 F280 K281 E282	D274-K278 PolarHBondContact O-N 3.5Å; P275-K278 PolarHBondContact O-N 3.12Å; R276-K278 VanDerWaalsContact C-N 3.25Å; R276-K278 PolarHBondContact O-N 3.38Å; K278-F280 PolarHBondContact O-N 3.39Å; K278-K281 PolarHBondContact O-N 3.33Å; K278-E282 WeakPolarHBondContact CE-OE1 3.45Å; K278-E282 WeakPolarHBondContact O-CG 3.46Å; K278-E282 PolarHBondContact O-N 3.33Å
279	K	94	Very high	94.7	Very high	100 Å²	100	69.1 Å²	69.1	44%	0.435	33%	0.328	S	S	.	.	H	α-helix	trans	-56.6	-49.8	176.2	-178.3	-179.8	172.4	-174.5	0	111.8	P275 R276 K281 E282 E283	P275-K279 PolarHBondContact O-N 2.9Å; R276-K279 WeakPolarHBondContact O-CB 3.35Å; R276-K279 PolarHBondContact O-N 3.47Å; R276-K279 VanDerWaalsContact O-N 3.12Å; K279-K281 VanDerWaalsContact C-N 3.33Å; K279-K281 PolarHBondContact O-N 2.67Å; K279-E282 PolarHBondContact O-N 2.92Å; K279-E282 VanDerWaalsContact O-N 3.16Å; K279-E283 WeakPolarHBondContact CE-OE1 3.09Å; K279-E283 HydrophobicContact CG-CG 4.44Å; K279-E283 WeakPolarHBondContact CG-OE1 3.31Å; K279-E283 WeakPolarHBondContact O-CB 3.36Å; K279-E283 WeakPolarHBondContact O-CG 3.35Å; K279-E283 PolarHBondContact O-N 2.74Å
280	F	94.6	Very high	94.6	Very high	35 Å²	35	71 Å²	71	15%	0.154	35%	0.345	C	S	.	.	H	α-helix	trans	-61.4	-39	178.7	-59	-36.7	0	0	0	112.7	F205 V208 R276 I277 K278 E284	F205-F280 HydrophobicContact CB-CD1 4.49Å; F205-F280 HydrophobicContact CB-CD2 4.41Å; F205-F280 HydrophobicContact CB-CE1 4.29Å; F205-F280 HydrophobicContact CB-CE2 4.18Å; F205-F280 HydrophobicContact CB-CZ 4.13Å; F205-F280 HydrophobicContact CD2-CB 4.05Å; F205-F280 HydrophobicContact CD2-CD1 4.49Å; F205-F280 AromaticContact CD2-CD2 3.58Å; F205-F280 HydrophobicContact CD2-CD2 3.58Å; F205-F280 HydrophobicContact CD2-CE2 4.09Å; F205-F280 AromaticContact CD2-CG 3.81Å; F205-F280 HydrophobicContact CD2-CG 3.81Å; F205-F280 HydrophobicContact CE2-CD2 4.39Å; F205-F280 HydrophobicContact CG-CD2 4.47Å; V208-F280 HydrophobicContact CB-CE2 4.13Å; V208-F280 HydrophobicContact CG1-CE2 4.35Å; V208-F280 HydrophobicContact CG2-CE2 4.1Å; R276-F280 HydrophobicContact CB-CD2 4.41Å; R276-F280 HydrophobicContact CB-CE2 3.84Å; R276-F280 HydrophobicContact CB-CZ 4.15Å; R276-F280 WeakPolarHBondContact O-CD2 3.31Å; R276-F280 WeakPolarHBondContact O-CG 3.27Å; R276-F280 PolarHBondContact O-N 3.46Å; I277-F280 HydrophobicContact CD1-CD2 4.46Å; K278-F280 PolarHBondContact O-N 3.39Å; F280-E284 WeakPolarHBondContact O-CB 3.42Å; F280-E284 PolarHBondContact O-N 2.82Å
281	K	93.4	Very high	94.5	Very high	115 Å²	115	77.2 Å²	77.2	50%	0.5	37%	0.374	S	S	.	.	H	α-helix	trans	-66.2	-39.2	175.6	-76.7	173.1	-179.7	167.8	0	112.4	I277 K278 K279 K285	I277-K281 HydrophobicContact CG2-CD 4.1Å; I277-K281 WeakPolarHBondContact O-CB 3.38Å; I277-K281 VanDerWaalsContact O-CG 3.31Å; I277-K281 WeakPolarHBondContact O-CG 2.99Å; I277-K281 PolarHBondContact O-N 3.29Å; K278-K281 PolarHBondContact O-N 3.33Å; K279-K281 VanDerWaalsContact C-N 3.33Å; K279-K281 PolarHBondContact O-N 2.67Å; K281-K285 VanDerWaalsContact O-CB 3.27Å; K281-K285 WeakPolarHBondContact O-CB 3.49Å; K281-K285 PolarHBondContact O-N 3.28Å
282	E	93.4	Very high	94.5	Very high	111 Å²	111	81.4 Å²	81.4	52%	0.519	39%	0.394	S	S	.	.	H	α-helix	trans	-68.7	-45.8	177.3	-73.1	173.6	-176.6	0	0	111.5	K278 K279 E284 K285 A286	K278-E282 WeakPolarHBondContact CE-OE1 3.45Å; K278-E282 WeakPolarHBondContact O-CG 3.46Å; K278-E282 PolarHBondContact O-N 3.33Å; K279-E282 PolarHBondContact O-N 2.92Å; K279-E282 VanDerWaalsContact O-N 3.16Å; E282-E284 PolarHBondContact O-N 3.5Å; E282-K285 PolarHBondContact O-N 3.1Å; E282-A286 WeakPolarHBondContact O-CB 3.37Å; E282-A286 PolarHBondContact O-N 3.3Å
283	E	92.7	Very high	94.5	Very high	101 Å²	101	85.2 Å²	85.2	47%	0.472	40%	0.402	S	S	.	.	H	α-helix	trans	-60.5	-44	174.8	-73.2	174	178.2	0	0	111.6	K279 K285 A286 R287	K279-E283 WeakPolarHBondContact CE-OE1 3.09Å; K279-E283 HydrophobicContact CG-CG 4.44Å; K279-E283 WeakPolarHBondContact CG-OE1 3.31Å; K279-E283 WeakPolarHBondContact O-CB 3.36Å; K279-E283 WeakPolarHBondContact O-CG 3.35Å; K279-E283 PolarHBondContact O-N 2.74Å; E283-K285 PolarHBondContact O-N 3.49Å; E283-A286 PolarHBondContact O-N 3.01Å; E283-R287 WeakPolarHBondContact O-CB 3.48Å; E283-R287 PolarHBondContact O-N 3.05Å
284	E	92.8	Very high	94.5	Very high	56 Å²	56	87.3 Å²	87.3	26%	0.262	42%	0.42	S	S	.	.	H	α-helix	trans	-67.4	-38.2	179.3	176.9	59.2	177.5	0	0	112.5	F280 E282 R287 K288	F280-E284 WeakPolarHBondContact O-CB 3.42Å; F280-E284 PolarHBondContact O-N 2.82Å; E282-E284 PolarHBondContact O-N 3.5Å; E284-R287 IonicContact OE1-CZ 2.67Å; E284-R287 IonicContact OE1-NH2 2.7Å; E284-R287 PolarHBondContact OE1-NH2 2.98Å; E284-R287 IonicContact OE2-CZ 3.8Å; E284-R287 IonicContact OE2-NE 3.23Å; E284-R287 PolarHBondContact OE2-NE 3.49Å; E284-R287 IonicContact OE2-NH1 2.64Å; E284-R287 IonicContact OE2-NH2 3.22Å; E284-R287 PolarHBondContact OE2-NH2 3.27Å; E284-K288 HydrophobicContact CG-CD 4.47Å; E284-K288 WeakPolarHBondContact O-CG 3.38Å; E284-K288 PolarHBondContact O-N 3.41Å; E284-K288 WeakPolarHBondContact OE1-CE 3.3Å; E284-K288 IonicContact OE1-NZ 2.73Å; E284-K288 PolarHBondContact OE1-NZ 2.96Å
285	K	94.3	Very high	94.4	Very high	134 Å²	134	94.8 Å²	94.8	58%	0.583	45%	0.452	S	S	*	.	H	α-helix	trans	-64.5	-45.3	172.9	-177.3	-179.1	173.1	-172.3	0	110.7	K281 E282 E283 R287 K288 E289	K281-K285 VanDerWaalsContact O-CB 3.27Å; K281-K285 WeakPolarHBondContact O-CB 3.49Å; K281-K285 PolarHBondContact O-N 3.28Å; E282-K285 PolarHBondContact O-N 3.1Å; E283-K285 PolarHBondContact O-N 3.49Å; K285-R287 VanDerWaalsContact C-N 3.35Å; K285-R287 PolarHBondContact O-N 3.27Å; K285-K288 PolarHBondContact O-N 3.46Å; K285-E289 WeakPolarHBondContact CE-OE1 3.2Å; K285-E289 WeakPolarHBondContact O-CB 3.29Å; K285-E289 WeakPolarHBondContact O-CG 3.45Å; K285-E289 PolarHBondContact O-N 3.3Å
286	A	95	Very high	94.4	Very high	55 Å²	55	95.1 Å²	95.1	46%	0.455	46%	0.46	S	S	.	.	H	α-helix	trans	-61.8	-41.9	177.4	0	0	0	0	0	111.8	E282 E283 E289 A290	E282-A286 WeakPolarHBondContact O-CB 3.37Å; E282-A286 PolarHBondContact O-N 3.3Å; E283-A286 PolarHBondContact O-N 3.01Å; A286-E289 PolarHBondContact O-N 3.17Å; A286-A290 VanDerWaalsContact O-CB 3.3Å; A286-A290 WeakPolarHBondContact O-CB 3.44Å; A286-A290 PolarHBondContact O-N 3.46Å
287	R	94.2	Very high	94.3	Very high	160 Å²	160	100 Å²	100	60%	0.604	48%	0.482	S	S	*	.	H	α-helix	trans	-59.2	-50	175.1	-174.5	177.6	71	161.2	7.2	111.7	E283 E284 K285 E289 A290 E291	E283-R287 WeakPolarHBondContact O-CB 3.48Å; E283-R287 PolarHBondContact O-N 3.05Å; E284-R287 IonicContact OE1-CZ 2.67Å; E284-R287 IonicContact OE1-NH2 2.7Å; E284-R287 PolarHBondContact OE1-NH2 2.98Å; E284-R287 IonicContact OE2-CZ 3.8Å; E284-R287 IonicContact OE2-NE 3.23Å; E284-R287 PolarHBondContact OE2-NE 3.49Å; E284-R287 IonicContact OE2-NH1 2.64Å; E284-R287 IonicContact OE2-NH2 3.22Å; E284-R287 PolarHBondContact OE2-NH2 3.27Å; K285-R287 VanDerWaalsContact C-N 3.35Å; K285-R287 PolarHBondContact O-N 3.27Å; R287-E289 PolarHBondContact O-N 2.88Å; R287-A290 PolarHBondContact O-N 2.85Å; R287-E291 WeakPolarHBondContact O-CB 3.48Å; R287-E291 PolarHBondContact O-N 3.14Å
288	K	94.9	Very high	94.3	Very high	121 Å²	121	102.2 Å²	102.2	53%	0.526	50%	0.503	S	S	.	.	H	α-helix	trans	-62.9	-39.6	177.6	-77.4	172.8	171.9	149.1	0	112.6	E284 K285 K292	E284-K288 HydrophobicContact CG-CD 4.47Å; E284-K288 WeakPolarHBondContact O-CG 3.38Å; E284-K288 PolarHBondContact O-N 3.41Å; E284-K288 WeakPolarHBondContact OE1-CE 3.3Å; E284-K288 IonicContact OE1-NZ 2.73Å; E284-K288 PolarHBondContact OE1-NZ 2.96Å; K285-K288 PolarHBondContact O-N 3.46Å; K288-K292 WeakPolarHBondContact O-CB 3.38Å; K288-K292 PolarHBondContact O-N 3.47Å
289	E	94.2	Very high	94.4	Very high	90 Å²	90	102 Å²	102	42%	0.421	50%	0.502	S	S	.	.	H	α-helix	trans	-67	-40.5	175.4	-74.8	-179.8	-169.8	0	0	112.1	K285 A286 R287 K292 K293	K285-E289 WeakPolarHBondContact CE-OE1 3.2Å; K285-E289 WeakPolarHBondContact O-CB 3.29Å; K285-E289 WeakPolarHBondContact O-CG 3.45Å; K285-E289 PolarHBondContact O-N 3.3Å; A286-E289 PolarHBondContact O-N 3.17Å; R287-E289 PolarHBondContact O-N 2.88Å; E289-K292 PolarHBondContact O-N 2.74Å; E289-K293 WeakPolarHBondContact O-CB 3.45Å; E289-K293 VanDerWaalsContact O-CG 3.27Å; E289-K293 WeakPolarHBondContact O-CG 3.44Å; E289-K293 PolarHBondContact O-N 3.38Å
290	A	94.8	Very high	94.5	Very high	56 Å²	56	102.9 Å²	102.9	46%	0.463	51%	0.506	S	S	.	.	H	α-helix	trans	-64.8	-44.6	175.4	0	0	0	0	0	111.6	A286 R287 K292 K293 A294	A286-A290 VanDerWaalsContact O-CB 3.3Å; A286-A290 WeakPolarHBondContact O-CB 3.44Å; A286-A290 PolarHBondContact O-N 3.46Å; R287-A290 PolarHBondContact O-N 2.85Å; A290-K292 PolarHBondContact O-N 2.92Å; A290-K293 PolarHBondContact O-N 2.97Å; A290-A294 WeakPolarHBondContact O-CB 3.39Å; A290-A294 PolarHBondContact O-N 3.48Å
291	E	95.2	Very high	94.4	Very high	130 Å²	130	107 Å²	107	61%	0.607	52%	0.523	S	S	*	.	H	α-helix	trans	-60.8	-44.8	175.4	-170.9	-169.8	161.8	0	0	111.3	R287 K293 A294 K295	R287-E291 WeakPolarHBondContact O-CB 3.48Å; R287-E291 PolarHBondContact O-N 3.14Å; E291-K293 PolarHBondContact O-N 3.43Å; E291-A294 PolarHBondContact O-N 2.87Å; E291-K295 WeakPolarHBondContact O-CB 3.33Å; E291-K295 PolarHBondContact O-N 3.35Å
292	K	95.4	Very high	94.5	Very high	164 Å²	164	106 Å²	106	71%	0.713	52%	0.521	S	S	*	.	H	α-helix	trans	-62.8	-41.7	176.4	-173.8	179.1	178.7	-177.5	0	111.9	K288 E289 A290 A296	K288-K292 WeakPolarHBondContact O-CB 3.38Å; K288-K292 PolarHBondContact O-N 3.47Å; E289-K292 PolarHBondContact O-N 2.74Å; A290-K292 PolarHBondContact O-N 2.92Å; K292-A296 WeakPolarHBondContact O-CB 3.23Å; K292-A296 PolarHBondContact O-N 2.64Å
293	K	95.3	Very high	94.4	Very high	146 Å²	146	106.1 Å²	106.1	64%	0.635	52%	0.521	S	S	*	.	H	α-helix	trans	-64.4	-46.4	175.5	-76.4	173.7	-178.1	175.9	0	111.2	E289 A290 E291 K295 A296 E297	E289-K293 WeakPolarHBondContact O-CB 3.45Å; E289-K293 VanDerWaalsContact O-CG 3.27Å; E289-K293 WeakPolarHBondContact O-CG 3.44Å; E289-K293 PolarHBondContact O-N 3.38Å; A290-K293 PolarHBondContact O-N 2.97Å; E291-K293 PolarHBondContact O-N 3.43Å; K293-K295 PolarHBondContact O-N 3.27Å; K293-A296 PolarHBondContact O-N 3.39Å; K293-E297 WeakPolarHBondContact O-CB 3.19Å; K293-E297 PolarHBondContact O-N 2.82Å
294	A	95.2	Very high	94.4	Very high	58 Å²	58	106.1 Å²	106.1	48%	0.479	52%	0.521	S	S	.	.	H	α-helix	trans	-60.5	-43.4	177.4	0	0	0	0	0	111.8	A290 E291 E297 A298	A290-A294 WeakPolarHBondContact O-CB 3.39Å; A290-A294 PolarHBondContact O-N 3.48Å; E291-A294 PolarHBondContact O-N 2.87Å; A294-E297 PolarHBondContact O-N 3.28Å; A294-A298 WeakPolarHBondContact O-CB 3.24Å; A294-A298 PolarHBondContact O-N 3.33Å
295	K	95.4	Very high	94.5	Very high	159 Å²	159	108.4 Å²	108.4	69%	0.691	53%	0.532	S	S	*	.	H	α-helix	trans	-65.7	-38.7	175.9	-171.3	171.8	-175.4	170.2	0	112.6	E291 K293 K299	E291-K295 WeakPolarHBondContact O-CB 3.33Å; E291-K295 PolarHBondContact O-N 3.35Å; K293-K295 PolarHBondContact O-N 3.27Å; K295-K299 WeakPolarHBondContact O-CB 3.41Å; K295-K299 PolarHBondContact O-N 3.12Å
296	A	94.4	Very high	94.4	Very high	59 Å²	59	108.1 Å²	108.1	49%	0.488	53%	0.531	S	S	.	.	H	α-helix	trans	-66.5	-41.8	175.5	0	0	0	0	0	111.7	K292 K293 K299 K300	K292-A296 WeakPolarHBondContact O-CB 3.23Å; K292-A296 PolarHBondContact O-N 2.64Å; K293-A296 PolarHBondContact O-N 3.39Å; A296-K299 PolarHBondContact O-N 3.21Å; A296-K300 WeakPolarHBondContact O-CB 3.34Å; A296-K300 PolarHBondContact O-N 3.38Å
297	E	94.6	Very high	94.3	Very high	105 Å²	105	109.5 Å²	109.5	49%	0.491	53%	0.528	S	S	.	.	H	α-helix	trans	-67.2	-43.3	176.9	-168.3	-176.7	156.3	0	0	111.9	K293 A294 K299 K300 K301	K293-E297 WeakPolarHBondContact O-CB 3.19Å; K293-E297 PolarHBondContact O-N 2.82Å; A294-E297 PolarHBondContact O-N 3.28Å; E297-K299 VanDerWaalsContact C-N 3.35Å; E297-K299 PolarHBondContact O-N 2.51Å; E297-K300 PolarHBondContact O-N 3.47Å; E297-K301 WeakPolarHBondContact O-CG 3.27Å; E297-K301 PolarHBondContact O-N 2.86Å; E297-K301 WeakPolarHBondContact OE1-CE 3.33Å; E297-K301 IonicContact OE1-NZ 3.4Å; E297-K301 PolarHBondContact OE1-NZ 2.94Å
298	A	94.5	Very high	94.3	Very high	59 Å²	59	109.1 Å²	109.1	49%	0.488	53%	0.526	S	S	.	.	H	α-helix	trans	-59.3	-45.5	174.8	0	0	0	0	0	111.5	A294 K300 K301 E302	A294-A298 WeakPolarHBondContact O-CB 3.24Å; A294-A298 PolarHBondContact O-N 3.33Å; A298-K300 VanDerWaalsContact C-N 3.35Å; A298-K300 PolarHBondContact O-N 2.89Å; A298-K301 PolarHBondContact O-N 2.82Å; A298-E302 WeakPolarHBondContact O-CB 3.45Å; A298-E302 PolarHBondContact O-N 3.36Å
299	K	94.9	Very high	94.3	Very high	127 Å²	127	107.3 Å²	107.3	55%	0.552	53%	0.525	S	S	*	.	H	α-helix	trans	-64.2	-37.9	175.8	-172.6	176.9	-179.3	179.9	0	112.4	K295 A296 E297 E302 Q303	K295-K299 WeakPolarHBondContact O-CB 3.41Å; K295-K299 PolarHBondContact O-N 3.12Å; A296-K299 PolarHBondContact O-N 3.21Å; E297-K299 VanDerWaalsContact C-N 3.35Å; E297-K299 PolarHBondContact O-N 2.51Å; K299-E302 PolarHBondContact O-N 3.43Å; K299-Q303 WeakPolarHBondContact O-CB 3.35Å; K299-Q303 VanDerWaalsContact O-CG 3.29Å; K299-Q303 WeakPolarHBondContact O-CG 3.3Å; K299-Q303 PolarHBondContact O-N 2.92Å
300	K	94.5	Very high	94.2	Very high	119 Å²	119	110.3 Å²	110.3	52%	0.517	53%	0.532	S	S	.	.	H	α-helix	trans	-64.3	-46.8	176.1	-168.4	-176	-174.9	-99.9	0	110.9	A296 E297 A298 E302 Q303 E304	A296-K300 WeakPolarHBondContact O-CB 3.34Å; A296-K300 PolarHBondContact O-N 3.38Å; E297-K300 PolarHBondContact O-N 3.47Å; A298-K300 VanDerWaalsContact C-N 3.35Å; A298-K300 PolarHBondContact O-N 2.89Å; K300-E302 VanDerWaalsContact C-N 3.35Å; K300-E302 PolarHBondContact O-N 3.42Å; K300-Q303 PolarHBondContact O-N 2.87Å; K300-E304 VanDerWaalsContact CE-OE1 3.31Å; K300-E304 WeakPolarHBondContact CE-OE1 3.36Å; K300-E304 IonicContact NZ-OE1 3.94Å; K300-E304 PolarHBondContact NZ-OE1 3.38Å; K300-E304 WeakPolarHBondContact O-CB 3.28Å; K300-E304 WeakPolarHBondContact O-CG 3.39Å; K300-E304 PolarHBondContact O-N 2.78Å
301	K	94.4	Very high	94.1	Very high	121 Å²	121	112.9 Å²	112.9	53%	0.526	54%	0.535	S	S	.	.	H	α-helix	trans	-60.8	-42.6	176.4	-73.1	178.9	-176.3	167.5	0	111.9	E297 A298 Q303 E304 E305	E297-K301 WeakPolarHBondContact O-CG 3.27Å; E297-K301 PolarHBondContact O-N 2.86Å; E297-K301 WeakPolarHBondContact OE1-CE 3.33Å; E297-K301 IonicContact OE1-NZ 3.4Å; E297-K301 PolarHBondContact OE1-NZ 2.94Å; A298-K301 PolarHBondContact O-N 2.82Å; K301-Q303 PolarHBondContact O-N 3.46Å; K301-E304 PolarHBondContact O-N 3.27Å; K301-E305 WeakPolarHBondContact O-CB 3.2Å; K301-E305 PolarHBondContact O-N 2.9Å
302	E	94.1	Very high	94	Very high	96 Å²	96	109.3 Å²	109.3	45%	0.449	53%	0.528	S	S	.	.	H	α-helix	trans	-63.3	-40.2	175.9	-168.9	-165.3	158.8	0	0	112.2	A298 K299 K300 K306	A298-E302 WeakPolarHBondContact O-CB 3.45Å; A298-E302 PolarHBondContact O-N 3.36Å; K299-E302 PolarHBondContact O-N 3.43Å; K300-E302 VanDerWaalsContact C-N 3.35Å; K300-E302 PolarHBondContact O-N 3.42Å; E302-K306 HydrophobicContact CG-CD 4.38Å; E302-K306 WeakPolarHBondContact O-CB 3.41Å; E302-K306 WeakPolarHBondContact O-CG 3.44Å; E302-K306 PolarHBondContact O-N 3.31Å; E302-K306 WeakPolarHBondContact OE1-CE 3.41Å; E302-K306 IonicContact OE1-NZ 2.87Å; E302-K306 PolarHBondContact OE1-NZ 3.38Å
303	Q	91.7	Very high	93.8	Very high	113 Å²	113	108.1 Å²	108.1	53%	0.528	53%	0.525	S	S	.	.	H	α-helix	trans	-67.6	-43.4	176.1	-75.9	179.1	-21.5	0	0	112.3	K299 K300 K301 E305 K306 E307	K299-Q303 WeakPolarHBondContact O-CB 3.35Å; K299-Q303 VanDerWaalsContact O-CG 3.29Å; K299-Q303 WeakPolarHBondContact O-CG 3.3Å; K299-Q303 PolarHBondContact O-N 2.92Å; K300-Q303 PolarHBondContact O-N 2.87Å; K301-Q303 PolarHBondContact O-N 3.46Å; Q303-E305 VanDerWaalsContact C-N 3.33Å; Q303-K306 PolarHBondContact O-N 3.19Å; Q303-E307 WeakPolarHBondContact O-CB 3.35Å; Q303-E307 PolarHBondContact O-N 2.94Å
304	E	93.7	Very high	93.7	Very high	100 Å²	100	106.5 Å²	106.5	47%	0.467	52%	0.522	S	S	.	.	H	α-helix	trans	-62.2	-40.9	175.7	-73.9	172.6	178.6	0	0	111.3	K300 K301 R308	K300-E304 VanDerWaalsContact CE-OE1 3.31Å; K300-E304 WeakPolarHBondContact CE-OE1 3.36Å; K300-E304 IonicContact NZ-OE1 3.94Å; K300-E304 PolarHBondContact NZ-OE1 3.38Å; K300-E304 WeakPolarHBondContact O-CB 3.28Å; K300-E304 WeakPolarHBondContact O-CG 3.39Å; K300-E304 PolarHBondContact O-N 2.78Å; K301-E304 PolarHBondContact O-N 3.27Å; E304-R308 WeakPolarHBondContact O-CB 3.37Å; E304-R308 PolarHBondContact O-N 3.33Å
305	E	93	Very high	93.5	Very high	104 Å²	104	109.3 Å²	109.3	49%	0.486	53%	0.526	S	S	.	.	H	α-helix	trans	-66.7	-45.2	175.2	177.3	159.6	-134.7	0	0	112.3	K301 Q303 E307 R308 V309	K301-E305 WeakPolarHBondContact O-CB 3.2Å; K301-E305 PolarHBondContact O-N 2.9Å; Q303-E305 VanDerWaalsContact C-N 3.33Å; E305-E307 VanDerWaalsContact C-N 3.32Å; E305-E307 PolarHBondContact O-N 3.23Å; E305-R308 PolarHBondContact O-N 3.13Å; E305-R308 IonicContact OE1-NH2 2.98Å; E305-R308 PolarHBondContact OE1-NH2 3.24Å; E305-V309 HydrophobicContact CG-CG2 4.45Å; E305-V309 VanDerWaalsContact O-CG2 3.3Å; E305-V309 WeakPolarHBondContact O-CG2 3.29Å; E305-V309 PolarHBondContact O-N 2.92Å
306	K	93.3	Very high	93.4	Very high	129 Å²	129	104.7 Å²	104.7	56%	0.561	52%	0.517	S	S	*	.	H	α-helix	trans	-59.7	-41.9	175.5	-80.5	173.7	172	170.3	0	112.2	E302 Q303 V309 R310	E302-K306 HydrophobicContact CG-CD 4.38Å; E302-K306 WeakPolarHBondContact O-CB 3.41Å; E302-K306 WeakPolarHBondContact O-CG 3.44Å; E302-K306 PolarHBondContact O-N 3.31Å; E302-K306 WeakPolarHBondContact OE1-CE 3.41Å; E302-K306 IonicContact OE1-NZ 2.87Å; E302-K306 PolarHBondContact OE1-NZ 3.38Å; Q303-K306 PolarHBondContact O-N 3.19Å; K306-V309 PolarHBondContact O-N 3.25Å; K306-R310 WeakPolarHBondContact O-CB 3.35Å; K306-R310 PolarHBondContact O-N 3.01Å
307	E	91.9	Very high	93.3	Very high	83 Å²	83	104.7 Å²	104.7	39%	0.388	52%	0.517	S	S	.	.	H	α-helix	trans	-68.1	-40.7	176.8	-175.5	57.4	-154.4	0	0	111.4	Q303 E305 V309 R310 Q311	Q303-E307 WeakPolarHBondContact O-CB 3.35Å; Q303-E307 PolarHBondContact O-N 2.94Å; E305-E307 VanDerWaalsContact C-N 3.32Å; E305-E307 PolarHBondContact O-N 3.23Å; E307-V309 PolarHBondContact O-N 3.25Å; E307-R310 PolarHBondContact O-N 2.93Å; E307-Q311 WeakPolarHBondContact O-CB 3.47Å; E307-Q311 WeakPolarHBondContact O-CG 3.49Å; E307-Q311 PolarHBondContact O-N 2.97Å; E307-Q311 PolarHBondContact OE1-NE2 3.13Å
308	R	94.6	Very high	93.1	Very high	153 Å²	153	107.3 Å²	107.3	58%	0.577	52%	0.523	S	S	*	.	H	α-helix	trans	-60.8	-43.7	174.2	-172.5	-176.9	66.7	-149.7	-3.5	112	E304 E305 Q311 A312	E304-R308 WeakPolarHBondContact O-CB 3.37Å; E304-R308 PolarHBondContact O-N 3.33Å; E305-R308 PolarHBondContact O-N 3.13Å; E305-R308 IonicContact OE1-NH2 2.98Å; E305-R308 PolarHBondContact OE1-NH2 3.24Å; R308-Q311 PolarHBondContact O-N 3.31Å; R308-A312 WeakPolarHBondContact O-CB 3.25Å; R308-A312 PolarHBondContact O-N 3.46Å
309	V	94.4	Very high	93	Very high	82 Å²	82	108.8 Å²	108.8	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-63.3	-45.4	176.1	171.7	0	0	0	0	110.6	E305 K306 E307 Q311 A312 E313	E305-V309 HydrophobicContact CG-CG2 4.45Å; E305-V309 VanDerWaalsContact O-CG2 3.3Å; E305-V309 WeakPolarHBondContact O-CG2 3.29Å; E305-V309 PolarHBondContact O-N 2.92Å; K306-V309 PolarHBondContact O-N 3.25Å; E307-V309 PolarHBondContact O-N 3.25Å; V309-Q311 VanDerWaalsContact C-N 3.33Å; V309-Q311 PolarHBondContact O-N 2.79Å; V309-A312 PolarHBondContact O-N 3.09Å; V309-E313 WeakPolarHBondContact O-CB 3.5Å; V309-E313 PolarHBondContact O-N 3.38Å
310	R	93.6	Very high	92.8	Very high	153 Å²	153	105.5 Å²	105.5	58%	0.577	52%	0.518	S	S	*	.	H	α-helix	trans	-61	-40.9	177.4	-172.4	-175.7	-176.8	-168.5	1.1	112.4	K306 E307 E313 L314	K306-R310 WeakPolarHBondContact O-CB 3.35Å; K306-R310 PolarHBondContact O-N 3.01Å; E307-R310 PolarHBondContact O-N 2.93Å; R310-E313 PolarHBondContact O-N 3.37Å; R310-L314 HydrophobicContact CG-CD1 4.33Å; R310-L314 WeakPolarHBondContact O-CB 3.5Å; R310-L314 VanDerWaalsContact O-CG 3.3Å; R310-L314 WeakPolarHBondContact O-CG 3.02Å; R310-L314 PolarHBondContact O-N 2.77Å
311	Q	91.7	Very high	92.7	Very high	111 Å²	111	106.9 Å²	106.9	52%	0.519	52%	0.524	S	S	.	.	H	α-helix	trans	-65.9	-43.5	176.8	-73.9	178.4	9.2	0	0	111.7	E307 R308 V309 E313 L314 E315	E307-Q311 WeakPolarHBondContact O-CB 3.47Å; E307-Q311 WeakPolarHBondContact O-CG 3.49Å; E307-Q311 PolarHBondContact O-N 2.97Å; E307-Q311 PolarHBondContact OE1-NE2 3.13Å; R308-Q311 PolarHBondContact O-N 3.31Å; V309-Q311 VanDerWaalsContact C-N 3.33Å; V309-Q311 PolarHBondContact O-N 2.79Å; Q311-E313 VanDerWaalsContact C-N 3.34Å; Q311-E313 PolarHBondContact O-N 3.5Å; Q311-L314 PolarHBondContact O-N 3.27Å; Q311-E315 WeakPolarHBondContact O-CB 3.19Å; Q311-E315 PolarHBondContact O-N 2.98Å
312	A	93.3	Very high	92.4	Very high	55 Å²	55	106.6 Å²	106.6	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-62.7	-39.4	175.3	0	0	0	0	0	112.3	R308 V309 E315 A316	R308-A312 WeakPolarHBondContact O-CB 3.25Å; R308-A312 PolarHBondContact O-N 3.46Å; V309-A312 PolarHBondContact O-N 3.09Å; A312-E315 PolarHBondContact O-N 3.31Å; A312-A316 WeakPolarHBondContact O-CB 3.33Å; A312-A316 PolarHBondContact O-N 3.39Å
313	E	92.3	Very high	92.2	Very high	138 Å²	138	107.9 Å²	107.9	65%	0.645	53%	0.529	S	S	*	.	H	α-helix	trans	-65.9	-43	176.4	-170.5	179.9	-177.6	0	0	112	V309 R310 Q311 E315 A316 A317	V309-E313 WeakPolarHBondContact O-CB 3.5Å; V309-E313 PolarHBondContact O-N 3.38Å; R310-E313 PolarHBondContact O-N 3.37Å; Q311-E313 VanDerWaalsContact C-N 3.34Å; Q311-E313 PolarHBondContact O-N 3.5Å; E313-E315 PolarHBondContact O-N 2.95Å; E313-A316 PolarHBondContact O-N 2.78Å; E313-A317 WeakPolarHBondContact O-CB 3.26Å; E313-A317 PolarHBondContact O-N 3.04Å
314	L	91.9	Very high	92.1	Very high	112 Å²	112	109 Å²	109	59%	0.586	53%	0.534	S	S	*	.	H	α-helix	trans	-63.2	-40.3	175.4	-74.6	170.5	0	0	0	112.2	R310 Q311 R318	R310-L314 HydrophobicContact CG-CD1 4.33Å; R310-L314 WeakPolarHBondContact O-CB 3.5Å; R310-L314 VanDerWaalsContact O-CG 3.3Å; R310-L314 WeakPolarHBondContact O-CG 3.02Å; R310-L314 PolarHBondContact O-N 2.77Å; Q311-L314 PolarHBondContact O-N 3.27Å; L314-R318 WeakPolarHBondContact O-CB 3.14Å; L314-R318 PolarHBondContact O-N 3.36Å
315	E	90.7	Very high	91.9	Very high	118 Å²	118	109.7 Å²	109.7	55%	0.551	54%	0.537	S	S	*	.	H	α-helix	trans	-67.7	-44	176.7	-176.1	169.7	-154.9	0	0	111.8	Q311 A312 E313 A317 R318 L319	Q311-E315 WeakPolarHBondContact O-CB 3.19Å; Q311-E315 PolarHBondContact O-N 2.98Å; A312-E315 PolarHBondContact O-N 3.31Å; E313-E315 PolarHBondContact O-N 2.95Å; E315-A317 VanDerWaalsContact C-N 3.35Å; E315-A317 PolarHBondContact O-N 3.05Å; E315-R318 PolarHBondContact O-N 3.21Å; E315-R318 IonicContact OE1-NH2 2.83Å; E315-L319 PolarHBondContact O-N 2.93Å
316	A	93	Very high	91.8	Very high	61 Å²	61	110.4 Å²	110.4	50%	0.504	54%	0.541	S	S	.	.	H	α-helix	trans	-61.6	-42.4	175.5	0	0	0	0	0	111.9	A312 E313 L319 A320	A312-A316 WeakPolarHBondContact O-CB 3.33Å; A312-A316 PolarHBondContact O-N 3.39Å; E313-A316 PolarHBondContact O-N 2.78Å; A316-L319 PolarHBondContact O-N 3.33Å; A316-A320 WeakPolarHBondContact O-CB 3.42Å; A316-A320 PolarHBondContact O-N 2.76Å
317	A	92.9	Very high	91.7	Very high	60 Å²	60	110.5 Å²	110.5	50%	0.496	54%	0.543	S	S	.	.	H	α-helix	trans	-64.4	-39.3	176	0	0	0	0	0	112.3	E313 E315 A320 K321	E313-A317 WeakPolarHBondContact O-CB 3.26Å; E313-A317 PolarHBondContact O-N 3.04Å; E315-A317 VanDerWaalsContact C-N 3.35Å; E315-A317 PolarHBondContact O-N 3.05Å; A317-A320 PolarHBondContact O-N 2.73Å; A317-K321 WeakPolarHBondContact O-CB 3.25Å; A317-K321 PolarHBondContact O-N 3.04Å
318	R	91.4	Very high	91.6	Very high	160 Å²	160	109.2 Å²	109.2	60%	0.604	55%	0.547	S	S	*	.	H	α-helix	trans	-62.1	-46.7	174.7	-171.3	-173.6	69.2	-156.8	-6.7	110.9	L314 E315 K321 E322	L314-R318 WeakPolarHBondContact O-CB 3.14Å; L314-R318 PolarHBondContact O-N 3.36Å; E315-R318 PolarHBondContact O-N 3.21Å; E315-R318 IonicContact OE1-NH2 2.83Å; R318-K321 PolarHBondContact O-N 2.85Å; R318-E322 WeakPolarHBondContact O-CB 3.24Å; R318-E322 PolarHBondContact O-N 3.34Å
319	L	90.9	Very high	91.5	Very high	90 Å²	90	109.2 Å²	109.2	47%	0.471	55%	0.547	S	S	.	.	H	α-helix	trans	-65.5	-38.9	179.9	-168.6	72.5	0	0	0	112	E315 A316 E322 K323	E315-L319 PolarHBondContact O-N 2.93Å; A316-L319 PolarHBondContact O-N 3.33Å; L319-E322 PolarHBondContact O-N 2.65Å; L319-K323 WeakPolarHBondContact O-CG 3.33Å; L319-K323 PolarHBondContact O-N 3.28Å
320	A	91.8	Very high	91.2	Very high	58 Å²	58	110.2 Å²	110.2	48%	0.479	55%	0.546	S	S	.	.	H	α-helix	trans	-63.8	-44.1	175.4	0	0	0	0	0	111.7	A316 A317 E322 K323 E324	A316-A320 WeakPolarHBondContact O-CB 3.42Å; A316-A320 PolarHBondContact O-N 2.76Å; A317-A320 PolarHBondContact O-N 2.73Å; A320-E322 PolarHBondContact O-N 2.95Å; A320-K323 PolarHBondContact O-N 3.08Å; A320-E324 PolarHBondContact O-N 3.12Å
321	K	91.5	Very high	91.1	Very high	147 Å²	147	105.5 Å²	105.5	64%	0.639	54%	0.54	S	S	*	.	H	α-helix	trans	-64.1	-39.8	177.1	-171	-178.7	178.1	-174.2	0	112.4	A317 R318 E324 E325	A317-K321 WeakPolarHBondContact O-CB 3.25Å; A317-K321 PolarHBondContact O-N 3.04Å; R318-K321 PolarHBondContact O-N 2.85Å; K321-E324 PolarHBondContact O-N 3.01Å; K321-E325 WeakPolarHBondContact O-CB 3.12Å; K321-E325 PolarHBondContact O-N 3.36Å
322	E	88.7	Confident	91	Very high	115 Å²	115	103.1 Å²	103.1	54%	0.537	54%	0.539	S	S	.	.	H	α-helix	trans	-63.7	-43.3	176.4	-173.3	172	-167.6	0	0	111.5	R318 L319 A320 E325 E326	R318-E322 WeakPolarHBondContact O-CB 3.24Å; R318-E322 PolarHBondContact O-N 3.34Å; L319-E322 PolarHBondContact O-N 2.65Å; A320-E322 PolarHBondContact O-N 2.95Å; E322-E325 PolarHBondContact O-N 3.36Å; E322-E326 WeakPolarHBondContact O-CB 3.36Å; E322-E326 PolarHBondContact O-N 3.38Å
323	K	90.6	Very high	90.7	Very high	124 Å²	124	105.8 Å²	105.8	54%	0.539	54%	0.542	S	S	.	.	H	α-helix	trans	-62.3	-45.7	173.9	-74.4	-178.5	178.9	-175.4	0	112.6	L319 A320 E325 E326 E327	L319-K323 WeakPolarHBondContact O-CG 3.33Å; L319-K323 PolarHBondContact O-N 3.28Å; A320-K323 PolarHBondContact O-N 3.08Å; K323-E325 VanDerWaalsContact C-N 3.34Å; K323-E325 PolarHBondContact O-N 3.26Å; K323-E326 PolarHBondContact O-N 2.75Å; K323-E327 WeakPolarHBondContact O-CB 3.11Å; K323-E327 WeakPolarHBondContact O-CG 3.41Å; K323-E327 PolarHBondContact O-N 3.21Å
324	E	89.3	Confident	90.4	Very high	137 Å²	137	105.4 Å²	105.4	64%	0.64	54%	0.541	S	S	*	.	H	α-helix	trans	-61.5	-41.9	178.1	-172	-174.7	171.5	0	0	111.5	A320 K321 A328	A320-E324 PolarHBondContact O-N 3.12Å; K321-E324 PolarHBondContact O-N 3.01Å; E324-A328 VanDerWaalsContact O-CB 3.23Å; E324-A328 WeakPolarHBondContact O-CB 3.49Å; E324-A328 PolarHBondContact O-N 2.98Å
325	E	90	Very high	90.3	Very high	114 Å²	114	102.1 Å²	102.1	53%	0.533	53%	0.53	S	S	.	.	H	α-helix	trans	-65.2	-39.4	176.8	-170.8	178.1	161.3	0	0	112	K321 E322 K323 R329	K321-E325 WeakPolarHBondContact O-CB 3.12Å; K321-E325 PolarHBondContact O-N 3.36Å; E322-E325 PolarHBondContact O-N 3.36Å; K323-E325 VanDerWaalsContact C-N 3.34Å; K323-E325 PolarHBondContact O-N 3.26Å; E325-R329 VanDerWaalsContact O-CB 3.32Å; E325-R329 WeakPolarHBondContact O-CB 3.46Å; E325-R329 PolarHBondContact O-N 3.43Å; E325-R329 IonicContact OE1-NH2 3.98Å
326	E	89	Confident	90.2	Very high	118 Å²	118	103.9 Å²	103.9	55%	0.551	54%	0.535	S	S	*	.	H	α-helix	trans	-68.5	-44.4	177.2	-172.6	156.5	-155.4	0	0	112.1	E322 K323 R329 Q330	E322-E326 WeakPolarHBondContact O-CB 3.36Å; E322-E326 PolarHBondContact O-N 3.38Å; K323-E326 PolarHBondContact O-N 2.75Å; E326-R329 PolarHBondContact O-N 3.22Å; E326-Q330 WeakPolarHBondContact O-CG 3.39Å; E326-Q330 PolarHBondContact O-N 3.49Å
327	E	91.4	Very high	90.1	Very high	131 Å²	131	107.8 Å²	107.8	61%	0.612	54%	0.541	S	S	*	.	H	α-helix	trans	-60.9	-44.8	173.8	-74.3	177.9	-171.5	0	0	111.4	K323 R329 Q330 A331	K323-E327 WeakPolarHBondContact O-CB 3.11Å; K323-E327 WeakPolarHBondContact O-CG 3.41Å; K323-E327 PolarHBondContact O-N 3.21Å; E327-R329 VanDerWaalsContact C-N 3.33Å; E327-R329 PolarHBondContact O-N 3.02Å; E327-Q330 PolarHBondContact O-N 3.45Å; E327-A331 WeakPolarHBondContact O-CB 3.34Å; E327-A331 PolarHBondContact O-N 3.38Å
328	A	90.9	Very high	89.7	Confident	57 Å²	57	110.5 Å²	110.5	47%	0.471	54%	0.543	S	S	.	.	H	α-helix	trans	-62.3	-39.3	176	0	0	0	0	0	112.1	E324 A331 A332	E324-A328 VanDerWaalsContact O-CB 3.23Å; E324-A328 WeakPolarHBondContact O-CB 3.49Å; E324-A328 PolarHBondContact O-N 2.98Å; A328-A331 PolarHBondContact O-N 3.24Å; A328-A332 VanDerWaalsContact O-CB 3.28Å; A328-A332 WeakPolarHBondContact O-CB 3.49Å; A328-A332 PolarHBondContact O-N 3.32Å
329	R	91.4	Very high	89.5	Confident	153 Å²	153	109.2 Å²	109.2	58%	0.577	54%	0.542	S	S	*	.	H	α-helix	trans	-65.5	-41.9	175.9	-173.4	178.1	-71.8	-171.7	2.1	111.3	E325 E326 E327 Q333	E325-R329 VanDerWaalsContact O-CB 3.32Å; E325-R329 WeakPolarHBondContact O-CB 3.46Å; E325-R329 PolarHBondContact O-N 3.43Å; E325-R329 IonicContact OE1-NH2 3.98Å; E326-R329 PolarHBondContact O-N 3.22Å; E327-R329 VanDerWaalsContact C-N 3.33Å; E327-R329 PolarHBondContact O-N 3.02Å; R329-Q333 WeakPolarHBondContact O-CG 3.34Å; R329-Q333 PolarHBondContact O-N 3.29Å; R329-Q333 VanDerWaalsContact O-N 3.08Å
330	Q	89.3	Confident	89.3	Confident	102 Å²	102	109 Å²	109	48%	0.477	54%	0.539	S	S	.	.	H	α-helix	trans	-65.2	-46.1	176.1	-70.3	-179	20.1	0	0	111.5	E326 E327 A332 Q333 Q334	E326-Q330 WeakPolarHBondContact O-CG 3.39Å; E326-Q330 PolarHBondContact O-N 3.49Å; E327-Q330 PolarHBondContact O-N 3.45Å; Q330-A332 PolarHBondContact O-N 3.49Å; Q330-Q333 PolarHBondContact O-N 3.36Å; Q330-Q334 WeakPolarHBondContact O-CG 3.27Å; Q330-Q334 PolarHBondContact O-N 3.21Å
331	A	91.1	Very high	89.2	Confident	55 Å²	55	111.9 Å²	111.9	46%	0.455	55%	0.545	S	S	.	.	H	α-helix	trans	-60.7	-43.5	176.8	0	0	0	0	0	112	E327 A328 Q333 Q334 A335	E327-A331 WeakPolarHBondContact O-CB 3.34Å; E327-A331 PolarHBondContact O-N 3.38Å; A328-A331 PolarHBondContact O-N 3.24Å; A331-Q333 VanDerWaalsContact C-N 3.34Å; A331-Q333 PolarHBondContact O-N 3.22Å; A331-Q334 PolarHBondContact O-N 3.17Å; A331-A335 WeakPolarHBondContact O-CB 3.37Å; A331-A335 PolarHBondContact O-N 2.84Å
332	A	88.9	Confident	88.9	Confident	61 Å²	61	109.2 Å²	109.2	50%	0.504	54%	0.535	S	S	.	.	H	α-helix	trans	-62.8	-38.8	176.6	0	0	0	0	0	112.4	A328 Q330 K336	A328-A332 VanDerWaalsContact O-CB 3.28Å; A328-A332 WeakPolarHBondContact O-CB 3.49Å; A328-A332 PolarHBondContact O-N 3.32Å; Q330-A332 PolarHBondContact O-N 3.49Å; A332-K336 WeakPolarHBondContact O-CB 3.22Å; A332-K336 PolarHBondContact O-N 3.4Å
333	Q	87.6	Confident	88.9	Confident	110 Å²	110	109.7 Å²	109.7	51%	0.514	54%	0.535	S	S	.	.	H	α-helix	trans	-66.1	-41.6	174.9	-74.3	-179.7	14.1	0	0	112.2	R329 Q330 A331 K336 K337	R329-Q333 WeakPolarHBondContact O-CG 3.34Å; R329-Q333 PolarHBondContact O-N 3.29Å; R329-Q333 VanDerWaalsContact O-N 3.08Å; Q330-Q333 PolarHBondContact O-N 3.36Å; A331-Q333 VanDerWaalsContact C-N 3.34Å; A331-Q333 PolarHBondContact O-N 3.22Å; Q333-K336 PolarHBondContact O-N 2.99Å; Q333-K337 WeakPolarHBondContact O-CG 3.4Å; Q333-K337 PolarHBondContact O-N 2.72Å; Q333-K337 VanDerWaalsContact O-N 3.12Å
334	Q	86.2	Confident	88.8	Confident	131 Å²	131	110.9 Å²	110.9	61%	0.612	54%	0.54	S	S	*	.	H	α-helix	trans	-64.4	-47.8	176.3	-71.7	-177.8	-1.5	0	0	111.5	Q330 A331 K336 K337 E338	Q330-Q334 WeakPolarHBondContact O-CG 3.27Å; Q330-Q334 PolarHBondContact O-N 3.21Å; A331-Q334 PolarHBondContact O-N 3.17Å; Q334-K336 VanDerWaalsContact C-N 3.26Å; Q334-K336 PolarHBondContact O-N 3.48Å; Q334-K337 WeakPolarHBondContact O-CB 3.37Å; Q334-K337 PolarHBondContact O-N 2.88Å; Q334-E338 PolarHBondContact O-N 3.46Å
335	A	88.8	Confident	88.8	Confident	43 Å²	43	105.8 Å²	105.8	36%	0.355	52%	0.522	S	S	.	.	H	α-helix	trans	-59.4	-35.9	177.1	0	0	0	0	0	112.4	A331 K339	A331-A335 WeakPolarHBondContact O-CB 3.37Å; A331-A335 PolarHBondContact O-N 2.84Å; A335-K339 WeakPolarHBondContact O-CB 3.38Å; A335-K339 VanDerWaalsContact O-CG 3.31Å; A335-K339 WeakPolarHBondContact O-CG 3.46Å; A335-K339 PolarHBondContact O-N 2.86Å
336	K	90	Very high	88.9	Confident	154 Å²	154	102.5 Å²	102.5	67%	0.67	51%	0.507	S	S	*	.	H	α-helix	trans	-66.4	-42.4	174.8	-169.7	177.2	-179.2	179.4	0	111.8	A332 Q333 Q334 E340	A332-K336 WeakPolarHBondContact O-CB 3.22Å; A332-K336 PolarHBondContact O-N 3.4Å; Q333-K336 PolarHBondContact O-N 2.99Å; Q334-K336 VanDerWaalsContact C-N 3.26Å; Q334-K336 PolarHBondContact O-N 3.48Å; K336-E340 WeakPolarHBondContact O-CG 3.32Å; K336-E340 PolarHBondContact O-N 2.92Å
337	K	89.7	Confident	89	Confident	143 Å²	143	104.5 Å²	104.5	62%	0.622	51%	0.514	S	S	*	.	H	α-helix	trans	-62.5	-44.1	176.2	-71.6	175.2	-178.5	177.8	0	111.1	Q333 Q334 E340 I341	Q333-K337 WeakPolarHBondContact O-CG 3.4Å; Q333-K337 PolarHBondContact O-N 2.72Å; Q333-K337 VanDerWaalsContact O-N 3.12Å; Q334-K337 WeakPolarHBondContact O-CB 3.37Å; Q334-K337 PolarHBondContact O-N 2.88Å; K337-E340 PolarHBondContact O-N 3.21Å; K337-I341 WeakPolarHBondContact O-CG1 3.15Å; K337-I341 PolarHBondContact O-N 3.4Å; K337-I341 VanDerWaalsContact O-N 3.13Å
338	E	85.9	Confident	89	Confident	117 Å²	117	105.6 Å²	105.6	55%	0.547	52%	0.517	S	S	.	.	H	α-helix	trans	-66.2	-44.4	-179.6	-169.1	172	-170.9	0	0	112.5	Q334 E340 I341 Q342	Q334-E338 PolarHBondContact O-N 3.46Å; E338-E340 VanDerWaalsContact C-N 3.28Å; E338-E340 PolarHBondContact O-N 3.03Å; E338-I341 WeakPolarHBondContact O-CB 3.48Å; E338-I341 PolarHBondContact O-N 3.37Å; E338-I341 VanDerWaalsContact O-N 3.1Å; E338-Q342 WeakPolarHBondContact O-CG 3.44Å; E338-Q342 PolarHBondContact O-N 2.95Å
339	K	85.8	Confident	89.1	Confident	134 Å²	134	104 Å²	104	58%	0.583	50%	0.5	S	S	*	.	H	α-helix	trans	-58.5	-38.5	174.5	-76.5	179.4	179.6	-177.2	0	112.5	A335 K343	A335-K339 WeakPolarHBondContact O-CB 3.38Å; A335-K339 VanDerWaalsContact O-CG 3.31Å; A335-K339 WeakPolarHBondContact O-CG 3.46Å; A335-K339 PolarHBondContact O-N 2.86Å; K339-K343 WeakPolarHBondContact O-CB 3.21Å; K339-K343 VanDerWaalsContact O-CG 3.28Å; K339-K343 WeakPolarHBondContact O-CG 3.41Å; K339-K343 PolarHBondContact O-N 2.81Å
340	E	88	Confident	89.2	Confident	84 Å²	84	99.6 Å²	99.6	39%	0.393	48%	0.483	S	S	.	.	H	α-helix	trans	-69	-34.9	176.5	-74.8	-62	126.3	0	0	112.6	K336 K337 E338 K343 K344	K336-E340 WeakPolarHBondContact O-CG 3.32Å; K336-E340 PolarHBondContact O-N 2.92Å; K337-E340 PolarHBondContact O-N 3.21Å; E338-E340 VanDerWaalsContact C-N 3.28Å; E338-E340 PolarHBondContact O-N 3.03Å; E340-K343 IonicContact OE1-NZ 3.03Å; E340-K343 PolarHBondContact OE1-NZ 3.14Å; E340-K344 WeakPolarHBondContact O-CG 3.27Å; E340-K344 PolarHBondContact O-N 2.95Å
341	I	88.4	Confident	89.3	Confident	119 Å²	119	99.8 Å²	99.8	61%	0.61	48%	0.484	S	S	*	.	H	α-helix	trans	-65.7	-48.1	173.2	-66.9	166.2	0	0	0	110.3	K337 E338 K343 K344 A345	K337-I341 WeakPolarHBondContact O-CG1 3.15Å; K337-I341 PolarHBondContact O-N 3.4Å; K337-I341 VanDerWaalsContact O-N 3.13Å; E338-I341 WeakPolarHBondContact O-CB 3.48Å; E338-I341 PolarHBondContact O-N 3.37Å; E338-I341 VanDerWaalsContact O-N 3.1Å; I341-K343 PolarHBondContact O-N 3.44Å; I341-K344 PolarHBondContact O-N 2.69Å; I341-A345 PolarHBondContact O-N 2.71Å
342	Q	85.7	Confident	89.3	Confident	91 Å²	91	101 Å²	101	43%	0.425	48%	0.479	S	S	.	.	H	α-helix	trans	-61.5	-43.6	179.4	-70.9	178.9	-3	0	0	112.1	E338 K344 A345 I346	E338-Q342 WeakPolarHBondContact O-CG 3.44Å; E338-Q342 PolarHBondContact O-N 2.95Å; Q342-K344 VanDerWaalsContact C-N 3.33Å; Q342-K344 PolarHBondContact O-N 3.5Å; Q342-A345 PolarHBondContact O-N 3.22Å; Q342-I346 WeakPolarHBondContact O-CG1 3.5Å; Q342-I346 PolarHBondContact O-N 3.48Å
343	K	88.3	Confident	89.5	Confident	126 Å²	126	98.1 Å²	98.1	55%	0.548	46%	0.455	S	S	.	.	H	α-helix	trans	-58.6	-42.9	175.2	-77.4	176.5	-173.4	173	0	112.5	K339 E340 I341 K347	K339-K343 WeakPolarHBondContact O-CB 3.21Å; K339-K343 VanDerWaalsContact O-CG 3.28Å; K339-K343 WeakPolarHBondContact O-CG 3.41Å; K339-K343 PolarHBondContact O-N 2.81Å; E340-K343 IonicContact OE1-NZ 3.03Å; E340-K343 PolarHBondContact OE1-NZ 3.14Å; I341-K343 PolarHBondContact O-N 3.44Å; K343-K347 WeakPolarHBondContact O-CB 3.43Å; K343-K347 PolarHBondContact O-N 3.29Å
344	K	89.8	Confident	89.7	Confident	149 Å²	149	96 Å²	96	65%	0.648	44%	0.442	S	S	*	.	H	α-helix	trans	-64.5	-41.2	177.4	-73.7	175.8	-177.3	-180	0	111.4	E340 I341 Q342 K348	E340-K344 WeakPolarHBondContact O-CG 3.27Å; E340-K344 PolarHBondContact O-N 2.95Å; I341-K344 PolarHBondContact O-N 2.69Å; Q342-K344 VanDerWaalsContact C-N 3.33Å; Q342-K344 PolarHBondContact O-N 3.5Å; K344-K348 PolarHBondContact O-N 3.35Å
345	A	89.4	Confident	89.9	Confident	30 Å²	30	92.5 Å²	92.5	25%	0.248	43%	0.43	C	S	.	.	H	α-helix	trans	-64.7	-48.2	176.7	0	0	0	0	0	112	I341 Q342 K347 K348 E349 L386	I341-A345 PolarHBondContact O-N 2.71Å; Q342-A345 PolarHBondContact O-N 3.22Å; A345-K347 VanDerWaalsContact C-N 3.32Å; A345-K347 PolarHBondContact O-N 2.88Å; A345-K348 WeakPolarHBondContact O-CB 3.41Å; A345-K348 PolarHBondContact O-N 2.86Å; A345-K348 VanDerWaalsContact O-N 3.09Å; A345-E349 PolarHBondContact O-N 3.15Å; A345-L386 HydrophobicContact CB-CD1 3.76Å; A345-L386 HydrophobicContact CB-CD2 3.68Å; A345-L386 HydrophobicContact CB-CG 4.4Å
346	I	91.2	Very high	89.8	Confident	44 Å²	44	91.7 Å²	91.7	23%	0.226	42%	0.421	C	S	.	.	H	α-helix	trans	-59.6	-43.4	177.9	-69.7	170.1	0	0	0	110.7	Q342 K348 E349 R350 L386 L389	Q342-I346 WeakPolarHBondContact O-CG1 3.5Å; Q342-I346 PolarHBondContact O-N 3.48Å; I346-K348 VanDerWaalsContact C-N 3.28Å; I346-K348 PolarHBondContact O-N 2.78Å; I346-E349 PolarHBondContact O-N 3.15Å; I346-R350 HydrophobicContact CG2-CG 4.2Å; I346-R350 VanDerWaalsContact CG2-NE 3.33Å; I346-R350 WeakPolarHBondContact O-CG 3.3Å; I346-R350 PolarHBondContact O-N 3.35Å; I346-L386 HydrophobicContact CD1-CB 4.31Å; I346-L386 HydrophobicContact CG1-CB 3.69Å; I346-L386 HydrophobicContact CG1-CD1 3.98Å; I346-L386 HydrophobicContact CG1-CG 4.31Å; I346-L389 HydrophobicContact CG2-CD1 4.15Å
347	K	91.1	Very high	89.7	Confident	161 Å²	161	84.4 Å²	84.4	70%	0.7	39%	0.389	S	S	*	.	H	α-helix	trans	-59.3	-40.2	177	-173.3	177.4	-180	179.4	0	112	K343 A345 Q351	K343-K347 WeakPolarHBondContact O-CB 3.43Å; K343-K347 PolarHBondContact O-N 3.29Å; A345-K347 VanDerWaalsContact C-N 3.32Å; A345-K347 PolarHBondContact O-N 2.88Å; K347-Q351 WeakPolarHBondContact O-CB 3.5Å; K347-Q351 PolarHBondContact O-N 2.98Å; K347-Q351 VanDerWaalsContact O-N 3.14Å
348	K	91.9	Very high	89.7	Confident	154 Å²	154	84.1 Å²	84.1	67%	0.67	39%	0.388	S	S	*	.	H	α-helix	trans	-65.2	-45	178.3	-170.3	-176.7	178.1	-173.1	0	111.5	K344 A345 I346 Q351 K352	K344-K348 PolarHBondContact O-N 3.35Å; A345-K348 WeakPolarHBondContact O-CB 3.41Å; A345-K348 PolarHBondContact O-N 2.86Å; A345-K348 VanDerWaalsContact O-N 3.09Å; I346-K348 VanDerWaalsContact C-N 3.28Å; I346-K348 PolarHBondContact O-N 2.78Å; K348-Q351 PolarHBondContact O-N 3.16Å; K348-K352 PolarHBondContact O-N 3.34Å
349	E	92.6	Very high	89.8	Confident	24 Å²	24	84.7 Å²	84.7	11%	0.112	39%	0.394	C	S	.	.	H	α-helix	trans	-71.3	-39.2	-179.2	-64.2	-57.2	139.1	0	0	112.9	A345 I346 Q351 K352 L353 L386 L389 Q390 N393	A345-E349 PolarHBondContact O-N 3.15Å; I346-E349 PolarHBondContact O-N 3.15Å; E349-Q351 VanDerWaalsContact C-N 3.29Å; E349-Q351 PolarHBondContact O-N 3.46Å; E349-K352 WeakPolarHBondContact O-CB 3.28Å; E349-K352 PolarHBondContact O-N 3.25Å; E349-L353 PolarHBondContact O-N 2.77Å; E349-L386 HydrophobicContact CG-CD1 3.86Å; E349-L389 HydrophobicContact CB-CB 3.87Å; E349-L389 HydrophobicContact CB-CD1 4.46Å; E349-Q390 HydrophobicContact CG-CG 3.72Å; E349-N393 PolarHBondContact O-ND2 3.03Å; E349-N393 PolarHBondContact OE2-ND2 3.48Å
350	R	93.6	Very high	89.8	Confident	59 Å²	59	82 Å²	82	22%	0.223	38%	0.381	C	S	.	.	H	α-helix	trans	-57.7	-43.1	170.7	-70.2	178.3	-177.4	-152.3	-6.4	111.5	I346 K352 L353 R354 C381 D382 L389	I346-R350 HydrophobicContact CG2-CG 4.2Å; I346-R350 VanDerWaalsContact CG2-NE 3.33Å; I346-R350 WeakPolarHBondContact O-CG 3.3Å; I346-R350 PolarHBondContact O-N 3.35Å; R350-K352 VanDerWaalsContact C-N 3.34Å; R350-K352 PolarHBondContact O-N 3.19Å; R350-L353 PolarHBondContact O-N 3.24Å; R350-R354 WeakPolarHBondContact O-CG 3.39Å; R350-R354 PolarHBondContact O-N 3.4Å; R350-R354 VanDerWaalsContact O-N 3.08Å; R350-C381 HydrophobicContact CB-CB 4.25Å; R350-C381 HydrophobicContact CG-CB 3.89Å; R350-C381 PolarHBondContact NE-O 2.98Å; R350-C381 PolarHBondContact NH2-O 2.83Å; R350-D382 IonicContact CZ-OD1 3.72Å; R350-D382 IonicContact NH1-OD1 3.67Å; R350-D382 PolarHBondContact NH1-OD1 2.86Å; R350-D382 PolarHBondContact NH2-O 3.11Å; R350-D382 IonicContact NH2-OD1 3.71Å; R350-L389 HydrophobicContact CG-CD1 3.77Å
351	Q	91.6	Very high	89.7	Confident	106 Å²	106	82.6 Å²	82.6	50%	0.495	39%	0.387	S	S	.	.	H	α-helix	trans	-64.3	-39.7	177.7	-174.6	59.9	37	0	0	112	K347 K348 E349 T355	K347-Q351 WeakPolarHBondContact O-CB 3.5Å; K347-Q351 PolarHBondContact O-N 2.98Å; K347-Q351 VanDerWaalsContact O-N 3.14Å; K348-Q351 PolarHBondContact O-N 3.16Å; E349-Q351 VanDerWaalsContact C-N 3.29Å; E349-Q351 PolarHBondContact O-N 3.46Å; Q351-T355 PolarHBondContact NE2-OG1 3.09Å; Q351-T355 WeakPolarHBondContact O-CB 3.35Å; Q351-T355 PolarHBondContact O-N 3.09Å; Q351-T355 PolarHBondContact O-OG1 3.49Å
352	K	91.6	Very high	89.6	Confident	81 Å²	81	78.9 Å²	78.9	35%	0.352	37%	0.365	S	S	.	.	H	α-helix	trans	-62.3	-46.3	176.4	-173.4	178.7	174.5	-165.5	0	110.9	K348 E349 R350 R354 T355 T356 N393	K348-K352 PolarHBondContact O-N 3.34Å; E349-K352 WeakPolarHBondContact O-CB 3.28Å; E349-K352 PolarHBondContact O-N 3.25Å; R350-K352 VanDerWaalsContact C-N 3.34Å; R350-K352 PolarHBondContact O-N 3.19Å; K352-R354 PolarHBondContact O-N 3.49Å; K352-T355 PolarHBondContact O-N 2.95Å; K352-T356 PolarHBondContact O-N 3.35Å; K352-T356 PolarHBondContact O-OG1 3.46Å; K352-T356 VanDerWaalsContact O-OG1 3.04Å; K352-N393 HydrophobicContact CD-CB 3.91Å; K352-N393 HydrophobicContact CG-CB 4.35Å
353	L	91.9	Very high	89.6	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-57.9	-51.8	177.2	-179.5	60.3	0	0	0	111.7	E349 R350 T355 T356 C357 V377 L380 L389 L392 N393 L396	E349-L353 PolarHBondContact O-N 2.77Å; R350-L353 PolarHBondContact O-N 3.24Å; L353-T355 VanDerWaalsContact C-N 3.31Å; L353-T355 PolarHBondContact O-N 3.12Å; L353-T356 PolarHBondContact O-N 2.97Å; L353-C357 PolarHBondContact O-N 3.33Å; L353-C357 PolarHBondContact O-SG 2.97Å; L353-C357 VanDerWaalsContact O-SG 3.37Å; L353-V377 HydrophobicContact CG-CG1 4.23Å; L353-L380 HydrophobicContact CD2-CB 4.14Å; L353-L389 HydrophobicContact CD2-CD2 3.97Å; L353-L392 HydrophobicContact CD1-CD2 3.77Å; L353-L392 HydrophobicContact CD1-CG 4.19Å; L353-L392 HydrophobicContact CD2-CD2 4.07Å; L353-N393 WeakPolarHBondContact CA-OD1 3.43Å; L353-N393 WeakPolarHBondContact CB-OD1 3.46Å; L353-N393 PolarHBondContact N-OD1 3.14Å; L353-N393 VanDerWaalsContact N-OD1 3.12Å; L353-L396 HydrophobicContact CD1-CD1 3.32Å
354	R	92.1	Very high	89.4	Confident	65 Å²	65	69.2 Å²	69.2	25%	0.245	32%	0.323	C	S	.	.	H	α-helix	trans	-56.4	-44.6	176.8	-70.9	178.1	-176.9	119	1.4	112.5	R350 K352 K358 V377 E378	R350-R354 WeakPolarHBondContact O-CG 3.39Å; R350-R354 PolarHBondContact O-N 3.4Å; R350-R354 VanDerWaalsContact O-N 3.08Å; K352-R354 PolarHBondContact O-N 3.49Å; R354-K358 VanDerWaalsContact O-CB 3.27Å; R354-K358 WeakPolarHBondContact O-CB 3.46Å; R354-K358 PolarHBondContact O-N 3.49Å; R354-V377 HydrophobicContact CG-CG1 4.42Å; R354-E378 WeakPolarHBondContact CD-OE1 3.22Å; R354-E378 IonicContact CZ-OE1 3.64Å; R354-E378 IonicContact CZ-OE2 3.39Å; R354-E378 IonicContact NE-OE1 2.72Å; R354-E378 PolarHBondContact NE-OE1 3.45Å; R354-E378 IonicContact NE-OE2 3.24Å; R354-E378 PolarHBondContact NE-OE2 3Å; R354-E378 IonicContact NH2-OE1 2.69Å; R354-E378 IonicContact NH2-OE2 2.89Å; R354-E378 PolarHBondContact NH2-OE2 3.22Å
355	T	90.2	Very high	88.8	Confident	59 Å²	59	69.8 Å²	69.8	36%	0.362	33%	0.333	S	S	.	.	H	α-helix	trans	-65.8	-44.7	-177.6	-54	0	0	0	0	110.8	Q351 K352 L353 K358 N359	Q351-T355 PolarHBondContact NE2-OG1 3.09Å; Q351-T355 WeakPolarHBondContact O-CB 3.35Å; Q351-T355 PolarHBondContact O-N 3.09Å; Q351-T355 PolarHBondContact O-OG1 3.49Å; K352-T355 PolarHBondContact O-N 2.95Å; L353-T355 VanDerWaalsContact C-N 3.31Å; L353-T355 PolarHBondContact O-N 3.12Å; T355-K358 PolarHBondContact O-N 3.16Å; T355-N359 VanDerWaalsContact O-CG 3.24Å; T355-N359 PolarHBondContact O-N 3.14Å; T355-N359 PolarHBondContact O-OD1 3.43Å
356	T	87.8	Confident	88.5	Confident	26 Å²	26	70.7 Å²	70.7	16%	0.16	34%	0.338	C	S	.	.	H	α-helix	trans	-63.1	-53.4	178.1	-53.9	0	0	0	0	110.5	K352 L353 K358 N359 W360 L396	K352-T356 PolarHBondContact O-N 3.35Å; K352-T356 PolarHBondContact O-OG1 3.46Å; K352-T356 VanDerWaalsContact O-OG1 3.04Å; L353-T356 PolarHBondContact O-N 2.97Å; T356-K358 VanDerWaalsContact C-N 3.27Å; T356-K358 PolarHBondContact O-N 3.26Å; T356-N359 WeakPolarHBondContact O-CB 3.35Å; T356-N359 PolarHBondContact O-N 3.32Å; T356-W360 PolarHBondContact O-N 3.45Å; T356-L396 HydrophobicContact CG2-CB 4Å
357	C	88.3	Confident	88	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-57.3	-38.6	179	-64.3	0	0	0	0	112.7	L353 W360 Y362 F363 V377	L353-C357 PolarHBondContact O-N 3.33Å; L353-C357 PolarHBondContact O-SG 2.97Å; L353-C357 VanDerWaalsContact O-SG 3.37Å; C357-W360 PolarHBondContact O-N 2.95Å; C357-Y362 HydrophobicContact CB-CD1 3.94Å; C357-Y362 HydrophobicContact CB-CE1 4.1Å; C357-Y362 WeakPolarHBondContact O-CA 3.36Å; C357-Y362 PolarHBondContact O-N 2.85Å; C357-F363 HydrophobicContact CB-CE2 4.31Å; C357-V377 HydrophobicContact CB-CG1 4.45Å; C357-V377 HydrophobicContact CB-CG2 4.03Å
358	K	89.3	Confident	87.6	Confident	138 Å²	138	72.2 Å²	72.2	60%	0.6	36%	0.357	S	S	*	.	H	α-helix	trans	-63	-42.1	174.9	-175.9	178.5	179	179.2	0	112.8	R354 T355 T356 W360 N361 Y362	R354-K358 VanDerWaalsContact O-CB 3.27Å; R354-K358 WeakPolarHBondContact O-CB 3.46Å; R354-K358 PolarHBondContact O-N 3.49Å; T355-K358 PolarHBondContact O-N 3.16Å; T356-K358 VanDerWaalsContact C-N 3.27Å; T356-K358 PolarHBondContact O-N 3.26Å; K358-W360 PolarHBondContact O-N 3.3Å; K358-N361 PolarHBondContact O-N 3.3Å; K358-Y362 HydrophobicContact CB-CE2 4.28Å; K358-Y362 HydrophobicContact CG-CE2 4.29Å
359	N	87.6	Confident	87.1	Confident	128 Å²	128	68.4 Å²	68.4	68%	0.684	34%	0.344	S	S	*	.	H	α-helix	trans	-63	-29	179.3	-71.3	-11.2	0	0	0	112.6	T355 T356 N361	T355-N359 VanDerWaalsContact O-CG 3.24Å; T355-N359 PolarHBondContact O-N 3.14Å; T355-N359 PolarHBondContact O-OD1 3.43Å; T356-N359 WeakPolarHBondContact O-CB 3.35Å; T356-N359 PolarHBondContact O-N 3.32Å; N359-N361 VanDerWaalsContact C-N 3.27Å; N359-N361 PolarHBondContact O-N 3.3Å
360	W	85.5	Confident	86.7	Confident	77 Å²	77	68 Å²	68	29%	0.292	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	14.3	174.7	-62.4	99.9	0	0	0	113.6	T356 C357 K358 Y362 F363 K401	T356-W360 PolarHBondContact O-N 3.45Å; C357-W360 PolarHBondContact O-N 2.95Å; K358-W360 PolarHBondContact O-N 3.3Å; W360-Y362 VanDerWaalsContact C-N 3.25Å; W360-Y362 PolarHBondContact O-N 3.41Å; W360-F363 HydrophobicContact CB-CD1 3.76Å; W360-F363 HydrophobicContact CB-CE1 3.45Å; W360-F363 VanDerWaalsContact CB-CE1 3.45Å; W360-F363 HydrophobicContact CB-CG 4.47Å; W360-F363 HydrophobicContact CB-CZ 3.93Å; W360-F363 AromaticContact CD1-CE1 3.91Å; W360-F363 AromaticContact CD1-CZ 3.96Å; W360-F363 HydrophobicContact CD2-CE1 4.05Å; W360-F363 HydrophobicContact CG-CD1 4.31Å; W360-F363 AromaticContact CG-CE1 3.57Å; W360-F363 HydrophobicContact CG-CE1 3.57Å; W360-F363 HydrophobicContact CG-CZ 4.03Å; W360-F363 PolarHBondContact O-N 2.9Å; W360-F363 VanDerWaalsContact O-N 3.09Å; W360-K401 HydrophobicContact CD2-CB 4.46Å; W360-K401 HydrophobicContact CD2-CG 4.14Å; W360-K401 HydrophobicContact CE3-CB 3.44Å; W360-K401 VanDerWaalsContact CE3-CB 3.44Å; W360-K401 HydrophobicContact CE3-CD 3.64Å; W360-K401 HydrophobicContact CE3-CG 3.24Å; W360-K401 VanDerWaalsContact CH2-CA 3.41Å; W360-K401 HydrophobicContact CH2-CB 3.84Å; W360-K401 HydrophobicContact CZ3-CB 3.11Å; W360-K401 HydrophobicContact CZ3-CD 4.02Å; W360-K401 HydrophobicContact CZ3-CG 3.54Å
361	N	85.6	Confident	86.3	Confident	97 Å²	97	68.3 Å²	68.3	52%	0.519	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	53.2	40.4	-174.7	-163.9	54.1	0	0	0	112.9	K358 N359 F363 A364	K358-N361 PolarHBondContact O-N 3.3Å; N359-N361 VanDerWaalsContact C-N 3.27Å; N359-N361 PolarHBondContact O-N 3.3Å; N361-F363 PolarHBondContact O-N 2.83Å; N361-A364 PolarHBondContact ND2-O 3.04Å; N361-A364 PolarHBondContact O-N 3.13Å
362	Y	86.8	Confident	86.1	Confident	41 Å²	41	68.9 Å²	68.9	16%	0.161	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	50.8	30.7	-176.1	-58.6	-81	0	0	0	113.7	C357 K358 W360 A364 S370 M373 M374	C357-Y362 HydrophobicContact CB-CD1 3.94Å; C357-Y362 HydrophobicContact CB-CE1 4.1Å; C357-Y362 WeakPolarHBondContact O-CA 3.36Å; C357-Y362 PolarHBondContact O-N 2.85Å; K358-Y362 HydrophobicContact CB-CE2 4.28Å; K358-Y362 HydrophobicContact CG-CE2 4.29Å; W360-Y362 VanDerWaalsContact C-N 3.25Å; W360-Y362 PolarHBondContact O-N 3.41Å; Y362-A364 PolarHBondContact O-N 2.73Å; Y362-S370 WeakPolarHBondContact CD2-OG 3.41Å; Y362-M373 VanDerWaalsContact O-CG 3.3Å; Y362-M373 WeakPolarHBondContact O-CG 3.37Å; Y362-M374 HydrophobicContact CD1-CG 3.62Å; Y362-M374 HydrophobicContact CD2-CG 3.81Å; Y362-M374 HydrophobicContact CD2-SD 4.18Å; Y362-M374 HydrophobicContact CE1-CB 4.48Å; Y362-M374 HydrophobicContact CE1-CG 3.42Å; Y362-M374 VanDerWaalsContact CE1-CG 3.42Å; Y362-M374 HydrophobicContact CE1-SD 4.39Å; Y362-M374 HydrophobicContact CE2-CG 3.58Å; Y362-M374 HydrophobicContact CE2-SD 3.61Å; Y362-M374 HydrophobicContact CG-CG 3.81Å
363	F	86.1	Confident	85.8	Confident	8 Å²	8	66.2 Å²	66.2	4%	0.035	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	55.7	25.1	176.6	-46.7	-77.6	0	0	0	114.6	C357 W360 N361 L396 K401 K405 V408	C357-F363 HydrophobicContact CB-CE2 4.31Å; W360-F363 HydrophobicContact CB-CD1 3.76Å; W360-F363 HydrophobicContact CB-CE1 3.45Å; W360-F363 VanDerWaalsContact CB-CE1 3.45Å; W360-F363 HydrophobicContact CB-CG 4.47Å; W360-F363 HydrophobicContact CB-CZ 3.93Å; W360-F363 AromaticContact CD1-CE1 3.91Å; W360-F363 AromaticContact CD1-CZ 3.96Å; W360-F363 HydrophobicContact CD2-CE1 4.05Å; W360-F363 HydrophobicContact CG-CD1 4.31Å; W360-F363 AromaticContact CG-CE1 3.57Å; W360-F363 HydrophobicContact CG-CE1 3.57Å; W360-F363 HydrophobicContact CG-CZ 4.03Å; W360-F363 PolarHBondContact O-N 2.9Å; W360-F363 VanDerWaalsContact O-N 3.09Å; N361-F363 PolarHBondContact O-N 2.83Å; F363-L396 HydrophobicContact CZ-CD2 4.43Å; F363-K401 HydrophobicContact CD1-CG 4.05Å; F363-K401 HydrophobicContact CE1-CG 4.42Å; F363-K405 HydrophobicContact CB-CB 3.98Å; F363-K405 HydrophobicContact CB-CD 3.82Å; F363-K405 HydrophobicContact CB-CG 3.69Å; F363-K405 HydrophobicContact CD1-CB 3.76Å; F363-K405 HydrophobicContact CD1-CG 4.43Å; F363-K405 HydrophobicContact CD2-CB 4.49Å; F363-K405 HydrophobicContact CE1-CB 4.36Å; F363-K405 HydrophobicContact CG-CB 3.84Å; F363-K405 HydrophobicContact CG-CG 4.04Å; F363-K405 PolarHBondContact O-NZ 2.99Å; F363-V408 HydrophobicContact CE2-CG2 4.26Å
364	A	84.5	Confident	85.6	Confident	7 Å²	7	69.3 Å²	69.3	6%	0.058	36%	0.357	C	S	.	.			trans	-123.7	142.9	-175.1	0	0	0	0	0	112.2	N361 Y362 D369 S370	N361-A364 PolarHBondContact ND2-O 3.04Å; N361-A364 PolarHBondContact O-N 3.13Å; Y362-A364 PolarHBondContact O-N 2.73Å; A364-D369 HydrophobicContact CB-CB 3.89Å; A364-S370 VanDerWaalsContact CB-N 3.3Å
365	D	76.9	Confident	85.5	Confident	160 Å²	160	72.2 Å²	72.2	86%	0.856	37%	0.374	S	S	*	.	S	Bend	trans	-100.6	-9.4	175.1	-56.8	-43.6	0	0	0	112
366	S	82.5	Confident	85.5	Confident	49 Å²	49	71.8 Å²	71.8	34%	0.343	37%	0.367	S	S	.	.	S	Bend	trans	-117.8	147.3	176.9	89.7	0	0	0	0	111.2	A368 D369 S370	S366-A368 VanDerWaalsContact C-N 3.27Å; S366-A368 PolarHBondContact O-N 2.75Å; S366-D369 PolarHBondContact O-N 3.02Å; S366-D369 WeakPolarHBondContact OG-CB 3.38Å; S366-D369 PolarHBondContact OG-N 3.12Å; S366-D369 VanDerWaalsContact OG-N 3.14Å; S366-D369 PolarHBondContact OG-OD2 3.47Å; S366-S370 PolarHBondContact O-N 3.34Å; S366-S370 VanDerWaalsContact O-N 3.09Å
367	E	80	Confident	85.7	Confident	175 Å²	175	70.6 Å²	70.6	82%	0.818	36%	0.36	S	S	*	.	H	α-helix	trans	-62	-36.8	177.6	-170.9	172.5	-172.2	0	0	111.7	D369 S370 V371	E367-D369 PolarHBondContact O-N 2.81Å; E367-S370 PolarHBondContact O-N 2.87Å; E367-V371 WeakPolarHBondContact O-CG2 3.46Å; E367-V371 PolarHBondContact O-N 2.88Å; E367-V371 VanDerWaalsContact O-N 3.15Å
368	A	82.5	Confident	85.9	Confident	62 Å²	62	74.3 Å²	74.3	51%	0.512	38%	0.378	S	S	.	.	H	α-helix	trans	-65.2	-39.1	178.9	0	0	0	0	0	112.9	S366 K372	S366-A368 VanDerWaalsContact C-N 3.27Å; S366-A368 PolarHBondContact O-N 2.75Å; A368-K372 WeakPolarHBondContact O-CG 3.49Å; A368-K372 PolarHBondContact O-N 3.13Å
369	D	82.6	Confident	86	Confident	75 Å²	75	70.7 Å²	70.7	40%	0.401	36%	0.362	S	S	.	.	H	α-helix	trans	-80.2	-28.7	-179.8	-59.7	-39.8	0	0	0	111.9	A364 S366 E367 V371 K372 M373	A364-D369 HydrophobicContact CB-CB 3.89Å; S366-D369 PolarHBondContact O-N 3.02Å; S366-D369 WeakPolarHBondContact OG-CB 3.38Å; S366-D369 PolarHBondContact OG-N 3.12Å; S366-D369 VanDerWaalsContact OG-N 3.14Å; S366-D369 PolarHBondContact OG-OD2 3.47Å; E367-D369 PolarHBondContact O-N 2.81Å; D369-V371 VanDerWaalsContact C-N 3.31Å; D369-V371 PolarHBondContact O-N 2.94Å; D369-K372 PolarHBondContact O-N 2.76Å; D369-K372 IonicContact OD1-NZ 2.9Å; D369-K372 PolarHBondContact OD1-NZ 2.9Å; D369-M373 WeakPolarHBondContact O-CB 3.5Å; D369-M373 PolarHBondContact O-N 2.92Å
370	S	83.4	Confident	86.2	Confident	16 Å²	16	64.6 Å²	64.6	11%	0.112	33%	0.329	C	S	.	.	H	α-helix	trans	-62.4	-39.1	170.3	-177.1	0	0	0	0	111.7	Y362 A364 S366 E367 M374	Y362-S370 WeakPolarHBondContact CD2-OG 3.41Å; A364-S370 VanDerWaalsContact CB-N 3.3Å; S366-S370 PolarHBondContact O-N 3.34Å; S366-S370 VanDerWaalsContact O-N 3.09Å; E367-S370 PolarHBondContact O-N 2.87Å; S370-M374 WeakPolarHBondContact O-CG 3.4Å; S370-M374 PolarHBondContact O-N 3.27Å
371	V	85.7	Confident	86.4	Confident	65 Å²	65	60.9 Å²	60.9	39%	0.394	32%	0.315	S	S	.	.	H	α-helix	trans	-66.5	-45.4	177.4	173.4	0	0	0	0	111.4	E367 D369 M373 M374 E375	E367-V371 WeakPolarHBondContact O-CG2 3.46Å; E367-V371 PolarHBondContact O-N 2.88Å; E367-V371 VanDerWaalsContact O-N 3.15Å; D369-V371 VanDerWaalsContact C-N 3.31Å; D369-V371 PolarHBondContact O-N 2.94Å; V371-M373 VanDerWaalsContact C-N 3.35Å; V371-M373 PolarHBondContact O-N 3.41Å; V371-M374 HydrophobicContact CB-CE 4.32Å; V371-M374 HydrophobicContact CG2-CE 3.9Å; V371-M374 WeakPolarHBondContact O-CB 3.33Å; V371-M374 PolarHBondContact O-N 2.97Å; V371-E375 PolarHBondContact O-N 3.48Å; V371-E375 VanDerWaalsContact O-N 3.1Å
372	K	86.6	Confident	86.7	Confident	118 Å²	118	61.1 Å²	61.1	51%	0.513	32%	0.317	S	S	.	.	H	α-helix	trans	-59.7	-45.1	175.9	-67.3	173	-165.5	157.1	0	111.9	A368 D369 M374 E375 E376	A368-K372 WeakPolarHBondContact O-CG 3.49Å; A368-K372 PolarHBondContact O-N 3.13Å; D369-K372 PolarHBondContact O-N 2.76Å; D369-K372 IonicContact OD1-NZ 2.9Å; D369-K372 PolarHBondContact OD1-NZ 2.9Å; K372-M374 VanDerWaalsContact C-N 3.31Å; K372-M374 PolarHBondContact O-N 3.45Å; K372-E375 PolarHBondContact O-N 3.07Å; K372-E376 WeakPolarHBondContact O-CG 3.33Å; K372-E376 PolarHBondContact O-N 3Å
373	M	86.8	Confident	86.9	Confident	24 Å²	24	65 Å²	65	12%	0.118	33%	0.331	C	S	.	.	H	α-helix	trans	-67.6	-32.1	179.3	-174	60	69.4	0	0	112.1	Y362 D369 V371 E376 V377 V408 E409	Y362-M373 VanDerWaalsContact O-CG 3.3Å; Y362-M373 WeakPolarHBondContact O-CG 3.37Å; D369-M373 WeakPolarHBondContact O-CB 3.5Å; D369-M373 PolarHBondContact O-N 2.92Å; V371-M373 VanDerWaalsContact C-N 3.35Å; V371-M373 PolarHBondContact O-N 3.41Å; M373-E376 PolarHBondContact O-N 2.9Å; M373-V377 HydrophobicContact CG-CG2 4.36Å; M373-V377 WeakPolarHBondContact O-CB 3.32Å; M373-V377 VanDerWaalsContact O-CG2 3.23Å; M373-V377 WeakPolarHBondContact O-CG2 3.22Å; M373-V377 PolarHBondContact O-N 3.02Å; M373-V377 HydrophobicContact SD-CG2 4.33Å; M373-V408 HydrophobicContact SD-CG1 3.75Å; M373-E409 HydrophobicContact CE-CG 3.92Å
374	M	88	Confident	87.1	Confident	65 Å²	65	65.2 Å²	65.2	32%	0.32	33%	0.333	S	S	.	.	H	α-helix	trans	-60.9	-45.6	170.6	-80	-172.7	-66.2	0	0	112	Y362 S370 V371 K372 E376 V377 E378	Y362-M374 HydrophobicContact CD1-CG 3.62Å; Y362-M374 HydrophobicContact CD2-CG 3.81Å; Y362-M374 HydrophobicContact CD2-SD 4.18Å; Y362-M374 HydrophobicContact CE1-CB 4.48Å; Y362-M374 HydrophobicContact CE1-CG 3.42Å; Y362-M374 VanDerWaalsContact CE1-CG 3.42Å; Y362-M374 HydrophobicContact CE1-SD 4.39Å; Y362-M374 HydrophobicContact CE2-CG 3.58Å; Y362-M374 HydrophobicContact CE2-SD 3.61Å; Y362-M374 HydrophobicContact CG-CG 3.81Å; S370-M374 WeakPolarHBondContact O-CG 3.4Å; S370-M374 PolarHBondContact O-N 3.27Å; V371-M374 HydrophobicContact CB-CE 4.32Å; V371-M374 HydrophobicContact CG2-CE 3.9Å; V371-M374 WeakPolarHBondContact O-CB 3.33Å; V371-M374 PolarHBondContact O-N 2.97Å; K372-M374 VanDerWaalsContact C-N 3.31Å; K372-M374 PolarHBondContact O-N 3.45Å; M374-E376 VanDerWaalsContact C-N 3.34Å; M374-E376 PolarHBondContact O-N 2.97Å; M374-V377 PolarHBondContact O-N 3.47Å; M374-E378 WeakPolarHBondContact O-CG 3.28Å; M374-E378 PolarHBondContact O-N 3.4Å
375	E	89.1	Confident	87.4	Confident	126 Å²	126	70.8 Å²	70.8	59%	0.589	36%	0.357	S	S	*	.	H	α-helix	trans	-61.4	-42.9	176.8	-69.1	178.5	170.1	0	0	111.6	V371 K372 E378 K379	V371-E375 PolarHBondContact O-N 3.48Å; V371-E375 VanDerWaalsContact O-N 3.1Å; K372-E375 PolarHBondContact O-N 3.07Å; E375-E378 PolarHBondContact O-N 2.89Å; E375-K379 WeakPolarHBondContact O-CB 3.48Å; E375-K379 PolarHBondContact O-N 3.2Å
376	E	90.9	Very high	88.1	Confident	50 Å²	50	65 Å²	65	23%	0.234	33%	0.326	C	S	.	.	H	α-helix	trans	-68.6	-36.6	178.2	-67.4	-58.1	160.5	0	0	112.4	K372 M373 M374 K379 L380 V412	K372-E376 WeakPolarHBondContact O-CG 3.33Å; K372-E376 PolarHBondContact O-N 3Å; M373-E376 PolarHBondContact O-N 2.9Å; M374-E376 VanDerWaalsContact C-N 3.34Å; M374-E376 PolarHBondContact O-N 2.97Å; E376-K379 WeakPolarHBondContact O-CB 3.39Å; E376-K379 PolarHBondContact O-N 3.36Å; E376-K379 IonicContact OE1-NZ 2.64Å; E376-K379 WeakPolarHBondContact OE2-CD 3.31Å; E376-K379 IonicContact OE2-NZ 3.49Å; E376-K379 PolarHBondContact OE2-NZ 3.03Å; E376-L380 WeakPolarHBondContact O-CG 3.37Å; E376-L380 PolarHBondContact O-N 3.48Å; E376-V412 HydrophobicContact CB-CG1 4.09Å; E376-V412 HydrophobicContact CB-CG2 3.71Å; E376-V412 HydrophobicContact CG-CG1 3.9Å; E376-V412 HydrophobicContact CG-CG2 4.44Å; E376-V412 WeakPolarHBondContact OE2-CG1 3.48Å
377	V	90.9	Very high	88.5	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.012	33%	0.333	C	S	.	.	H	α-helix	trans	-66.3	-38.5	173.7	169	0	0	0	0	112	L353 R354 C357 M373 M374 L380 C381 V408	L353-V377 HydrophobicContact CG-CG1 4.23Å; R354-V377 HydrophobicContact CG-CG1 4.42Å; C357-V377 HydrophobicContact CB-CG1 4.45Å; C357-V377 HydrophobicContact CB-CG2 4.03Å; M373-V377 HydrophobicContact CG-CG2 4.36Å; M373-V377 WeakPolarHBondContact O-CB 3.32Å; M373-V377 VanDerWaalsContact O-CG2 3.23Å; M373-V377 WeakPolarHBondContact O-CG2 3.22Å; M373-V377 PolarHBondContact O-N 3.02Å; M373-V377 HydrophobicContact SD-CG2 4.33Å; M374-V377 PolarHBondContact O-N 3.47Å; V377-L380 PolarHBondContact O-N 3.46Å; V377-C381 PolarHBondContact O-N 3.46Å; V377-C381 PolarHBondContact O-SG 3.25Å; V377-V408 HydrophobicContact CG2-CG1 4.31Å
378	E	92.4	Very high	89	Confident	78 Å²	78	60 Å²	60	36%	0.364	31%	0.307	S	S	.	.	H	α-helix	trans	-66.4	-39.4	173.7	-72.1	-56.2	142.2	0	0	111.7	R354 M374 E375 L380 C381 D382	R354-E378 WeakPolarHBondContact CD-OE1 3.22Å; R354-E378 IonicContact CZ-OE1 3.64Å; R354-E378 IonicContact CZ-OE2 3.39Å; R354-E378 IonicContact NE-OE1 2.72Å; R354-E378 PolarHBondContact NE-OE1 3.45Å; R354-E378 IonicContact NE-OE2 3.24Å; R354-E378 PolarHBondContact NE-OE2 3Å; R354-E378 IonicContact NH2-OE1 2.69Å; R354-E378 IonicContact NH2-OE2 2.89Å; R354-E378 PolarHBondContact NH2-OE2 3.22Å; M374-E378 WeakPolarHBondContact O-CG 3.28Å; M374-E378 PolarHBondContact O-N 3.4Å; E375-E378 PolarHBondContact O-N 2.89Å; E378-L380 VanDerWaalsContact C-N 3.34Å; E378-L380 PolarHBondContact O-N 2.99Å; E378-C381 WeakPolarHBondContact O-CB 3.4Å; E378-C381 PolarHBondContact O-N 2.91Å; E378-C381 VanDerWaalsContact O-N 3.13Å; E378-D382 PolarHBondContact O-N 3.39Å
379	K	91.1	Very high	89.4	Confident	61 Å²	61	57.1 Å²	57.1	27%	0.265	28%	0.283	S	S	.	.	H	α-helix	trans	-60.8	-42.5	173.8	-168.1	-170.7	-150	162.8	0	112.2	E375 E376 D382 R383 V415 N416	E375-K379 WeakPolarHBondContact O-CB 3.48Å; E375-K379 PolarHBondContact O-N 3.2Å; E376-K379 WeakPolarHBondContact O-CB 3.39Å; E376-K379 PolarHBondContact O-N 3.36Å; E376-K379 IonicContact OE1-NZ 2.64Å; E376-K379 WeakPolarHBondContact OE2-CD 3.31Å; E376-K379 IonicContact OE2-NZ 3.49Å; E376-K379 PolarHBondContact OE2-NZ 3.03Å; K379-D382 PolarHBondContact O-N 2.89Å; K379-R383 WeakPolarHBondContact O-CB 3.42Å; K379-R383 WeakPolarHBondContact O-CG 3.38Å; K379-R383 PolarHBondContact O-N 3.37Å; K379-V415 HydrophobicContact CD-CG1 4.48Å; K379-V415 HydrophobicContact CG-CG1 4.35Å; K379-N416 WeakPolarHBondContact CE-OD1 3.24Å; K379-N416 PolarHBondContact NZ-OD1 3.35Å
380	L	91.6	Very high	89.8	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.1	-44.2	172.2	-71	-171.9	0	0	0	111.4	L353 E376 V377 E378 D382 R383 L384 L392 V408 Q411 V412 V415	L353-L380 HydrophobicContact CD2-CB 4.14Å; E376-L380 WeakPolarHBondContact O-CG 3.37Å; E376-L380 PolarHBondContact O-N 3.48Å; V377-L380 PolarHBondContact O-N 3.46Å; E378-L380 VanDerWaalsContact C-N 3.34Å; E378-L380 PolarHBondContact O-N 2.99Å; L380-D382 VanDerWaalsContact C-N 3.25Å; L380-D382 PolarHBondContact O-N 3.39Å; L380-R383 PolarHBondContact O-N 2.84Å; L380-L384 HydrophobicContact CB-CD1 4.05Å; L380-L384 HydrophobicContact CB-CG 4.43Å; L380-L384 HydrophobicContact CD2-CD1 4.13Å; L380-L384 HydrophobicContact CD2-CG 4.31Å; L380-L384 VanDerWaalsContact O-CB 3.26Å; L380-L384 WeakPolarHBondContact O-CB 3.43Å; L380-L384 VanDerWaalsContact O-CG 3.29Å; L380-L384 WeakPolarHBondContact O-CG 3.44Å; L380-L384 PolarHBondContact O-N 3Å; L380-L392 HydrophobicContact CD1-CD2 3.89Å; L380-V408 HydrophobicContact CD1-CG1 4.07Å; L380-Q411 HydrophobicContact CD1-CB 4.21Å; L380-Q411 HydrophobicContact CD2-CB 4.13Å; L380-Q411 HydrophobicContact CD2-CG 4.07Å; L380-V412 HydrophobicContact CD1-CG2 3.84Å; L380-V412 HydrophobicContact CD2-CG2 4.02Å; L380-V412 HydrophobicContact CG-CG2 3.83Å; L380-V415 HydrophobicContact CD2-CB 4.16Å; L380-V415 HydrophobicContact CD2-CG2 3.68Å
381	C	91.2	Very high	90.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-55.4	-45.1	176.1	-74.1	0	0	0	0	110.7	R350 V377 E378	R350-C381 HydrophobicContact CB-CB 4.25Å; R350-C381 HydrophobicContact CG-CB 3.89Å; R350-C381 PolarHBondContact NE-O 2.98Å; R350-C381 PolarHBondContact NH2-O 2.83Å; V377-C381 PolarHBondContact O-N 3.46Å; V377-C381 PolarHBondContact O-SG 3.25Å; E378-C381 WeakPolarHBondContact O-CB 3.4Å; E378-C381 PolarHBondContact O-N 2.91Å; E378-C381 VanDerWaalsContact O-N 3.13Å
382	D	90.3	Very high	90.5	Very high	102 Å²	102	56.4 Å²	56.4	55%	0.545	28%	0.279	S	S	.	.	H	α-helix	trans	-75.3	-34	-176.2	-76.5	-23.6	0	0	0	114.7	R350 E378 K379 L380	R350-D382 IonicContact CZ-OD1 3.72Å; R350-D382 IonicContact NH1-OD1 3.67Å; R350-D382 PolarHBondContact NH1-OD1 2.86Å; R350-D382 PolarHBondContact NH2-O 3.11Å; R350-D382 IonicContact NH2-OD1 3.71Å; E378-D382 PolarHBondContact O-N 3.39Å; K379-D382 PolarHBondContact O-N 2.89Å; L380-D382 VanDerWaalsContact C-N 3.25Å; L380-D382 PolarHBondContact O-N 3.39Å
383	R	91.3	Very high	90.7	Very high	121 Å²	121	50.9 Å²	50.9	46%	0.457	26%	0.255	S	S	.	.	H	α-helix	trans	-94.2	-30.3	-173.5	-68.2	-55.2	-147.6	133.7	0.4	114.7	K379 L380 V415 E422	K379-R383 WeakPolarHBondContact O-CB 3.42Å; K379-R383 WeakPolarHBondContact O-CG 3.38Å; K379-R383 PolarHBondContact O-N 3.37Å; L380-R383 PolarHBondContact O-N 2.84Å; R383-V415 HydrophobicContact CB-CG1 3.82Å; R383-V415 HydrophobicContact CB-CG2 4.41Å; R383-V415 HydrophobicContact CG-CG1 3.91Å; R383-E422 IonicContact CZ-OE2 3.61Å; R383-E422 IonicContact NH1-OE1 3.78Å; R383-E422 PolarHBondContact NH1-OE1 3.41Å; R383-E422 IonicContact NH1-OE2 3.42Å; R383-E422 PolarHBondContact NH1-OE2 2.93Å; R383-E422 IonicContact NH2-OE2 3.07Å; R383-E422 PolarHBondContact NH2-OE2 3.31Å
384	L	91.6	Very high	90.9	Very high	14 Å²	14	55.8 Å²	55.8	7%	0.073	28%	0.277	C	S	.	.			trans	-76.4	136.4	-177.5	-64.2	-179.8	0	0	0	111.6	L380 L389 L392 Q411 V415	L380-L384 HydrophobicContact CB-CD1 4.05Å; L380-L384 HydrophobicContact CB-CG 4.43Å; L380-L384 HydrophobicContact CD2-CD1 4.13Å; L380-L384 HydrophobicContact CD2-CG 4.31Å; L380-L384 VanDerWaalsContact O-CB 3.26Å; L380-L384 WeakPolarHBondContact O-CB 3.43Å; L380-L384 VanDerWaalsContact O-CG 3.29Å; L380-L384 WeakPolarHBondContact O-CG 3.44Å; L380-L384 PolarHBondContact O-N 3Å; L384-L389 HydrophobicContact CB-CD1 4.49Å; L384-L389 HydrophobicContact CB-CD2 3.81Å; L384-L389 HydrophobicContact CB-CG 3.65Å; L384-L389 HydrophobicContact CD1-CD2 3.99Å; L384-L392 HydrophobicContact CD1-CD2 3.99Å; L384-Q411 HydrophobicContact CD1-CG 3.88Å; L384-Q411 HydrophobicContact CD2-CG 4.03Å; L384-V415 HydrophobicContact CD2-CG2 3.79Å; L384-V415 HydrophobicContact CG-CG2 4.44Å
385	E	91.1	Very high	91	Very high	124 Å²	124	56.2 Å²	56.2	58%	0.579	28%	0.28	S	S	*	.			trans	-74.3	167.5	169.4	58.2	172.5	-161.5	0	0	111.9	T387 S388 L389	E385-T387 VanDerWaalsContact C-N 3.31Å; E385-T387 VanDerWaalsContact CD-OG1 3.22Å; E385-T387 WeakPolarHBondContact CG-OG1 3.49Å; E385-T387 PolarHBondContact O-N 3.05Å; E385-T387 PolarHBondContact OE1-OG1 3.39Å; E385-S388 PolarHBondContact O-N 3.24Å; E385-L389 WeakPolarHBondContact O-CG 3.25Å; E385-L389 PolarHBondContact O-N 3.46Å
386	L	90.6	Very high	90.9	Very high	38 Å²	38	50.4 Å²	50.4	20%	0.199	25%	0.253	C	S	.	.	H	α-helix	trans	-53.1	-47.6	-174.4	179.3	57.7	0	0	0	112.7	A345 I346 E349 L389 Q390	A345-L386 HydrophobicContact CB-CD1 3.76Å; A345-L386 HydrophobicContact CB-CD2 3.68Å; A345-L386 HydrophobicContact CB-CG 4.4Å; I346-L386 HydrophobicContact CD1-CB 4.31Å; I346-L386 HydrophobicContact CG1-CB 3.69Å; I346-L386 HydrophobicContact CG1-CD1 3.98Å; I346-L386 HydrophobicContact CG1-CG 4.31Å; E349-L386 HydrophobicContact CG-CD1 3.86Å; L386-L389 PolarHBondContact O-N 3.26Å; L386-Q390 HydrophobicContact CD1-CG 4.24Å; L386-Q390 WeakPolarHBondContact O-CB 3.41Å; L386-Q390 VanDerWaalsContact O-CG 3.26Å; L386-Q390 WeakPolarHBondContact O-CG 3.49Å; L386-Q390 PolarHBondContact O-N 3.28Å
387	T	90.3	Very high	90.8	Very high	80 Å²	80	51.7 Å²	51.7	49%	0.491	27%	0.272	S	S	.	.	H	α-helix	trans	-59.7	-47.5	179.7	33.6	0	0	0	0	111.9	E385 Q390 S391	E385-T387 VanDerWaalsContact C-N 3.31Å; E385-T387 VanDerWaalsContact CD-OG1 3.22Å; E385-T387 WeakPolarHBondContact CG-OG1 3.49Å; E385-T387 PolarHBondContact O-N 3.05Å; E385-T387 PolarHBondContact OE1-OG1 3.39Å; T387-Q390 PolarHBondContact O-N 3.17Å; T387-S391 PolarHBondContact O-N 2.95Å
388	S	91.6	Very high	90.5	Very high	39 Å²	39	56.8 Å²	56.8	27%	0.273	31%	0.308	S	S	.	.	H	α-helix	trans	-68.4	-37.6	178.7	-55.1	0	0	0	0	112.4	E385 L392	E385-S388 PolarHBondContact O-N 3.24Å; S388-L392 WeakPolarHBondContact O-CB 3.42Å; S388-L392 PolarHBondContact O-N 3.44Å
389	L	91.1	Very high	90.3	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-63.9	-41.7	173.3	-75.9	169.5	0	0	0	112.1	I346 E349 R350 L353 L384 E385 L386 N393	I346-L389 HydrophobicContact CG2-CD1 4.15Å; E349-L389 HydrophobicContact CB-CB 3.87Å; E349-L389 HydrophobicContact CB-CD1 4.46Å; R350-L389 HydrophobicContact CG-CD1 3.77Å; L353-L389 HydrophobicContact CD2-CD2 3.97Å; L384-L389 HydrophobicContact CB-CD1 4.49Å; L384-L389 HydrophobicContact CB-CD2 3.81Å; L384-L389 HydrophobicContact CB-CG 3.65Å; L384-L389 HydrophobicContact CD1-CD2 3.99Å; E385-L389 WeakPolarHBondContact O-CG 3.25Å; E385-L389 PolarHBondContact O-N 3.46Å; L386-L389 PolarHBondContact O-N 3.26Å; L389-N393 VanDerWaalsContact O-CB 3.29Å; L389-N393 WeakPolarHBondContact O-CB 3.28Å; L389-N393 VanDerWaalsContact O-CG 3.32Å; L389-N393 PolarHBondContact O-N 3.34Å; L389-N393 PolarHBondContact O-ND2 3.34Å
390	Q	91.3	Very high	90.1	Very high	74 Å²	74	53.5 Å²	53.5	35%	0.346	30%	0.303	S	S	.	.	H	α-helix	trans	-62.2	-49.9	176.5	-75.1	173.8	-36.3	0	0	111.1	E349 L386 T387 L392 N393 E394	E349-Q390 HydrophobicContact CG-CG 3.72Å; L386-Q390 HydrophobicContact CD1-CG 4.24Å; L386-Q390 WeakPolarHBondContact O-CB 3.41Å; L386-Q390 VanDerWaalsContact O-CG 3.26Å; L386-Q390 WeakPolarHBondContact O-CG 3.49Å; L386-Q390 PolarHBondContact O-N 3.28Å; T387-Q390 PolarHBondContact O-N 3.17Å; Q390-L392 PolarHBondContact O-N 3.2Å; Q390-N393 PolarHBondContact O-N 2.79Å; Q390-E394 WeakPolarHBondContact O-CG 3.44Å; Q390-E394 PolarHBondContact O-N 3.16Å
391	S	91.1	Very high	89.8	Confident	64 Å²	64	56.8 Å²	56.8	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-57.6	-47.7	178.3	-178	0	0	0	0	111.8	T387 N393 E394 I395	T387-S391 PolarHBondContact O-N 2.95Å; S391-N393 PolarHBondContact O-N 3.06Å; S391-E394 PolarHBondContact O-N 3.03Å; S391-I395 WeakPolarHBondContact O-CG1 3.48Å; S391-I395 PolarHBondContact O-N 2.81Å
392	L	91.1	Very high	89.5	Confident	4 Å²	4	63 Å²	63	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-61.7	-44.7	176.9	-177.8	61.8	0	0	0	111.7	L353 L380 L384 S388 Q390 E394 I395 L396 A407 V408 Q411	L353-L392 HydrophobicContact CD1-CD2 3.77Å; L353-L392 HydrophobicContact CD1-CG 4.19Å; L353-L392 HydrophobicContact CD2-CD2 4.07Å; L380-L392 HydrophobicContact CD1-CD2 3.89Å; L384-L392 HydrophobicContact CD1-CD2 3.99Å; S388-L392 WeakPolarHBondContact O-CB 3.42Å; S388-L392 PolarHBondContact O-N 3.44Å; Q390-L392 PolarHBondContact O-N 3.2Å; L392-E394 VanDerWaalsContact C-N 3.3Å; L392-E394 PolarHBondContact O-N 3.25Å; L392-I395 PolarHBondContact O-N 3.39Å; L392-L396 HydrophobicContact CD1-CD1 4.46Å; L392-L396 HydrophobicContact CD1-CG 4.44Å; L392-L396 HydrophobicContact CG-CD1 4.1Å; L392-L396 HydrophobicContact CG-CG 4.49Å; L392-L396 WeakPolarHBondContact O-CB 3.4Å; L392-L396 WeakPolarHBondContact O-CG 3.39Å; L392-L396 PolarHBondContact O-N 2.97Å; L392-A407 HydrophobicContact CD1-CB 4.29Å; L392-V408 HydrophobicContact CD1-CG2 4.45Å; L392-Q411 HydrophobicContact CD1-CB 4.48Å; L392-Q411 HydrophobicContact CD2-CB 4.41Å; L392-Q411 HydrophobicContact CD2-CG 4.37Å
393	N	91.1	Very high	89.3	Confident	1 Å²	1	63 Å²	63	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-66	-29.3	177.9	-81.5	-32	0	0	0	113.9	E349 K352 L353 L389 Q390 S391 A397	E349-N393 PolarHBondContact O-ND2 3.03Å; E349-N393 PolarHBondContact OE2-ND2 3.48Å; K352-N393 HydrophobicContact CD-CB 3.91Å; K352-N393 HydrophobicContact CG-CB 4.35Å; L353-N393 WeakPolarHBondContact CA-OD1 3.43Å; L353-N393 WeakPolarHBondContact CB-OD1 3.46Å; L353-N393 PolarHBondContact N-OD1 3.14Å; L353-N393 VanDerWaalsContact N-OD1 3.12Å; L389-N393 VanDerWaalsContact O-CB 3.29Å; L389-N393 WeakPolarHBondContact O-CB 3.28Å; L389-N393 VanDerWaalsContact O-CG 3.32Å; L389-N393 PolarHBondContact O-N 3.34Å; L389-N393 PolarHBondContact O-ND2 3.34Å; Q390-N393 PolarHBondContact O-N 2.79Å; S391-N393 PolarHBondContact O-N 3.06Å; N393-A397 WeakPolarHBondContact O-CB 3.36Å; N393-A397 PolarHBondContact O-N 3.43Å
394	E	91.7	Very high	89.2	Confident	128 Å²	128	57.2 Å²	57.2	60%	0.598	32%	0.324	S	S	*	.	H	α-helix	trans	-70.5	-45.2	174.1	-78	176.4	-175	0	0	111.1	Q390 S391 L392 L396 A397 S398	Q390-E394 WeakPolarHBondContact O-CG 3.44Å; Q390-E394 PolarHBondContact O-N 3.16Å; S391-E394 PolarHBondContact O-N 3.03Å; L392-E394 VanDerWaalsContact C-N 3.3Å; L392-E394 PolarHBondContact O-N 3.25Å; E394-L396 VanDerWaalsContact C-N 3.34Å; E394-L396 PolarHBondContact O-N 2.95Å; E394-A397 PolarHBondContact O-N 3.4Å; E394-A397 VanDerWaalsContact O-N 3.15Å; E394-S398 PolarHBondContact O-N 2.93Å; E394-S398 PolarHBondContact O-OG 2.93Å
395	I	89	Confident	89	Confident	73 Å²	73	60 Å²	60	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-57	-51	173.8	-65.7	165	0	0	0	109.5	S391 L392 A397 S398 A399 A407	S391-I395 WeakPolarHBondContact O-CG1 3.48Å; S391-I395 PolarHBondContact O-N 2.81Å; L392-I395 PolarHBondContact O-N 3.39Å; I395-A397 PolarHBondContact O-N 3.45Å; I395-A397 VanDerWaalsContact O-N 3.15Å; I395-S398 PolarHBondContact O-N 3.31Å; I395-S398 VanDerWaalsContact O-N 3.09Å; I395-S398 PolarHBondContact O-OG 3.35Å; I395-A399 HydrophobicContact CG2-CB 4.45Å; I395-A399 WeakPolarHBondContact O-CB 3.29Å; I395-A399 PolarHBondContact O-N 2.78Å; I395-A407 HydrophobicContact CG2-CB 3.74Å
396	L	88.4	Confident	88.9	Confident	4 Å²	4	56.6 Å²	56.6	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-22.1	179	-70.9	177	0	0	0	114.9	L353 T356 F363 L392 E394 S404 V408	L353-L396 HydrophobicContact CD1-CD1 3.32Å; T356-L396 HydrophobicContact CG2-CB 4Å; F363-L396 HydrophobicContact CZ-CD2 4.43Å; L392-L396 HydrophobicContact CD1-CD1 4.46Å; L392-L396 HydrophobicContact CD1-CG 4.44Å; L392-L396 HydrophobicContact CG-CD1 4.1Å; L392-L396 HydrophobicContact CG-CG 4.49Å; L392-L396 WeakPolarHBondContact O-CB 3.4Å; L392-L396 WeakPolarHBondContact O-CG 3.39Å; L392-L396 PolarHBondContact O-N 2.97Å; E394-L396 VanDerWaalsContact C-N 3.34Å; E394-L396 PolarHBondContact O-N 2.95Å; L396-S404 VanDerWaalsContact CD2-CB 3.43Å; L396-V408 HydrophobicContact CD1-CG2 4.19Å; L396-V408 HydrophobicContact CD2-CG2 3.93Å
397	A	87.7	Confident	88.9	Confident	78 Å²	78	55.7 Å²	55.7	65%	0.645	33%	0.326	S	S	*	.	H	α-helix	trans	-82.7	-21.5	178.2	0	0	0	0	0	113.1	N393 E394 I395	N393-A397 WeakPolarHBondContact O-CB 3.36Å; N393-A397 PolarHBondContact O-N 3.43Å; E394-A397 PolarHBondContact O-N 3.4Å; E394-A397 VanDerWaalsContact O-N 3.15Å; I395-A397 PolarHBondContact O-N 3.45Å; I395-A397 VanDerWaalsContact O-N 3.15Å
398	S	86.1	Confident	88.8	Confident	108 Å²	108	51.9 Å²	51.9	76%	0.755	30%	0.303	S	S	*	.	H	α-helix	trans	-113.6	-14.1	-172.4	65.7	0	0	0	0	114.3	E394 I395	E394-S398 PolarHBondContact O-N 2.93Å; E394-S398 PolarHBondContact O-OG 2.93Å; I395-S398 PolarHBondContact O-N 3.31Å; I395-S398 VanDerWaalsContact O-N 3.09Å; I395-S398 PolarHBondContact O-OG 3.35Å
399	A	86.8	Confident	88.8	Confident	25 Å²	25	53.7 Å²	53.7	21%	0.207	31%	0.307	C	S	.	.	S	Bend	trans	-93.6	161.5	-172.4	0	0	0	0	0	113.3	I395 D403	I395-A399 HydrophobicContact CG2-CB 4.45Å; I395-A399 WeakPolarHBondContact O-CB 3.29Å; I395-A399 PolarHBondContact O-N 2.78Å; A399-D403 HydrophobicContact CB-CB 3.81Å
400	S	87.8	Confident	88.8	Confident	45 Å²	45	59.5 Å²	59.5	32%	0.315	33%	0.332	S	S	.	.			trans	-69.9	175.7	171.2	71.2	0	0	0	0	112	E402 D403 S404	S400-E402 VanDerWaalsContact C-N 3.28Å; S400-E402 PolarHBondContact O-N 2.79Å; S400-D403 WeakPolarHBondContact OG-CB 3.5Å; S400-D403 PolarHBondContact OG-N 3.34Å; S400-D403 PolarHBondContact OG-OD2 3.3Å; S400-S404 WeakPolarHBondContact O-CB 3.48Å; S400-S404 PolarHBondContact O-N 2.93Å; S400-S404 PolarHBondContact O-OG 3.5Å
401	K	85.1	Confident	88.8	Confident	70 Å²	70	57.8 Å²	57.8	30%	0.304	33%	0.325	S	S	.	.	H	α-helix	trans	-58.8	-46.3	177.3	-168.1	166.3	-179.1	-166.6	0	110.7	W360 F363 K405	W360-K401 HydrophobicContact CD2-CB 4.46Å; W360-K401 HydrophobicContact CD2-CG 4.14Å; W360-K401 HydrophobicContact CE3-CB 3.44Å; W360-K401 VanDerWaalsContact CE3-CB 3.44Å; W360-K401 HydrophobicContact CE3-CD 3.64Å; W360-K401 HydrophobicContact CE3-CG 3.24Å; W360-K401 VanDerWaalsContact CH2-CA 3.41Å; W360-K401 HydrophobicContact CH2-CB 3.84Å; W360-K401 HydrophobicContact CZ3-CB 3.11Å; W360-K401 HydrophobicContact CZ3-CD 4.02Å; W360-K401 HydrophobicContact CZ3-CG 3.54Å; F363-K401 HydrophobicContact CD1-CG 4.05Å; F363-K401 HydrophobicContact CE1-CG 4.42Å; K401-K405 WeakPolarHBondContact O-CB 3.42Å; K401-K405 PolarHBondContact O-N 2.93Å
402	E	85.6	Confident	88.8	Confident	131 Å²	131	55.4 Å²	55.4	61%	0.612	31%	0.307	S	S	*	.	H	α-helix	trans	-70.4	-43.2	-174.1	-65.6	70.7	-153.1	0	0	110.4	S400 K405 A406	S400-E402 VanDerWaalsContact C-N 3.28Å; S400-E402 PolarHBondContact O-N 2.79Å; E402-K405 WeakPolarHBondContact O-CB 3.48Å; E402-K405 PolarHBondContact O-N 3.03Å; E402-A406 PolarHBondContact O-N 3.35Å
403	D	85.8	Confident	88.8	Confident	100 Å²	100	61.6 Å²	61.6	54%	0.535	34%	0.336	S	S	.	.	H	α-helix	trans	-68.5	-37.9	176.6	-63.4	-38.1	0	0	0	111.8	A399 S400 A406 A407	A399-D403 HydrophobicContact CB-CB 3.81Å; S400-D403 WeakPolarHBondContact OG-CB 3.5Å; S400-D403 PolarHBondContact OG-N 3.34Å; S400-D403 PolarHBondContact OG-OD2 3.3Å; D403-A406 PolarHBondContact O-N 2.68Å; D403-A407 WeakPolarHBondContact O-CB 3.45Å; D403-A407 PolarHBondContact O-N 2.63Å
404	S	87.6	Confident	88.8	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-64.4	-41.2	175	-69.4	0	0	0	0	112	L396 S400 A407 V408	L396-S404 VanDerWaalsContact CD2-CB 3.43Å; S400-S404 WeakPolarHBondContact O-CB 3.48Å; S400-S404 PolarHBondContact O-N 2.93Å; S400-S404 PolarHBondContact O-OG 3.5Å; S404-A407 PolarHBondContact O-N 3.43Å; S404-V408 WeakPolarHBondContact O-CG2 3.21Å; S404-V408 PolarHBondContact O-N 3.21Å; S404-V408 VanDerWaalsContact O-N 3.11Å
405	K	87.9	Confident	88.8	Confident	74 Å²	74	59.8 Å²	59.8	32%	0.322	33%	0.328	S	S	.	.	H	α-helix	trans	-60.7	-50	174	-177.4	-178.1	-177	158.2	0	110.7	F363 K401 E402 A407 V408 E409	F363-K405 HydrophobicContact CB-CB 3.98Å; F363-K405 HydrophobicContact CB-CD 3.82Å; F363-K405 HydrophobicContact CB-CG 3.69Å; F363-K405 HydrophobicContact CD1-CB 3.76Å; F363-K405 HydrophobicContact CD1-CG 4.43Å; F363-K405 HydrophobicContact CD2-CB 4.49Å; F363-K405 HydrophobicContact CE1-CB 4.36Å; F363-K405 HydrophobicContact CG-CB 3.84Å; F363-K405 HydrophobicContact CG-CG 4.04Å; F363-K405 PolarHBondContact O-NZ 2.99Å; K401-K405 WeakPolarHBondContact O-CB 3.42Å; K401-K405 PolarHBondContact O-N 2.93Å; E402-K405 WeakPolarHBondContact O-CB 3.48Å; E402-K405 PolarHBondContact O-N 3.03Å; K405-A407 VanDerWaalsContact C-N 3.3Å; K405-A407 PolarHBondContact O-N 3.06Å; K405-V408 PolarHBondContact O-N 2.8Å; K405-E409 WeakPolarHBondContact CE-OE1 3.27Å; K405-E409 HydrophobicContact CG-CG 4.44Å; K405-E409 WeakPolarHBondContact O-CG 3.29Å; K405-E409 PolarHBondContact O-N 2.89Å
406	A	89.1	Confident	88.9	Confident	52 Å²	52	58.8 Å²	58.8	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-61	-37.9	179.2	0	0	0	0	0	112.4	E402 D403 K410	E402-A406 PolarHBondContact O-N 3.35Å; D403-A406 PolarHBondContact O-N 2.68Å; A406-K410 WeakPolarHBondContact O-CB 3.5Å; A406-K410 PolarHBondContact O-N 3.16Å
407	A	89.9	Confident	89	Confident	18 Å²	18	61 Å²	61	15%	0.149	34%	0.343	C	S	.	.	H	α-helix	trans	-65.5	-40.9	176.4	0	0	0	0	0	112.7	L392 I395 D403 S404 K405 Q411	L392-A407 HydrophobicContact CD1-CB 4.29Å; I395-A407 HydrophobicContact CG2-CB 3.74Å; D403-A407 WeakPolarHBondContact O-CB 3.45Å; D403-A407 PolarHBondContact O-N 2.63Å; S404-A407 PolarHBondContact O-N 3.43Å; K405-A407 VanDerWaalsContact C-N 3.3Å; K405-A407 PolarHBondContact O-N 3.06Å; A407-Q411 PolarHBondContact O-N 2.94Å; A407-Q411 VanDerWaalsContact O-N 3.1Å
408	V	90.3	Very high	88.9	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-68.4	-47.4	176.2	171.4	0	0	0	0	110.9	F363 M373 V377 L380 L392 L396 S404 K405 K410 Q411 V412	F363-V408 HydrophobicContact CE2-CG2 4.26Å; M373-V408 HydrophobicContact SD-CG1 3.75Å; V377-V408 HydrophobicContact CG2-CG1 4.31Å; L380-V408 HydrophobicContact CD1-CG1 4.07Å; L392-V408 HydrophobicContact CD1-CG2 4.45Å; L396-V408 HydrophobicContact CD1-CG2 4.19Å; L396-V408 HydrophobicContact CD2-CG2 3.93Å; S404-V408 WeakPolarHBondContact O-CG2 3.21Å; S404-V408 PolarHBondContact O-N 3.21Å; S404-V408 VanDerWaalsContact O-N 3.11Å; K405-V408 PolarHBondContact O-N 2.8Å; V408-K410 VanDerWaalsContact C-N 3.34Å; V408-K410 PolarHBondContact O-N 3.41Å; V408-Q411 PolarHBondContact O-N 2.85Å; V408-Q411 VanDerWaalsContact O-N 3.14Å; V408-V412 HydrophobicContact CG1-CG2 4.31Å; V408-V412 WeakPolarHBondContact O-CB 3.23Å; V408-V412 VanDerWaalsContact O-CG2 3.25Å; V408-V412 WeakPolarHBondContact O-CG2 3.37Å; V408-V412 PolarHBondContact O-N 3.34Å
409	E	89.8	Confident	89	Confident	77 Å²	77	59.4 Å²	59.4	36%	0.36	31%	0.311	S	S	.	.	H	α-helix	trans	-60.5	-43	178.8	-73.3	174.2	166.9	0	0	111.6	M373 K405 Q411 V412 E413	M373-E409 HydrophobicContact CE-CG 3.92Å; K405-E409 WeakPolarHBondContact CE-OE1 3.27Å; K405-E409 HydrophobicContact CG-CG 4.44Å; K405-E409 WeakPolarHBondContact O-CG 3.29Å; K405-E409 PolarHBondContact O-N 2.89Å; E409-Q411 VanDerWaalsContact C-N 3.35Å; E409-Q411 PolarHBondContact O-N 2.96Å; E409-V412 WeakPolarHBondContact O-CB 3.06Å; E409-V412 PolarHBondContact O-N 3.19Å; E409-E413 WeakPolarHBondContact O-CG 3.31Å; E409-E413 PolarHBondContact O-N 3.23Å
410	K	91.6	Very high	89	Confident	123 Å²	123	62.9 Å²	62.9	54%	0.535	32%	0.322	S	S	.	.	H	α-helix	trans	-58.7	-45.7	173.3	-175	-172.2	177.7	-159.1	0	111.8	A406 V408 V412 E413 E414	A406-K410 WeakPolarHBondContact O-CB 3.5Å; A406-K410 PolarHBondContact O-N 3.16Å; V408-K410 VanDerWaalsContact C-N 3.34Å; V408-K410 PolarHBondContact O-N 3.41Å; K410-V412 VanDerWaalsContact C-N 3.29Å; K410-V412 PolarHBondContact O-N 2.97Å; K410-E413 PolarHBondContact O-N 2.94Å; K410-E414 VanDerWaalsContact CE-OE1 3.23Å; K410-E414 WeakPolarHBondContact CE-OE1 3.15Å; K410-E414 IonicContact NZ-OE1 3.44Å; K410-E414 WeakPolarHBondContact O-CG 3.14Å; K410-E414 PolarHBondContact O-N 3.03Å
411	Q	92.1	Very high	89	Confident	39 Å²	39	68 Å²	68	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-68.3	-33	-179.3	-152.2	58.8	39.5	0	0	112.2	L380 L384 L392 A407 V408 E409 E414 V415	L380-Q411 HydrophobicContact CD1-CB 4.21Å; L380-Q411 HydrophobicContact CD2-CB 4.13Å; L380-Q411 HydrophobicContact CD2-CG 4.07Å; L384-Q411 HydrophobicContact CD1-CG 3.88Å; L384-Q411 HydrophobicContact CD2-CG 4.03Å; L392-Q411 HydrophobicContact CD1-CB 4.48Å; L392-Q411 HydrophobicContact CD2-CB 4.41Å; L392-Q411 HydrophobicContact CD2-CG 4.37Å; A407-Q411 PolarHBondContact O-N 2.94Å; A407-Q411 VanDerWaalsContact O-N 3.1Å; V408-Q411 PolarHBondContact O-N 2.85Å; V408-Q411 VanDerWaalsContact O-N 3.14Å; E409-Q411 VanDerWaalsContact C-N 3.35Å; E409-Q411 PolarHBondContact O-N 2.96Å; Q411-E414 PolarHBondContact NE2-OE2 2.93Å; Q411-E414 PolarHBondContact O-N 3.12Å; Q411-E414 PolarHBondContact OE1-OE2 3.17Å; Q411-V415 WeakPolarHBondContact O-CB 3.1Å; Q411-V415 WeakPolarHBondContact O-CG2 3.34Å; Q411-V415 PolarHBondContact O-N 3.06Å
412	V	91.5	Very high	89.2	Confident	14 Å²	14	68.4 Å²	68.4	9%	0.085	34%	0.342	C	S	.	.	H	α-helix	trans	-64	-46.4	172.8	165.4	0	0	0	0	110.7	E376 L380 V408 E409 K410 E414 V415 N416	E376-V412 HydrophobicContact CB-CG1 4.09Å; E376-V412 HydrophobicContact CB-CG2 3.71Å; E376-V412 HydrophobicContact CG-CG1 3.9Å; E376-V412 HydrophobicContact CG-CG2 4.44Å; E376-V412 WeakPolarHBondContact OE2-CG1 3.48Å; L380-V412 HydrophobicContact CD1-CG2 3.84Å; L380-V412 HydrophobicContact CD2-CG2 4.02Å; L380-V412 HydrophobicContact CG-CG2 3.83Å; V408-V412 HydrophobicContact CG1-CG2 4.31Å; V408-V412 WeakPolarHBondContact O-CB 3.23Å; V408-V412 VanDerWaalsContact O-CG2 3.25Å; V408-V412 WeakPolarHBondContact O-CG2 3.37Å; V408-V412 PolarHBondContact O-N 3.34Å; E409-V412 WeakPolarHBondContact O-CB 3.06Å; E409-V412 PolarHBondContact O-N 3.19Å; K410-V412 VanDerWaalsContact C-N 3.29Å; K410-V412 PolarHBondContact O-N 2.97Å; V412-E414 VanDerWaalsContact C-N 3.35Å; V412-E414 PolarHBondContact O-N 3.05Å; V412-V415 PolarHBondContact O-N 3.2Å; V412-N416 WeakPolarHBondContact CG1-ND2 3.45Å; V412-N416 VanDerWaalsContact O-CB 3.27Å; V412-N416 WeakPolarHBondContact O-CB 3.43Å; V412-N416 PolarHBondContact O-N 3.48Å; V412-N416 PolarHBondContact O-ND2 3.43Å
413	E	89.8	Confident	89.2	Confident	134 Å²	134	67.1 Å²	67.1	63%	0.626	33%	0.334	S	S	*	.	H	α-helix	trans	-59.9	-43.9	175.6	-74.2	178	-179.8	0	0	111.9	E409 K410 N416 A417	E409-E413 WeakPolarHBondContact O-CG 3.31Å; E409-E413 PolarHBondContact O-N 3.23Å; K410-E413 PolarHBondContact O-N 2.94Å; E413-N416 PolarHBondContact O-N 3.27Å; E413-A417 WeakPolarHBondContact O-CB 3.41Å; E413-A417 PolarHBondContact O-N 3.42Å
414	E	91.1	Very high	89.2	Confident	84 Å²	84	65.8 Å²	65.8	39%	0.393	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-46.7	176.4	-73.9	178.7	-172	0	0	111.9	K410 Q411 V412 N416 A417 Q418	K410-E414 VanDerWaalsContact CE-OE1 3.23Å; K410-E414 WeakPolarHBondContact CE-OE1 3.15Å; K410-E414 IonicContact NZ-OE1 3.44Å; K410-E414 WeakPolarHBondContact O-CG 3.14Å; K410-E414 PolarHBondContact O-N 3.03Å; Q411-E414 PolarHBondContact NE2-OE2 2.93Å; Q411-E414 PolarHBondContact O-N 3.12Å; Q411-E414 PolarHBondContact OE1-OE2 3.17Å; V412-E414 VanDerWaalsContact C-N 3.35Å; V412-E414 PolarHBondContact O-N 3.05Å; E414-N416 VanDerWaalsContact C-N 3.31Å; E414-N416 PolarHBondContact O-N 3.11Å; E414-A417 PolarHBondContact O-N 3.33Å; E414-Q418 WeakPolarHBondContact O-CB 3.24Å; E414-Q418 PolarHBondContact O-N 2.86Å
415	V	92.6	Very high	89	Confident	6 Å²	6	68.4 Å²	68.4	4%	0.036	35%	0.349	C	S	.	.	H	α-helix	trans	-63.6	-37.4	176.3	167.4	0	0	0	0	111.3	K379 L380 R383 L384 Q411 V412 Q418 L419	K379-V415 HydrophobicContact CD-CG1 4.48Å; K379-V415 HydrophobicContact CG-CG1 4.35Å; L380-V415 HydrophobicContact CD2-CB 4.16Å; L380-V415 HydrophobicContact CD2-CG2 3.68Å; R383-V415 HydrophobicContact CB-CG1 3.82Å; R383-V415 HydrophobicContact CB-CG2 4.41Å; R383-V415 HydrophobicContact CG-CG1 3.91Å; L384-V415 HydrophobicContact CD2-CG2 3.79Å; L384-V415 HydrophobicContact CG-CG2 4.44Å; Q411-V415 WeakPolarHBondContact O-CB 3.1Å; Q411-V415 WeakPolarHBondContact O-CG2 3.34Å; Q411-V415 PolarHBondContact O-N 3.06Å; V412-V415 PolarHBondContact O-N 3.2Å; V415-Q418 PolarHBondContact O-N 3.32Å; V415-L419 WeakPolarHBondContact O-CB 3.33Å; V415-L419 PolarHBondContact O-N 3.48Å
416	N	89.6	Confident	88.9	Confident	53 Å²	53	71.6 Å²	71.6	28%	0.283	37%	0.365	S	S	.	.	H	α-helix	trans	-67.7	-42.7	176.4	-74.3	-24.4	0	0	0	112.2	K379 V412 E413 E414 Q418 L419 Q420	K379-N416 WeakPolarHBondContact CE-OD1 3.24Å; K379-N416 PolarHBondContact NZ-OD1 3.35Å; V412-N416 WeakPolarHBondContact CG1-ND2 3.45Å; V412-N416 VanDerWaalsContact O-CB 3.27Å; V412-N416 WeakPolarHBondContact O-CB 3.43Å; V412-N416 PolarHBondContact O-N 3.48Å; V412-N416 PolarHBondContact O-ND2 3.43Å; E413-N416 PolarHBondContact O-N 3.27Å; E414-N416 VanDerWaalsContact C-N 3.31Å; E414-N416 PolarHBondContact O-N 3.11Å; N416-Q418 VanDerWaalsContact C-N 3.3Å; N416-Q418 PolarHBondContact O-N 2.83Å; N416-L419 PolarHBondContact O-N 3.27Å; N416-Q420 WeakPolarHBondContact O-CB 3.25Å; N416-Q420 PolarHBondContact O-N 2.95Å
417	A	90.4	Very high	88.5	Confident	51 Å²	51	72.7 Å²	72.7	42%	0.421	37%	0.366	S	S	.	.	H	α-helix	trans	-63.7	-38.2	174.3	0	0	0	0	0	111.4	E413 E414 Q420 K421	E413-A417 WeakPolarHBondContact O-CB 3.41Å; E413-A417 PolarHBondContact O-N 3.42Å; E414-A417 PolarHBondContact O-N 3.33Å; A417-Q420 PolarHBondContact O-N 3.08Å; A417-K421 WeakPolarHBondContact O-CG 3.47Å; A417-K421 PolarHBondContact O-N 3.01Å
418	Q	87.5	Confident	88.3	Confident	115 Å²	115	78 Å²	78	54%	0.537	39%	0.388	S	S	.	.	H	α-helix	trans	-66.8	-44.6	175.2	-172.2	170.1	10.6	0	0	111.8	E414 V415 N416 Q420 K421 E422	E414-Q418 WeakPolarHBondContact O-CB 3.24Å; E414-Q418 PolarHBondContact O-N 2.86Å; V415-Q418 PolarHBondContact O-N 3.32Å; N416-Q418 VanDerWaalsContact C-N 3.3Å; N416-Q418 PolarHBondContact O-N 2.83Å; Q418-Q420 VanDerWaalsContact C-N 3.3Å; Q418-Q420 PolarHBondContact O-N 3.25Å; Q418-K421 PolarHBondContact O-N 2.89Å; Q418-E422 WeakPolarHBondContact O-CG 3.47Å; Q418-E422 PolarHBondContact O-N 3.43Å
419	L	87.6	Confident	87.7	Confident	37 Å²	37	81 Å²	81	19%	0.194	41%	0.412	C	S	.	.	H	α-helix	trans	-61	-39.8	175.7	-178.3	69.2	0	0	0	111.9	V415 N416 E422 K423	V415-L419 WeakPolarHBondContact O-CB 3.33Å; V415-L419 PolarHBondContact O-N 3.48Å; N416-L419 PolarHBondContact O-N 3.27Å; L419-E422 PolarHBondContact O-N 3.22Å; L419-K423 WeakPolarHBondContact O-CG 3.42Å; L419-K423 PolarHBondContact O-N 2.66Å
420	Q	86	Confident	87.1	Confident	97 Å²	97	84.8 Å²	84.8	45%	0.453	42%	0.423	S	S	.	.	H	α-helix	trans	-65.8	-42.3	176.7	-169.3	58.2	38.3	0	0	110.9	N416 A417 Q418 E422 K423 D424	N416-Q420 WeakPolarHBondContact O-CB 3.25Å; N416-Q420 PolarHBondContact O-N 2.95Å; A417-Q420 PolarHBondContact O-N 3.08Å; Q418-Q420 VanDerWaalsContact C-N 3.3Å; Q418-Q420 PolarHBondContact O-N 3.25Å; Q420-E422 PolarHBondContact O-N 3.14Å; Q420-K423 PolarHBondContact O-N 3.42Å; Q420-D424 PolarHBondContact NE2-OD1 2.84Å; Q420-D424 WeakPolarHBondContact O-CB 3.46Å; Q420-D424 PolarHBondContact O-N 3.01Å
421	K	88.4	Confident	86.3	Confident	153 Å²	153	84 Å²	84	67%	0.665	42%	0.421	S	S	*	.	H	α-helix	trans	-62.3	-40.6	173.1	-75.1	176.2	-179	176.8	0	113	A417 Q418 D424 A425	A417-K421 WeakPolarHBondContact O-CG 3.47Å; A417-K421 PolarHBondContact O-N 3.01Å; Q418-K421 PolarHBondContact O-N 2.89Å; K421-D424 PolarHBondContact O-N 3.21Å; K421-A425 WeakPolarHBondContact O-CB 3.4Å; K421-A425 PolarHBondContact O-N 2.64Å
422	E	88.3	Confident	85.5	Confident	78 Å²	78	84.9 Å²	84.9	36%	0.364	44%	0.436	S	S	.	.	H	α-helix	trans	-60.7	-46.6	174.7	-75.7	176.1	-177.5	0	0	110.9	R383 Q418 L419 Q420 A425 E426	R383-E422 IonicContact CZ-OE2 3.61Å; R383-E422 IonicContact NH1-OE1 3.78Å; R383-E422 PolarHBondContact NH1-OE1 3.41Å; R383-E422 IonicContact NH1-OE2 3.42Å; R383-E422 PolarHBondContact NH1-OE2 2.93Å; R383-E422 IonicContact NH2-OE2 3.07Å; R383-E422 PolarHBondContact NH2-OE2 3.31Å; Q418-E422 WeakPolarHBondContact O-CG 3.47Å; Q418-E422 PolarHBondContact O-N 3.43Å; L419-E422 PolarHBondContact O-N 3.22Å; Q420-E422 PolarHBondContact O-N 3.14Å; E422-A425 PolarHBondContact O-N 2.92Å; E422-E426 WeakPolarHBondContact O-CB 3.16Å; E422-E426 PolarHBondContact O-N 2.84Å
423	K	86.4	Confident	84.3	Confident	104 Å²	104	86.9 Å²	86.9	45%	0.452	45%	0.453	S	S	.	.	H	α-helix	trans	-63.3	-44.1	176.5	-73.6	175.6	179.2	178	0	112.1	L419 Q420 A425 E426 V427	L419-K423 WeakPolarHBondContact O-CG 3.42Å; L419-K423 PolarHBondContact O-N 2.66Å; Q420-K423 PolarHBondContact O-N 3.42Å; K423-A425 VanDerWaalsContact C-N 3.33Å; K423-E426 PolarHBondContact O-N 2.98Å; K423-V427 WeakPolarHBondContact O-CB 3.25Å; K423-V427 VanDerWaalsContact O-CG2 3.25Å; K423-V427 WeakPolarHBondContact O-CG2 2.95Å; K423-V427 PolarHBondContact O-N 3.48Å
424	D	85.8	Confident	83.3	Confident	73 Å²	73	87 Å²	87	39%	0.39	45%	0.448	S	S	.	.	H	α-helix	trans	-66.1	-38.6	178.7	-65.2	-18.4	0	0	0	110.7	Q420 K421 V427 Q428	Q420-D424 PolarHBondContact NE2-OD1 2.84Å; Q420-D424 WeakPolarHBondContact O-CB 3.46Å; Q420-D424 PolarHBondContact O-N 3.01Å; K421-D424 PolarHBondContact O-N 3.21Å; D424-V427 PolarHBondContact O-N 3.4Å; D424-Q428 VanDerWaalsContact O-CB 3.3Å; D424-Q428 WeakPolarHBondContact O-CB 3.5Å; D424-Q428 VanDerWaalsContact O-CG 3.23Å; D424-Q428 WeakPolarHBondContact O-CG 3.48Å; D424-Q428 PolarHBondContact O-N 2.86Å
425	A	84.4	Confident	81.9	Confident	54 Å²	54	86.5 Å²	86.5	45%	0.446	45%	0.454	S	S	.	.	H	α-helix	trans	-68.6	-37.9	175	0	0	0	0	0	112.5	K421 E422 K423 Q428 A429	K421-A425 WeakPolarHBondContact O-CB 3.4Å; K421-A425 PolarHBondContact O-N 2.64Å; E422-A425 PolarHBondContact O-N 2.92Å; K423-A425 VanDerWaalsContact C-N 3.33Å; A425-Q428 PolarHBondContact O-N 3.07Å; A425-A429 WeakPolarHBondContact O-CB 3.17Å; A425-A429 PolarHBondContact O-N 3.23Å
426	E	84.4	Confident	80.3	Confident	142 Å²	142	88.7 Å²	88.7	66%	0.664	47%	0.473	S	S	*	.	H	α-helix	trans	-66.7	-42.9	174.2	-173.8	176.6	-168.4	0	0	111.2	E422 K423 A429 W430	E422-E426 WeakPolarHBondContact O-CB 3.16Å; E422-E426 PolarHBondContact O-N 2.84Å; K423-E426 PolarHBondContact O-N 2.98Å; E426-A429 PolarHBondContact O-N 3.25Å; E426-W430 VanDerWaalsContact O-CB 3.23Å; E426-W430 WeakPolarHBondContact O-CB 3.35Å; E426-W430 PolarHBondContact O-N 3.14Å
427	V	82	Confident	78.4	Confident	74 Å²	74	93.6 Å²	93.6	45%	0.448	49%	0.494	S	S	.	.	H	α-helix	trans	-63.5	-41.9	173.6	171.1	0	0	0	0	110.7	K423 D424 W430 Q431	K423-V427 WeakPolarHBondContact O-CB 3.25Å; K423-V427 VanDerWaalsContact O-CG2 3.25Å; K423-V427 WeakPolarHBondContact O-CG2 2.95Å; K423-V427 PolarHBondContact O-N 3.48Å; D424-V427 PolarHBondContact O-N 3.4Å; V427-W430 PolarHBondContact O-N 2.93Å; V427-Q431 HydrophobicContact CG1-CG 4.42Å; V427-Q431 VanDerWaalsContact O-CB 3.3Å; V427-Q431 WeakPolarHBondContact O-CB 3.36Å; V427-Q431 WeakPolarHBondContact O-CG 3.36Å; V427-Q431 PolarHBondContact O-N 2.82Å
428	Q	83.8	Confident	76.4	Confident	131 Å²	131	99.1 Å²	99.1	61%	0.612	51%	0.511	S	S	*	.	H	α-helix	trans	-67.1	-39.6	175.2	-77.7	-176.6	12.9	0	0	112.4	D424 A425 Q431 A432	D424-Q428 VanDerWaalsContact O-CB 3.3Å; D424-Q428 WeakPolarHBondContact O-CB 3.5Å; D424-Q428 VanDerWaalsContact O-CG 3.23Å; D424-Q428 WeakPolarHBondContact O-CG 3.48Å; D424-Q428 PolarHBondContact O-N 2.86Å; A425-Q428 PolarHBondContact O-N 3.07Å; Q428-Q431 PolarHBondContact O-N 3.17Å; Q428-A432 WeakPolarHBondContact O-CB 3.39Å; Q428-A432 PolarHBondContact O-N 3.46Å
429	A	79	Confident	74.6	Confident	61 Å²	61	98.1 Å²	98.1	50%	0.504	52%	0.522	S	S	.	.	H	α-helix	trans	-67.6	-37.5	175.4	0	0	0	0	0	111.4	A425 E426 A432 A433	A425-A429 WeakPolarHBondContact O-CB 3.17Å; A425-A429 PolarHBondContact O-N 3.23Å; E426-A429 PolarHBondContact O-N 3.25Å; A429-A432 PolarHBondContact O-N 3.45Å; A429-A433 WeakPolarHBondContact O-CB 3.19Å; A429-A433 PolarHBondContact O-N 3.43Å
430	W	76	Confident	72.3	Confident	158 Å²	158	99.7 Å²	99.7	60%	0.598	54%	0.537	S	S	*	.	H	α-helix	trans	-68.4	-41.5	174.2	-174.8	85.7	0	0	0	112	E426 V427 A433 R434	E426-W430 VanDerWaalsContact O-CB 3.23Å; E426-W430 WeakPolarHBondContact O-CB 3.35Å; E426-W430 PolarHBondContact O-N 3.14Å; V427-W430 PolarHBondContact O-N 2.93Å; W430-A433 PolarHBondContact O-N 2.91Å; W430-R434 PolarHBondContact O-N 3.38Å
431	Q	76.2	Confident	69.9	Low	105 Å²	105	98.6 Å²	98.6	49%	0.491	55%	0.551	S	S	.	*	H	α-helix	trans	-66.4	-41.7	173.2	-75.4	175.1	-4.6	0	0	111.5	V427 Q428 R434 S435	V427-Q431 HydrophobicContact CG1-CG 4.42Å; V427-Q431 VanDerWaalsContact O-CB 3.3Å; V427-Q431 WeakPolarHBondContact O-CB 3.36Å; V427-Q431 WeakPolarHBondContact O-CG 3.36Å; V427-Q431 PolarHBondContact O-N 2.82Å; Q428-Q431 PolarHBondContact O-N 3.17Å; Q431-R434 PolarHBondContact O-N 3.14Å; Q431-S435 WeakPolarHBondContact O-CB 3.25Å; Q431-S435 PolarHBondContact O-N 3.43Å; Q431-S435 PolarHBondContact O-OG 3.21Å; Q431-S435 VanDerWaalsContact O-OG 3.13Å
432	A	74.8	Confident	67.2	Low	59 Å²	59	94.8 Å²	94.8	49%	0.488	56%	0.556	S	S	.	*	H	α-helix	trans	-66.6	-36.3	175.2	0	0	0	0	0	112.1	Q428 A429 S435 A436	Q428-A432 WeakPolarHBondContact O-CB 3.39Å; Q428-A432 PolarHBondContact O-N 3.46Å; A429-A432 PolarHBondContact O-N 3.45Å; A432-S435 PolarHBondContact O-N 3.12Å; A432-A436 WeakPolarHBondContact O-CB 3.38Å; A432-A436 PolarHBondContact O-N 2.95Å
433	A	66.9	Low	64.8	Low	55 Å²	55	95.2 Å²	95.2	46%	0.455	58%	0.58	S	S	.	*	H	α-helix	trans	-67.1	-42.9	172.9	0	0	0	0	0	111.8	A429 W430 A436 E437	A429-A433 WeakPolarHBondContact O-CB 3.19Å; A429-A433 PolarHBondContact O-N 3.43Å; W430-A433 PolarHBondContact O-N 2.91Å; A433-A436 PolarHBondContact O-N 3.48Å; A433-E437 PolarHBondContact O-N 3.34Å
434	R	67.6	Low	62.4	Low	138 Å²	138	93.9 Å²	93.9	52%	0.521	60%	0.596	S	S	.	*	H	α-helix	trans	-62.9	-42.5	172.1	-98.8	179.2	75.6	121.5	-3.4	112.5	W430 Q431 A436 E437 Q438	W430-R434 PolarHBondContact O-N 3.38Å; Q431-R434 PolarHBondContact O-N 3.14Å; R434-A436 VanDerWaalsContact C-N 3.34Å; R434-E437 PolarHBondContact O-N 3.01Å; R434-Q438 PolarHBondContact O-N 3.46Å
435	S	63	Low	60.1	Low	73 Å²	73	94.4 Å²	94.4	51%	0.51	62%	0.619	S	S	.	*	H	α-helix	trans	-70.2	-30.6	176.3	-67.9	0	0	0	0	112	Q431 A432 Q438 A439	Q431-S435 WeakPolarHBondContact O-CB 3.25Å; Q431-S435 PolarHBondContact O-N 3.43Å; Q431-S435 PolarHBondContact O-OG 3.21Å; Q431-S435 VanDerWaalsContact O-OG 3.13Å; A432-S435 PolarHBondContact O-N 3.12Å; S435-Q438 PolarHBondContact O-N 2.94Å; S435-A439 WeakPolarHBondContact O-CB 3.47Å; S435-A439 PolarHBondContact O-N 3.43Å
436	A	58.4	Low	58	Low	52 Å²	52	95.1 Å²	95.1	43%	0.43	63%	0.632	S	S	.	*	H	α-helix	trans	-73.1	-29.8	171.3	0	0	0	0	0	112.5	A432 A433 R434 Q438 S440	A432-A436 WeakPolarHBondContact O-CB 3.38Å; A432-A436 PolarHBondContact O-N 2.95Å; A433-A436 PolarHBondContact O-N 3.48Å; R434-A436 VanDerWaalsContact C-N 3.34Å; A436-Q438 VanDerWaalsContact C-N 3.33Å; A436-S440 VanDerWaalsContact O-CA 3.27Å; A436-S440 WeakPolarHBondContact O-CA 3.36Å; A436-S440 WeakPolarHBondContact O-CB 2.83Å; A436-S440 PolarHBondContact O-N 3.24Å; A436-S440 PolarHBondContact O-OG 3.45Å
437	E	48.8	Very low	56.4	Low	155 Å²	155	98.8 Å²	98.8	72%	0.724	65%	0.645	S	S	*	*	H	α-helix	trans	-72.5	-24.3	168.7	-102.2	176.6	153.2	0	0	113.2	A433 R434 S440	A433-E437 PolarHBondContact O-N 3.34Å; R434-E437 PolarHBondContact O-N 3.01Å; E437-S440 VanDerWaalsContact O-O 3.12Å
438	Q	49.2	Very low	55.3	Low	167 Å²	167	96.3 Å²	96.3	78%	0.78	64%	0.635	S	S	*	*	H	α-helix	trans	-97.5	-22.6	179.3	-130.1	169	-8.9	0	0	113.7	R434 S435 A436	R434-Q438 PolarHBondContact O-N 3.46Å; S435-Q438 PolarHBondContact O-N 2.94Å; A436-Q438 VanDerWaalsContact C-N 3.33Å
439	A	48.9	Very low	54.7	Low	94 Å²	94	92.4 Å²	92.4	78%	0.777	61%	0.614	S	S	*	*	H	α-helix	trans	-102.3	-18.6	174.5	0	0	0	0	0	113.2	S435	S435-A439 WeakPolarHBondContact O-CB 3.47Å; S435-A439 PolarHBondContact O-N 3.43Å
440	S	39.2	Very low	54.6	Low	71 Å²	71	92.1 Å²	92.1	50%	0.497	60%	0.604	S	S	.	*	S	Bend	trans	-104.1	94.3	159.5	106.9	0	0	0	0	107.4	A436 E437 G442	A436-S440 VanDerWaalsContact O-CA 3.27Å; A436-S440 WeakPolarHBondContact O-CA 3.36Å; A436-S440 WeakPolarHBondContact O-CB 2.83Å; A436-S440 PolarHBondContact O-N 3.24Å; A436-S440 PolarHBondContact O-OG 3.45Å; E437-S440 VanDerWaalsContact O-O 3.12Å; S440-G442 VanDerWaalsContact C-N 3.28Å; S440-G442 PolarHBondContact O-N 3.06Å
441	G	36.6	Very low	54.5	Low	74 Å²	74	88.2 Å²	88.2	76%	0.763	59%	0.593	S	S	*	*			trans	-56.5	102.6	156.9	0	0	0	0	0	106.8	G443	G441-G443 VanDerWaalsContact C-N 3.34Å; G441-G443 PolarHBondContact O-N 3.43Å
442	G	31.6	Very low	54.5	Low	73 Å²	73	87.4 Å²	87.4	75%	0.753	59%	0.592	S	S	*	*			trans	-48	92.5	-175.2	0	0	0	0	0	112.4	S440 G444	S440-G442 VanDerWaalsContact C-N 3.28Å; S440-G442 PolarHBondContact O-N 3.06Å; G442-G444 PolarHBondContact O-N 3.09Å; G442-G444 VanDerWaalsContact O-N 3.09Å
443	G	37.8	Very low	54.9	Low	86 Å²	86	84.6 Å²	84.6	89%	0.887	57%	0.569	S	S	*	*			trans	-76.5	78.3	163	0	0	0	0	0	108.4	G441	G441-G443 VanDerWaalsContact C-N 3.34Å; G441-G443 PolarHBondContact O-N 3.43Å
444	G	36.1	Very low	55.7	Low	76 Å²	76	83.3 Å²	83.3	78%	0.784	55%	0.554	S	S	*	*	S	Bend	trans	-135.4	71	179.2	0	0	0	0	0	110.7	G442	G442-G444 PolarHBondContact O-N 3.09Å; G442-G444 VanDerWaalsContact O-N 3.09Å
445	G	37.5	Very low	56.2	Low	85 Å²	85	81 Å²	81	88%	0.876	55%	0.549	S	S	*	.	S	Bend	trans	88.5	84.1	167.9	0	0	0	0	0	115.3
446	G	40.2	Very low	57.3	Low	68 Å²	68	78.7 Å²	78.7	70%	0.701	53%	0.531	S	S	*	.			trans	163.1	-11.5	164.6	0	0	0	0	0	119.1
447	K	50.4	Low	58.6	Low	219 Å²	219	76.3 Å²	76.3	95%	0.952	51%	0.511	S	S	*	.	S	Bend	trans	-115.9	99.4	-178.9	-82.5	178.2	175.5	173.1	0	110.7
448	G	58.9	Low	60.2	Low	22 Å²	22	72.4 Å²	72.4	23%	0.227	49%	0.494	C	S	.	.	S	Bend	trans	-177.2	-37.5	174.2	0	0	0	0	0	110.8	N450 R489	G448-N450 PolarHBondContact O-N 3.21Å; G448-R489 VanDerWaalsContact C-NH2 3.34Å; G448-R489 PolarHBondContact O-NH2 3.1Å
449	W	71.4	Confident	61.7	Low	49 Å²	49	70.5 Å²	70.5	19%	0.186	48%	0.483	C	S	.	.			trans	-82.1	103.8	174.4	-63.5	84.1	0	0	0	109.2	D453 L454 L457 M479 R489 D493 V494 K497	W449-D453 HydrophobicContact CE3-CB 3.98Å; W449-L454 HydrophobicContact CB-CD2 3.87Å; W449-L454 HydrophobicContact CB-CG 4.13Å; W449-L454 HydrophobicContact CD2-CD2 4.44Å; W449-L454 HydrophobicContact CE3-CD2 4.14Å; W449-L454 HydrophobicContact CG-CD2 4.35Å; W449-L457 HydrophobicContact CE3-CD2 4.38Å; W449-L457 HydrophobicContact CH2-CD2 4.05Å; W449-L457 HydrophobicContact CZ3-CB 4.14Å; W449-L457 HydrophobicContact CZ3-CD2 3.71Å; W449-L457 HydrophobicContact CZ3-CG 4.4Å; W449-M479 HydrophobicContact CE3-CE 4.27Å; W449-M479 HydrophobicContact CH2-CE 4Å; W449-M479 HydrophobicContact CH2-SD 4.21Å; W449-M479 HydrophobicContact CZ3-CE 3.35Å; W449-M479 HydrophobicContact CZ3-SD 4.01Å; W449-R489 HydrophobicContact CH2-CG 4.35Å; W449-D493 HydrophobicContact CZ2-CB 4.34Å; W449-V494 HydrophobicContact CH2-CG2 4.32Å; W449-K497 HydrophobicContact CD2-CB 4.28Å; W449-K497 HydrophobicContact CD2-CD 4.07Å; W449-K497 HydrophobicContact CD2-CG 3.65Å; W449-K497 HydrophobicContact CE3-CG 4.02Å; W449-K497 HydrophobicContact CG-CD 3.97Å; W449-K497 HydrophobicContact CG-CG 4.1Å; W449-K497 HydrophobicContact CH2-CB 3.92Å; W449-K497 HydrophobicContact CH2-CG 4.19Å; W449-K497 HydrophobicContact CZ2-CB 3.48Å; W449-K497 VanDerWaalsContact CZ2-CB 3.48Å; W449-K497 HydrophobicContact CZ2-CG 3.84Å; W449-K497 HydrophobicContact CZ3-CB 4.45Å; W449-K497 HydrophobicContact CZ3-CG 4.24Å
450	N	77.3	Confident	63.4	Low	55 Å²	55	66 Å²	66	29%	0.294	45%	0.446	S	S	.	.			trans	-75.4	167.5	168.2	65.6	8.9	0	0	0	109.7	G448 D452 D453 L454	G448-N450 PolarHBondContact O-N 3.21Å; N450-D452 PolarHBondContact O-N 3.12Å; N450-D453 PolarHBondContact O-N 2.94Å; N450-D453 WeakPolarHBondContact OD1-CA 3.34Å; N450-D453 WeakPolarHBondContact OD1-CB 3.36Å; N450-D453 PolarHBondContact OD1-N 3.26Å; N450-D453 PolarHBondContact OD1-OD1 2.87Å; N450-L454 WeakPolarHBondContact O-CG 3.46Å; N450-L454 PolarHBondContact O-N 3.06Å; N450-L454 VanDerWaalsContact O-N 3.11Å
451	E	74.6	Confident	65.5	Low	76 Å²	76	64.3 Å²	64.3	36%	0.355	43%	0.433	S	S	.	.	H	α-helix	trans	-58.5	-38.5	-177.7	-170.3	59.2	-146.2	0	0	111.7	L454 Q455	E451-L454 WeakPolarHBondContact O-CB 3.26Å; E451-L454 PolarHBondContact O-N 2.92Å; E451-Q455 WeakPolarHBondContact O-CG 3.33Å; E451-Q455 PolarHBondContact O-N 3.06Å
452	D	75.8	Confident	67.4	Low	88 Å²	88	66.7 Å²	66.7	47%	0.471	43%	0.428	S	S	.	.	H	α-helix	trans	-65.7	-40.6	179.4	-56.1	-22.5	0	0	0	112	N450 L454 Q455 L456	N450-D452 PolarHBondContact O-N 3.12Å; D452-L454 VanDerWaalsContact C-N 3.33Å; D452-L454 PolarHBondContact O-N 3.06Å; D452-Q455 PolarHBondContact O-N 3.19Å; D452-L456 VanDerWaalsContact O-CB 3.29Å; D452-L456 WeakPolarHBondContact O-CB 3.3Å; D452-L456 PolarHBondContact O-N 2.65Å
453	D	83.4	Confident	69.6	Low	1 Å²	1	68 Å²	68	1%	0.005	42%	0.417	C	S	.	.	H	α-helix	trans	-65.6	-36	174.7	-79.2	-6.6	0	0	0	111.4	W449 N450 L456 L457 M479 S483 S485 R489	W449-D453 HydrophobicContact CE3-CB 3.98Å; N450-D453 PolarHBondContact O-N 2.94Å; N450-D453 WeakPolarHBondContact OD1-CA 3.34Å; N450-D453 WeakPolarHBondContact OD1-CB 3.36Å; N450-D453 PolarHBondContact OD1-N 3.26Å; N450-D453 PolarHBondContact OD1-OD1 2.87Å; D453-L456 PolarHBondContact O-N 3.32Å; D453-L457 VanDerWaalsContact O-CB 3.31Å; D453-L457 WeakPolarHBondContact O-CB 3.46Å; D453-L457 PolarHBondContact O-N 3.02Å; D453-M479 HydrophobicContact CB-CE 4.28Å; D453-M479 WeakPolarHBondContact O-CE 3.38Å; D453-S483 VanDerWaalsContact OD1-CB 3.31Å; D453-S483 WeakPolarHBondContact OD1-CB 3.43Å; D453-S483 PolarHBondContact OD1-OG 3.24Å; D453-S485 PolarHBondContact OD2-OG 2.8Å; D453-R489 IonicContact OD2-CZ 3.84Å; D453-R489 IonicContact OD2-NE 2.89Å; D453-R489 IonicContact OD2-NH2 2.87Å; D453-R489 PolarHBondContact OD2-NH2 2.8Å
454	L	83.6	Confident	71.8	Confident	28 Å²	28	66.5 Å²	66.5	15%	0.147	39%	0.387	C	S	.	.	H	α-helix	trans	-67.3	-44	176.9	-67.3	172.8	0	0	0	110.9	W449 N450 E451 D452 L456 L457 I458 K497 L501	W449-L454 HydrophobicContact CB-CD2 3.87Å; W449-L454 HydrophobicContact CB-CG 4.13Å; W449-L454 HydrophobicContact CD2-CD2 4.44Å; W449-L454 HydrophobicContact CE3-CD2 4.14Å; W449-L454 HydrophobicContact CG-CD2 4.35Å; N450-L454 WeakPolarHBondContact O-CG 3.46Å; N450-L454 PolarHBondContact O-N 3.06Å; N450-L454 VanDerWaalsContact O-N 3.11Å; E451-L454 WeakPolarHBondContact O-CB 3.26Å; E451-L454 PolarHBondContact O-N 2.92Å; D452-L454 VanDerWaalsContact C-N 3.33Å; D452-L454 PolarHBondContact O-N 3.06Å; L454-L456 VanDerWaalsContact C-N 3.34Å; L454-L457 PolarHBondContact O-N 2.86Å; L454-I458 WeakPolarHBondContact O-CD1 3.4Å; L454-I458 VanDerWaalsContact O-CG1 3.26Å; L454-I458 WeakPolarHBondContact O-CG1 3.24Å; L454-I458 PolarHBondContact O-N 3.1Å; L454-K497 HydrophobicContact CD2-CG 4.36Å; L454-L501 HydrophobicContact CD2-CD1 4.16Å; L454-L501 HydrophobicContact CD2-CD2 4.46Å
455	Q	77.3	Confident	73.7	Confident	90 Å²	90	67 Å²	67	42%	0.421	38%	0.376	S	S	.	.	H	α-helix	trans	-62.3	-42.7	174.4	-69.7	-177	2.9	0	0	111.7	E451 D452 L457 I458 K459	E451-Q455 WeakPolarHBondContact O-CG 3.33Å; E451-Q455 PolarHBondContact O-N 3.06Å; D452-Q455 PolarHBondContact O-N 3.19Å; Q455-L457 PolarHBondContact O-N 3.4Å; Q455-I458 PolarHBondContact O-N 3.22Å; Q455-K459 WeakPolarHBondContact O-CB 3.46Å; Q455-K459 PolarHBondContact O-N 3.19Å
456	L	85.7	Confident	75.1	Confident	24 Å²	24	67 Å²	67	13%	0.126	37%	0.368	C	S	.	.	H	α-helix	trans	-65	-39.6	178.3	-169.6	65.7	0	0	0	111.8	D452 D453 L454 K459 A460 Y478 M479 H482	D452-L456 VanDerWaalsContact O-CB 3.29Å; D452-L456 WeakPolarHBondContact O-CB 3.3Å; D452-L456 PolarHBondContact O-N 2.65Å; D453-L456 PolarHBondContact O-N 3.32Å; L454-L456 VanDerWaalsContact C-N 3.34Å; L456-K459 PolarHBondContact O-N 3.04Å; L456-A460 WeakPolarHBondContact O-CB 3.08Å; L456-A460 PolarHBondContact O-N 3.23Å; L456-Y478 HydrophobicContact CD1-CD1 4.34Å; L456-Y478 HydrophobicContact CD1-CE1 3.67Å; L456-Y478 HydrophobicContact CG-CE1 4.33Å; L456-M479 HydrophobicContact CD2-CB 4.44Å; L456-M479 HydrophobicContact CD2-CG 4.45Å; L456-M479 HydrophobicContact CG-CG 4.38Å; L456-H482 HydrophobicContact CD1-CB 3.73Å; L456-H482 VanDerWaalsContact CD2-C 3.5Å; L456-H482 HydrophobicContact CD2-CB 3.76Å; L456-H482 HydrophobicContact CG-CB 4.35Å
457	L	86.4	Confident	75.8	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.005	38%	0.376	C	S	.	.	H	α-helix	trans	-62.2	-47.7	173.3	176.9	61.1	0	0	0	111.6	W449 D453 L454 Q455 K459 A460 V461 I475 M479 V494 K497 L501	W449-L457 HydrophobicContact CE3-CD2 4.38Å; W449-L457 HydrophobicContact CH2-CD2 4.05Å; W449-L457 HydrophobicContact CZ3-CB 4.14Å; W449-L457 HydrophobicContact CZ3-CD2 3.71Å; W449-L457 HydrophobicContact CZ3-CG 4.4Å; D453-L457 VanDerWaalsContact O-CB 3.31Å; D453-L457 WeakPolarHBondContact O-CB 3.46Å; D453-L457 PolarHBondContact O-N 3.02Å; L454-L457 PolarHBondContact O-N 2.86Å; Q455-L457 PolarHBondContact O-N 3.4Å; L457-K459 VanDerWaalsContact C-N 3.33Å; L457-K459 PolarHBondContact O-N 2.71Å; L457-A460 PolarHBondContact O-N 3.11Å; L457-V461 HydrophobicContact CD1-CG2 3.93Å; L457-V461 HydrophobicContact CG-CG2 4.39Å; L457-V461 WeakPolarHBondContact O-CB 3.48Å; L457-V461 WeakPolarHBondContact O-CG2 3.43Å; L457-V461 PolarHBondContact O-N 3.42Å; L457-I475 HydrophobicContact CD1-CG2 4.05Å; L457-M479 HydrophobicContact CB-CE 3.93Å; L457-M479 HydrophobicContact CB-SD 3.71Å; L457-M479 HydrophobicContact CD1-SD 3.58Å; L457-M479 VanDerWaalsContact CD1-SD 3.58Å; L457-M479 HydrophobicContact CG-SD 4.2Å; L457-V494 HydrophobicContact CD1-CG1 3.59Å; L457-K497 HydrophobicContact CD2-CB 4Å; L457-K497 HydrophobicContact CD2-CG 3.89Å; L457-L501 HydrophobicContact CD2-CD1 3.92Å
458	I	81.8	Confident	76	Confident	73 Å²	73	61.5 Å²	61.5	37%	0.374	36%	0.356	S	S	.	.	H	α-helix	trans	-60.7	-45.6	178.8	-68.4	164.3	0	0	0	110	L454 Q455 V461 N462	L454-I458 WeakPolarHBondContact O-CD1 3.4Å; L454-I458 VanDerWaalsContact O-CG1 3.26Å; L454-I458 WeakPolarHBondContact O-CG1 3.24Å; L454-I458 PolarHBondContact O-N 3.1Å; Q455-I458 PolarHBondContact O-N 3.22Å; I458-V461 PolarHBondContact O-N 3.22Å; I458-N462 PolarHBondContact O-N 2.93Å; I458-N462 VanDerWaalsContact O-N 3.16Å; I458-N462 PolarHBondContact O-ND2 3.02Å
459	K	81.4	Confident	75.8	Confident	127 Å²	127	68.2 Å²	68.2	55%	0.552	39%	0.387	S	S	*	.	H	α-helix	trans	-60.5	-46.6	176.4	-173	177.1	-178.4	179.4	0	111.6	Q455 L456 L457 N462 L463	Q455-K459 WeakPolarHBondContact O-CB 3.46Å; Q455-K459 PolarHBondContact O-N 3.19Å; L456-K459 PolarHBondContact O-N 3.04Å; L457-K459 VanDerWaalsContact C-N 3.33Å; L457-K459 PolarHBondContact O-N 2.71Å; K459-N462 PolarHBondContact O-N 3.27Å; K459-L463 VanDerWaalsContact O-CB 3.31Å; K459-L463 WeakPolarHBondContact O-CB 3.39Å; K459-L463 PolarHBondContact O-N 2.72Å
460	A	83.7	Confident	76	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-66.1	-39.8	-179.7	0	0	0	0	0	112.5	L456 L457 N462 L463 F464 I475 Y478	L456-A460 WeakPolarHBondContact O-CB 3.08Å; L456-A460 PolarHBondContact O-N 3.23Å; L457-A460 PolarHBondContact O-N 3.11Å; A460-N462 VanDerWaalsContact C-N 3.29Å; A460-N462 PolarHBondContact O-N 3.13Å; A460-L463 PolarHBondContact O-N 3.25Å; A460-F464 WeakPolarHBondContact O-CD2 3.33Å; A460-F464 PolarHBondContact O-N 2.73Å; A460-I475 HydrophobicContact CB-CG1 4.49Å; A460-I475 HydrophobicContact CB-CG2 3.78Å; A460-Y478 HydrophobicContact CB-CD1 3.5Å; A460-Y478 VanDerWaalsContact CB-CD1 3.5Å; A460-Y478 HydrophobicContact CB-CE1 3.89Å; A460-Y478 HydrophobicContact CB-CG 4.39Å
461	V	83.8	Confident	76.3	Confident	35 Å²	35	67.8 Å²	67.8	21%	0.212	39%	0.393	C	S	.	.	H	α-helix	trans	-63.7	-35	176.9	168.3	0	0	0	0	111.9	L457 I458 F464 R471 W472 I475 A498	L457-V461 HydrophobicContact CD1-CG2 3.93Å; L457-V461 HydrophobicContact CG-CG2 4.39Å; L457-V461 WeakPolarHBondContact O-CB 3.48Å; L457-V461 WeakPolarHBondContact O-CG2 3.43Å; L457-V461 PolarHBondContact O-N 3.42Å; I458-V461 PolarHBondContact O-N 3.22Å; V461-F464 CarbonylContact O-C 3.29Å; V461-F464 VanDerWaalsContact O-O 3.05Å; V461-R471 PolarHBondContact O-NH2 3.05Å; V461-W472 HydrophobicContact CG2-CZ3 4.29Å; V461-I475 HydrophobicContact CG2-CD1 4.12Å; V461-A498 HydrophobicContact CG2-CB 4.4Å
462	N	76.8	Confident	77	Confident	124 Å²	124	67.3 Å²	67.3	66%	0.663	39%	0.388	S	S	*	.	H	α-helix	trans	-76.4	-38.6	174.7	-72.3	-21.2	0	0	0	112.5	I458 K459 A460 F464	I458-N462 PolarHBondContact O-N 2.93Å; I458-N462 VanDerWaalsContact O-N 3.16Å; I458-N462 PolarHBondContact O-ND2 3.02Å; K459-N462 PolarHBondContact O-N 3.27Å; A460-N462 VanDerWaalsContact C-N 3.29Å; A460-N462 PolarHBondContact O-N 3.13Å; N462-F464 VanDerWaalsContact C-N 3.28Å; N462-F464 PolarHBondContact O-N 3.29Å
463	L	79	Confident	77.5	Confident	100 Å²	100	68.8 Å²	68.8	52%	0.524	39%	0.392	S	S	.	.	H	α-helix	trans	-66.7	-32.5	177.8	-167.4	67.9	0	0	0	111.8	K459 A460 P465 Y478	K459-L463 VanDerWaalsContact O-CB 3.31Å; K459-L463 WeakPolarHBondContact O-CB 3.39Å; K459-L463 PolarHBondContact O-N 2.72Å; A460-L463 PolarHBondContact O-N 3.25Å; L463-P465 WeakPolarHBondContact O-CD 3.33Å; L463-Y478 HydrophobicContact CD2-CE2 3.99Å
464	F	82.3	Confident	77.4	Confident	56 Å²	56	71.7 Å²	71.7	25%	0.246	41%	0.409	C	S	.	.	S	Bend	trans	-117.7	84.2	179	-54.8	-69.3	0	0	0	110.3	A460 V461 N462 R471 V474 I475 Y478	A460-F464 WeakPolarHBondContact O-CD2 3.33Å; A460-F464 PolarHBondContact O-N 2.73Å; V461-F464 CarbonylContact O-C 3.29Å; V461-F464 VanDerWaalsContact O-O 3.05Å; N462-F464 VanDerWaalsContact C-N 3.28Å; N462-F464 PolarHBondContact O-N 3.29Å; F464-R471 VanDerWaalsContact O-CZ 3.29Å; F464-R471 PolarHBondContact O-NE 3.27Å; F464-R471 PolarHBondContact O-NH2 2.93Å; F464-V474 HydrophobicContact CD1-CG1 3.94Å; F464-V474 HydrophobicContact CD2-CG1 4.28Å; F464-V474 HydrophobicContact CE1-CG1 3.77Å; F464-V474 HydrophobicContact CE2-CG1 4.14Å; F464-V474 HydrophobicContact CG-CG1 4.2Å; F464-V474 HydrophobicContact CZ-CG1 3.88Å; F464-I475 HydrophobicContact CB-CD1 4.32Å; F464-I475 HydrophobicContact CB-CG1 4.04Å; F464-I475 HydrophobicContact CD2-CG1 3.91Å; F464-I475 HydrophobicContact CG-CG1 4.35Å; F464-Y478 HydrophobicContact CE2-CD2 4.03Å; F464-Y478 AromaticContact CE2-CG 3.97Å; F464-Y478 HydrophobicContact CE2-CG 3.97Å; F464-Y478 HydrophobicContact CZ-CD2 4.3Å
465	P	76.8	Confident	77.5	Confident	85 Å²	85	70.3 Å²	70.3	55%	0.552	40%	0.402	S	S	*	.			trans	-69.6	167	-178.3	27.6	-34.3	0	0	0	113.2	L463 G467	L463-P465 WeakPolarHBondContact O-CD 3.33Å; P465-G467 PolarHBondContact O-N 2.85Å
466	A	66.3	Low	78	Confident	87 Å²	87	66.2 Å²	66.2	72%	0.719	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	127.3	-178.7	0	0	0	0	0	111.7
467	G	55.4	Low	78	Confident	85 Å²	85	70.2 Å²	70.2	88%	0.876	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	142.9	-13.1	177.1	0	0	0	0	0	115.4	P465	P465-G467 PolarHBondContact O-N 2.85Å
468	T	54.7	Low	77.9	Confident	86 Å²	86	72.1 Å²	72.1	53%	0.528	41%	0.413	S	S	.	.	S	Bend	trans	-92	134.4	175.2	26.9	0	0	0	0	112.2	R471	T468-R471 PolarHBondContact O-N 2.9Å
469	N	54.2	Low	78.2	Confident	162 Å²	162	68.7 Å²	68.7	87%	0.866	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	139.8	170	-76.1	-22	0	0	0	109.5	R471	N469-R471 VanDerWaalsContact C-N 3.27Å; N469-R471 PolarHBondContact O-N 3.09Å
470	A	76.7	Confident	78.5	Confident	55 Å²	55	65.3 Å²	65.3	46%	0.455	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	22.8	-177.4	0	0	0	0	0	116.3	W472 E473 V474	A470-W472 PolarHBondContact O-N 2.97Å; A470-E473 HydrophobicContact CB-CB 4.35Å; A470-E473 HydrophobicContact CB-CG 4.44Å; A470-E473 WeakPolarHBondContact O-CB 3.47Å; A470-E473 PolarHBondContact O-N 3.29Å; A470-V474 PolarHBondContact O-N 3.44Å
471	R	82.6	Confident	78.6	Confident	40 Å²	40	71.7 Å²	71.7	15%	0.151	42%	0.416	C	S	.	.	H	α-helix	trans	-42	-46.3	176.9	179.6	-174.9	-176.8	-147.2	4.6	114.3	V461 F464 T468 N469 E473 V474 I475	V461-R471 PolarHBondContact O-NH2 3.05Å; F464-R471 VanDerWaalsContact O-CZ 3.29Å; F464-R471 PolarHBondContact O-NE 3.27Å; F464-R471 PolarHBondContact O-NH2 2.93Å; T468-R471 PolarHBondContact O-N 2.9Å; N469-R471 VanDerWaalsContact C-N 3.27Å; N469-R471 PolarHBondContact O-N 3.09Å; R471-E473 VanDerWaalsContact C-N 3.33Å; R471-E473 PolarHBondContact O-N 2.89Å; R471-V474 PolarHBondContact O-N 2.83Å; R471-I475 HydrophobicContact CG-CD1 3.79Å; R471-I475 VanDerWaalsContact O-CG1 3.28Å; R471-I475 WeakPolarHBondContact O-CG1 3.48Å; R471-I475 PolarHBondContact O-N 2.94Å
472	W	88.9	Confident	78.5	Confident	66 Å²	66	75 Å²	75	25%	0.25	43%	0.429	C	S	.	.	H	α-helix	trans	-72.6	-26.1	-175.7	-59.5	115.4	0	0	0	113.4	V461 A470 I475 A476 A491 V494 I495 A498	V461-W472 HydrophobicContact CG2-CZ3 4.29Å; A470-W472 PolarHBondContact O-N 2.97Å; W472-I475 HydrophobicContact CE3-CD1 3.87Å; W472-I475 HydrophobicContact CZ3-CD1 3.93Å; W472-A476 VanDerWaalsContact O-CB 3.31Å; W472-A476 WeakPolarHBondContact O-CB 3.2Å; W472-A476 PolarHBondContact O-N 3.2Å; W472-A491 HydrophobicContact CB-CB 4.02Å; W472-V494 HydrophobicContact CE3-CG1 3.92Å; W472-V494 HydrophobicContact CZ3-CG1 4.34Å; W472-I495 HydrophobicContact CD2-CB 3.83Å; W472-I495 HydrophobicContact CD2-CD1 4.23Å; W472-I495 HydrophobicContact CD2-CG1 3.89Å; W472-I495 HydrophobicContact CE3-CB 4.11Å; W472-I495 HydrophobicContact CE3-CG1 4.41Å; W472-I495 HydrophobicContact CG-CB 4.05Å; W472-I495 HydrophobicContact CG-CD1 4.18Å; W472-I495 HydrophobicContact CG-CG1 4.27Å; W472-I495 HydrophobicContact CH2-CG1 4.39Å; W472-I495 HydrophobicContact CZ2-CD1 4.32Å; W472-I495 HydrophobicContact CZ2-CG1 3.87Å; W472-A498 HydrophobicContact CH2-CB 4.02Å; W472-A498 HydrophobicContact CZ3-CB 3.88Å
473	E	87.1	Confident	78.8	Confident	119 Å²	119	70.2 Å²	70.2	56%	0.556	41%	0.406	S	S	*	.	H	α-helix	trans	-72.6	-42.1	172.5	-62.1	-177.8	175.1	0	0	110.8	A470 R471 I475 A476 N477 A491	A470-E473 HydrophobicContact CB-CB 4.35Å; A470-E473 HydrophobicContact CB-CG 4.44Å; A470-E473 WeakPolarHBondContact O-CB 3.47Å; A470-E473 PolarHBondContact O-N 3.29Å; R471-E473 VanDerWaalsContact C-N 3.33Å; R471-E473 PolarHBondContact O-N 2.89Å; E473-I475 PolarHBondContact O-N 2.81Å; E473-A476 PolarHBondContact O-N 3.18Å; E473-N477 WeakPolarHBondContact O-CB 3.27Å; E473-N477 VanDerWaalsContact O-CG 3.29Å; E473-N477 PolarHBondContact O-N 3.15Å; E473-N477 PolarHBondContact O-ND2 3.11Å; E473-A491 HydrophobicContact CG-CB 3.96Å
474	V	82.3	Confident	78.7	Confident	62 Å²	62	71 Å²	71	38%	0.376	42%	0.415	S	S	.	.	H	α-helix	trans	-62.2	-44.4	175.7	178.2	0	0	0	0	111	F464 A470 R471 N477 Y478	F464-V474 HydrophobicContact CD1-CG1 3.94Å; F464-V474 HydrophobicContact CD2-CG1 4.28Å; F464-V474 HydrophobicContact CE1-CG1 3.77Å; F464-V474 HydrophobicContact CE2-CG1 4.14Å; F464-V474 HydrophobicContact CG-CG1 4.2Å; F464-V474 HydrophobicContact CZ-CG1 3.88Å; A470-V474 PolarHBondContact O-N 3.44Å; R471-V474 PolarHBondContact O-N 2.83Å; V474-N477 PolarHBondContact O-N 3Å; V474-Y478 WeakPolarHBondContact O-CB 3.46Å; V474-Y478 PolarHBondContact O-N 2.88Å
475	I	85.1	Confident	78.2	Confident	0 Å²	0	70 Å²	70	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-64.3	-43.4	176.9	-66.7	169.3	0	0	0	110.5	L457 A460 V461 F464 R471 W472 E473 N477 Y478 M479 V494	L457-I475 HydrophobicContact CD1-CG2 4.05Å; A460-I475 HydrophobicContact CB-CG1 4.49Å; A460-I475 HydrophobicContact CB-CG2 3.78Å; V461-I475 HydrophobicContact CG2-CD1 4.12Å; F464-I475 HydrophobicContact CB-CD1 4.32Å; F464-I475 HydrophobicContact CB-CG1 4.04Å; F464-I475 HydrophobicContact CD2-CG1 3.91Å; F464-I475 HydrophobicContact CG-CG1 4.35Å; R471-I475 HydrophobicContact CG-CD1 3.79Å; R471-I475 VanDerWaalsContact O-CG1 3.28Å; R471-I475 WeakPolarHBondContact O-CG1 3.48Å; R471-I475 PolarHBondContact O-N 2.94Å; W472-I475 HydrophobicContact CE3-CD1 3.87Å; W472-I475 HydrophobicContact CZ3-CD1 3.93Å; E473-I475 PolarHBondContact O-N 2.81Å; I475-N477 PolarHBondContact O-N 2.86Å; I475-Y478 PolarHBondContact O-N 2.93Å; I475-M479 HydrophobicContact CG2-CG 4.4Å; I475-M479 HydrophobicContact CG2-SD 4.45Å; I475-M479 WeakPolarHBondContact O-CB 3.49Å; I475-M479 VanDerWaalsContact O-CG 3.27Å; I475-M479 WeakPolarHBondContact O-CG 3.39Å; I475-M479 PolarHBondContact O-N 3.48Å; I475-V494 HydrophobicContact CB-CG1 4.01Å; I475-V494 HydrophobicContact CG2-CG1 3.33Å
476	A	88.2	Confident	77.9	Confident	3 Å²	3	69.7 Å²	69.7	3%	0.025	43%	0.427	C	S	.	.	H	α-helix	trans	-62	-42	176.8	0	0	0	0	0	112.6	W472 E473 M479 N480 V494	W472-A476 VanDerWaalsContact O-CB 3.31Å; W472-A476 WeakPolarHBondContact O-CB 3.2Å; W472-A476 PolarHBondContact O-N 3.2Å; E473-A476 PolarHBondContact O-N 3.18Å; A476-M479 PolarHBondContact O-N 3.29Å; A476-N480 WeakPolarHBondContact O-CB 3.42Å; A476-N480 PolarHBondContact O-N 3.15Å; A476-N480 PolarHBondContact O-ND2 3.21Å; A476-N480 VanDerWaalsContact O-ND2 3.14Å; A476-V494 HydrophobicContact CB-CG2 3.87Å
477	N	84.7	Confident	78.3	Confident	108 Å²	108	70 Å²	70	58%	0.578	42%	0.415	S	S	*	.	H	α-helix	trans	-65.6	-44.2	176.5	-72.1	-17.5	0	0	0	111.9	E473 V474 I475 M479 N480 L481	E473-N477 WeakPolarHBondContact O-CB 3.27Å; E473-N477 VanDerWaalsContact O-CG 3.29Å; E473-N477 PolarHBondContact O-N 3.15Å; E473-N477 PolarHBondContact O-ND2 3.11Å; V474-N477 PolarHBondContact O-N 3Å; I475-N477 PolarHBondContact O-N 2.86Å; N477-M479 VanDerWaalsContact C-N 3.3Å; N477-M479 PolarHBondContact O-N 3.45Å; N477-N480 PolarHBondContact O-N 2.8Å; N477-L481 WeakPolarHBondContact O-CB 3.18Å; N477-L481 PolarHBondContact O-N 2.7Å
478	Y	85.3	Confident	79.5	Confident	42 Å²	42	74.9 Å²	74.9	17%	0.165	41%	0.412	C	S	.	.	H	α-helix	trans	-58.8	-44.2	174.4	-178.7	-92.5	0	0	0	111.4	L456 A460 L463 F464 V474 I475 L481 H482	L456-Y478 HydrophobicContact CD1-CD1 4.34Å; L456-Y478 HydrophobicContact CD1-CE1 3.67Å; L456-Y478 HydrophobicContact CG-CE1 4.33Å; A460-Y478 HydrophobicContact CB-CD1 3.5Å; A460-Y478 VanDerWaalsContact CB-CD1 3.5Å; A460-Y478 HydrophobicContact CB-CE1 3.89Å; A460-Y478 HydrophobicContact CB-CG 4.39Å; L463-Y478 HydrophobicContact CD2-CE2 3.99Å; F464-Y478 HydrophobicContact CE2-CD2 4.03Å; F464-Y478 AromaticContact CE2-CG 3.97Å; F464-Y478 HydrophobicContact CE2-CG 3.97Å; F464-Y478 HydrophobicContact CZ-CD2 4.3Å; V474-Y478 WeakPolarHBondContact O-CB 3.46Å; V474-Y478 PolarHBondContact O-N 2.88Å; I475-Y478 PolarHBondContact O-N 2.93Å; Y478-L481 PolarHBondContact O-N 3.03Å; Y478-H482 AromaticContact CD2-CD2 3.57Å; Y478-H482 AromaticContact CD2-NE2 3.85Å; Y478-H482 AromaticContact CE2-CD2 3.41Å; Y478-H482 VanDerWaalsContact CE2-CD2 3.41Å; Y478-H482 WeakPolarHBondContact CE2-CD2 3.17Å; Y478-H482 AromaticContact CE2-NE2 3.53Å; Y478-H482 AromaticContact CG-CD2 3.97Å; Y478-H482 AromaticContact CZ-CD2 3.69Å; Y478-H482 WeakPolarHBondContact O-CB 3.35Å; Y478-H482 PolarHBondContact O-CD2 2.86Å; Y478-H482 PolarHBondContact O-N 3.1Å; Y478-H482 VanDerWaalsContact O-N 3.12Å
479	M	88.4	Confident	80.9	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-63.6	-44.2	176.1	-76.2	-163.5	68.4	0	0	112.7	W449 D453 L456 L457 I475 A476 N477 L481 H482 S483 V494	W449-M479 HydrophobicContact CE3-CE 4.27Å; W449-M479 HydrophobicContact CH2-CE 4Å; W449-M479 HydrophobicContact CH2-SD 4.21Å; W449-M479 HydrophobicContact CZ3-CE 3.35Å; W449-M479 HydrophobicContact CZ3-SD 4.01Å; D453-M479 HydrophobicContact CB-CE 4.28Å; D453-M479 WeakPolarHBondContact O-CE 3.38Å; L456-M479 HydrophobicContact CD2-CB 4.44Å; L456-M479 HydrophobicContact CD2-CG 4.45Å; L456-M479 HydrophobicContact CG-CG 4.38Å; L457-M479 HydrophobicContact CB-CE 3.93Å; L457-M479 HydrophobicContact CB-SD 3.71Å; L457-M479 HydrophobicContact CD1-SD 3.58Å; L457-M479 VanDerWaalsContact CD1-SD 3.58Å; L457-M479 HydrophobicContact CG-SD 4.2Å; I475-M479 HydrophobicContact CG2-CG 4.4Å; I475-M479 HydrophobicContact CG2-SD 4.45Å; I475-M479 WeakPolarHBondContact O-CB 3.49Å; I475-M479 VanDerWaalsContact O-CG 3.27Å; I475-M479 WeakPolarHBondContact O-CG 3.39Å; I475-M479 PolarHBondContact O-N 3.48Å; A476-M479 PolarHBondContact O-N 3.29Å; N477-M479 VanDerWaalsContact C-N 3.3Å; N477-M479 PolarHBondContact O-N 3.45Å; M479-L481 VanDerWaalsContact C-N 3.26Å; M479-L481 PolarHBondContact O-N 3.19Å; M479-H482 PolarHBondContact O-N 3.48Å; M479-S483 WeakPolarHBondContact O-CA 3.37Å; M479-S483 WeakPolarHBondContact O-CB 3.47Å; M479-S483 PolarHBondContact O-N 3.33Å; M479-V494 HydrophobicContact SD-CG2 3.94Å
480	N	87.4	Confident	82.5	Confident	56 Å²	56	67.8 Å²	67.8	30%	0.299	37%	0.372	S	S	.	.	H	α-helix	trans	-67.9	-26.7	179.4	-70.1	-27.7	0	0	0	113.2	A476 N477 K488 R489	A476-N480 WeakPolarHBondContact O-CB 3.42Å; A476-N480 PolarHBondContact O-N 3.15Å; A476-N480 PolarHBondContact O-ND2 3.21Å; A476-N480 VanDerWaalsContact O-ND2 3.14Å; N477-N480 PolarHBondContact O-N 2.8Å; N480-K488 WeakPolarHBondContact OD1-CA 3.46Å; N480-R489 PolarHBondContact ND2-O 3.35Å; N480-R489 PolarHBondContact OD1-N 3.29Å
481	L	83.9	Confident	82.8	Confident	135 Å²	135	66.5 Å²	66.5	71%	0.707	36%	0.361	S	S	*	.	H	α-helix	trans	-79.3	-33.1	177.8	-174.6	63.2	0	0	0	112.5	N477 Y478 M479	N477-L481 WeakPolarHBondContact O-CB 3.18Å; N477-L481 PolarHBondContact O-N 2.7Å; Y478-L481 PolarHBondContact O-N 3.03Å; M479-L481 VanDerWaalsContact C-N 3.26Å; M479-L481 PolarHBondContact O-N 3.19Å
482	H	81.8	Confident	82.7	Confident	103 Å²	103	71.9 Å²	71.9	48%	0.477	39%	0.386	S	S	.	.	H	α-helix	trans	-110.1	-5	-172.4	-66.9	-65.9	0	0	0	114.2	L456 Y478 M479	L456-H482 HydrophobicContact CD1-CB 3.73Å; L456-H482 VanDerWaalsContact CD2-C 3.5Å; L456-H482 HydrophobicContact CD2-CB 3.76Å; L456-H482 HydrophobicContact CG-CB 4.35Å; Y478-H482 AromaticContact CD2-CD2 3.57Å; Y478-H482 AromaticContact CD2-NE2 3.85Å; Y478-H482 AromaticContact CE2-CD2 3.41Å; Y478-H482 VanDerWaalsContact CE2-CD2 3.41Å; Y478-H482 WeakPolarHBondContact CE2-CD2 3.17Å; Y478-H482 AromaticContact CE2-NE2 3.53Å; Y478-H482 AromaticContact CG-CD2 3.97Å; Y478-H482 AromaticContact CZ-CD2 3.69Å; Y478-H482 WeakPolarHBondContact O-CB 3.35Å; Y478-H482 PolarHBondContact O-CD2 2.86Å; Y478-H482 PolarHBondContact O-N 3.1Å; Y478-H482 VanDerWaalsContact O-N 3.12Å; M479-H482 PolarHBondContact O-N 3.48Å
483	S	84.8	Confident	82.5	Confident	24 Å²	24	71.9 Å²	71.9	17%	0.168	39%	0.391	C	S	.	.			trans	-79.7	133.1	175.2	177	0	0	0	0	110.9	D453 M479 S485	D453-S483 VanDerWaalsContact OD1-CB 3.31Å; D453-S483 WeakPolarHBondContact OD1-CB 3.43Å; D453-S483 PolarHBondContact OD1-OG 3.24Å; M479-S483 WeakPolarHBondContact O-CA 3.37Å; M479-S483 WeakPolarHBondContact O-CB 3.47Å; M479-S483 PolarHBondContact O-N 3.33Å; S483-S485 WeakPolarHBondContact OG-CB 2.99Å; S483-S485 PolarHBondContact OG-N 3.27Å; S483-S485 VanDerWaalsContact OG-N 3.12Å; S483-S485 PolarHBondContact OG-OG 3.44Å
484	T	76.3	Confident	82.5	Confident	118 Å²	118	66.2 Å²	66.2	72%	0.724	36%	0.364	S	S	*	.	S	Bend	trans	-90.8	-0.2	171.8	53.1	0	0	0	0	112.5	G486	T484-G486 PolarHBondContact O-N 3.17Å
485	S	71.8	Confident	82.6	Confident	33 Å²	33	64.9 Å²	64.9	23%	0.231	36%	0.355	C	S	.	.	S	Bend	trans	-73	-11	-174.7	73.5	0	0	0	0	114.3	D453 S483 M487	D453-S485 PolarHBondContact OD2-OG 2.8Å; S483-S485 WeakPolarHBondContact OG-CB 2.99Å; S483-S485 PolarHBondContact OG-N 3.27Å; S483-S485 VanDerWaalsContact OG-N 3.12Å; S483-S485 PolarHBondContact OG-OG 3.44Å; S485-M487 PolarHBondContact O-N 3.32Å; S485-M487 VanDerWaalsContact O-N 3.08Å; S485-M487 PolarHBondContact OG-N 3.47Å
486	G	70.1	Confident	82.5	Confident	79 Å²	79	69.2 Å²	69.2	81%	0.814	38%	0.378	S	S	*	.			trans	66.4	2.4	-174.3	0	0	0	0	0	114.4	T484	T484-G486 PolarHBondContact O-N 3.17Å
487	M	75.1	Confident	82.3	Confident	95 Å²	95	71.3 Å²	71.3	47%	0.468	39%	0.386	S	S	.	.			trans	-105.1	110.6	-170.8	-148.6	176.2	-74.1	0	0	110.1	S485 R489	S485-M487 PolarHBondContact O-N 3.32Å; S485-M487 VanDerWaalsContact O-N 3.08Å; S485-M487 PolarHBondContact OG-N 3.47Å; M487-R489 PolarHBondContact O-N 3.43Å; M487-R489 PolarHBondContact SD-NH1 3.4Å
488	K	80.1	Confident	82.2	Confident	187 Å²	187	66.9 Å²	66.9	81%	0.813	36%	0.364	S	S	*	.			trans	-69.4	130.2	-180	-67	-173.5	178.9	-178.5	0	111.1	N480	N480-K488 WeakPolarHBondContact OD1-CA 3.46Å
489	R	84.4	Confident	81.9	Confident	22 Å²	22	69.9 Å²	69.9	8%	0.083	38%	0.379	C	S	.	.			trans	-104.9	134.9	177	-54.2	-58.7	-177.4	-158	-9.6	110.7	G448 W449 D453 N480 M487 V494	G448-R489 VanDerWaalsContact C-NH2 3.34Å; G448-R489 PolarHBondContact O-NH2 3.1Å; W449-R489 HydrophobicContact CH2-CG 4.35Å; D453-R489 IonicContact OD2-CZ 3.84Å; D453-R489 IonicContact OD2-NE 2.89Å; D453-R489 IonicContact OD2-NH2 2.87Å; D453-R489 PolarHBondContact OD2-NH2 2.8Å; N480-R489 PolarHBondContact ND2-O 3.35Å; N480-R489 PolarHBondContact OD1-N 3.29Å; M487-R489 PolarHBondContact O-N 3.43Å; M487-R489 PolarHBondContact SD-NH1 3.4Å; R489-V494 HydrophobicContact CB-CG2 4.03Å
490	T	87.1	Confident	81.5	Confident	76 Å²	76	74.2 Å²	74.2	47%	0.466	40%	0.401	S	S	.	.			trans	-90.7	162.7	171.8	70.1	0	0	0	0	110.9	K492 D493 V494	T490-K492 PolarHBondContact O-N 3.08Å; T490-K492 VanDerWaalsContact O-N 3.11Å; T490-K492 PolarHBondContact OG1-N 3.22Å; T490-D493 WeakPolarHBondContact CB-OD2 3.26Å; T490-D493 PolarHBondContact N-OD2 3.01Å; T490-D493 PolarHBondContact O-N 3.04Å; T490-D493 PolarHBondContact OG1-N 3.36Å; T490-D493 PolarHBondContact OG1-OD2 2.95Å; T490-V494 WeakPolarHBondContact O-CG2 3.49Å; T490-V494 PolarHBondContact O-N 3.12Å; T490-V494 VanDerWaalsContact O-N 3.1Å
491	A	84.1	Confident	80.7	Confident	29 Å²	29	73.1 Å²	73.1	24%	0.24	40%	0.395	C	S	.	.	H	α-helix	trans	-54.1	-31	173.2	0	0	0	0	0	112.6	W472 E473 I495	W472-A491 HydrophobicContact CB-CB 4.02Å; E473-A491 HydrophobicContact CG-CB 3.96Å; A491-I495 WeakPolarHBondContact O-CB 3.3Å; A491-I495 VanDerWaalsContact O-CG2 3.25Å; A491-I495 WeakPolarHBondContact O-CG2 3.28Å; A491-I495 PolarHBondContact O-N 3.1Å
492	K	80.8	Confident	79.9	Confident	152 Å²	152	73.9 Å²	73.9	66%	0.661	40%	0.395	S	S	*	.	H	α-helix	trans	-72	-35.9	177.5	-163.8	174.8	-177.7	177.6	0	112.5	T490 I495 N496	T490-K492 PolarHBondContact O-N 3.08Å; T490-K492 VanDerWaalsContact O-N 3.11Å; T490-K492 PolarHBondContact OG1-N 3.22Å; K492-I495 VanDerWaalsContact O-CG2 3.28Å; K492-I495 WeakPolarHBondContact O-CG2 3.12Å; K492-N496 VanDerWaalsContact O-CB 3.29Å; K492-N496 WeakPolarHBondContact O-CB 3.42Å; K492-N496 PolarHBondContact O-N 2.63Å; K492-N496 PolarHBondContact O-ND2 3.04Å; K492-N496 VanDerWaalsContact O-ND2 3.14Å
493	D	83.8	Confident	79.3	Confident	66 Å²	66	77.7 Å²	77.7	35%	0.353	41%	0.411	S	S	.	.	H	α-helix	trans	-70.7	-43.8	176.9	-56.1	-45.3	0	0	0	111.1	W449 T490 N496 K497	W449-D493 HydrophobicContact CZ2-CB 4.34Å; T490-D493 WeakPolarHBondContact CB-OD2 3.26Å; T490-D493 PolarHBondContact N-OD2 3.01Å; T490-D493 PolarHBondContact O-N 3.04Å; T490-D493 PolarHBondContact OG1-N 3.36Å; T490-D493 PolarHBondContact OG1-OD2 2.95Å; D493-N496 PolarHBondContact O-N 3.14Å; D493-K497 WeakPolarHBondContact O-CB 3.33Å; D493-K497 PolarHBondContact O-N 3.04Å
494	V	86.6	Confident	77.8	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-62.7	-48.8	179.3	170.8	0	0	0	0	111.3	W449 L457 W472 I475 A476 M479 R489 T490 N496 K497 A498	W449-V494 HydrophobicContact CH2-CG2 4.32Å; L457-V494 HydrophobicContact CD1-CG1 3.59Å; W472-V494 HydrophobicContact CE3-CG1 3.92Å; W472-V494 HydrophobicContact CZ3-CG1 4.34Å; I475-V494 HydrophobicContact CB-CG1 4.01Å; I475-V494 HydrophobicContact CG2-CG1 3.33Å; A476-V494 HydrophobicContact CB-CG2 3.87Å; M479-V494 HydrophobicContact SD-CG2 3.94Å; R489-V494 HydrophobicContact CB-CG2 4.03Å; T490-V494 WeakPolarHBondContact O-CG2 3.49Å; T490-V494 PolarHBondContact O-N 3.12Å; T490-V494 VanDerWaalsContact O-N 3.1Å; V494-N496 VanDerWaalsContact C-N 3.35Å; V494-N496 PolarHBondContact O-N 2.85Å; V494-K497 PolarHBondContact O-N 3.3Å; V494-A498 VanDerWaalsContact O-CB 3.23Å; V494-A498 WeakPolarHBondContact O-CB 3.41Å; V494-A498 PolarHBondContact O-N 3.17Å
495	I	83.9	Confident	76.6	Confident	34 Å²	34	78.3 Å²	78.3	17%	0.174	41%	0.408	C	S	.	.	H	α-helix	trans	-64.9	-39.4	178.7	-168.8	177.4	0	0	0	111.7	W472 A491 K492 K499	W472-I495 HydrophobicContact CD2-CB 3.83Å; W472-I495 HydrophobicContact CD2-CD1 4.23Å; W472-I495 HydrophobicContact CD2-CG1 3.89Å; W472-I495 HydrophobicContact CE3-CB 4.11Å; W472-I495 HydrophobicContact CE3-CG1 4.41Å; W472-I495 HydrophobicContact CG-CB 4.05Å; W472-I495 HydrophobicContact CG-CD1 4.18Å; W472-I495 HydrophobicContact CG-CG1 4.27Å; W472-I495 HydrophobicContact CH2-CG1 4.39Å; W472-I495 HydrophobicContact CZ2-CD1 4.32Å; W472-I495 HydrophobicContact CZ2-CG1 3.87Å; A491-I495 WeakPolarHBondContact O-CB 3.3Å; A491-I495 VanDerWaalsContact O-CG2 3.25Å; A491-I495 WeakPolarHBondContact O-CG2 3.28Å; A491-I495 PolarHBondContact O-N 3.1Å; K492-I495 VanDerWaalsContact O-CG2 3.28Å; K492-I495 WeakPolarHBondContact O-CG2 3.12Å; I495-K499 HydrophobicContact CG1-CD 4.17Å; I495-K499 HydrophobicContact CG1-CG 4.48Å; I495-K499 WeakPolarHBondContact O-CB 2.9Å; I495-K499 VanDerWaalsContact O-CG 3.28Å; I495-K499 WeakPolarHBondContact O-CG 3.47Å; I495-K499 PolarHBondContact O-N 2.94Å
496	N	83.1	Confident	75.8	Confident	91 Å²	91	80.9 Å²	80.9	49%	0.487	42%	0.423	S	S	.	.	H	α-helix	trans	-66.7	-43	179.3	-77.6	-19	0	0	0	111.2	K492 D493 V494 N500	K492-N496 VanDerWaalsContact O-CB 3.29Å; K492-N496 WeakPolarHBondContact O-CB 3.42Å; K492-N496 PolarHBondContact O-N 2.63Å; K492-N496 PolarHBondContact O-ND2 3.04Å; K492-N496 VanDerWaalsContact O-ND2 3.14Å; D493-N496 PolarHBondContact O-N 3.14Å; V494-N496 VanDerWaalsContact C-N 3.35Å; V494-N496 PolarHBondContact O-N 2.85Å; N496-N500 VanDerWaalsContact O-CB 3.3Å; N496-N500 WeakPolarHBondContact O-CB 3.49Å; N496-N500 PolarHBondContact O-N 3.13Å
497	K	83.9	Confident	75	Confident	48 Å²	48	83.5 Å²	83.5	21%	0.209	42%	0.418	C	S	.	.	H	α-helix	trans	-70.1	-41	177.7	-166.8	67.6	171.7	174.9	0	112.1	W449 L454 L457 D493 V494 K499 N500 L501	W449-K497 HydrophobicContact CD2-CB 4.28Å; W449-K497 HydrophobicContact CD2-CD 4.07Å; W449-K497 HydrophobicContact CD2-CG 3.65Å; W449-K497 HydrophobicContact CE3-CG 4.02Å; W449-K497 HydrophobicContact CG-CD 3.97Å; W449-K497 HydrophobicContact CG-CG 4.1Å; W449-K497 HydrophobicContact CH2-CB 3.92Å; W449-K497 HydrophobicContact CH2-CG 4.19Å; W449-K497 HydrophobicContact CZ2-CB 3.48Å; W449-K497 VanDerWaalsContact CZ2-CB 3.48Å; W449-K497 HydrophobicContact CZ2-CG 3.84Å; W449-K497 HydrophobicContact CZ3-CB 4.45Å; W449-K497 HydrophobicContact CZ3-CG 4.24Å; L454-K497 HydrophobicContact CD2-CG 4.36Å; L457-K497 HydrophobicContact CD2-CB 4Å; L457-K497 HydrophobicContact CD2-CG 3.89Å; D493-K497 WeakPolarHBondContact O-CB 3.33Å; D493-K497 PolarHBondContact O-N 3.04Å; V494-K497 PolarHBondContact O-N 3.3Å; K497-K499 PolarHBondContact O-N 3.43Å; K497-N500 PolarHBondContact O-N 2.91Å; K497-L501 HydrophobicContact CG-CD1 4.48Å; K497-L501 WeakPolarHBondContact O-CG 3.36Å; K497-L501 PolarHBondContact O-N 2.87Å
498	A	82.8	Confident	73.9	Confident	14 Å²	14	84 Å²	84	12%	0.116	42%	0.419	C	S	.	.	H	α-helix	trans	-61	-43.6	175.4	0	0	0	0	0	111.8	V461 W472 V494 L501 Q502	V461-A498 HydrophobicContact CG2-CB 4.4Å; W472-A498 HydrophobicContact CH2-CB 4.02Å; W472-A498 HydrophobicContact CZ3-CB 3.88Å; V494-A498 VanDerWaalsContact O-CB 3.23Å; V494-A498 WeakPolarHBondContact O-CB 3.41Å; V494-A498 PolarHBondContact O-N 3.17Å; A498-L501 PolarHBondContact O-N 3.15Å; A498-Q502 WeakPolarHBondContact O-CB 3.21Å; A498-Q502 PolarHBondContact O-N 3.26Å
499	K	80.6	Confident	72.6	Confident	106 Å²	106	78.5 Å²	78.5	46%	0.461	40%	0.395	S	S	.	.	H	α-helix	trans	-64.8	-37.4	174	-75.3	177.3	177	179.8	0	112.5	I495 K497 Q502 K503	I495-K499 HydrophobicContact CG1-CD 4.17Å; I495-K499 HydrophobicContact CG1-CG 4.48Å; I495-K499 WeakPolarHBondContact O-CB 2.9Å; I495-K499 VanDerWaalsContact O-CG 3.28Å; I495-K499 WeakPolarHBondContact O-CG 3.47Å; I495-K499 PolarHBondContact O-N 2.94Å; K497-K499 PolarHBondContact O-N 3.43Å; K499-Q502 PolarHBondContact O-N 3.1Å; K499-K503 WeakPolarHBondContact O-CG 3.49Å; K499-K503 PolarHBondContact O-N 3.18Å
500	N	78.4	Confident	71.2	Confident	90 Å²	90	82.4 Å²	82.4	48%	0.481	42%	0.418	S	S	.	.	H	α-helix	trans	-67.1	-44.4	177.1	-170.1	-67	0	0	0	111.3	N496 K497 Q502 K503	N496-N500 VanDerWaalsContact O-CB 3.3Å; N496-N500 WeakPolarHBondContact O-CB 3.49Å; N496-N500 PolarHBondContact O-N 3.13Å; K497-N500 PolarHBondContact O-N 2.91Å; N500-Q502 VanDerWaalsContact C-N 3.27Å; N500-Q502 PolarHBondContact O-N 3.35Å; N500-K503 WeakPolarHBondContact O-CB 3.35Å; N500-K503 PolarHBondContact O-N 2.84Å; N500-K503 VanDerWaalsContact O-N 3.12Å
501	L	72.4	Confident	69.9	Low	33 Å²	33	81.8 Å²	81.8	17%	0.173	41%	0.409	C	S	.	.	H	α-helix	trans	-61	-37.6	172.5	-71.4	172.9	0	0	0	111.6	L454 L457 K497 A498 K503 L504 K509	L454-L501 HydrophobicContact CD2-CD1 4.16Å; L454-L501 HydrophobicContact CD2-CD2 4.46Å; L457-L501 HydrophobicContact CD2-CD1 3.92Å; K497-L501 HydrophobicContact CG-CD1 4.48Å; K497-L501 WeakPolarHBondContact O-CG 3.36Å; K497-L501 PolarHBondContact O-N 2.87Å; A498-L501 PolarHBondContact O-N 3.15Å; L501-K503 PolarHBondContact O-N 3.03Å; L501-L504 HydrophobicContact CD2-CD1 4.02Å; L501-L504 PolarHBondContact O-N 2.94Å; L501-K509 WeakPolarHBondContact O-CE 3.38Å; L501-K509 PolarHBondContact O-NZ 3.24Å; L501-K509 VanDerWaalsContact O-NZ 3.14Å
502	Q	66.9	Low	68.4	Low	151 Å²	151	83.8 Å²	83.8	71%	0.706	42%	0.416	S	S	*	.	H	α-helix	trans	-63.3	-31.1	177.4	-152.5	170.9	11.6	0	0	112.4	A498 K499 N500 K509	A498-Q502 WeakPolarHBondContact O-CB 3.21Å; A498-Q502 PolarHBondContact O-N 3.26Å; K499-Q502 PolarHBondContact O-N 3.1Å; N500-Q502 VanDerWaalsContact C-N 3.27Å; N500-Q502 PolarHBondContact O-N 3.35Å; Q502-K509 PolarHBondContact O-NZ 3.16Å
503	K	67.8	Low	67.1	Low	184 Å²	184	80.6 Å²	80.6	80%	0.8	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-10.1	178.1	-71.2	178.2	179.6	-171.8	0	115.3	K499 N500 L501	K499-K503 WeakPolarHBondContact O-CG 3.49Å; K499-K503 PolarHBondContact O-N 3.18Å; N500-K503 WeakPolarHBondContact O-CB 3.35Å; N500-K503 PolarHBondContact O-N 2.84Å; N500-K503 VanDerWaalsContact O-N 3.12Å; L501-K503 PolarHBondContact O-N 3.03Å
504	L	55	Low	66.3	Low	55 Å²	55	83.5 Å²	83.5	29%	0.288	41%	0.412	S	S	.	.	S	Bend	trans	-75.7	140.3	174.8	-70.6	165	0	0	0	111.2	L501 K509	L501-L504 HydrophobicContact CD2-CD1 4.02Å; L501-L504 PolarHBondContact O-N 2.94Å; L504-K509 HydrophobicContact CB-CG 4.47Å; L504-K509 WeakPolarHBondContact O-CE 3.49Å; L504-K509 PolarHBondContact O-NZ 2.82Å
505	D	50.9	Low	65.4	Low	100 Å²	100	89.5 Å²	89.5	54%	0.535	44%	0.438	S	S	.	.			trans	-58	138.2	-179.5	-152.8	7.2	0	0	0	110.5	L507 Q508 K509	D505-L507 PolarHBondContact O-N 3.11Å; D505-L507 VanDerWaalsContact O-N 3.1Å; D505-Q508 HydrophobicContact CB-CG 4.37Å; D505-Q508 WeakPolarHBondContact O-CB 3.05Å; D505-Q508 PolarHBondContact O-N 3Å; D505-K509 PolarHBondContact O-N 3.42Å
506	P	55.2	Low	63.9	Low	86 Å²	86	88.5 Å²	88.5	56%	0.558	44%	0.435	S	S	*	.	H	α-helix	trans	-54	-34.6	-173.3	-29	37.6	0	0	0	114.5	Q508 K509 D510	P506-Q508 VanDerWaalsContact C-N 3.31Å; P506-Q508 PolarHBondContact O-N 3.45Å; P506-K509 PolarHBondContact O-N 2.64Å; P506-D510 PolarHBondContact O-N 3.09Å
507	L	51.4	Low	62.5	Low	135 Å²	135	91.7 Å²	91.7	71%	0.707	44%	0.441	S	S	*	.	H	α-helix	trans	-67.4	-29.2	177.6	-67.6	169.9	0	0	0	113.4	D505 E511	D505-L507 PolarHBondContact O-N 3.11Å; D505-L507 VanDerWaalsContact O-N 3.1Å; L507-E511 PolarHBondContact O-N 3.11Å
508	Q	53.3	Low	61.4	Low	106 Å²	106	95 Å²	95	50%	0.495	46%	0.457	S	S	.	.	H	α-helix	trans	-77.8	-29.3	176.8	-67.8	179.9	-29.6	0	0	111.8	D505 P506 I512	D505-Q508 HydrophobicContact CB-CG 4.37Å; D505-Q508 WeakPolarHBondContact O-CB 3.05Å; D505-Q508 PolarHBondContact O-N 3Å; P506-Q508 VanDerWaalsContact C-N 3.31Å; P506-Q508 PolarHBondContact O-N 3.45Å; Q508-I512 WeakPolarHBondContact O-CD1 3.4Å; Q508-I512 VanDerWaalsContact O-CG1 3.26Å; Q508-I512 WeakPolarHBondContact O-CG1 3.34Å; Q508-I512 PolarHBondContact O-N 3.11Å
509	K	53.2	Low	60.2	Low	70 Å²	70	100.7 Å²	100.7	30%	0.304	48%	0.479	S	S	.	.	H	α-helix	trans	-67.6	-40.3	173.4	-73.3	172.5	174.5	131.8	0	111.9	L501 Q502 L504 D505 P506 I512 N513	L501-K509 WeakPolarHBondContact O-CE 3.38Å; L501-K509 PolarHBondContact O-NZ 3.24Å; L501-K509 VanDerWaalsContact O-NZ 3.14Å; Q502-K509 PolarHBondContact O-NZ 3.16Å; L504-K509 HydrophobicContact CB-CG 4.47Å; L504-K509 WeakPolarHBondContact O-CE 3.49Å; L504-K509 PolarHBondContact O-NZ 2.82Å; D505-K509 PolarHBondContact O-N 3.42Å; P506-K509 PolarHBondContact O-N 2.64Å; K509-I512 PolarHBondContact O-N 3.2Å; K509-N513 PolarHBondContact O-N 3.46Å; K509-N513 VanDerWaalsContact O-N 3.15Å
510	D	55	Low	58.8	Low	104 Å²	104	101.9 Å²	101.9	56%	0.556	49%	0.485	S	S	*	.	H	α-helix	trans	-69.2	-37.2	178.6	-70.5	-20.5	0	0	0	112	P506 I512 N513 R514	P506-D510 PolarHBondContact O-N 3.09Å; D510-I512 PolarHBondContact O-N 3.28Å; D510-N513 PolarHBondContact O-N 3.19Å; D510-R514 VanDerWaalsContact O-CB 3.24Å; D510-R514 WeakPolarHBondContact O-CB 3.33Å; D510-R514 PolarHBondContact O-N 3.49Å
511	E	58.3	Low	57.7	Low	63 Å²	63	104.1 Å²	104.1	29%	0.294	49%	0.49	S	S	.	.	H	α-helix	trans	-66.3	-35.2	177	-177.5	60.7	-167.7	0	0	113.2	L507 R514 K515	L507-E511 PolarHBondContact O-N 3.11Å; E511-R514 IonicContact OE1-CZ 3.24Å; E511-R514 IonicContact OE1-NH2 3.48Å; E511-R514 PolarHBondContact OE1-NH2 2.99Å; E511-R514 IonicContact OE2-CZ 3.42Å; E511-R514 VanDerWaalsContact OE2-CZ 3.23Å; E511-R514 IonicContact OE2-NE 3.52Å; E511-R514 PolarHBondContact OE2-NE 2.91Å; E511-R514 IonicContact OE2-NH2 3.63Å; E511-R514 PolarHBondContact OE2-NH2 2.87Å; E511-K515 WeakPolarHBondContact O-CG 3.38Å; E511-K515 PolarHBondContact O-N 3.27Å; E511-K515 VanDerWaalsContact O-N 3.13Å; E511-K515 WeakPolarHBondContact OE1-CE 3.16Å; E511-K515 IonicContact OE1-NZ 2.84Å; E511-K515 PolarHBondContact OE1-NZ 3.41Å
512	I	53.9	Low	57	Low	72 Å²	72	111.5 Å²	111.5	37%	0.369	52%	0.521	S	S	.	.	H	α-helix	trans	-71.1	-46	176	-66.6	165.5	0	0	0	110.3	Q508 K509 D510 R514 K515 A516	Q508-I512 WeakPolarHBondContact O-CD1 3.4Å; Q508-I512 VanDerWaalsContact O-CG1 3.26Å; Q508-I512 WeakPolarHBondContact O-CG1 3.34Å; Q508-I512 PolarHBondContact O-N 3.11Å; K509-I512 PolarHBondContact O-N 3.2Å; D510-I512 PolarHBondContact O-N 3.28Å; I512-R514 VanDerWaalsContact C-N 3.3Å; I512-R514 PolarHBondContact O-N 3.43Å; I512-K515 PolarHBondContact O-N 3.36Å; I512-A516 PolarHBondContact O-N 3.31Å; I512-A516 VanDerWaalsContact O-N 3.07Å
513	N	52.8	Low	56.2	Low	85 Å²	85	110.7 Å²	110.7	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-61.2	-37.4	174.9	-79.6	-26.8	0	0	0	112.5	K509 D510 Y517	K509-N513 PolarHBondContact O-N 3.46Å; K509-N513 VanDerWaalsContact O-N 3.15Å; D510-N513 PolarHBondContact O-N 3.19Å; N513-Y517 WeakPolarHBondContact O-CB 3.49Å; N513-Y517 PolarHBondContact O-N 2.94Å
514	R	67.3	Low	55.4	Low	126 Å²	126	109 Å²	109	48%	0.475	51%	0.512	S	S	.	.	H	α-helix	trans	-65.7	-46	177.7	-172	176.3	73.1	91.1	-5.4	112.3	D510 E511 I512 A516 Y517 E518	D510-R514 VanDerWaalsContact O-CB 3.24Å; D510-R514 WeakPolarHBondContact O-CB 3.33Å; D510-R514 PolarHBondContact O-N 3.49Å; E511-R514 IonicContact OE1-CZ 3.24Å; E511-R514 IonicContact OE1-NH2 3.48Å; E511-R514 PolarHBondContact OE1-NH2 2.99Å; E511-R514 IonicContact OE2-CZ 3.42Å; E511-R514 VanDerWaalsContact OE2-CZ 3.23Å; E511-R514 IonicContact OE2-NE 3.52Å; E511-R514 PolarHBondContact OE2-NE 2.91Å; E511-R514 IonicContact OE2-NH2 3.63Å; E511-R514 PolarHBondContact OE2-NH2 2.87Å; I512-R514 VanDerWaalsContact C-N 3.3Å; I512-R514 PolarHBondContact O-N 3.43Å; R514-A516 VanDerWaalsContact C-N 3.32Å; R514-A516 PolarHBondContact O-N 3.37Å; R514-Y517 PolarHBondContact O-N 3.28Å; R514-E518 IonicContact NH1-OE1 2.98Å; R514-E518 PolarHBondContact O-N 3.22Å; R514-E518 VanDerWaalsContact O-N 3.12Å
515	K	68.2	Low	54.7	Low	126 Å²	126	112.1 Å²	112.1	55%	0.548	53%	0.533	S	S	.	.	H	α-helix	trans	-65.7	-34.5	177.6	-78.7	174.2	173.4	152.3	0	112.7	E511 I512 K519	E511-K515 WeakPolarHBondContact O-CG 3.38Å; E511-K515 PolarHBondContact O-N 3.27Å; E511-K515 VanDerWaalsContact O-N 3.13Å; E511-K515 WeakPolarHBondContact OE1-CE 3.16Å; E511-K515 IonicContact OE1-NZ 2.84Å; E511-K515 PolarHBondContact OE1-NZ 3.41Å; I512-K515 PolarHBondContact O-N 3.36Å; K515-K519 PolarHBondContact O-N 3.05Å
516	A	52.4	Low	54	Low	14 Å²	14	112.4 Å²	112.4	12%	0.116	54%	0.543	C	S	.	.	H	α-helix	trans	-68.7	-40.4	174.9	0	0	0	0	0	112.6	I512 R514 K519 F520	I512-A516 PolarHBondContact O-N 3.31Å; I512-A516 VanDerWaalsContact O-N 3.07Å; R514-A516 VanDerWaalsContact C-N 3.32Å; R514-A516 PolarHBondContact O-N 3.37Å; A516-K519 PolarHBondContact O-N 3.46Å; A516-F520 PolarHBondContact O-N 2.96Å
517	Y	52.6	Low	53	Low	158 Å²	158	114.9 Å²	114.9	62%	0.62	56%	0.556	S	S	*	*	H	α-helix	trans	-66.9	-37.6	177.5	-170.5	-104.2	0	0	0	112.9	N513 R514 F520 K521	N513-Y517 WeakPolarHBondContact O-CB 3.49Å; N513-Y517 PolarHBondContact O-N 2.94Å; R514-Y517 PolarHBondContact O-N 3.28Å; Y517-F520 PolarHBondContact O-N 2.97Å; Y517-K521 PolarHBondContact O-N 3.5Å; Y517-K521 VanDerWaalsContact O-N 3.13Å
518	E	62	Low	52.4	Low	116 Å²	116	113.8 Å²	113.8	54%	0.542	56%	0.558	S	S	.	*	H	α-helix	trans	-67.2	-33.7	175.9	-77	-170.3	177.3	0	0	113.1	R514 K522	R514-E518 IonicContact NH1-OE1 2.98Å; R514-E518 PolarHBondContact O-N 3.22Å; R514-E518 VanDerWaalsContact O-N 3.12Å; E518-K522 PolarHBondContact O-N 3.49Å
519	K	57.1	Low	52.3	Low	134 Å²	134	114.6 Å²	114.6	58%	0.583	57%	0.572	S	S	*	*	H	α-helix	trans	-69	-44.3	176	-165.8	-176.1	176.4	-163.1	0	111.7	K515 A516 K521 K522 E523	K515-K519 PolarHBondContact O-N 3.05Å; A516-K519 PolarHBondContact O-N 3.46Å; K519-K521 VanDerWaalsContact C-N 3.31Å; K519-K521 PolarHBondContact O-N 3.48Å; K519-K522 PolarHBondContact O-N 2.84Å; K519-E523 PolarHBondContact O-N 2.94Å
520	F	51.4	Low	51.2	Low	132 Å²	132	116.2 Å²	116.2	58%	0.579	59%	0.592	S	S	*	*	H	α-helix	trans	-60.4	-38.3	175.9	-177.9	-99.9	0	0	0	112.6	A516 Y517 K522 E523	A516-F520 PolarHBondContact O-N 2.96Å; Y517-F520 PolarHBondContact O-N 2.97Å; F520-K522 VanDerWaalsContact C-N 3.33Å; F520-K522 PolarHBondContact O-N 3.44Å; F520-E523 PolarHBondContact O-N 2.83Å
521	K	55.6	Low	50.2	Low	137 Å²	137	118.1 Å²	118.1	60%	0.596	60%	0.601	S	S	*	*	H	α-helix	trans	-70.8	-27.4	179.3	-155.8	177.2	-177.3	-176.2	0	113.2	Y517 K519	Y517-K521 PolarHBondContact O-N 3.5Å; Y517-K521 VanDerWaalsContact O-N 3.13Å; K519-K521 VanDerWaalsContact C-N 3.31Å; K519-K521 PolarHBondContact O-N 3.48Å
522	K	56.1	Low	48.7	Very low	187 Å²	187	121.5 Å²	121.5	81%	0.813	62%	0.621	S	S	*	*	H	α-helix	trans	-76.5	-29.3	177.8	-111.5	178.4	178.2	175.9	0	113.4	E518 K519 F520	E518-K522 PolarHBondContact O-N 3.49Å; K519-K522 PolarHBondContact O-N 2.84Å; F520-K522 VanDerWaalsContact C-N 3.33Å; F520-K522 PolarHBondContact O-N 3.44Å
523	E	51.8	Low	48.1	Very low	135 Å²	135	124.9 Å²	124.9	63%	0.631	64%	0.64	S	S	*	*	H	α-helix	trans	-87	-7.1	-176.9	-73	177.2	-174.2	0	0	113.9	K519 F520	K519-E523 PolarHBondContact O-N 2.94Å; F520-E523 PolarHBondContact O-N 2.83Å
524	H	50.2	Low	46.8	Very low	147 Å²	147	125.5 Å²	125.5	68%	0.681	66%	0.657	S	S	*	*	S	Bend	trans	-128.9	27.6	-174.3	-82.1	-15.7	0	0	0	116.7
525	T	40.4	Very low	45.6	Very low	121 Å²	121	127.5 Å²	127.5	74%	0.742	68%	0.676	S	S	*	*			trans	-113.5	80.9	170.2	-59.3	0	0	0	0	111.9
526	S	35.4	Very low	43.8	Very low	106 Å²	106	127.4 Å²	127.4	74%	0.741	69%	0.688	S	S	*	*	S	Bend	trans	-165.8	95.4	150.5	57.5	0	0	0	0	112.3
527	V	34.5	Very low	42.7	Very low	138 Å²	138	132.3 Å²	132.3	84%	0.836	72%	0.722	S	S	*	*			trans	34.1	151.5	138.9	-132.1	0	0	0	0	120.4
528	P	38.3	Very low	41.8	Very low	113 Å²	113	133 Å²	133	73%	0.734	73%	0.731	S	S	*	*				-136.7	-153.7	-52.4	52.2	-36.4	0	0	0	111
529	P	52	Low	40.2	Very low	122 Å²	122	139.5 Å²	139.5	79%	0.792	75%	0.75	S	S	*	*			trans	-112.1	134.3	-144.6	35.7	-14.8	0	0	0	116.1
530	S	29.4	Very low	38.9	Very low	104 Å²	104	140.7 Å²	140.7	73%	0.727	76%	0.756	S	S	*	*			trans	-172.4	132.3	146.1	-157.1	0	0	0	0	112.7
531	I	35.2	Very low	37.8	Very low	145 Å²	145	142.5 Å²	142.5	74%	0.744	77%	0.771	S	S	*	*			trans	28.2	114.1	141	-48.2	167.4	0	0	0	117.2
532	D	27.4	Very low	36.8	Very low	134 Å²	134	138.9 Å²	138.9	72%	0.717	77%	0.767	S	S	*	*				178.2	154.3	89.7	-134.6	-19.7	0	0	0	113.3
533	N	40.8	Very low	35.7	Very low	143 Å²	143	137.2 Å²	137.2	77%	0.765	77%	0.773	S	S	*	*			trans	1.8	130.2	162.7	-76.5	-62.8	0	0	0	121.6
534	A	24.1	Very low	34.6	Very low	98 Å²	98	134.8 Å²	134.8	81%	0.81	78%	0.784	S	S	*	*			trans	-152.4	116	143.7	0	0	0	0	0	111.8
535	L	42.7	Very low	33.9	Very low	167 Å²	167	133.2 Å²	133.2	87%	0.874	79%	0.789	S	S	*	*			trans	-63	149.7	169.3	-75.5	151	0	0	0	111.9
536	P	31.1	Very low	33.8	Very low	124 Å²	124	134.4 Å²	134.4	81%	0.805	79%	0.791	S	S	*	*			trans	-113.5	110.3	146.6	-3.5	24.2	0	0	0	112.7
537	S	28.5	Very low	34.1	Very low	118 Å²	118	131.8 Å²	131.8	83%	0.825	78%	0.78	S	S	*	*			trans	31.7	115.2	138.9	-159.5	0	0	0	0	119.2
538	E	34	Very low	35	Very low	173 Å²	173	129 Å²	129	81%	0.808	76%	0.761	S	S	*	*			trans	-55.6	148.1	160.5	-59.5	-171.7	148.2	0	0	112.8
539	R	29.2	Very low	35.9	Very low	252 Å²	252	130.3 Å²	130.3	95%	0.951	77%	0.767	S	S	*	*			trans	-130.3	115.2	147	-157.2	175	-171.9	171	2.5	108.5
540	F	28.5	Very low	36.8	Very low	159 Å²	159	126.5 Å²	126.5	70%	0.697	75%	0.746	S	S	*	*			trans	-72.8	134.9	-176.5	-154.7	-97.5	0	0	0	111.1	A542	F540-A542 HydrophobicContact CE1-CB 3.96Å; F540-A542 HydrophobicContact CZ-CB 4.29Å
541	D	29.7	Very low	39.2	Very low	170 Å²	170	127 Å²	127	91%	0.909	75%	0.746	S	S	*	*			trans	-157.6	130.5	133.3	-102.5	-32	0	0	0	109.8
542	A	33.6	Very low	41.7	Very low	60 Å²	60	122.7 Å²	122.7	50%	0.496	72%	0.721	S	S	.	*			trans	-107	146.6	-166.3	0	0	0	0	0	112.5	F540	F540-A542 HydrophobicContact CE1-CB 3.96Å; F540-A542 HydrophobicContact CZ-CB 4.29Å
543	T	33	Very low	44.7	Very low	153 Å²	153	119.4 Å²	119.4	94%	0.939	71%	0.706	S	S	*	*				164.3	128.1	114.2	40	0	0	0	0	111.8
544	G	29.7	Very low	46.8	Very low	84 Å²	84	118 Å²	118	87%	0.866	70%	0.703	S	S	*	*			trans	126.3	110.7	160.8	0	0	0	0	0	116.6
545	S	34	Very low	49.9	Very low	114 Å²	114	119.5 Å²	119.5	80%	0.797	69%	0.693	S	S	*	*			trans	-69.7	157.3	-165.6	-153.8	0	0	0	0	117.8
546	D	39.7	Very low	52.2	Low	146 Å²	146	112.8 Å²	112.8	78%	0.781	66%	0.657	S	S	*	*	S	Bend	trans	100.3	51.8	156.4	-66	3.8	0	0	0	120.3
547	G	41.5	Very low	55.1	Low	50 Å²	50	108.1 Å²	108.1	52%	0.515	63%	0.625	S	S	.	*			trans	-171.2	128	154.1	0	0	0	0	0	111.5	T549	G547-T549 PolarHBondContact O-N 3.47Å
548	N	53.1	Low	58.2	Low	80 Å²	80	109.5 Å²	109.5	43%	0.428	62%	0.616	S	S	.	*			trans	-64.5	98.6	170.4	-175.5	9.2	0	0	0	108.9	A550 R585	N548-A550 PolarHBondContact O-N 3.46Å; N548-A550 VanDerWaalsContact OD1-CB 3.24Å; N548-A550 WeakPolarHBondContact OD1-CB 3.33Å; N548-A550 PolarHBondContact OD1-N 2.84Å; N548-R585 PolarHBondContact O-NH1 3.11Å
549	T	56	Low	61	Low	140 Å²	140	104.7 Å²	104.7	86%	0.859	60%	0.595	S	S	*	*			trans	-83.3	14.5	179.3	51.1	0	0	0	0	113.3	G547	G547-T549 PolarHBondContact O-N 3.47Å
550	A	71.6	Confident	64.1	Low	42 Å²	42	92.7 Å²	92.7	35%	0.347	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-61.2	136.5	175	0	0	0	0	0	111	N548 R585	N548-A550 PolarHBondContact O-N 3.46Å; N548-A550 VanDerWaalsContact OD1-CB 3.24Å; N548-A550 WeakPolarHBondContact OD1-CB 3.33Å; N548-A550 PolarHBondContact OD1-N 2.84Å; A550-R585 PolarHBondContact O-NH1 2.99Å; A550-R585 PolarHBondContact O-NH2 3.39Å
551	P	80.8	Confident	67.1	Low	114 Å²	114	89.3 Å²	89.3	74%	0.74	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-55.2	143.6	172.6	-21.7	31.6	0	0	0	111.6	T553 R585	P551-T553 PolarHBondContact O-N 3.45Å; P551-R585 PolarHBondContact O-NH2 2.91Å
552	W	86.1	Confident	70.2	Confident	55 Å²	55	86.7 Å²	86.7	21%	0.208	52%	0.518	C	S	.	.	P	Polyproline II helix	trans	-65.3	123.9	176.5	-79.4	76.7	0	0	0	110.5	E556 L560 V582 R585 D589 R593	W552-E556 WeakPolarHBondContact CA-OE2 3.37Å; W552-E556 HydrophobicContact CE3-CB 3.75Å; W552-E556 HydrophobicContact CZ3-CB 4.04Å; W552-L560 HydrophobicContact CH2-CB 4.31Å; W552-L560 HydrophobicContact CH2-CD1 4.48Å; W552-L560 HydrophobicContact CH2-CD2 3.68Å; W552-L560 HydrophobicContact CH2-CG 4.36Å; W552-L560 HydrophobicContact CZ2-CD2 4.31Å; W552-L560 HydrophobicContact CZ3-CB 3.87Å; W552-L560 HydrophobicContact CZ3-CD2 3.78Å; W552-L560 HydrophobicContact CZ3-CG 4.35Å; W552-V582 HydrophobicContact CZ3-CG1 4.3Å; W552-R585 HydrophobicContact CH2-CB 4.11Å; W552-R585 HydrophobicContact CH2-CG 3.79Å; W552-R585 HydrophobicContact CZ2-CG 4.14Å; W552-R585 HydrophobicContact CZ3-CG 4.1Å; W552-D589 HydrophobicContact CZ2-CB 4.43Å; W552-R593 HydrophobicContact CD2-CB 4.48Å; W552-R593 HydrophobicContact CD2-CG 3.88Å; W552-R593 VanDerWaalsContact CE2-CG 3.49Å; W552-R593 HydrophobicContact CE3-CG 4.39Å; W552-R593 HydrophobicContact CG-CG 4.37Å; W552-R593 HydrophobicContact CH2-CB 4.18Å; W552-R593 HydrophobicContact CH2-CG 4.27Å; W552-R593 HydrophobicContact CZ2-CB 3.43Å; W552-R593 VanDerWaalsContact CZ2-CB 3.43Å; W552-R593 HydrophobicContact CZ2-CG 3.71Å
553	T	91.2	Very high	73.1	Confident	66 Å²	66	84 Å²	84	41%	0.405	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-76.7	163.9	172.6	71.5	0	0	0	0	110.9	P551 E555 E556 Q557	P551-T553 PolarHBondContact O-N 3.45Å; T553-E555 PolarHBondContact O-N 3.35Å; T553-E556 PolarHBondContact N-OE2 2.62Å; T553-E556 PolarHBondContact O-N 2.85Å; T553-E556 WeakPolarHBondContact OG1-CB 3.29Å; T553-E556 WeakPolarHBondContact OG1-CG 3.5Å; T553-E556 PolarHBondContact OG1-N 3.29Å; T553-E556 PolarHBondContact OG1-OE2 2.77Å; T553-Q557 WeakPolarHBondContact O-CB 3.48Å; T553-Q557 PolarHBondContact O-N 2.93Å
554	T	85.8	Confident	75.9	Confident	113 Å²	113	78 Å²	78	69%	0.693	46%	0.459	S	S	*	.	H	α-helix	trans	-62.6	-37.4	178.3	-50.3	0	0	0	0	111	K558	T554-K558 WeakPolarHBondContact O-CB 3.42Å; T554-K558 PolarHBondContact O-N 3.03Å
555	E	88.5	Confident	78.9	Confident	130 Å²	130	82.2 Å²	82.2	61%	0.607	45%	0.453	S	S	*	.	H	α-helix	trans	-68.1	-48	179.2	-66.5	69.8	-153.8	0	0	111.4	T553 Q557 K558 L559	T553-E555 PolarHBondContact O-N 3.35Å; E555-Q557 VanDerWaalsContact C-N 3.35Å; E555-Q557 PolarHBondContact O-N 3.21Å; E555-K558 PolarHBondContact O-N 3.45Å; E555-L559 WeakPolarHBondContact O-CG 3.14Å; E555-L559 PolarHBondContact O-N 3.01Å
556	E	91.6	Very high	81.7	Confident	25 Å²	25	80.8 Å²	80.8	12%	0.117	44%	0.44	C	S	.	.	H	α-helix	trans	-61.4	-42.8	176.3	-71	173.6	138.4	0	0	111.8	W552 T553 K558 L559 L560 R585	W552-E556 WeakPolarHBondContact CA-OE2 3.37Å; W552-E556 HydrophobicContact CE3-CB 3.75Å; W552-E556 HydrophobicContact CZ3-CB 4.04Å; T553-E556 PolarHBondContact N-OE2 2.62Å; T553-E556 PolarHBondContact O-N 2.85Å; T553-E556 WeakPolarHBondContact OG1-CB 3.29Å; T553-E556 WeakPolarHBondContact OG1-CG 3.5Å; T553-E556 PolarHBondContact OG1-N 3.29Å; T553-E556 PolarHBondContact OG1-OE2 2.77Å; E556-K558 VanDerWaalsContact C-N 3.32Å; E556-K558 PolarHBondContact O-N 3.18Å; E556-L559 PolarHBondContact O-N 2.9Å; E556-L560 PolarHBondContact O-N 3.23Å; E556-R585 IonicContact OE1-CZ 3.13Å; E556-R585 IonicContact OE1-NE 3.72Å; E556-R585 PolarHBondContact OE1-NE 2.87Å; E556-R585 IonicContact OE1-NH2 3.72Å; E556-R585 PolarHBondContact OE1-NH2 2.98Å; E556-R585 IonicContact OE2-CZ 3.27Å; E556-R585 IonicContact OE2-NE 3.35Å; E556-R585 PolarHBondContact OE2-NE 2.99Å; E556-R585 IonicContact OE2-NH2 3.48Å; E556-R585 PolarHBondContact OE2-NH2 2.84Å
557	Q	91.8	Very high	84.2	Confident	27 Å²	27	77.2 Å²	77.2	13%	0.126	42%	0.415	C	S	.	.	H	α-helix	trans	-62.9	-40.7	177.9	179.9	65.3	39.2	0	0	111.1	T553 E555 L560 E561 R593	T553-Q557 WeakPolarHBondContact O-CB 3.48Å; T553-Q557 PolarHBondContact O-N 2.93Å; E555-Q557 VanDerWaalsContact C-N 3.35Å; E555-Q557 PolarHBondContact O-N 3.21Å; Q557-L560 PolarHBondContact O-N 2.92Å; Q557-E561 PolarHBondContact NE2-OE1 3.25Å; Q557-E561 WeakPolarHBondContact O-CG 3.39Å; Q557-E561 PolarHBondContact O-N 3.3Å; Q557-R593 VanDerWaalsContact OE1-NE 3.08Å
558	K	92.6	Very high	86.5	Confident	146 Å²	146	78.3 Å²	78.3	64%	0.635	41%	0.414	S	S	*	.	H	α-helix	trans	-65.1	-41.4	176.6	-172.5	-179.8	178.5	-175.4	0	111.9	T554 E555 E556 E561 Q562	T554-K558 WeakPolarHBondContact O-CB 3.42Å; T554-K558 PolarHBondContact O-N 3.03Å; E555-K558 PolarHBondContact O-N 3.45Å; E556-K558 VanDerWaalsContact C-N 3.32Å; E556-K558 PolarHBondContact O-N 3.18Å; K558-E561 PolarHBondContact O-N 2.87Å; K558-Q562 WeakPolarHBondContact O-CB 3.31Å; K558-Q562 PolarHBondContact O-N 3.4Å
559	L	93.3	Very high	88.1	Confident	73 Å²	73	79.6 Å²	79.6	38%	0.382	42%	0.424	S	S	.	.	H	α-helix	trans	-63.8	-43.7	175.6	-71.8	172.6	0	0	0	111.7	E555 E556 E561 Q562 A563 V582	E555-L559 WeakPolarHBondContact O-CG 3.14Å; E555-L559 PolarHBondContact O-N 3.01Å; E556-L559 PolarHBondContact O-N 2.9Å; L559-E561 PolarHBondContact O-N 3.5Å; L559-Q562 PolarHBondContact O-N 2.87Å; L559-A563 VanDerWaalsContact O-CB 3.31Å; L559-A563 WeakPolarHBondContact O-CB 3.5Å; L559-A563 PolarHBondContact O-N 3.03Å; L559-V582 HydrophobicContact CB-CG2 4.09Å
560	L	93.3	Very high	89.6	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-60.8	-46.1	175.7	178.6	66.6	0	0	0	111.7	W552 E556 Q557 Q562 A563 L564 I578 V582 C590 R593 L597	W552-L560 HydrophobicContact CH2-CB 4.31Å; W552-L560 HydrophobicContact CH2-CD1 4.48Å; W552-L560 HydrophobicContact CH2-CD2 3.68Å; W552-L560 HydrophobicContact CH2-CG 4.36Å; W552-L560 HydrophobicContact CZ2-CD2 4.31Å; W552-L560 HydrophobicContact CZ3-CB 3.87Å; W552-L560 HydrophobicContact CZ3-CD2 3.78Å; W552-L560 HydrophobicContact CZ3-CG 4.35Å; E556-L560 PolarHBondContact O-N 3.23Å; Q557-L560 PolarHBondContact O-N 2.92Å; L560-Q562 VanDerWaalsContact C-N 3.34Å; L560-Q562 PolarHBondContact O-N 3.38Å; L560-A563 PolarHBondContact O-N 3.26Å; L560-L564 HydrophobicContact CD1-CD1 4.2Å; L560-L564 HydrophobicContact CD1-CG 4.32Å; L560-L564 HydrophobicContact CG-CD1 3.93Å; L560-L564 HydrophobicContact CG-CG 4.48Å; L560-L564 WeakPolarHBondContact O-CB 3.4Å; L560-L564 WeakPolarHBondContact O-CG 3.46Å; L560-L564 PolarHBondContact O-N 3.21Å; L560-I578 HydrophobicContact CD1-CG2 3.75Å; L560-V582 HydrophobicContact CB-CG2 4.23Å; L560-C590 HydrophobicContact CD1-CB 3.85Å; L560-R593 HydrophobicContact CD2-CB 3.87Å; L560-R593 HydrophobicContact CD2-CG 3.57Å; L560-L597 HydrophobicContact CD2-CD1 4.43Å
561	E	93	Very high	90.4	Very high	88 Å²	88	79.8 Å²	79.8	41%	0.411	42%	0.415	S	S	.	.	H	α-helix	trans	-64.7	-38.1	178.4	-74.5	177.2	-164.4	0	0	112.6	Q557 K558 L559 K565	Q557-E561 PolarHBondContact NE2-OE1 3.25Å; Q557-E561 WeakPolarHBondContact O-CG 3.39Å; Q557-E561 PolarHBondContact O-N 3.3Å; K558-E561 PolarHBondContact O-N 2.87Å; L559-E561 PolarHBondContact O-N 3.5Å; E561-K565 WeakPolarHBondContact O-CG 3.15Å; E561-K565 PolarHBondContact O-N 3.49Å
562	Q	93.8	Very high	90.6	Very high	114 Å²	114	79 Å²	79	53%	0.533	41%	0.411	S	S	.	.	H	α-helix	trans	-65.9	-47.4	174.2	-175.8	173.9	-10.3	0	0	110.8	K558 L559 L560 L564 K565 T566	K558-Q562 WeakPolarHBondContact O-CB 3.31Å; K558-Q562 PolarHBondContact O-N 3.4Å; L559-Q562 PolarHBondContact O-N 2.87Å; L560-Q562 VanDerWaalsContact C-N 3.34Å; L560-Q562 PolarHBondContact O-N 3.38Å; Q562-L564 VanDerWaalsContact C-N 3.32Å; Q562-L564 PolarHBondContact O-N 2.85Å; Q562-K565 WeakPolarHBondContact O-CB 3.5Å; Q562-K565 PolarHBondContact O-N 2.92Å; Q562-K565 VanDerWaalsContact O-N 3.12Å; Q562-T566 PolarHBondContact O-N 3.48Å; Q562-T566 PolarHBondContact O-OG1 2.94Å
563	A	93.9	Very high	90.8	Very high	4 Å²	4	82.6 Å²	82.6	3%	0.033	43%	0.43	C	S	.	.	H	α-helix	trans	-60.9	-39.5	177.7	0	0	0	0	0	112.4	L559 L560 K565 T566 Y567 I578 A581	L559-A563 VanDerWaalsContact O-CB 3.31Å; L559-A563 WeakPolarHBondContact O-CB 3.5Å; L559-A563 PolarHBondContact O-N 3.03Å; L560-A563 PolarHBondContact O-N 3.26Å; A563-K565 VanDerWaalsContact C-N 3.29Å; A563-K565 PolarHBondContact O-N 3.01Å; A563-T566 PolarHBondContact O-N 3.02Å; A563-Y567 HydrophobicContact CB-CD2 4.48Å; A563-Y567 VanDerWaalsContact O-CD2 3.28Å; A563-Y567 WeakPolarHBondContact O-CD2 3.46Å; A563-Y567 PolarHBondContact O-N 2.9Å; A563-I578 HydrophobicContact CB-CB 4.43Å; A563-I578 HydrophobicContact CB-CG1 4.26Å; A563-I578 HydrophobicContact CB-CG2 4.13Å; A563-A581 HydrophobicContact CB-CB 3.76Å
564	L	93.1	Very high	90.8	Very high	28 Å²	28	80.8 Å²	80.8	15%	0.147	42%	0.415	C	S	.	.	H	α-helix	trans	-65	-29.8	176.1	-76.4	167.5	0	0	0	113.4	L560 Q562 W575 I578 Y594	L560-L564 HydrophobicContact CD1-CD1 4.2Å; L560-L564 HydrophobicContact CD1-CG 4.32Å; L560-L564 HydrophobicContact CG-CD1 3.93Å; L560-L564 HydrophobicContact CG-CG 4.48Å; L560-L564 WeakPolarHBondContact O-CB 3.4Å; L560-L564 WeakPolarHBondContact O-CG 3.46Å; L560-L564 PolarHBondContact O-N 3.21Å; Q562-L564 VanDerWaalsContact C-N 3.32Å; Q562-L564 PolarHBondContact O-N 2.85Å; L564-W575 HydrophobicContact CD2-CH2 4.14Å; L564-W575 HydrophobicContact CD2-CZ3 4.21Å; L564-I578 HydrophobicContact CD2-CD1 3.76Å; L564-I578 HydrophobicContact CG-CD1 4.49Å; L564-Y594 HydrophobicContact CD1-CD2 3.73Å; L564-Y594 HydrophobicContact CD1-CE2 4.38Å; L564-Y594 HydrophobicContact CD2-CD2 3.67Å; L564-Y594 HydrophobicContact CD2-CE2 3.97Å; L564-Y594 HydrophobicContact CD2-CG 4.39Å; L564-Y594 HydrophobicContact CG-CD2 4.38Å
565	K	92.4	Very high	91.2	Very high	172 Å²	172	78.1 Å²	78.1	75%	0.748	39%	0.392	S	S	*	.	H	α-helix	trans	-77	-40.4	172.7	-72.1	172.5	-178.1	172.2	0	111.6	E561 Q562 A563	E561-K565 WeakPolarHBondContact O-CG 3.15Å; E561-K565 PolarHBondContact O-N 3.49Å; Q562-K565 WeakPolarHBondContact O-CB 3.5Å; Q562-K565 PolarHBondContact O-N 2.92Å; Q562-K565 VanDerWaalsContact O-N 3.12Å; A563-K565 VanDerWaalsContact C-N 3.29Å; A563-K565 PolarHBondContact O-N 3.01Å
566	T	92.3	Very high	91.4	Very high	84 Å²	84	75.8 Å²	75.8	52%	0.515	38%	0.382	S	S	.	.	H	α-helix	trans	-69.2	-33.2	-179.3	-54.7	0	0	0	0	112.7	Q562 A563 P568	Q562-T566 PolarHBondContact O-N 3.48Å; Q562-T566 PolarHBondContact O-OG1 2.94Å; A563-T566 PolarHBondContact O-N 3.02Å; T566-P568 WeakPolarHBondContact O-CD 3.42Å
567	Y	93.5	Very high	91.4	Very high	70 Å²	70	78 Å²	78	28%	0.275	39%	0.391	S	S	.	.	S	Bend	trans	-116.7	92.2	-179.5	-53.7	-62.6	0	0	0	111.5	A563 T571 R574 K577 I578	A563-Y567 HydrophobicContact CB-CD2 4.48Å; A563-Y567 VanDerWaalsContact O-CD2 3.28Å; A563-Y567 WeakPolarHBondContact O-CD2 3.46Å; A563-Y567 PolarHBondContact O-N 2.9Å; Y567-T571 HydrophobicContact CD1-CG2 4.16Å; Y567-R574 PolarHBondContact O-NE 2.8Å; Y567-R574 PolarHBondContact O-NH2 3.43Å; Y567-K577 HydrophobicContact CD1-CB 4.17Å; Y567-K577 HydrophobicContact CD1-CD 4.22Å; Y567-K577 HydrophobicContact CD2-CB 4.03Å; Y567-K577 HydrophobicContact CE1-CB 4Å; Y567-K577 HydrophobicContact CE1-CD 4.07Å; Y567-K577 HydrophobicContact CE2-CB 3.84Å; Y567-K577 VanDerWaalsContact CE2-O 3.29Å; Y567-K577 WeakPolarHBondContact CE2-O 3.28Å; Y567-K577 HydrophobicContact CG-CB 4.18Å; Y567-I578 HydrophobicContact CD2-CG1 3.88Å; Y567-I578 HydrophobicContact CG-CG1 4.49Å
568	P	89.9	Confident	91.5	Very high	74 Å²	74	76.7 Å²	76.7	48%	0.481	39%	0.385	S	S	.	.			trans	-63.4	171.4	176.1	-21.6	32.4	0	0	0	114	T566 N570 T571 R574	T566-P568 WeakPolarHBondContact O-CD 3.42Å; P568-N570 PolarHBondContact O-N 3.05Å; P568-N570 VanDerWaalsContact O-N 3.11Å; P568-T571 WeakPolarHBondContact CD-OG1 3.36Å; P568-T571 WeakPolarHBondContact O-CB 3.45Å; P568-T571 PolarHBondContact O-N 2.91Å; P568-T571 VanDerWaalsContact O-N 3.09Å; P568-T571 PolarHBondContact O-OG1 3.08Å; P568-T571 VanDerWaalsContact O-OG1 3.09Å; P568-R574 VanDerWaalsContact O-CD 3.27Å; P568-R574 WeakPolarHBondContact O-CD 3.34Å; P568-R574 PolarHBondContact O-NE 3.29Å
569	V	86.3	Confident	91.5	Very high	106 Å²	106	70.4 Å²	70.4	64%	0.642	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-30.7	-175.9	-177.2	0	0	0	0	113.3	T571	V569-T571 VanDerWaalsContact C-N 3.31Å; V569-T571 PolarHBondContact O-N 3.23Å
570	N	86.9	Confident	91.5	Very high	153 Å²	153	73.1 Å²	73.1	82%	0.818	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	3.7	-176.6	-62.4	-10.5	0	0	0	113.8	P568 P572	P568-N570 PolarHBondContact O-N 3.05Å; P568-N570 VanDerWaalsContact O-N 3.11Å; N570-P572 WeakPolarHBondContact O-CD 3.23Å
571	T	88.9	Confident	91.3	Very high	34 Å²	34	74.9 Å²	74.9	21%	0.209	39%	0.389	C	S	.	.	S	Bend	trans	-73.4	123.6	179	-57.4	0	0	0	0	110.5	Y567 P568 V569 E573 R574 K577	Y567-T571 HydrophobicContact CD1-CG2 4.16Å; P568-T571 WeakPolarHBondContact CD-OG1 3.36Å; P568-T571 WeakPolarHBondContact O-CB 3.45Å; P568-T571 PolarHBondContact O-N 2.91Å; P568-T571 VanDerWaalsContact O-N 3.09Å; P568-T571 PolarHBondContact O-OG1 3.08Å; P568-T571 VanDerWaalsContact O-OG1 3.09Å; V569-T571 VanDerWaalsContact C-N 3.31Å; V569-T571 PolarHBondContact O-N 3.23Å; T571-E573 PolarHBondContact O-N 2.85Å; T571-R574 WeakPolarHBondContact O-CB 3.34Å; T571-R574 PolarHBondContact O-N 2.88Å; T571-K577 HydrophobicContact CG2-CD 4.09Å
572	P	83.9	Confident	91.3	Very high	98 Å²	98	70.8 Å²	70.8	64%	0.636	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	137.7	170.8	-22.2	33.4	0	0	0	110.7	N570 R574 K577	N570-P572 WeakPolarHBondContact O-CD 3.23Å; P572-R574 PolarHBondContact O-N 3.22Å; P572-K577 PolarHBondContact O-NZ 3.45Å
573	E	90.1	Very high	90.7	Very high	130 Å²	130	70.5 Å²	70.5	61%	0.607	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	29.6	-177.8	-63.8	166.6	-179.8	0	0	113.3	T571 W575 E576 K577	T571-E573 PolarHBondContact O-N 2.85Å; E573-W575 PolarHBondContact O-N 2.84Å; E573-E576 HydrophobicContact CB-CB 4.43Å; E573-E576 WeakPolarHBondContact O-CB 3.39Å; E573-E576 PolarHBondContact O-N 2.9Å; E573-K577 PolarHBondContact O-N 3.06Å
574	R	93.1	Very high	90.2	Very high	28 Å²	28	77 Å²	77	11%	0.106	41%	0.408	C	S	.	.	H	α-helix	trans	-41.4	-48.7	-176.9	-173.1	-175.7	-175.7	-160.9	-0.3	113.9	Y567 P568 T571 P572 K577 I578	Y567-R574 PolarHBondContact O-NE 2.8Å; Y567-R574 PolarHBondContact O-NH2 3.43Å; P568-R574 VanDerWaalsContact O-CD 3.27Å; P568-R574 WeakPolarHBondContact O-CD 3.34Å; P568-R574 PolarHBondContact O-NE 3.29Å; T571-R574 WeakPolarHBondContact O-CB 3.34Å; T571-R574 PolarHBondContact O-N 2.88Å; P572-R574 PolarHBondContact O-N 3.22Å; R574-K577 PolarHBondContact O-N 2.91Å; R574-I578 HydrophobicContact CG-CD1 3.72Å; R574-I578 VanDerWaalsContact O-CG1 3.22Å; R574-I578 WeakPolarHBondContact O-CG1 3.17Å; R574-I578 PolarHBondContact O-N 3.45Å
575	W	93.1	Very high	89.9	Confident	56 Å²	56	76.1 Å²	76.1	21%	0.212	40%	0.403	C	S	.	.	H	α-helix	trans	-75	-25	-173.3	-70.2	115.7	0	0	0	113.7	L564 E573 I578 A579 K587 M591 Y594	L564-W575 HydrophobicContact CD2-CH2 4.14Å; L564-W575 HydrophobicContact CD2-CZ3 4.21Å; E573-W575 PolarHBondContact O-N 2.84Å; W575-I578 HydrophobicContact CD2-CD1 4.41Å; W575-I578 HydrophobicContact CE3-CB 4.42Å; W575-I578 HydrophobicContact CE3-CD1 3.81Å; W575-I578 HydrophobicContact CE3-CG2 4.39Å; W575-I578 HydrophobicContact CZ3-CD1 3.9Å; W575-I578 HydrophobicContact CZ3-CG2 4.46Å; W575-A579 WeakPolarHBondContact O-CB 3.36Å; W575-A579 PolarHBondContact O-N 3.41Å; W575-A579 VanDerWaalsContact O-N 3.12Å; W575-K587 HydrophobicContact CB-CD 4.23Å; W575-K587 HydrophobicContact CB-CG 3.77Å; W575-M591 HydrophobicContact CB-CG 4.43Å; W575-M591 HydrophobicContact CB-SD 4.39Å; W575-M591 HydrophobicContact CD2-CG 3.38Å; W575-M591 HydrophobicContact CD2-SD 4.1Å; W575-M591 HydrophobicContact CE3-CG 3.5Å; W575-M591 VanDerWaalsContact CE3-CG 3.5Å; W575-M591 HydrophobicContact CG-CG 3.82Å; W575-M591 HydrophobicContact CG-SD 3.91Å; W575-M591 HydrophobicContact CH2-CG 4.24Å; W575-M591 HydrophobicContact CZ2-CG 4.12Å; W575-M591 HydrophobicContact CZ3-CG 3.94Å; W575-Y594 AromaticContact CH2-CD1 3.58Å; W575-Y594 HydrophobicContact CH2-CD1 3.58Å; W575-Y594 HydrophobicContact CH2-CD2 4.25Å; W575-Y594 HydrophobicContact CH2-CE1 4.25Å; W575-Y594 AromaticContact CH2-CG 3.56Å; W575-Y594 HydrophobicContact CH2-CG 3.56Å; W575-Y594 AromaticContact CZ2-CD1 3.91Å; W575-Y594 HydrophobicContact CZ2-CD1 3.91Å; W575-Y594 HydrophobicContact CZ2-CE1 4.28Å; W575-Y594 HydrophobicContact CZ2-CG 4.35Å; W575-Y594 HydrophobicContact CZ3-CG 4.49Å
576	E	92.8	Very high	89.8	Confident	82 Å²	82	70.5 Å²	70.5	38%	0.383	39%	0.385	S	S	.	.	H	α-helix	trans	-70.9	-48.6	171.6	-77.4	153.2	-147.8	0	0	109.5	E573 I578 A579 D580 K587	E573-E576 HydrophobicContact CB-CB 4.43Å; E573-E576 WeakPolarHBondContact O-CB 3.39Å; E573-E576 PolarHBondContact O-N 2.9Å; E576-I578 VanDerWaalsContact C-N 3.27Å; E576-I578 PolarHBondContact O-N 2.89Å; E576-A579 WeakPolarHBondContact O-CB 3.33Å; E576-A579 PolarHBondContact O-N 2.89Å; E576-D580 VanDerWaalsContact O-CG 3.3Å; E576-D580 PolarHBondContact O-N 3.37Å; E576-K587 HydrophobicContact CG-CD 4.06Å; E576-K587 IonicContact OE1-NZ 2.77Å; E576-K587 PolarHBondContact OE1-NZ 3.29Å
577	K	92.1	Very high	89.8	Confident	71 Å²	71	70.4 Å²	70.4	31%	0.309	38%	0.378	S	S	.	.	H	α-helix	trans	-61.4	-31.7	175.9	-66	175.4	179.9	155.5	0	114.1	Y567 T571 P572 E573 R574 A581	Y567-K577 HydrophobicContact CD1-CB 4.17Å; Y567-K577 HydrophobicContact CD1-CD 4.22Å; Y567-K577 HydrophobicContact CD2-CB 4.03Å; Y567-K577 HydrophobicContact CE1-CB 4Å; Y567-K577 HydrophobicContact CE1-CD 4.07Å; Y567-K577 HydrophobicContact CE2-CB 3.84Å; Y567-K577 VanDerWaalsContact CE2-O 3.29Å; Y567-K577 WeakPolarHBondContact CE2-O 3.28Å; Y567-K577 HydrophobicContact CG-CB 4.18Å; T571-K577 HydrophobicContact CG2-CD 4.09Å; P572-K577 PolarHBondContact O-NZ 3.45Å; E573-K577 PolarHBondContact O-N 3.06Å; R574-K577 PolarHBondContact O-N 2.91Å; K577-A581 PolarHBondContact O-N 2.95Å
578	I	93.1	Very high	89.6	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-71.5	-41.6	173.8	-71.3	166.7	0	0	0	111	L560 A563 L564 Y567 R574 W575 E576 A581 V582 C590	L560-I578 HydrophobicContact CD1-CG2 3.75Å; A563-I578 HydrophobicContact CB-CB 4.43Å; A563-I578 HydrophobicContact CB-CG1 4.26Å; A563-I578 HydrophobicContact CB-CG2 4.13Å; L564-I578 HydrophobicContact CD2-CD1 3.76Å; L564-I578 HydrophobicContact CG-CD1 4.49Å; Y567-I578 HydrophobicContact CD2-CG1 3.88Å; Y567-I578 HydrophobicContact CG-CG1 4.49Å; R574-I578 HydrophobicContact CG-CD1 3.72Å; R574-I578 VanDerWaalsContact O-CG1 3.22Å; R574-I578 WeakPolarHBondContact O-CG1 3.17Å; R574-I578 PolarHBondContact O-N 3.45Å; W575-I578 HydrophobicContact CD2-CD1 4.41Å; W575-I578 HydrophobicContact CE3-CB 4.42Å; W575-I578 HydrophobicContact CE3-CD1 3.81Å; W575-I578 HydrophobicContact CE3-CG2 4.39Å; W575-I578 HydrophobicContact CZ3-CD1 3.9Å; W575-I578 HydrophobicContact CZ3-CG2 4.46Å; E576-I578 VanDerWaalsContact C-N 3.27Å; E576-I578 PolarHBondContact O-N 2.89Å; I578-A581 PolarHBondContact O-N 3.12Å; I578-V582 PolarHBondContact O-N 2.98Å; I578-C590 HydrophobicContact CG2-CB 4.07Å
579	A	92.9	Very high	89.5	Confident	14 Å²	14	72.1 Å²	72.1	12%	0.116	38%	0.38	C	S	.	.	H	α-helix	trans	-65.5	-40.3	178.1	0	0	0	0	0	111.5	W575 E576 A581 V582 K587	W575-A579 WeakPolarHBondContact O-CB 3.36Å; W575-A579 PolarHBondContact O-N 3.41Å; W575-A579 VanDerWaalsContact O-N 3.12Å; E576-A579 WeakPolarHBondContact O-CB 3.33Å; E576-A579 PolarHBondContact O-N 2.89Å; A579-A581 PolarHBondContact O-N 3.17Å; A579-V582 CarbonylContact O-C 3.58Å; A579-V582 VanDerWaalsContact O-C 3.29Å; A579-V582 PolarHBondContact O-N 3.15Å; A579-V582 VanDerWaalsContact O-O 3.12Å; A579-K587 HydrophobicContact CB-CB 4.14Å
580	D	92.5	Very high	89.7	Confident	130 Å²	130	67.1 Å²	67.1	70%	0.695	35%	0.35	S	S	*	.	H	α-helix	trans	-61.3	-27.4	176.5	-64.7	-19.4	0	0	0	112.8	E576 V582	E576-D580 VanDerWaalsContact O-CG 3.3Å; E576-D580 PolarHBondContact O-N 3.37Å; D580-V582 VanDerWaalsContact C-N 3.32Å
581	A	90.9	Very high	89.8	Confident	36 Å²	36	62.7 Å²	62.7	30%	0.298	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-4.8	176.1	0	0	0	0	0	113.7	A563 K577 I578 A579	A563-A581 HydrophobicContact CB-CB 3.76Å; K577-A581 PolarHBondContact O-N 2.95Å; I578-A581 PolarHBondContact O-N 3.12Å; A579-A581 PolarHBondContact O-N 3.17Å
582	V	92.6	Very high	89.7	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.012	34%	0.343	C	S	.	.	S	Bend	trans	-131.1	78.2	178	-167.6	0	0	0	0	108.9	W552 L559 L560 I578 A579 D580 E584 R585	W552-V582 HydrophobicContact CZ3-CG1 4.3Å; L559-V582 HydrophobicContact CB-CG2 4.09Å; L560-V582 HydrophobicContact CB-CG2 4.23Å; I578-V582 PolarHBondContact O-N 2.98Å; A579-V582 CarbonylContact O-C 3.58Å; A579-V582 VanDerWaalsContact O-C 3.29Å; A579-V582 PolarHBondContact O-N 3.15Å; A579-V582 VanDerWaalsContact O-O 3.12Å; D580-V582 VanDerWaalsContact C-N 3.32Å; V582-E584 VanDerWaalsContact C-N 3.27Å; V582-E584 PolarHBondContact O-N 3.05Å; V582-R585 HydrophobicContact CB-CB 4.33Å; V582-R585 HydrophobicContact CG1-CB 3.72Å; V582-R585 HydrophobicContact CG1-CG 3.74Å; V582-R585 PolarHBondContact O-N 3.42Å
583	P	81.3	Confident	90.1	Very high	109 Å²	109	65.6 Å²	65.6	71%	0.708	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-31	-163.8	-27.8	35.2	0	0	0	116.1	R585	P583-R585 VanDerWaalsContact C-N 3.35Å
584	E	82.7	Confident	90.1	Very high	139 Å²	139	63 Å²	63	65%	0.65	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	0.7	-177.9	-63.5	-62.3	150	0	0	113.6	V582	V582-E584 VanDerWaalsContact C-N 3.27Å; V582-E584 PolarHBondContact O-N 3.05Å
585	R	86.8	Confident	89.8	Confident	10 Å²	10	68.7 Å²	68.7	4%	0.038	33%	0.334	C	S	.	.	S	Bend	trans	-128	129.7	-174.2	-61.6	-63.4	179.4	161.7	6.2	111.9	N548 A550 P551 W552 E556 V582 P583 D589	N548-R585 PolarHBondContact O-NH1 3.11Å; A550-R585 PolarHBondContact O-NH1 2.99Å; A550-R585 PolarHBondContact O-NH2 3.39Å; P551-R585 PolarHBondContact O-NH2 2.91Å; W552-R585 HydrophobicContact CH2-CB 4.11Å; W552-R585 HydrophobicContact CH2-CG 3.79Å; W552-R585 HydrophobicContact CZ2-CG 4.14Å; W552-R585 HydrophobicContact CZ3-CG 4.1Å; E556-R585 IonicContact OE1-CZ 3.13Å; E556-R585 IonicContact OE1-NE 3.72Å; E556-R585 PolarHBondContact OE1-NE 2.87Å; E556-R585 IonicContact OE1-NH2 3.72Å; E556-R585 PolarHBondContact OE1-NH2 2.98Å; E556-R585 IonicContact OE2-CZ 3.27Å; E556-R585 IonicContact OE2-NE 3.35Å; E556-R585 PolarHBondContact OE2-NE 2.99Å; E556-R585 IonicContact OE2-NH2 3.48Å; E556-R585 PolarHBondContact OE2-NH2 2.84Å; V582-R585 HydrophobicContact CB-CB 4.33Å; V582-R585 HydrophobicContact CG1-CB 3.72Å; V582-R585 HydrophobicContact CG1-CG 3.74Å; V582-R585 PolarHBondContact O-N 3.42Å; P583-R585 VanDerWaalsContact C-N 3.35Å; R585-D589 HydrophobicContact CB-CB 4.25Å
586	S	90.9	Very high	89.5	Confident	55 Å²	55	69.1 Å²	69.1	39%	0.385	34%	0.338	S	S	.	.			trans	-71.1	163.7	178.9	74.4	0	0	0	0	112	K588 D589 C590	S586-K588 PolarHBondContact O-N 3.32Å; S586-K588 VanDerWaalsContact O-N 3.16Å; S586-K588 PolarHBondContact OG-N 3.06Å; S586-D589 WeakPolarHBondContact CB-OD2 3.21Å; S586-D589 PolarHBondContact N-OD2 3.18Å; S586-D589 PolarHBondContact O-N 3.29Å; S586-D589 PolarHBondContact OG-N 3.15Å; S586-D589 PolarHBondContact OG-OD2 2.84Å; S586-C590 PolarHBondContact O-N 2.97Å; S586-C590 PolarHBondContact O-SG 3.25Å
587	K	92	Very high	89	Confident	82 Å²	82	67 Å²	67	36%	0.357	33%	0.329	S	S	.	.	H	α-helix	trans	-47.3	-42	167.7	-171.4	-175.3	-176.3	174	0	112	W575 E576 A579 M591	W575-K587 HydrophobicContact CB-CD 4.23Å; W575-K587 HydrophobicContact CB-CG 3.77Å; E576-K587 HydrophobicContact CG-CD 4.06Å; E576-K587 IonicContact OE1-NZ 2.77Å; E576-K587 PolarHBondContact OE1-NZ 3.29Å; A579-K587 HydrophobicContact CB-CB 4.14Å; K587-M591 HydrophobicContact CG-CE 3.99Å; K587-M591 WeakPolarHBondContact O-CB 3.43Å; K587-M591 WeakPolarHBondContact O-CE 3.18Å; K587-M591 WeakPolarHBondContact O-CG 3.5Å; K587-M591 PolarHBondContact O-N 2.96Å; K587-M591 VanDerWaalsContact O-N 3.07Å
588	K	89.3	Confident	88.6	Confident	153 Å²	153	65.8 Å²	65.8	67%	0.665	33%	0.328	S	S	*	.	H	α-helix	trans	-67.5	-39.6	-179.1	-167.7	179.9	177.6	-174	0	111.5	S586 M591 K592	S586-K588 PolarHBondContact O-N 3.32Å; S586-K588 VanDerWaalsContact O-N 3.16Å; S586-K588 PolarHBondContact OG-N 3.06Å; K588-M591 PolarHBondContact O-N 2.78Å; K588-K592 WeakPolarHBondContact O-CB 3.3Å; K588-K592 PolarHBondContact O-N 3.48Å
589	D	87.9	Confident	88.2	Confident	27 Å²	27	72.3 Å²	72.3	14%	0.144	36%	0.358	C	S	.	.	H	α-helix	trans	-68.9	-44	178.7	-57.8	-42.9	0	0	0	111.5	W552 R585 S586 M591 K592 R593	W552-D589 HydrophobicContact CZ2-CB 4.43Å; R585-D589 HydrophobicContact CB-CB 4.25Å; S586-D589 WeakPolarHBondContact CB-OD2 3.21Å; S586-D589 PolarHBondContact N-OD2 3.18Å; S586-D589 PolarHBondContact O-N 3.29Å; S586-D589 PolarHBondContact OG-N 3.15Å; S586-D589 PolarHBondContact OG-OD2 2.84Å; D589-M591 VanDerWaalsContact C-N 3.35Å; D589-M591 PolarHBondContact O-N 3.25Å; D589-K592 PolarHBondContact O-N 2.79Å; D589-R593 WeakPolarHBondContact O-CB 2.99Å; D589-R593 PolarHBondContact O-N 3.01Å
590	C	90.4	Very high	87.4	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-60.8	-42.6	175.6	-65.5	0	0	0	0	111.8	L560 I578 S586 Y594	L560-C590 HydrophobicContact CD1-CB 3.85Å; I578-C590 HydrophobicContact CG2-CB 4.07Å; S586-C590 PolarHBondContact O-N 2.97Å; S586-C590 PolarHBondContact O-SG 3.25Å; C590-Y594 WeakPolarHBondContact O-CB 3.28Å; C590-Y594 PolarHBondContact O-N 3.46Å
591	M	88.4	Confident	86.8	Confident	60 Å²	60	74.9 Å²	74.9	30%	0.296	37%	0.372	S	S	.	.	H	α-helix	trans	-65.5	-41.8	175.8	-76.2	-172.9	-63.7	0	0	112.6	W575 K587 K588 D589 K595	W575-M591 HydrophobicContact CB-CG 4.43Å; W575-M591 HydrophobicContact CB-SD 4.39Å; W575-M591 HydrophobicContact CD2-CG 3.38Å; W575-M591 HydrophobicContact CD2-SD 4.1Å; W575-M591 HydrophobicContact CE3-CG 3.5Å; W575-M591 VanDerWaalsContact CE3-CG 3.5Å; W575-M591 HydrophobicContact CG-CG 3.82Å; W575-M591 HydrophobicContact CG-SD 3.91Å; W575-M591 HydrophobicContact CH2-CG 4.24Å; W575-M591 HydrophobicContact CZ2-CG 4.12Å; W575-M591 HydrophobicContact CZ3-CG 3.94Å; K587-M591 HydrophobicContact CG-CE 3.99Å; K587-M591 WeakPolarHBondContact O-CB 3.43Å; K587-M591 WeakPolarHBondContact O-CE 3.18Å; K587-M591 WeakPolarHBondContact O-CG 3.5Å; K587-M591 PolarHBondContact O-N 2.96Å; K587-M591 VanDerWaalsContact O-N 3.07Å; K588-M591 PolarHBondContact O-N 2.78Å; D589-M591 VanDerWaalsContact C-N 3.35Å; D589-M591 PolarHBondContact O-N 3.25Å; M591-K595 WeakPolarHBondContact O-CG 3.21Å; M591-K595 PolarHBondContact O-N 3.39Å; M591-K595 VanDerWaalsContact O-N 3.15Å
592	K	87.8	Confident	86.4	Confident	134 Å²	134	80 Å²	80	58%	0.583	39%	0.387	S	S	*	.	H	α-helix	trans	-63.2	-48.9	177.7	-176.5	-177.9	174	-173.9	0	110.6	K588 D589 Y594 K595 E596	K588-K592 WeakPolarHBondContact O-CB 3.3Å; K588-K592 PolarHBondContact O-N 3.48Å; D589-K592 PolarHBondContact O-N 2.79Å; K592-Y594 VanDerWaalsContact C-N 3.32Å; K592-Y594 PolarHBondContact O-N 3.5Å; K592-K595 WeakPolarHBondContact O-CB 3.11Å; K592-K595 PolarHBondContact O-N 3.44Å; K592-K595 VanDerWaalsContact O-N 3.15Å; K592-E596 PolarHBondContact O-N 3.35Å; K592-E596 VanDerWaalsContact O-N 3.16Å
593	R	90.6	Very high	85.9	Confident	59 Å²	59	82.9 Å²	82.9	22%	0.223	41%	0.411	C	S	.	.	H	α-helix	trans	-63	-38.5	179.2	-171.5	58.9	172.8	172.5	-3.1	112.6	W552 Q557 L560 D589 K595 E596 L597	W552-R593 HydrophobicContact CD2-CB 4.48Å; W552-R593 HydrophobicContact CD2-CG 3.88Å; W552-R593 VanDerWaalsContact CE2-CG 3.49Å; W552-R593 HydrophobicContact CE3-CG 4.39Å; W552-R593 HydrophobicContact CG-CG 4.37Å; W552-R593 HydrophobicContact CH2-CB 4.18Å; W552-R593 HydrophobicContact CH2-CG 4.27Å; W552-R593 HydrophobicContact CZ2-CB 3.43Å; W552-R593 VanDerWaalsContact CZ2-CB 3.43Å; W552-R593 HydrophobicContact CZ2-CG 3.71Å; Q557-R593 VanDerWaalsContact OE1-NE 3.08Å; L560-R593 HydrophobicContact CD2-CB 3.87Å; L560-R593 HydrophobicContact CD2-CG 3.57Å; D589-R593 WeakPolarHBondContact O-CB 2.99Å; D589-R593 PolarHBondContact O-N 3.01Å; R593-K595 PolarHBondContact O-N 3.13Å; R593-E596 WeakPolarHBondContact CD-OE2 3.15Å; R593-E596 IonicContact CZ-OE2 3.18Å; R593-E596 IonicContact NH1-OE2 3.69Å; R593-E596 PolarHBondContact NH1-OE2 2.81Å; R593-E596 PolarHBondContact O-N 3.47Å; R593-L597 HydrophobicContact CG-CD1 4.42Å; R593-L597 WeakPolarHBondContact O-CG 3.16Å; R593-L597 PolarHBondContact O-N 2.8Å
594	Y	89.9	Confident	85.9	Confident	75 Å²	75	84.2 Å²	84.2	29%	0.294	41%	0.406	S	S	.	.	H	α-helix	trans	-61.1	-42	173.9	176	-104.7	0	0	0	112.8	L564 W575 C590 K592 L597 V598	L564-Y594 HydrophobicContact CD1-CD2 3.73Å; L564-Y594 HydrophobicContact CD1-CE2 4.38Å; L564-Y594 HydrophobicContact CD2-CD2 3.67Å; L564-Y594 HydrophobicContact CD2-CE2 3.97Å; L564-Y594 HydrophobicContact CD2-CG 4.39Å; L564-Y594 HydrophobicContact CG-CD2 4.38Å; W575-Y594 AromaticContact CH2-CD1 3.58Å; W575-Y594 HydrophobicContact CH2-CD1 3.58Å; W575-Y594 HydrophobicContact CH2-CD2 4.25Å; W575-Y594 HydrophobicContact CH2-CE1 4.25Å; W575-Y594 AromaticContact CH2-CG 3.56Å; W575-Y594 HydrophobicContact CH2-CG 3.56Å; W575-Y594 AromaticContact CZ2-CD1 3.91Å; W575-Y594 HydrophobicContact CZ2-CD1 3.91Å; W575-Y594 HydrophobicContact CZ2-CE1 4.28Å; W575-Y594 HydrophobicContact CZ2-CG 4.35Å; W575-Y594 HydrophobicContact CZ3-CG 4.49Å; C590-Y594 WeakPolarHBondContact O-CB 3.28Å; C590-Y594 PolarHBondContact O-N 3.46Å; K592-Y594 VanDerWaalsContact C-N 3.32Å; K592-Y594 PolarHBondContact O-N 3.5Å; Y594-L597 PolarHBondContact O-N 3.38Å; Y594-V598 HydrophobicContact CD1-CG2 4.29Å; Y594-V598 HydrophobicContact CD2-CG2 4.46Å; Y594-V598 HydrophobicContact CE1-CG2 3.87Å; Y594-V598 HydrophobicContact CE2-CG2 4.06Å; Y594-V598 WeakPolarHBondContact O-CG2 3.48Å; Y594-V598 PolarHBondContact O-N 3.28Å
595	K	87.7	Confident	85.9	Confident	149 Å²	149	83.5 Å²	83.5	65%	0.648	40%	0.4	S	S	*	.	H	α-helix	trans	-61.3	-44.8	176.1	-73	177.3	-179	-179.6	0	111.6	M591 K592 R593 L597 V598 E599	M591-K595 WeakPolarHBondContact O-CG 3.21Å; M591-K595 PolarHBondContact O-N 3.39Å; M591-K595 VanDerWaalsContact O-N 3.15Å; K592-K595 WeakPolarHBondContact O-CB 3.11Å; K592-K595 PolarHBondContact O-N 3.44Å; K592-K595 VanDerWaalsContact O-N 3.15Å; R593-K595 PolarHBondContact O-N 3.13Å; K595-L597 VanDerWaalsContact C-N 3.33Å; K595-L597 PolarHBondContact O-N 2.91Å; K595-V598 PolarHBondContact O-N 3.06Å; K595-E599 PolarHBondContact O-N 2.91Å
596	E	85.9	Confident	85.5	Confident	64 Å²	64	85 Å²	85	30%	0.299	42%	0.415	S	S	.	.	H	α-helix	trans	-58.6	-43.2	175.5	-66.8	170.1	-173	0	0	111.9	K592 R593 E599 M600	K592-E596 PolarHBondContact O-N 3.35Å; K592-E596 VanDerWaalsContact O-N 3.16Å; R593-E596 WeakPolarHBondContact CD-OE2 3.15Å; R593-E596 IonicContact CZ-OE2 3.18Å; R593-E596 IonicContact NH1-OE2 3.69Å; R593-E596 PolarHBondContact NH1-OE2 2.81Å; R593-E596 PolarHBondContact O-N 3.47Å; E596-E599 PolarHBondContact O-N 2.95Å; E596-M600 HydrophobicContact CB-CE 4.47Å; E596-M600 WeakPolarHBondContact O-CG 3.3Å; E596-M600 PolarHBondContact O-N 3.42Å
597	L	83.8	Confident	85	Confident	38 Å²	38	84.9 Å²	84.9	20%	0.199	42%	0.417	C	S	.	.	H	α-helix	trans	-63.6	-41.3	176.4	-69.1	167.5	0	0	0	112.3	L560 R593 Y594 K595 E599 M600 V601	L560-L597 HydrophobicContact CD2-CD1 4.43Å; R593-L597 HydrophobicContact CG-CD1 4.42Å; R593-L597 WeakPolarHBondContact O-CG 3.16Å; R593-L597 PolarHBondContact O-N 2.8Å; Y594-L597 PolarHBondContact O-N 3.38Å; K595-L597 VanDerWaalsContact C-N 3.33Å; K595-L597 PolarHBondContact O-N 2.91Å; L597-E599 VanDerWaalsContact C-N 3.35Å; L597-M600 HydrophobicContact CD2-CE 3.89Å; L597-M600 HydrophobicContact CG-CE 4.49Å; L597-M600 PolarHBondContact O-N 3.2Å; L597-V601 WeakPolarHBondContact O-CB 3.33Å; L597-V601 VanDerWaalsContact O-CG2 3.29Å; L597-V601 WeakPolarHBondContact O-CG2 3.32Å; L597-V601 PolarHBondContact O-N 3.29Å
598	V	84.2	Confident	84.2	Confident	46 Å²	46	86.6 Å²	86.6	28%	0.279	43%	0.426	S	S	.	.	H	α-helix	trans	-63.2	-42	176.6	169.9	0	0	0	0	111.1	Y594 K595 V601 K602	Y594-V598 HydrophobicContact CD1-CG2 4.29Å; Y594-V598 HydrophobicContact CD2-CG2 4.46Å; Y594-V598 HydrophobicContact CE1-CG2 3.87Å; Y594-V598 HydrophobicContact CE2-CG2 4.06Å; Y594-V598 WeakPolarHBondContact O-CG2 3.48Å; Y594-V598 PolarHBondContact O-N 3.28Å; K595-V598 PolarHBondContact O-N 3.06Å; V598-V601 PolarHBondContact O-N 2.86Å; V598-K602 HydrophobicContact CG1-CD 4.32Å; V598-K602 WeakPolarHBondContact O-CB 3.42Å; V598-K602 WeakPolarHBondContact O-CG 3.26Å; V598-K602 PolarHBondContact O-N 3.15Å
599	E	83.7	Confident	83.7	Confident	136 Å²	136	84.7 Å²	84.7	64%	0.636	42%	0.42	S	S	*	.	H	α-helix	trans	-65.6	-43.5	176.2	-70.8	-170.8	142.2	0	0	112	K595 E596 L597 V601 K602 A603	K595-E599 PolarHBondContact O-N 2.91Å; E596-E599 PolarHBondContact O-N 2.95Å; L597-E599 VanDerWaalsContact C-N 3.35Å; E599-V601 VanDerWaalsContact C-N 3.34Å; E599-V601 PolarHBondContact O-N 3.42Å; E599-K602 PolarHBondContact O-N 3.5Å; E599-A603 WeakPolarHBondContact O-CB 3.46Å; E599-A603 PolarHBondContact O-N 3.17Å
600	M	75.5	Confident	83	Confident	101 Å²	101	90 Å²	90	50%	0.498	44%	0.444	S	S	.	.	H	α-helix	trans	-60.2	-41.7	174.3	-79.4	-169.9	-82.9	0	0	112.4	E596 L597 A603 K604	E596-M600 HydrophobicContact CB-CE 4.47Å; E596-M600 WeakPolarHBondContact O-CG 3.3Å; E596-M600 PolarHBondContact O-N 3.42Å; L597-M600 HydrophobicContact CD2-CE 3.89Å; L597-M600 HydrophobicContact CG-CE 4.49Å; L597-M600 PolarHBondContact O-N 3.2Å; M600-A603 PolarHBondContact O-N 3.38Å; M600-K604 VanDerWaalsContact O-CB 3.3Å; M600-K604 WeakPolarHBondContact O-CB 3.49Å; M600-K604 PolarHBondContact O-N 3Å
601	V	81.3	Confident	82.3	Confident	98 Å²	98	94.2 Å²	94.2	59%	0.594	47%	0.469	S	S	*	.	H	α-helix	trans	-66.9	-41.7	176.8	170.8	0	0	0	0	111.3	L597 V598 E599 K604 K605	L597-V601 WeakPolarHBondContact O-CB 3.33Å; L597-V601 VanDerWaalsContact O-CG2 3.29Å; L597-V601 WeakPolarHBondContact O-CG2 3.32Å; L597-V601 PolarHBondContact O-N 3.29Å; V598-V601 PolarHBondContact O-N 2.86Å; E599-V601 VanDerWaalsContact C-N 3.34Å; E599-V601 PolarHBondContact O-N 3.42Å; V601-K604 PolarHBondContact O-N 3.32Å; V601-K605 WeakPolarHBondContact O-CB 3.36Å; V601-K605 PolarHBondContact O-N 3.03Å
602	K	82.7	Confident	81.4	Confident	143 Å²	143	93.9 Å²	93.9	62%	0.622	48%	0.476	S	S	*	.	H	α-helix	trans	-61.6	-45.6	174.7	-77.9	178.8	179.6	-179.7	0	111.7	V598 E599 K605 A606	V598-K602 HydrophobicContact CG1-CD 4.32Å; V598-K602 WeakPolarHBondContact O-CB 3.42Å; V598-K602 WeakPolarHBondContact O-CG 3.26Å; V598-K602 PolarHBondContact O-N 3.15Å; E599-K602 PolarHBondContact O-N 3.5Å; K602-K605 PolarHBondContact O-N 3.01Å; K602-A606 WeakPolarHBondContact O-CB 3.46Å; K602-A606 PolarHBondContact O-N 3.1Å
603	A	80.5	Confident	80.5	Confident	62 Å²	62	90.5 Å²	90.5	51%	0.512	47%	0.473	S	S	.	.	H	α-helix	trans	-62.3	-43.3	176.9	0	0	0	0	0	111.6	E599 M600 K605 A606 A607	E599-A603 WeakPolarHBondContact O-CB 3.46Å; E599-A603 PolarHBondContact O-N 3.17Å; M600-A603 PolarHBondContact O-N 3.38Å; A603-K605 PolarHBondContact O-N 3.17Å; A603-A606 PolarHBondContact O-N 3.16Å; A603-A607 WeakPolarHBondContact O-CB 3.36Å; A603-A607 PolarHBondContact O-N 3.26Å
604	K	82.3	Confident	79.1	Confident	138 Å²	138	95.6 Å²	95.6	60%	0.6	50%	0.497	S	S	*	.	H	α-helix	trans	-62.2	-42	175.9	-172.5	176.2	-179.1	178.6	0	112	M600 V601 A607 Q608	M600-K604 VanDerWaalsContact O-CB 3.3Å; M600-K604 WeakPolarHBondContact O-CB 3.49Å; M600-K604 PolarHBondContact O-N 3Å; V601-K604 PolarHBondContact O-N 3.32Å; K604-A607 PolarHBondContact O-N 2.83Å; K604-Q608 WeakPolarHBondContact O-CB 3.45Å; K604-Q608 WeakPolarHBondContact O-CG 3.47Å; K604-Q608 PolarHBondContact O-N 3.07Å
605	K	81.9	Confident	77.5	Confident	124 Å²	124	98.5 Å²	98.5	54%	0.539	52%	0.517	S	S	.	.	H	α-helix	trans	-67.1	-44.4	177.9	-168	178.4	179.4	-175.3	0	111.8	V601 K602 A603 A607 Q608 E609	V601-K605 WeakPolarHBondContact O-CB 3.36Å; V601-K605 PolarHBondContact O-N 3.03Å; K602-K605 PolarHBondContact O-N 3.01Å; A603-K605 PolarHBondContact O-N 3.17Å; K605-A607 VanDerWaalsContact C-N 3.32Å; K605-A607 PolarHBondContact O-N 3.19Å; K605-Q608 PolarHBondContact O-N 3.02Å; K605-E609 VanDerWaalsContact CE-OE1 3.26Å; K605-E609 WeakPolarHBondContact CE-OE1 3.4Å; K605-E609 WeakPolarHBondContact O-CB 3Å; K605-E609 WeakPolarHBondContact O-CG 3.28Å; K605-E609 PolarHBondContact O-N 3.2Å
606	A	79.8	Confident	75.8	Confident	42 Å²	42	100.6 Å²	100.6	35%	0.347	53%	0.527	S	S	.	.	H	α-helix	trans	-61.2	-40.7	175.2	0	0	0	0	0	111.9	K602 A603 E609 Q610	K602-A606 WeakPolarHBondContact O-CB 3.46Å; K602-A606 PolarHBondContact O-N 3.1Å; A603-A606 PolarHBondContact O-N 3.16Å; A606-E609 PolarHBondContact O-N 3.32Å; A606-Q610 VanDerWaalsContact O-CG 3.31Å; A606-Q610 WeakPolarHBondContact O-CG 3.44Å; A606-Q610 PolarHBondContact O-N 3.44Å
607	A	80.1	Confident	73.7	Confident	51 Å²	51	109.3 Å²	109.3	42%	0.421	56%	0.563	S	S	.	*	H	α-helix	trans	-64.5	-42.7	174.4	0	0	0	0	0	112	A603 K604 K605 Q610 V611	A603-A607 WeakPolarHBondContact O-CB 3.36Å; A603-A607 PolarHBondContact O-N 3.26Å; K604-A607 PolarHBondContact O-N 2.83Å; K605-A607 VanDerWaalsContact C-N 3.32Å; K605-A607 PolarHBondContact O-N 3.19Å; A607-Q610 PolarHBondContact O-N 3.45Å; A607-V611 VanDerWaalsContact O-CG2 3.32Å; A607-V611 WeakPolarHBondContact O-CG2 3.3Å; A607-V611 PolarHBondContact O-N 3.09Å
608	Q	74	Confident	73.2	Confident	119 Å²	119	112.9 Å²	112.9	56%	0.556	58%	0.582	S	S	*	*	H	α-helix	trans	-64.2	-40	176	-77.1	177.9	-24.3	0	0	112.6	K604 K605 V611 A612	K604-Q608 WeakPolarHBondContact O-CB 3.45Å; K604-Q608 WeakPolarHBondContact O-CG 3.47Å; K604-Q608 PolarHBondContact O-N 3.07Å; K605-Q608 PolarHBondContact O-N 3.02Å; Q608-V611 PolarHBondContact O-N 3.11Å; Q608-A612 WeakPolarHBondContact O-CB 3.34Å; Q608-A612 PolarHBondContact O-N 3.31Å
609	E	79.1	Confident	72.6	Confident	113 Å²	113	116.4 Å²	116.4	53%	0.528	60%	0.598	S	S	.	*	H	α-helix	trans	-65.1	-38.9	175.5	-75.5	171.1	-175	0	0	111.7	K605 A606 A612 A613	K605-E609 VanDerWaalsContact CE-OE1 3.26Å; K605-E609 WeakPolarHBondContact CE-OE1 3.4Å; K605-E609 WeakPolarHBondContact O-CB 3Å; K605-E609 WeakPolarHBondContact O-CG 3.28Å; K605-E609 PolarHBondContact O-N 3.2Å; A606-E609 PolarHBondContact O-N 3.32Å; E609-A612 PolarHBondContact O-N 2.67Å; E609-A613 VanDerWaalsContact O-CB 3.29Å; E609-A613 WeakPolarHBondContact O-CB 3.35Å; E609-A613 PolarHBondContact O-N 3.35Å
610	Q	73.9	Confident	72	Confident	138 Å²	138	115.3 Å²	115.3	65%	0.645	60%	0.596	S	S	*	*	H	α-helix	trans	-66.7	-36.8	174.5	-73.4	-179	21.2	0	0	112.9	A606 A607 K614	A606-Q610 VanDerWaalsContact O-CG 3.31Å; A606-Q610 WeakPolarHBondContact O-CG 3.44Å; A606-Q610 PolarHBondContact O-N 3.44Å; A607-Q610 PolarHBondContact O-N 3.45Å; Q610-K614 PolarHBondContact O-N 3.44Å; Q610-K614 VanDerWaalsContact O-N 3.11Å
611	V	74.8	Confident	71.7	Confident	88 Å²	88	116.1 Å²	116.1	53%	0.533	60%	0.601	S	S	.	*	H	α-helix	trans	-69.5	-42	174.5	173.4	0	0	0	0	110.8	A607 Q608 A613 K614 N615	A607-V611 VanDerWaalsContact O-CG2 3.32Å; A607-V611 WeakPolarHBondContact O-CG2 3.3Å; A607-V611 PolarHBondContact O-N 3.09Å; Q608-V611 PolarHBondContact O-N 3.11Å; V611-A613 VanDerWaalsContact C-N 3.34Å; V611-A613 PolarHBondContact O-N 3.38Å; V611-K614 PolarHBondContact O-N 2.96Å; V611-N615 PolarHBondContact O-N 3.48Å; V611-N615 VanDerWaalsContact O-N 3.12Å
612	A	71.1	Confident	71.2	Confident	54 Å²	54	117.3 Å²	117.3	45%	0.446	60%	0.602	S	S	.	*	H	α-helix	trans	-65.9	-34.7	176.4	0	0	0	0	0	112.7	Q608 E609	Q608-A612 WeakPolarHBondContact O-CB 3.34Å; Q608-A612 PolarHBondContact O-N 3.31Å; E609-A612 PolarHBondContact O-N 2.67Å
613	A	67.9	Low	70.4	Confident	63 Å²	63	115.5 Å²	115.5	52%	0.521	60%	0.6	S	S	.	*	H	α-helix	trans	-70.3	-31.8	174.2	0	0	0	0	0	112.7	E609 V611	E609-A613 VanDerWaalsContact O-CB 3.29Å; E609-A613 WeakPolarHBondContact O-CB 3.35Å; E609-A613 PolarHBondContact O-N 3.35Å; V611-A613 VanDerWaalsContact C-N 3.34Å; V611-A613 PolarHBondContact O-N 3.38Å
614	K	61.9	Low	69.7	Low	166 Å²	166	119.4 Å²	119.4	72%	0.722	61%	0.607	S	S	*	*	H	α-helix	trans	-72.5	-30.6	174	-88	-176.4	174.5	179.8	0	113.7	Q610 V611 K616	Q610-K614 PolarHBondContact O-N 3.44Å; Q610-K614 VanDerWaalsContact O-N 3.11Å; V611-K614 PolarHBondContact O-N 2.96Å; K614-K616 VanDerWaalsContact C-N 3.28Å; K614-K616 PolarHBondContact O-N 3.39Å
615	N	56.8	Low	68.7	Low	135 Å²	135	117.9 Å²	117.9	72%	0.722	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-3.7	176.9	-72.3	-8	0	0	0	113.7	V611	V611-N615 PolarHBondContact O-N 3.48Å; V611-N615 VanDerWaalsContact O-N 3.12Å
616	K	51.4	Low	67.6	Low	194 Å²	194	117.4 Å²	117.4	84%	0.843	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-3.1	176.3	-80.9	-174.5	174.1	-177.9	0	113.8	K614	K614-K616 VanDerWaalsContact C-N 3.28Å; K614-K616 PolarHBondContact O-N 3.39Å
617	K	40.4	Very low	66.5	Low	246 Å²	246	124.3 Å²	124.3	100%	1.07	64%	0.637	S	S	*	*			trans	-107.8	0	166.7	-83.8	-173.9	174	-176.3	0	108.2

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